From mailer@bialko.llnl.gov Thu Aug 15 07:22:08 2002 Date: Thu, 15 Aug 2002 07:22:03 -0700 (PDT) From: Automatic Reply To: karplus@soe.ucsc.edu X-SpamBouncer: 1.4 (10/07/01) X-SBPass: NoBounce X-SBClass: OK # # Protein Structure Prediction Center, LLNL, Livermore, CA # Verification system Thu Aug 15 06:54:02 PDT 2002 by Adam Zemla # # The PIN number of your submission is: PIN_672192_24607 # (PIN number is not an ACCESSION CODE) # Thank you for your submission. Your prediction has been accepted with an ACCESSION CODE: T0185SS389_1 Current information on models submitted in prediction T0185SS389 MODEL_INDEX PIN CODE DATE E-mail T0185SS389_1 PIN_672192_24607 1549-8716-6404 08/15/02 06:54:02 casp5@bialko.llnl.gov PLEASE NOTE: Submission of a duplicate prediction (same target, format, model index) will REPLACE an existing submission (ACCESSION CODE), provided it is received before the target has expired. The current status of models accepted for target T0185 MODEL_INDEX PIN CODE DATE E-mail T0185SS389_1 PIN_672192_24607 1549-8716-6404 08/15/02 06:54:02 casp5@bialko.llnl.gov For more information on accepted models submitted to CASP5 see: http://PredictionCenter.llnl.gov/casp5/models/casp5-models.html Please check below if the verified data of your submission is correct. # Reading prediction format SS PFRMAT SS TARGET T0185 AUTHOR 1549-8716-6404 # Reading MODEL 1 # Reading prediction format SS (DONE) # Checking the SS prediction MODEL 1 # Checking the SS prediction MODEL 1 (DONE) # MODEL index: 1 # Total number of residues in model: 457 # Number of residues with nonzero confidence: 457 # Number of METHOD records: 65 # No errors. ################################ # # # SUBMISSION # # # ################################ # # # BEGIN # # # ################################ PFRMAT SS TARGET T0185 AUTHOR 1549-8716-6404 METHOD CAFASP METHOD samt02_dssp_ehl METHOD This file is the result of combining several RDB files, specifically METHOD T0185.t2k.dssp-ebghstl.rdb (weight 1.53986) METHOD T0185.t2k.stride-ebghtl.rdb (weight 1.24869) METHOD T0185.t2k.str.rdb (weight 1.53983) METHOD These files were combined by translating their predictions into EHL METHOD predictions with tables generated by compare-real, and then combining METHOD those predictions with weights proportional to their mutual information METHOD with the EHL alphabet. The comments from the individual files follow. METHOD METHOD Comments from T0185.t2k.dssp-ebghstl.rdb METHOD ============================================ METHOD TARGET T0185 METHOD Using neural net t2k-5740-IDaaHr-5-15-7-15-9-15-13-ebghstl-seeded.net METHOD This is a 4-layer network, with METHOD window units METHOD 5 15 METHOD 7 15 METHOD 9 15 METHOD 13 7 (1 EBGHSTL ) METHOD The input amino acid frequencies were determined from METHOD alignment T0185.t2k-thin90.a2m.gz METHOD with weighted counts, using HenikoffWeight(-1 bits/column, 1) METHOD Counts were regularized to probabilities using METHOD /projects/compbio/lib/recode3.20comp METHOD Total sequence weight for alignment was 270 METHOD METHOD ============================================ METHOD Comments from T0185.t2k.stride-ebghtl.rdb METHOD ============================================ METHOD TARGET T0185 METHOD Using neural net t2k-5651-IDaaHr-5-15-7-15-9-15-13-ebghtl-seeded.net METHOD This is a 4-layer network, with METHOD window units METHOD 5 15 METHOD 7 15 METHOD 9 15 METHOD 13 6 (1 EBGHTL ) METHOD The input amino acid frequencies were determined from METHOD alignment T0185.t2k-thin90.a2m.gz METHOD with weighted counts, using HenikoffWeight(-1 bits/column, 1) METHOD Counts were regularized to probabilities using METHOD /projects/compbio/lib/recode3.20comp METHOD Total sequence weight for alignment was 270 METHOD METHOD ============================================ METHOD Comments from T0185.t2k.str.rdb METHOD ============================================ METHOD TARGET T0185 METHOD Using neural net t2k-5651-IDaaHr-5-15-7-15-9-15-13-str-seeded.net METHOD This is a 4-layer network, with METHOD window units METHOD 5 15 METHOD 7 15 METHOD 9 15 METHOD 13 13 (1 str ) METHOD The input amino acid frequencies were determined from METHOD alignment T0185.t2k-thin90.a2m.gz METHOD with weighted counts, using HenikoffWeight(-1 bits/column, 1) METHOD Counts were regularized to probabilities using METHOD /projects/compbio/lib/recode3.20comp METHOD Total sequence weight for alignment was 270 METHOD METHOD ============================================ MODEL 1 M C 0.90 K E 0.53 I E 0.92 H E 0.97 F E 0.98 V E 0.96 G E 0.80 I C 0.56 G C 0.85 G C 0.74 I C 0.66 G C 0.50 M H 0.90 S H 0.95 A H 0.97 V H 0.97 A H 0.97 L H 0.97 H H 0.97 E H 0.96 F H 0.92 S H 0.81 N C 0.58 G C 0.97 N C 0.92 D E 0.56 V E 0.91 Y E 0.94 G E 0.93 S E 0.79 N C 0.64 I C 0.77 E C 0.79 E C 0.80 T C 0.85 E C 0.78 R C 0.52 T H 0.58 A H 0.70 Y H 0.75 L H 0.72 R H 0.70 K H 0.66 L H 0.48 G C 0.82 I C 0.68 P E 0.66 I E 0.69 F E 0.57 V C 0.67 P C 0.84 H C 0.86 S C 0.81 A H 0.70 D H 0.72 N H 0.75 W H 0.64 Y C 0.64 D C 0.88 P C 0.88 D C 0.57 L E 0.96 V E 0.98 I E 0.97 K E 0.86 T C 0.71 P C 0.89 A C 0.86 V C 0.84 R C 0.93 D C 0.89 D C 0.88 N C 0.87 P H 0.53 E H 0.70 I H 0.79 V H 0.84 R H 0.87 A H 0.87 R H 0.88 M H 0.84 E H 0.58 R C 0.87 V C 0.84 P C 0.54 I H 0.49 E H 0.53 N H 0.54 R H 0.77 L H 0.88 H H 0.91 Y H 0.92 F H 0.90 R H 0.86 D H 0.75 T H 0.64 L C 0.62 K C 0.66 R C 0.72 E C 0.79 K C 0.91 K C 0.87 E C 0.55 E E 0.95 F E 0.97 A E 0.97 V E 0.95 T E 0.78 G C 0.74 T C 0.93 D C 0.95 G C 0.93 K C 0.50 T H 0.81 T H 0.92 T H 0.96 T H 0.98 A H 0.98 M H 0.98 V H 0.98 A H 0.98 H H 0.97 V H 0.97 L H 0.97 K H 0.95 H H 0.87 L C 0.54 R C 0.97 K C 0.93 S C 0.71 P C 0.48 T E 0.61 V E 0.69 F E 0.58 L C 0.56 G C 0.72 G C 0.72 I C 0.68 M C 0.65 D C 0.65 S C 0.55 L C 0.45 E H 0.43 H H 0.41 G H 0.43 N E 0.42 Y E 0.38 E C 0.58 K C 0.84 G C 0.90 N C 0.81 G C 0.63 P E 0.93 V E 0.97 V E 0.98 Y E 0.97 E E 0.93 L E 0.73 D C 0.67 E C 0.81 S C 0.85 E C 0.82 E C 0.77 F C 0.57 F C 0.52 S C 0.46 E E 0.52 F C 0.51 S C 0.66 P C 0.67 N C 0.52 Y E 0.96 L E 0.98 I E 0.98 I E 0.96 T E 0.78 N C 0.59 A C 0.79 R C 0.88 G H 0.68 D H 0.75 H H 0.81 L H 0.77 E H 0.66 N H 0.54 Y C 0.72 G C 0.87 N C 0.90 S C 0.80 L H 0.96 T H 0.97 R H 0.97 Y H 0.97 R H 0.97 S H 0.96 A H 0.96 F H 0.96 E H 0.96 K H 0.94 I H 0.92 S H 0.87 R H 0.76 N C 0.53 T C 0.83 D C 0.86 L E 0.70 V E 0.92 V E 0.94 T E 0.88 F C 0.58 A C 0.91 E C 0.93 D C 0.87 E H 0.61 L H 0.61 T H 0.65 S H 0.49 H C 0.58 L C 0.73 G C 0.70 D E 0.73 V E 0.86 T E 0.88 F E 0.79 G E 0.54 V C 0.68 K C 0.85 K C 0.84 G C 0.81 T C 0.64 Y E 0.52 T E 0.75 L E 0.80 E E 0.78 M E 0.74 R E 0.80 S E 0.85 A E 0.84 S E 0.66 R C 0.59 A C 0.83 E C 0.79 Q E 0.51 K E 0.85 A E 0.92 M E 0.95 V E 0.95 E E 0.92 K E 0.73 N C 0.77 G C 0.82 K C 0.53 R E 0.62 Y E 0.64 L E 0.54 E E 0.66 L E 0.78 K E 0.75 L E 0.65 K C 0.56 V C 0.68 P C 0.76 G C 0.71 F H 0.69 H H 0.73 N H 0.85 V H 0.95 L H 0.96 N H 0.97 A H 0.98 L H 0.98 A H 0.98 V H 0.98 I H 0.98 A H 0.98 L H 0.98 F H 0.98 D H 0.97 S H 0.91 L C 0.53 G C 0.97 Y C 0.98 D C 0.96 L H 0.95 A H 0.97 P H 0.97 V H 0.97 L H 0.97 E H 0.96 A H 0.95 L H 0.93 E H 0.84 E H 0.63 F C 0.68 R C 0.81 G C 0.83 V C 0.84 H C 0.78 R C 0.71 R C 0.48 F E 0.52 S E 0.64 I E 0.64 A E 0.59 F E 0.50 H C 0.57 D C 0.70 P C 0.71 E C 0.70 T C 0.82 N C 0.84 I E 0.56 Y E 0.91 V E 0.96 I E 0.95 D E 0.87 D C 0.55 Y C 0.84 A C 0.90 H C 0.92 T C 0.93 P H 0.66 D H 0.86 E H 0.93 I H 0.97 R H 0.98 N H 0.97 L H 0.97 L H 0.98 Q H 0.97 T H 0.97 A H 0.96 K H 0.93 E H 0.82 V H 0.64 F C 0.78 E C 0.89 N C 0.94 E C 0.82 K E 0.81 I E 0.96 V E 0.97 V E 0.97 I E 0.89 F E 0.55 Q C 0.74 P C 0.80 H C 0.80 R C 0.79 Y C 0.78 S C 0.71 R C 0.64 L H 0.48 E H 0.78 R H 0.80 E H 0.80 D H 0.82 G H 0.84 N H 0.82 F H 0.69 A H 0.53 K C 0.57 A C 0.64 L C 0.76 Q C 0.78 L C 0.68 A C 0.55 D C 0.49 E H 0.65 V H 0.72 V H 0.73 V H 0.74 T H 0.70 E H 0.73 V H 0.72 Y H 0.60 D H 0.53 A H 0.58 F H 0.55 E H 0.49 E H 0.49 K H 0.56 K H 0.70 N H 0.74 G H 0.74 I H 0.77 S H 0.74 G H 0.83 K H 0.86 M H 0.85 I H 0.85 W H 0.85 D H 0.84 S H 0.81 L H 0.72 K H 0.66 S H 0.59 L C 0.49 G C 0.84 K C 0.89 E C 0.88 A C 0.77 Y C 0.70 F C 0.68 V C 0.69 E C 0.73 K H 0.69 L H 0.85 P H 0.89 E H 0.91 L H 0.93 E H 0.94 K H 0.94 V H 0.93 I H 0.93 S H 0.90 V H 0.87 S H 0.83 E H 0.81 N H 0.75 T H 0.71 V H 0.67 F H 0.65 L H 0.62 F H 0.56 V H 0.53 G H 0.44 A C 0.52 G C 0.64 D C 0.62 I C 0.59 I C 0.65 Y H 0.73 S H 0.82 S H 0.88 R H 0.93 R H 0.96 F H 0.97 V H 0.96 E H 0.96 R H 0.95 Y H 0.87 Q H 0.71 S C 0.67 S C 0.92 K C 0.91 S C 0.95 S C 0.73 P E 0.92 S E 0.97 R E 0.97 V E 0.94 L E 0.66 G C 0.72 S C 0.88 N C 0.93 K C 0.98 END END ################################ # # # END # # # ################################ From mailer@bialko.llnl.gov Wed Aug 21 10:59:19 2002 Date: Wed, 21 Aug 2002 10:59:14 -0700 (PDT) From: Automatic Reply To: karplus@soe.ucsc.edu Subject: T0185 TS samt02.pdb 1 X-SpamBouncer: 1.4 (10/07/01) X-SBPass: NoBounce X-SBClass: OK # # Protein Structure Prediction Center, LLNL, Livermore, CA # Verification system Wed Aug 21 10:30:13 PDT 2002 by Adam Zemla # # The PIN number of your submission is: PIN_457787_29788 # (PIN number is not an ACCESSION CODE) # Thank you for your submission. Your prediction has been accepted with an ACCESSION CODE: T0185TS189_1 Current information on models submitted in prediction T0185TS189 MODEL_INDEX PIN CODE DATE E-mail T0185TS189_1 PIN_457787_29788 5035-2079-5263 08/21/02 10:30:13 casp5@bialko.llnl.gov T0185TS189_3 PIN_427473_29779 5035-2079-5263 08/21/02 10:27:24 casp5@bialko.llnl.gov T0185TS189_2 PIN_401671_29771 5035-2079-5263 08/21/02 10:24:54 casp5@bialko.llnl.gov PLEASE NOTE: Submission of a duplicate prediction (same target, format, model index) will REPLACE an existing submission (ACCESSION CODE), provided it is received before the target has expired. The current status of models accepted for target T0185 MODEL_INDEX PIN CODE DATE E-mail T0185TS189_1 PIN_457787_29788 5035-2079-5263 08/21/02 10:30:13 casp5@bialko.llnl.gov T0185TS189_2 PIN_401671_29771 5035-2079-5263 08/21/02 10:24:54 casp5@bialko.llnl.gov T0185TS189_3 PIN_427473_29779 5035-2079-5263 08/21/02 10:27:24 casp5@bialko.llnl.gov For more information on accepted models submitted to CASP5 see: http://PredictionCenter.llnl.gov/casp5/models/casp5-models.html Please check below if the verified data of your submission is correct. # Reading prediction format TS PFRMAT TS TARGET T0185 AUTHOR 5035-2079-5263 # Reading MODEL 1 PARENT 1UAG # Loading PARENT structure: 1uag (chain: ) # Number of residues in PARENT structure: 427 # Reading prediction format TS (DONE) # Checking the TS prediction MODEL 1 # IMPORTANT NOTE! Not complete main chain atoms for residue M 1 # !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! # # It is requested that coordinate data be supplied for at least # # all non-hydrogen main chain atoms, i.e. the N, CA, C and O # # atoms of every residue. Specifically, if only CA atoms are # # predicted by the method, predictors are encouraged to build # # the main chain atoms for every residue before submission to # # CASP. If only CA atoms were submitted it would not be possible # # to run most of the analysis software, which would severely # # limit the evaluation of that prediction. # # !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! # # IMPORTANT NOTE! Not complete main chain atoms for residue K 2 # IMPORTANT NOTE! Not complete main chain atoms for residue I 3 # IMPORTANT NOTE! Not complete main chain atoms for residue H 4 # IMPORTANT NOTE! Not complete main chain atoms for residue F 5 # IMPORTANT NOTE! Not complete main chain atoms for residue V 6 # IMPORTANT NOTE! Not complete main chain atoms for residue G 7 # IMPORTANT NOTE! Not complete main chain atoms for residue I 8 # IMPORTANT NOTE! Not complete main chain atoms for residue G 9 # IMPORTANT NOTE! Not complete main chain atoms for residue G 10 # IMPORTANT NOTE! Not complete main chain atoms for residue I 11 # IMPORTANT NOTE! Not complete main chain atoms for residue G 12 # IMPORTANT NOTE! Not complete main chain atoms for residue M 13 # IMPORTANT NOTE! Not complete main chain atoms for residue S 14 # IMPORTANT NOTE! Not complete main chain atoms for residue A 15 # IMPORTANT NOTE! Not complete main chain atoms for residue A 17 # IMPORTANT NOTE! Not complete main chain atoms for residue L 18 # IMPORTANT NOTE! Not complete main chain atoms for residue H 19 # IMPORTANT NOTE! Not complete main chain atoms for residue E 20 # IMPORTANT NOTE! Not complete main chain atoms for residue F 21 # IMPORTANT NOTE! Not complete main chain atoms for residue S 22 # IMPORTANT NOTE! Not complete main chain atoms for residue N 23 # IMPORTANT NOTE! Not complete main chain atoms for residue G 24 # IMPORTANT NOTE! Not complete main chain atoms for residue N 25 # IMPORTANT NOTE! Not complete main chain atoms for residue D 26 # IMPORTANT NOTE! Not complete main chain atoms for residue V 27 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 28 # IMPORTANT NOTE! Not complete main chain atoms for residue G 29 # IMPORTANT NOTE! Not complete main chain atoms for residue S 30 # IMPORTANT NOTE! Not complete main chain atoms for residue N 31 # IMPORTANT NOTE! Not complete main chain atoms for residue I 32 # IMPORTANT NOTE! Not complete main chain atoms for residue E 33 # IMPORTANT NOTE! Not complete main chain atoms for residue E 34 # IMPORTANT NOTE! Not complete main chain atoms for residue T 35 # IMPORTANT NOTE! Not complete main chain atoms for residue E 36 # IMPORTANT NOTE! Not complete main chain atoms for residue R 37 # IMPORTANT NOTE! Not complete main chain atoms for residue T 38 # IMPORTANT NOTE! Not complete main chain atoms for residue A 39 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 40 # IMPORTANT NOTE! Not complete main chain atoms for residue L 41 # IMPORTANT NOTE! Not complete main chain atoms for residue R 42 # IMPORTANT NOTE! Not complete main chain atoms for residue K 43 # IMPORTANT NOTE! Not complete main chain atoms for residue L 44 # IMPORTANT NOTE! Not complete main chain atoms for residue G 45 # IMPORTANT NOTE! Not complete main chain atoms for residue I 46 # IMPORTANT NOTE! Not complete main chain atoms for residue P 47 # IMPORTANT NOTE! Not complete main chain atoms for residue I 48 # IMPORTANT NOTE! Not complete main chain atoms for residue F 49 # IMPORTANT NOTE! Not complete main chain atoms for residue V 50 # IMPORTANT NOTE! Not complete main chain atoms for residue P 51 # IMPORTANT NOTE! Not complete main chain atoms for residue H 52 # IMPORTANT NOTE! Not complete main chain atoms for residue S 53 # IMPORTANT NOTE! Not complete main chain atoms for residue A 54 # IMPORTANT NOTE! Not complete main chain atoms for residue D 55 # IMPORTANT NOTE! Not complete main chain atoms for residue N 56 # IMPORTANT NOTE! Not complete main chain atoms for residue W 57 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 58 # IMPORTANT NOTE! Not complete main chain atoms for residue D 59 # IMPORTANT NOTE! Not complete main chain atoms for residue P 60 # IMPORTANT NOTE! Not complete main chain atoms for residue D 61 # IMPORTANT NOTE! Not complete main chain atoms for residue L 62 # IMPORTANT NOTE! Not complete main chain atoms for residue V 63 # IMPORTANT NOTE! Not complete main chain atoms for residue I 64 # IMPORTANT NOTE! Not complete main chain atoms for residue K 65 # IMPORTANT NOTE! Not complete main chain atoms for residue T 66 # IMPORTANT NOTE! Not complete main chain atoms for residue P 67 # IMPORTANT NOTE! Not complete main chain atoms for residue A 68 # IMPORTANT NOTE! Not complete main chain atoms for residue V 69 # IMPORTANT NOTE! Not complete main chain atoms for residue R 70 # IMPORTANT NOTE! Not complete main chain atoms for residue D 71 # IMPORTANT NOTE! Not complete main chain atoms for residue D 72 # IMPORTANT NOTE! Not complete main chain atoms for residue N 73 # IMPORTANT NOTE! Not complete main chain atoms for residue P 74 # IMPORTANT NOTE! Not complete main chain atoms for residue E 75 # IMPORTANT NOTE! Not complete main chain atoms for residue I 76 # IMPORTANT NOTE! Not complete main chain atoms for residue V 77 # IMPORTANT NOTE! Not complete main chain atoms for residue R 78 # IMPORTANT NOTE! Not complete main chain atoms for residue A 79 # IMPORTANT NOTE! Not complete main chain atoms for residue R 80 # IMPORTANT NOTE! Not complete main chain atoms for residue M 81 # IMPORTANT NOTE! Not complete main chain atoms for residue E 82 # IMPORTANT NOTE! Not complete main chain atoms for residue R 83 # IMPORTANT NOTE! Not complete main chain atoms for residue V 84 # IMPORTANT NOTE! Not complete main chain atoms for residue P 85 # IMPORTANT NOTE! Not complete main chain atoms for residue I 86 # IMPORTANT NOTE! Not complete main chain atoms for residue E 87 # IMPORTANT NOTE! Not complete main chain atoms for residue N 88 # IMPORTANT NOTE! Not complete main chain atoms for residue R 89 # IMPORTANT NOTE! Not complete main chain atoms for residue L 90 # IMPORTANT NOTE! Not complete main chain atoms for residue H 91 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 92 # IMPORTANT NOTE! Not complete main chain atoms for residue F 93 # IMPORTANT NOTE! Not complete main chain atoms for residue R 94 # IMPORTANT NOTE! Not complete main chain atoms for residue D 95 # IMPORTANT NOTE! Not complete main chain atoms for residue T 96 # IMPORTANT NOTE! Not complete main chain atoms for residue L 97 # IMPORTANT NOTE! Not complete main chain atoms for residue K 98 # IMPORTANT NOTE! Not complete main chain atoms for residue K 102 # IMPORTANT NOTE! Not complete main chain atoms for residue E 103 # IMPORTANT NOTE! Not complete main chain atoms for residue E 104 # IMPORTANT NOTE! Not complete main chain atoms for residue F 105 # IMPORTANT NOTE! Not complete main chain atoms for residue A 106 # IMPORTANT NOTE! Not complete main chain atoms for residue V 107 # IMPORTANT NOTE! Not complete main chain atoms for residue T 108 # IMPORTANT NOTE! Not complete main chain atoms for residue G 109 # IMPORTANT NOTE! Not complete main chain atoms for residue T 110 # IMPORTANT NOTE! Not complete main chain atoms for residue D 111 # IMPORTANT NOTE! Not complete main chain atoms for residue G 112 # IMPORTANT NOTE! Not complete main chain atoms for residue K 113 # IMPORTANT NOTE! Not complete main chain atoms for residue T 114 # IMPORTANT NOTE! Not complete main chain atoms for residue T 115 # IMPORTANT NOTE! Not complete main chain atoms for residue T 116 # IMPORTANT NOTE! Not complete main chain atoms for residue T 117 # IMPORTANT NOTE! Not complete main chain atoms for residue A 118 # IMPORTANT NOTE! Not complete main chain atoms for residue M 119 # IMPORTANT NOTE! Not complete main chain atoms for residue V 120 # IMPORTANT NOTE! Not complete main chain atoms for residue A 121 # IMPORTANT NOTE! Not complete main chain atoms for residue H 122 # IMPORTANT NOTE! Not complete main chain atoms for residue V 123 # IMPORTANT NOTE! Not complete main chain atoms for residue L 124 # IMPORTANT NOTE! Not complete main chain atoms for residue K 125 # IMPORTANT NOTE! Not complete main chain atoms for residue H 126 # IMPORTANT NOTE! Not complete main chain atoms for residue L 127 # IMPORTANT NOTE! Not complete main chain atoms for residue R 128 # IMPORTANT NOTE! Not complete main chain atoms for residue K 129 # IMPORTANT NOTE! Not complete main chain atoms for residue S 130 # IMPORTANT NOTE! Not complete main chain atoms for residue P 131 # IMPORTANT NOTE! Not complete main chain atoms for residue T 132 # IMPORTANT NOTE! Not complete main chain atoms for residue V 133 # IMPORTANT NOTE! Not complete main chain atoms for residue F 134 # IMPORTANT NOTE! Not complete main chain atoms for residue G 137 # IMPORTANT NOTE! Not complete main chain atoms for residue I 138 # IMPORTANT NOTE! Not complete main chain atoms for residue M 139 # IMPORTANT NOTE! Not complete main chain atoms for residue D 140 # IMPORTANT NOTE! Not complete main chain atoms for residue S 141 # IMPORTANT NOTE! Not complete main chain atoms for residue L 142 # IMPORTANT NOTE! Not complete main chain atoms for residue E 143 # IMPORTANT NOTE! Not complete main chain atoms for residue H 144 # IMPORTANT NOTE! Not complete main chain atoms for residue G 145 # IMPORTANT NOTE! Not complete main chain atoms for residue N 146 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 147 # IMPORTANT NOTE! Not complete main chain atoms for residue E 148 # IMPORTANT NOTE! Not complete main chain atoms for residue K 149 # IMPORTANT NOTE! Not complete main chain atoms for residue G 150 # IMPORTANT NOTE! Not complete main chain atoms for residue N 151 # IMPORTANT NOTE! Not complete main chain atoms for residue G 152 # IMPORTANT NOTE! Not complete main chain atoms for residue P 153 # IMPORTANT NOTE! Not complete main chain atoms for residue V 154 # IMPORTANT NOTE! Not complete main chain atoms for residue V 155 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 156 # IMPORTANT NOTE! Not complete main chain atoms for residue E 157 # IMPORTANT NOTE! Not complete main chain atoms for residue L 158 # IMPORTANT NOTE! Not complete main chain atoms for residue D 159 # IMPORTANT NOTE! Not complete main chain atoms for residue E 160 # IMPORTANT NOTE! Not complete main chain atoms for residue S 161 # IMPORTANT NOTE! Not complete main chain atoms for residue E 162 # IMPORTANT NOTE! Not complete main chain atoms for residue E 163 # IMPORTANT NOTE! Not complete main chain atoms for residue F 164 # IMPORTANT NOTE! Not complete main chain atoms for residue F 165 # IMPORTANT NOTE! Not complete main chain atoms for residue S 166 # IMPORTANT NOTE! Not complete main chain atoms for residue E 167 # IMPORTANT NOTE! Not complete main chain atoms for residue F 168 # IMPORTANT NOTE! Not complete main chain atoms for residue S 169 # IMPORTANT NOTE! Not complete main chain atoms for residue P 170 # IMPORTANT NOTE! Not complete main chain atoms for residue N 171 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 172 # IMPORTANT NOTE! Not complete main chain atoms for residue L 173 # IMPORTANT NOTE! Not complete main chain atoms for residue I 174 # IMPORTANT NOTE! Not complete main chain atoms for residue I 175 # IMPORTANT NOTE! Not complete main chain atoms for residue T 176 # IMPORTANT NOTE! Not complete main chain atoms for residue N 177 # IMPORTANT NOTE! Not complete main chain atoms for residue A 178 # IMPORTANT NOTE! Not complete main chain atoms for residue R 179 # IMPORTANT NOTE! Not complete main chain atoms for residue G 180 # IMPORTANT NOTE! Not complete main chain atoms for residue D 181 # IMPORTANT NOTE! Not complete main chain atoms for residue H 182 # IMPORTANT NOTE! Not complete main chain atoms for residue L 183 # IMPORTANT NOTE! Not complete main chain atoms for residue E 184 # IMPORTANT NOTE! Not complete main chain atoms for residue N 185 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 186 # IMPORTANT NOTE! Not complete main chain atoms for residue G 187 # IMPORTANT NOTE! Not complete main chain atoms for residue N 188 # IMPORTANT NOTE! Not complete main chain atoms for residue S 189 # IMPORTANT NOTE! Not complete main chain atoms for residue L 190 # IMPORTANT NOTE! Not complete main chain atoms for residue T 191 # IMPORTANT NOTE! Not complete main chain atoms for residue R 192 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 193 # IMPORTANT NOTE! Not complete main chain atoms for residue R 194 # IMPORTANT NOTE! Not complete main chain atoms for residue S 195 # IMPORTANT NOTE! Not complete main chain atoms for residue A 196 # IMPORTANT NOTE! Not complete main chain atoms for residue E 198 # IMPORTANT NOTE! Not complete main chain atoms for residue K 199 # IMPORTANT NOTE! Not complete main chain atoms for residue I 200 # IMPORTANT NOTE! Not complete main chain atoms for residue S 201 # IMPORTANT NOTE! Not complete main chain atoms for residue R 202 # IMPORTANT NOTE! Not complete main chain atoms for residue N 203 # IMPORTANT NOTE! Not complete main chain atoms for residue T 204 # IMPORTANT NOTE! Not complete main chain atoms for residue D 205 # IMPORTANT NOTE! Not complete main chain atoms for residue L 206 # IMPORTANT NOTE! Not complete main chain atoms for residue V 207 # IMPORTANT NOTE! Not complete main chain atoms for residue V 208 # IMPORTANT NOTE! Not complete main chain atoms for residue T 209 # IMPORTANT NOTE! Not complete main chain atoms for residue F 210 # IMPORTANT NOTE! Not complete main chain atoms for residue A 211 # IMPORTANT NOTE! Not complete main chain atoms for residue E 212 # IMPORTANT NOTE! Not complete main chain atoms for residue D 213 # IMPORTANT NOTE! Not complete main chain atoms for residue E 214 # IMPORTANT NOTE! Not complete main chain atoms for residue L 215 # IMPORTANT NOTE! Not complete main chain atoms for residue T 216 # IMPORTANT NOTE! Not complete main chain atoms for residue S 217 # IMPORTANT NOTE! Not complete main chain atoms for residue H 218 # IMPORTANT NOTE! Not complete main chain atoms for residue L 219 # IMPORTANT NOTE! Not complete main chain atoms for residue G 220 # IMPORTANT NOTE! Not complete main chain atoms for residue D 221 # IMPORTANT NOTE! Not complete main chain atoms for residue V 222 # IMPORTANT NOTE! Not complete main chain atoms for residue T 223 # IMPORTANT NOTE! Not complete main chain atoms for residue F 224 # IMPORTANT NOTE! Not complete main chain atoms for residue G 225 # IMPORTANT NOTE! Not complete main chain atoms for residue V 226 # IMPORTANT NOTE! Not complete main chain atoms for residue K 227 # IMPORTANT NOTE! Not complete main chain atoms for residue K 228 # IMPORTANT NOTE! Not complete main chain atoms for residue G 229 # IMPORTANT NOTE! Not complete main chain atoms for residue T 230 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 231 # IMPORTANT NOTE! Not complete main chain atoms for residue T 232 # IMPORTANT NOTE! Not complete main chain atoms for residue L 233 # IMPORTANT NOTE! Not complete main chain atoms for residue E 234 # IMPORTANT NOTE! Not complete main chain atoms for residue Q 243 # IMPORTANT NOTE! Not complete main chain atoms for residue K 244 # IMPORTANT NOTE! Not complete main chain atoms for residue A 245 # IMPORTANT NOTE! Not complete main chain atoms for residue M 246 # IMPORTANT NOTE! Not complete main chain atoms for residue V 247 # IMPORTANT NOTE! Not complete main chain atoms for residue E 248 # IMPORTANT NOTE! Not complete main chain atoms for residue K 249 # IMPORTANT NOTE! Not complete main chain atoms for residue N 250 # IMPORTANT NOTE! Not complete main chain atoms for residue G 251 # IMPORTANT NOTE! Not complete main chain atoms for residue K 252 # IMPORTANT NOTE! Not complete main chain atoms for residue R 253 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 254 # IMPORTANT NOTE! Not complete main chain atoms for residue L 255 # IMPORTANT NOTE! Not complete main chain atoms for residue E 256 # IMPORTANT NOTE! Not complete main chain atoms for residue L 257 # IMPORTANT NOTE! Not complete main chain atoms for residue K 258 # IMPORTANT NOTE! Not complete main chain atoms for residue L 259 # IMPORTANT NOTE! Not complete main chain atoms for residue K 260 # IMPORTANT NOTE! Not complete main chain atoms for residue V 261 # IMPORTANT NOTE! Not complete main chain atoms for residue P 262 # IMPORTANT NOTE! Not complete main chain atoms for residue G 263 # IMPORTANT NOTE! Not complete main chain atoms for residue F 264 # IMPORTANT NOTE! Not complete main chain atoms for residue H 265 # IMPORTANT NOTE! Not complete main chain atoms for residue N 266 # IMPORTANT NOTE! Not complete main chain atoms for residue V 267 # IMPORTANT NOTE! Not complete main chain atoms for residue L 268 # IMPORTANT NOTE! Not complete main chain atoms for residue N 269 # IMPORTANT NOTE! Not complete main chain atoms for residue A 270 # IMPORTANT NOTE! Not complete main chain atoms for residue L 271 # IMPORTANT NOTE! Not complete main chain atoms for residue A 272 # IMPORTANT NOTE! Not complete main chain atoms for residue V 273 # IMPORTANT NOTE! Not complete main chain atoms for residue I 274 # IMPORTANT NOTE! Not complete main chain atoms for residue A 275 # IMPORTANT NOTE! Not complete main chain atoms for residue L 276 # IMPORTANT NOTE! Not complete main chain atoms for residue F 277 # IMPORTANT NOTE! Not complete main chain atoms for residue D 278 # IMPORTANT NOTE! Not complete main chain atoms for residue S 279 # IMPORTANT NOTE! Not complete main chain atoms for residue L 280 # IMPORTANT NOTE! Not complete main chain atoms for residue G 281 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 282 # IMPORTANT NOTE! Not complete main chain atoms for residue D 283 # IMPORTANT NOTE! Not complete main chain atoms for residue L 284 # IMPORTANT NOTE! Not complete main chain atoms for residue A 285 # IMPORTANT NOTE! Not complete main chain atoms for residue P 286 # IMPORTANT NOTE! Not complete main chain atoms for residue V 287 # IMPORTANT NOTE! Not complete main chain atoms for residue L 288 # IMPORTANT NOTE! Not complete main chain atoms for residue E 289 # IMPORTANT NOTE! Not complete main chain atoms for residue A 290 # IMPORTANT NOTE! Not complete main chain atoms for residue L 291 # IMPORTANT NOTE! Not complete main chain atoms for residue E 292 # IMPORTANT NOTE! Not complete main chain atoms for residue E 293 # IMPORTANT NOTE! Not complete main chain atoms for residue F 294 # IMPORTANT NOTE! Not complete main chain atoms for residue R 295 # IMPORTANT NOTE! Not complete main chain atoms for residue G 296 # IMPORTANT NOTE! Not complete main chain atoms for residue V 297 # IMPORTANT NOTE! Not complete main chain atoms for residue H 298 # IMPORTANT NOTE! Not complete main chain atoms for residue R 299 # IMPORTANT NOTE! Not complete main chain atoms for residue R 300 # IMPORTANT NOTE! Not complete main chain atoms for residue F 301 # IMPORTANT NOTE! Not complete main chain atoms for residue S 302 # IMPORTANT NOTE! Not complete main chain atoms for residue I 303 # IMPORTANT NOTE! Not complete main chain atoms for residue A 304 # IMPORTANT NOTE! Not complete main chain atoms for residue D 307 # IMPORTANT NOTE! Not complete main chain atoms for residue P 308 # IMPORTANT NOTE! Not complete main chain atoms for residue E 309 # IMPORTANT NOTE! Not complete main chain atoms for residue T 310 # IMPORTANT NOTE! Not complete main chain atoms for residue N 311 # IMPORTANT NOTE! Not complete main chain atoms for residue I 312 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 313 # IMPORTANT NOTE! Not complete main chain atoms for residue V 314 # IMPORTANT NOTE! Not complete main chain atoms for residue I 315 # IMPORTANT NOTE! Not complete main chain atoms for residue D 316 # IMPORTANT NOTE! Not complete main chain atoms for residue D 317 # IMPORTANT NOTE! Not complete main chain atoms for residue H 320 # IMPORTANT NOTE! Not complete main chain atoms for residue T 321 # IMPORTANT NOTE! Not complete main chain atoms for residue P 322 # IMPORTANT NOTE! Not complete main chain atoms for residue D 323 # IMPORTANT NOTE! Not complete main chain atoms for residue E 324 # IMPORTANT NOTE! Not complete main chain atoms for residue I 325 # IMPORTANT NOTE! Not complete main chain atoms for residue R 326 # IMPORTANT NOTE! Not complete main chain atoms for residue N 327 # IMPORTANT NOTE! Not complete main chain atoms for residue L 328 # IMPORTANT NOTE! Not complete main chain atoms for residue L 329 # IMPORTANT NOTE! Not complete main chain atoms for residue Q 330 # IMPORTANT NOTE! Not complete main chain atoms for residue T 331 # IMPORTANT NOTE! Not complete main chain atoms for residue A 332 # IMPORTANT NOTE! Not complete main chain atoms for residue K 333 # IMPORTANT NOTE! Not complete main chain atoms for residue E 334 # IMPORTANT NOTE! Not complete main chain atoms for residue V 335 # IMPORTANT NOTE! Not complete main chain atoms for residue F 336 # IMPORTANT NOTE! Not complete main chain atoms for residue E 337 # IMPORTANT NOTE! Not complete main chain atoms for residue N 338 # IMPORTANT NOTE! Not complete main chain atoms for residue E 339 # IMPORTANT NOTE! Not complete main chain atoms for residue K 340 # IMPORTANT NOTE! Not complete main chain atoms for residue I 341 # IMPORTANT NOTE! Not complete main chain atoms for residue V 342 # IMPORTANT NOTE! Not complete main chain atoms for residue V 343 # IMPORTANT NOTE! Not complete main chain atoms for residue I 344 # IMPORTANT NOTE! Not complete main chain atoms for residue F 345 # IMPORTANT NOTE! Not complete main chain atoms for residue K 362 # IMPORTANT NOTE! Not complete main chain atoms for residue A 363 # IMPORTANT NOTE! Not complete main chain atoms for residue L 364 # IMPORTANT NOTE! Not complete main chain atoms for residue Q 365 # IMPORTANT NOTE! Not complete main chain atoms for residue L 366 # IMPORTANT NOTE! Not complete main chain atoms for residue A 367 # IMPORTANT NOTE! Not complete main chain atoms for residue D 368 # IMPORTANT NOTE! Not complete main chain atoms for residue E 369 # IMPORTANT NOTE! Not complete main chain atoms for residue V 370 # IMPORTANT NOTE! Not complete main chain atoms for residue V 371 # IMPORTANT NOTE! Not complete main chain atoms for residue V 372 # IMPORTANT NOTE! Not complete main chain atoms for residue T 373 # IMPORTANT NOTE! Not complete main chain atoms for residue E 374 # IMPORTANT NOTE! Not complete main chain atoms for residue V 375 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 376 # IMPORTANT NOTE! Not complete main chain atoms for residue D 377 # IMPORTANT NOTE! Not complete main chain atoms for residue A 378 # IMPORTANT NOTE! Not complete main chain atoms for residue F 379 # IMPORTANT NOTE! Not complete main chain atoms for residue E 380 # IMPORTANT NOTE! Not complete main chain atoms for residue E 381 # IMPORTANT NOTE! Not complete main chain atoms for residue K 382 # IMPORTANT NOTE! Not complete main chain atoms for residue K 383 # IMPORTANT NOTE! Not complete main chain atoms for residue N 384 # IMPORTANT NOTE! Not complete main chain atoms for residue G 385 # IMPORTANT NOTE! Not complete main chain atoms for residue I 386 # IMPORTANT NOTE! Not complete main chain atoms for residue S 387 # IMPORTANT NOTE! Not complete main chain atoms for residue G 388 # IMPORTANT NOTE! Not complete main chain atoms for residue K 389 # IMPORTANT NOTE! Not complete main chain atoms for residue M 390 # IMPORTANT NOTE! Not complete main chain atoms for residue I 391 # IMPORTANT NOTE! Not complete main chain atoms for residue W 392 # IMPORTANT NOTE! Not complete main chain atoms for residue D 393 # IMPORTANT NOTE! Not complete main chain atoms for residue S 394 # IMPORTANT NOTE! Not complete main chain atoms for residue L 395 # IMPORTANT NOTE! Not complete main chain atoms for residue L 424 # IMPORTANT NOTE! Not complete main chain atoms for residue F 425 # IMPORTANT NOTE! Not complete main chain atoms for residue V 426 # IMPORTANT NOTE! Not complete main chain atoms for residue G 427 # IMPORTANT NOTE! Not complete main chain atoms for residue A 428 # IMPORTANT NOTE! Not complete main chain atoms for residue G 429 # IMPORTANT NOTE! Not complete main chain atoms for residue D 430 # IMPORTANT NOTE! Not complete main chain atoms for residue I 431 # IMPORTANT NOTE! Not complete main chain atoms for residue I 432 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 433 # IMPORTANT NOTE! Not complete main chain atoms for residue S 434 # IMPORTANT NOTE! Not complete main chain atoms for residue S 435 # IMPORTANT NOTE! Not complete main chain atoms for residue R 436 # IMPORTANT NOTE! Not complete main chain atoms for residue R 437 # IMPORTANT NOTE! Not complete main chain atoms for residue F 438 # IMPORTANT NOTE! Not complete main chain atoms for residue V 439 # IMPORTANT NOTE! Not complete main chain atoms for residue E 440 # IMPORTANT NOTE! Not complete main chain atoms for residue R 441 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 442 # IMPORTANT NOTE! Not complete main chain atoms for residue Q 443 # IMPORTANT NOTE! Not complete main chain atoms for residue S 444 # IMPORTANT NOTE! Not complete main chain atoms for residue S 445 # IMPORTANT NOTE! Not complete main chain atoms for residue K 446 # IMPORTANT NOTE! Not complete main chain atoms for residue S 447 # IMPORTANT NOTE! Not complete main chain atoms for residue S 448 # IMPORTANT NOTE! Not complete main chain atoms for residue P 449 # IMPORTANT NOTE! Not complete main chain atoms for residue S 450 # IMPORTANT NOTE! Not complete main chain atoms for residue R 451 # IMPORTANT NOTE! Not complete main chain atoms for residue V 452 # IMPORTANT NOTE! Not complete main chain atoms for residue L 453 # Checking the TS prediction MODEL 1 (DONE) # MODEL index: 1 # Target name: T0185 # Total number of residues in target: 457 # Total number of residues in model: 390 # Total number of atoms in model: 390 # Number of atoms with 1.0 occupancy: 390 # Number of fragments in model: 1 # Number of METHOD records: 1 # No errors. # Number of Warnings: 390 ################################ # # # SUBMISSION # # # ################################ # # # BEGIN # # # ################################ PFRMAT TS TARGET T0185 AUTHOR 5035-2079-5263 METHOD CAFASP MODEL 1 PARENT 1UAG ATOM 6 CA MET 1 69.127 2.585 27.010 1.00 1.00 ATOM 7 CA LYS 2 68.628 3.358 23.326 1.00 1.00 ATOM 8 CA ILE 3 64.850 2.923 23.054 1.00 1.00 ATOM 9 CA HIS 4 63.024 2.807 19.714 1.00 1.00 ATOM 10 CA PHE 5 59.211 2.749 19.532 1.00 1.00 ATOM 11 CA VAL 6 57.411 1.524 16.425 1.00 1.00 ATOM 12 CA GLY 7 53.947 2.996 16.038 1.00 1.00 ATOM 13 CA ILE 8 52.656 6.528 16.284 1.00 1.00 ATOM 14 CA GLY 9 49.127 5.635 17.252 1.00 1.00 ATOM 15 CA GLY 10 47.572 5.403 20.701 1.00 1.00 ATOM 16 CA ILE 11 50.051 2.775 21.925 1.00 1.00 ATOM 17 CA GLY 12 53.102 4.548 20.577 1.00 1.00 ATOM 18 CA MET 13 52.159 7.821 22.267 1.00 1.00 ATOM 19 CA SER 14 51.527 6.190 25.621 1.00 1.00 ATOM 20 CA ALA 15 54.991 4.546 25.360 1.00 1.00 ATOM 21 CA ALA 17 56.632 7.883 24.478 1.00 1.00 ATOM 22 CA LEU 18 55.172 9.359 27.629 1.00 1.00 ATOM 23 CA HIS 19 56.107 6.271 29.647 1.00 1.00 ATOM 24 CA GLU 20 59.753 6.575 28.737 1.00 1.00 ATOM 25 CA PHE 21 59.883 10.354 29.032 1.00 1.00 ATOM 26 CA SER 22 58.532 10.172 32.593 1.00 1.00 ATOM 27 CA ASN 23 61.382 7.733 33.337 1.00 1.00 ATOM 28 CA GLY 24 64.150 10.006 32.106 1.00 1.00 ATOM 29 CA ASN 25 64.482 8.282 28.720 1.00 1.00 ATOM 30 CA ASP 26 63.993 9.983 25.372 1.00 1.00 ATOM 31 CA VAL 27 62.972 7.325 22.828 1.00 1.00 ATOM 32 CA TYR 28 62.919 7.640 19.077 1.00 1.00 ATOM 33 CA GLY 29 59.678 6.716 17.302 1.00 1.00 ATOM 34 CA SER 30 58.990 5.438 13.785 1.00 1.00 ATOM 35 CA ASN 31 55.923 4.389 11.813 1.00 1.00 ATOM 36 CA ILE 32 55.527 3.056 8.279 1.00 1.00 ATOM 37 CA GLU 33 52.523 5.368 7.722 1.00 1.00 ATOM 38 CA GLU 34 53.602 8.595 6.041 1.00 1.00 ATOM 39 CA THR 35 51.309 10.692 8.293 1.00 1.00 ATOM 40 CA GLU 36 50.296 8.566 11.266 1.00 1.00 ATOM 41 CA ARG 37 47.530 9.824 13.589 1.00 1.00 ATOM 42 CA THR 38 49.702 10.498 16.640 1.00 1.00 ATOM 43 CA ALA 39 52.134 12.666 14.658 1.00 1.00 ATOM 44 CA TYR 40 50.310 15.795 15.792 1.00 1.00 ATOM 45 CA LEU 41 50.537 14.957 19.479 1.00 1.00 ATOM 46 CA ARG 42 54.200 13.853 19.630 1.00 1.00 ATOM 47 CA LYS 43 56.344 16.050 21.954 1.00 1.00 ATOM 48 CA LEU 44 58.643 18.196 19.846 1.00 1.00 ATOM 49 CA GLY 45 61.843 16.901 21.435 1.00 1.00 ATOM 50 CA ILE 46 61.138 13.336 20.350 1.00 1.00 ATOM 51 CA PRO 47 62.821 12.305 17.084 1.00 1.00 ATOM 52 CA ILE 48 60.399 10.618 14.691 1.00 1.00 ATOM 53 CA PHE 49 60.626 8.777 11.388 1.00 1.00 ATOM 54 CA VAL 50 57.567 8.145 9.223 1.00 1.00 ATOM 55 CA PRO 51 56.831 6.496 5.903 1.00 1.00 ATOM 56 CA HIS 52 58.998 3.461 6.661 1.00 1.00 ATOM 57 CA SER 53 60.819 1.679 9.428 1.00 1.00 ATOM 58 CA ALA 54 64.312 3.065 9.968 1.00 1.00 ATOM 60 CA ASP 55 69.659 2.448 11.292 1.00 1.00 ATOM 61 CA ASN 56 67.532 3.201 14.333 1.00 1.00 ATOM 62 CA TRP 57 66.345 -0.405 14.700 1.00 1.00 ATOM 63 CA TYR 58 69.785 -1.981 14.467 1.00 1.00 ATOM 64 CA ASP 59 71.154 0.608 16.935 1.00 1.00 ATOM 65 CA PRO 60 68.473 0.029 19.551 1.00 1.00 ATOM 66 CA ASP 61 68.922 -1.602 22.949 1.00 1.00 ATOM 67 CA LEU 62 65.129 -2.102 23.175 1.00 1.00 ATOM 68 CA VAL 63 62.437 -1.974 20.501 1.00 1.00 ATOM 69 CA ILE 64 58.876 -1.332 21.699 1.00 1.00 ATOM 70 CA LYS 65 56.569 -2.556 18.953 1.00 1.00 ATOM 71 CA THR 66 52.959 -1.356 18.856 1.00 1.00 ATOM 72 CA PRO 67 50.503 -4.214 18.172 1.00 1.00 ATOM 73 CA ALA 68 49.851 -2.828 14.693 1.00 1.00 ATOM 74 CA VAL 69 53.315 -3.766 13.342 1.00 1.00 ATOM 75 CA ARG 70 53.958 -7.436 12.526 1.00 1.00 ATOM 76 CA ASP 71 56.995 -8.973 14.259 1.00 1.00 ATOM 77 CA ASP 72 57.594 -10.723 10.916 1.00 1.00 ATOM 78 CA ASN 73 58.255 -7.371 9.263 1.00 1.00 ATOM 79 CA PRO 74 61.654 -8.014 7.666 1.00 1.00 ATOM 80 CA GLU 75 63.191 -4.959 9.374 1.00 1.00 ATOM 81 CA ILE 76 61.944 -6.193 12.723 1.00 1.00 ATOM 82 CA VAL 77 62.967 -9.824 12.182 1.00 1.00 ATOM 83 CA ARG 78 66.454 -8.546 11.278 1.00 1.00 ATOM 84 CA ALA 79 66.693 -6.838 14.689 1.00 1.00 ATOM 85 CA ARG 80 65.352 -9.960 16.457 1.00 1.00 ATOM 86 CA MET 81 67.970 -11.973 14.558 1.00 1.00 ATOM 87 CA GLU 82 70.621 -9.590 15.907 1.00 1.00 ATOM 88 CA ARG 83 69.414 -10.362 19.425 1.00 1.00 ATOM 89 CA VAL 84 67.802 -6.978 19.967 1.00 1.00 ATOM 90 CA PRO 85 65.046 -7.207 22.570 1.00 1.00 ATOM 91 CA ILE 86 61.508 -6.503 21.321 1.00 1.00 ATOM 92 CA GLU 87 58.592 -5.939 23.669 1.00 1.00 ATOM 93 CA ASN 88 55.231 -4.207 23.371 1.00 1.00 ATOM 94 CA ARG 89 53.373 -1.916 25.753 1.00 1.00 ATOM 95 CA LEU 90 51.600 -4.778 27.588 1.00 1.00 ATOM 96 CA HIS 91 55.027 -6.221 28.366 1.00 1.00 ATOM 97 CA TYR 92 56.181 -2.870 29.747 1.00 1.00 ATOM 98 CA PHE 93 52.979 -2.676 31.778 1.00 1.00 ATOM 99 CA ARG 94 53.441 -6.175 33.281 1.00 1.00 ATOM 100 CA ASP 95 56.935 -5.229 34.492 1.00 1.00 ATOM 101 CA THR 96 55.518 -2.171 36.290 1.00 1.00 ATOM 102 CA LEU 97 52.091 -3.318 37.516 1.00 1.00 ATOM 103 CA LYS 98 51.828 -4.003 41.267 1.00 1.00 ATOM 104 CA LYS 102 48.288 -5.476 41.532 1.00 1.00 ATOM 105 CA GLU 103 46.722 -8.697 40.149 1.00 1.00 ATOM 106 CA GLU 104 45.836 -8.751 36.445 1.00 1.00 ATOM 107 CA PHE 105 42.770 -10.407 34.913 1.00 1.00 ATOM 108 CA ALA 106 43.576 -10.932 31.250 1.00 1.00 ATOM 109 CA VAL 107 40.950 -11.506 28.547 1.00 1.00 ATOM 110 CA THR 108 41.291 -12.357 24.870 1.00 1.00 ATOM 111 CA GLY 109 39.064 -14.011 22.309 1.00 1.00 ATOM 112 CA THR 110 37.737 -13.430 18.825 1.00 1.00 ATOM 113 CA ASP 111 34.446 -12.017 20.173 1.00 1.00 ATOM 114 CA GLY 112 33.125 -11.062 23.621 1.00 1.00 ATOM 115 CA LYS 113 36.444 -9.553 24.750 1.00 1.00 ATOM 116 CA THR 114 35.341 -6.017 25.610 1.00 1.00 ATOM 117 CA THR 115 32.047 -7.206 27.095 1.00 1.00 ATOM 118 CA THR 116 33.785 -9.641 29.488 1.00 1.00 ATOM 119 CA THR 117 36.574 -7.141 30.255 1.00 1.00 ATOM 120 CA ALA 118 34.023 -4.449 31.161 1.00 1.00 ATOM 121 CA MET 119 31.926 -6.891 33.156 1.00 1.00 ATOM 122 CA VAL 120 34.891 -7.915 35.296 1.00 1.00 ATOM 123 CA ALA 121 35.664 -4.236 35.816 1.00 1.00 ATOM 124 CA HIS 122 32.062 -3.644 36.940 1.00 1.00 ATOM 125 CA VAL 123 32.223 -6.622 39.283 1.00 1.00 ATOM 126 CA LEU 124 35.416 -5.193 40.839 1.00 1.00 ATOM 127 CA LYS 125 33.790 -1.794 41.273 1.00 1.00 ATOM 128 CA HIS 126 30.687 -3.410 42.808 1.00 1.00 ATOM 129 CA LEU 127 33.035 -4.922 45.400 1.00 1.00 ATOM 130 CA ARG 128 34.598 -1.504 46.118 1.00 1.00 ATOM 131 CA LYS 129 37.909 -2.541 44.506 1.00 1.00 ATOM 132 CA SER 130 40.045 0.152 42.859 1.00 1.00 ATOM 133 CA PRO 131 40.223 -1.358 39.379 1.00 1.00 ATOM 134 CA THR 132 42.012 -0.232 36.225 1.00 1.00 ATOM 135 CA VAL 133 40.396 -1.404 32.973 1.00 1.00 ATOM 136 CA PHE 134 42.207 -1.020 29.627 1.00 1.00 ATOM 137 CA GLY 137 44.324 -2.640 26.941 1.00 1.00 ATOM 138 CA ILE 138 42.899 -3.430 23.514 1.00 1.00 ATOM 139 CA MET 139 39.505 -2.170 24.722 1.00 1.00 ATOM 140 CA ASP 140 40.958 1.249 23.930 1.00 1.00 ATOM 141 CA SER 141 42.736 2.764 26.939 1.00 1.00 ATOM 142 CA LEU 142 46.486 2.052 26.643 1.00 1.00 ATOM 143 CA GLU 143 47.470 -0.191 29.558 1.00 1.00 ATOM 144 CA HIS 144 50.450 1.950 30.595 1.00 1.00 ATOM 145 CA GLY 145 47.911 4.716 31.305 1.00 1.00 ATOM 146 CA ASN 146 46.307 2.491 33.938 1.00 1.00 ATOM 147 CA TYR 147 49.435 2.287 36.107 1.00 1.00 ATOM 148 CA GLU 148 48.461 3.612 39.506 1.00 1.00 ATOM 149 CA LYS 149 49.787 2.703 42.929 1.00 1.00 ATOM 150 CA GLY 150 46.336 2.814 44.472 1.00 1.00 ATOM 151 CA ASN 151 45.055 0.341 41.920 1.00 1.00 ATOM 152 CA GLY 152 44.076 -3.025 43.399 1.00 1.00 ATOM 153 CA PRO 153 43.172 -4.985 40.271 1.00 1.00 ATOM 154 CA VAL 154 43.882 -4.572 36.577 1.00 1.00 ATOM 155 CA VAL 155 41.521 -5.939 33.964 1.00 1.00 ATOM 156 CA TYR 156 43.160 -6.172 30.538 1.00 1.00 ATOM 157 CA GLU 157 41.553 -6.937 27.224 1.00 1.00 ATOM 158 CA LEU 158 44.415 -8.353 25.079 1.00 1.00 ATOM 159 CA ASP 159 44.623 -9.022 21.346 1.00 1.00 ATOM 160 CA GLU 160 46.694 -11.797 19.797 1.00 1.00 ATOM 161 CA SER 161 48.986 -8.995 18.512 1.00 1.00 ATOM 162 CA GLU 162 49.657 -7.700 22.030 1.00 1.00 ATOM 164 CA GLU 163 52.851 -11.941 20.701 1.00 1.00 ATOM 165 CA PHE 164 55.119 -9.351 22.295 1.00 1.00 ATOM 166 CA PHE 165 54.330 -10.118 25.937 1.00 1.00 ATOM 167 CA SER 166 56.510 -12.417 28.051 1.00 1.00 ATOM 168 CA GLU 167 56.022 -11.275 31.677 1.00 1.00 ATOM 169 CA PHE 168 52.257 -11.713 32.031 1.00 1.00 ATOM 170 CA SER 169 51.325 -13.846 35.013 1.00 1.00 ATOM 171 CA PRO 170 47.557 -13.356 35.155 1.00 1.00 ATOM 172 CA ASN 171 45.643 -14.178 38.340 1.00 1.00 ATOM 173 CA TYR 172 42.973 -15.332 35.890 1.00 1.00 ATOM 174 CA LEU 173 43.188 -15.620 32.110 1.00 1.00 ATOM 175 CA ILE 174 40.691 -16.602 29.400 1.00 1.00 ATOM 176 CA ILE 175 40.503 -17.131 25.686 1.00 1.00 ATOM 177 CA THR 176 36.754 -16.735 25.116 1.00 1.00 ATOM 178 CA ASN 177 36.704 -18.273 21.648 1.00 1.00 ATOM 179 CA ALA 178 38.904 -18.624 18.592 1.00 1.00 ATOM 180 CA ARG 179 37.462 -17.825 15.182 1.00 1.00 ATOM 181 CA GLY 180 39.155 -16.674 11.987 1.00 1.00 ATOM 182 CA ASP 181 40.478 -13.133 12.229 1.00 1.00 ATOM 183 CA HIS 182 43.579 -11.120 11.300 1.00 1.00 ATOM 184 CA LEU 183 44.603 -13.620 8.619 1.00 1.00 ATOM 185 CA GLU 184 46.501 -10.795 6.950 1.00 1.00 ATOM 186 CA ASN 185 48.846 -10.873 9.983 1.00 1.00 ATOM 187 CA TYR 186 49.069 -14.649 10.313 1.00 1.00 ATOM 188 CA GLY 187 50.366 -16.310 7.132 1.00 1.00 ATOM 189 CA ASN 188 50.448 -19.598 9.008 1.00 1.00 ATOM 190 CA SER 189 46.699 -19.300 9.436 1.00 1.00 ATOM 191 CA LEU 190 44.338 -20.190 12.236 1.00 1.00 ATOM 192 CA THR 191 46.777 -22.159 14.328 1.00 1.00 ATOM 193 CA ARG 192 49.309 -19.312 14.343 1.00 1.00 ATOM 194 CA TYR 193 46.588 -16.889 15.404 1.00 1.00 ATOM 195 CA ARG 194 45.509 -19.376 18.102 1.00 1.00 ATOM 196 CA SER 195 49.105 -19.771 19.218 1.00 1.00 ATOM 197 CA ALA 196 49.362 -16.022 19.901 1.00 1.00 ATOM 199 CA GLU 198 47.404 -19.233 23.945 1.00 1.00 ATOM 200 CA LYS 199 50.276 -17.144 25.367 1.00 1.00 ATOM 201 CA ILE 200 47.743 -15.577 27.710 1.00 1.00 ATOM 202 CA SER 201 47.676 -18.784 29.782 1.00 1.00 ATOM 203 CA ARG 202 51.418 -18.862 30.456 1.00 1.00 ATOM 204 CA ASN 203 52.002 -18.563 34.160 1.00 1.00 ATOM 205 CA THR 204 48.359 -17.710 34.772 1.00 1.00 ATOM 206 CA ASP 205 47.161 -18.778 38.229 1.00 1.00 ATOM 207 CA LEU 206 43.724 -19.798 36.930 1.00 1.00 ATOM 208 CA VAL 207 43.006 -20.446 33.244 1.00 1.00 ATOM 209 CA VAL 208 39.364 -20.193 32.169 1.00 1.00 ATOM 210 CA THR 209 38.493 -22.020 28.985 1.00 1.00 ATOM 211 CA PHE 210 35.428 -22.329 26.742 1.00 1.00 ATOM 212 CA ALA 211 34.238 -25.940 27.058 1.00 1.00 ATOM 213 CA GLU 212 32.384 -25.539 23.751 1.00 1.00 ATOM 214 CA ASP 213 35.512 -24.248 21.928 1.00 1.00 ATOM 215 CA GLU 214 38.421 -26.684 21.889 1.00 1.00 ATOM 216 CA LEU 215 40.825 -24.089 20.465 1.00 1.00 ATOM 217 CA THR 216 40.573 -22.049 23.670 1.00 1.00 ATOM 218 CA SER 217 42.211 -24.889 25.563 1.00 1.00 ATOM 219 CA HIS 218 45.942 -25.197 26.302 1.00 1.00 ATOM 220 CA LEU 219 47.804 -27.708 24.147 1.00 1.00 ATOM 226 CA GLY 220 43.221 -28.282 34.497 1.00 1.00 ATOM 227 CA ASP 221 41.392 -25.080 33.519 1.00 1.00 ATOM 228 CA VAL 222 38.112 -23.788 34.970 1.00 1.00 ATOM 229 CA THR 223 35.550 -24.048 32.174 1.00 1.00 ATOM 230 CA PHE 224 32.385 -22.270 31.114 1.00 1.00 ATOM 231 CA GLY 225 29.988 -23.472 28.450 1.00 1.00 ATOM 232 CA VAL 226 26.346 -23.750 27.460 1.00 1.00 ATOM 233 CA LYS 227 25.476 -27.272 28.546 1.00 1.00 ATOM 234 CA LYS 228 28.848 -28.178 29.958 1.00 1.00 ATOM 235 CA GLY 229 31.448 -26.461 32.101 1.00 1.00 ATOM 236 CA THR 230 32.112 -25.496 35.710 1.00 1.00 ATOM 237 CA TYR 231 30.065 -22.452 34.804 1.00 1.00 ATOM 238 CA THR 232 27.173 -23.314 32.499 1.00 1.00 ATOM 239 CA LEU 233 23.593 -22.446 31.576 1.00 1.00 ATOM 240 CA GLU 234 20.481 -24.217 32.916 1.00 1.00 ATOM 245 CA GLN 243 14.001 -18.926 31.066 1.00 1.00 ATOM 246 CA LYS 244 17.781 -19.244 31.475 1.00 1.00 ATOM 247 CA ALA 245 19.916 -19.584 34.544 1.00 1.00 ATOM 248 CA MET 246 23.598 -19.076 35.104 1.00 1.00 ATOM 249 CA VAL 247 24.849 -22.009 37.189 1.00 1.00 ATOM 250 CA GLU 248 28.119 -22.801 38.860 1.00 1.00 ATOM 251 CA LYS 249 28.587 -26.548 39.283 1.00 1.00 ATOM 252 CA ASN 250 24.881 -27.322 39.231 1.00 1.00 ATOM 253 CA GLY 251 23.806 -24.558 41.622 1.00 1.00 ATOM 254 CA LYS 252 21.631 -21.740 40.190 1.00 1.00 ATOM 255 CA ARG 253 23.253 -18.358 40.804 1.00 1.00 ATOM 256 CA TYR 254 21.322 -16.004 38.486 1.00 1.00 ATOM 257 CA LEU 255 18.140 -15.967 36.427 1.00 1.00 ATOM 258 CA GLU 256 19.189 -14.077 33.279 1.00 1.00 ATOM 259 CA LEU 257 15.944 -12.079 33.340 1.00 1.00 ATOM 260 CA LYS 258 17.831 -9.975 35.877 1.00 1.00 ATOM 261 CA LEU 259 20.450 -9.105 33.246 1.00 1.00 ATOM 262 CA LYS 260 20.118 -6.162 30.888 1.00 1.00 ATOM 263 CA VAL 261 22.188 -8.076 28.313 1.00 1.00 ATOM 264 CA PRO 262 20.444 -10.729 26.227 1.00 1.00 ATOM 265 CA GLY 263 21.386 -13.533 23.897 1.00 1.00 ATOM 266 CA PHE 264 23.066 -16.830 24.686 1.00 1.00 ATOM 267 CA HIS 265 26.509 -15.627 23.670 1.00 1.00 ATOM 268 CA ASN 266 26.126 -12.866 26.234 1.00 1.00 ATOM 269 CA VAL 267 25.107 -15.375 28.915 1.00 1.00 ATOM 270 CA LEU 268 28.271 -17.332 28.286 1.00 1.00 ATOM 271 CA ASN 269 30.121 -13.949 28.393 1.00 1.00 ATOM 272 CA ALA 270 28.537 -13.416 31.802 1.00 1.00 ATOM 273 CA LEU 271 29.698 -16.924 32.840 1.00 1.00 ATOM 274 CA ALA 272 33.273 -16.187 31.685 1.00 1.00 ATOM 275 CA VAL 273 33.236 -12.896 33.549 1.00 1.00 ATOM 276 CA ILE 274 31.967 -14.569 36.737 1.00 1.00 ATOM 277 CA ALA 275 34.606 -17.300 36.440 1.00 1.00 ATOM 278 CA LEU 276 37.365 -14.688 36.167 1.00 1.00 ATOM 279 CA PHE 277 35.934 -12.549 38.997 1.00 1.00 ATOM 280 CA ASP 278 35.701 -15.597 41.272 1.00 1.00 ATOM 281 CA SER 279 39.325 -16.536 40.478 1.00 1.00 ATOM 282 CA LEU 280 40.501 -12.989 41.112 1.00 1.00 ATOM 283 CA GLY 281 38.894 -13.347 44.533 1.00 1.00 ATOM 284 CA TYR 282 35.979 -10.935 44.091 1.00 1.00 ATOM 285 CA ASP 283 32.871 -11.673 46.188 1.00 1.00 ATOM 286 CA LEU 284 30.273 -13.471 44.051 1.00 1.00 ATOM 287 CA ALA 285 27.296 -11.534 45.395 1.00 1.00 ATOM 288 CA PRO 286 28.580 -8.145 44.211 1.00 1.00 ATOM 289 CA VAL 287 29.792 -9.805 40.996 1.00 1.00 ATOM 290 CA LEU 288 26.228 -11.018 40.300 1.00 1.00 ATOM 291 CA GLU 289 24.984 -7.528 41.119 1.00 1.00 ATOM 292 CA ALA 290 27.163 -5.991 38.395 1.00 1.00 ATOM 293 CA LEU 291 25.755 -8.542 35.922 1.00 1.00 ATOM 294 CA GLU 292 22.289 -7.076 36.523 1.00 1.00 ATOM 295 CA GLU 293 23.363 -3.435 36.040 1.00 1.00 ATOM 296 CA PHE 294 25.563 -3.610 32.932 1.00 1.00 ATOM 297 CA ARG 295 23.670 -2.300 29.890 1.00 1.00 ATOM 298 CA GLY 296 26.205 -3.076 27.140 1.00 1.00 ATOM 299 CA VAL 297 28.801 -1.235 25.039 1.00 1.00 ATOM 300 CA HIS 298 28.449 1.343 22.279 1.00 1.00 ATOM 301 CA ARG 299 28.686 -0.154 18.769 1.00 1.00 ATOM 302 CA ARG 300 27.933 -3.605 20.163 1.00 1.00 ATOM 303 CA PHE 301 24.496 -4.554 18.852 1.00 1.00 ATOM 304 CA SER 302 23.419 -1.060 19.913 1.00 1.00 ATOM 305 CA ILE 303 19.906 0.128 19.012 1.00 1.00 ATOM 306 CA ALA 304 20.494 3.651 17.766 1.00 1.00 ATOM 307 CA ASP 307 16.916 4.337 16.546 1.00 1.00 ATOM 308 CA PRO 308 13.624 2.549 16.916 1.00 1.00 ATOM 309 CA GLU 309 11.050 4.451 14.965 1.00 1.00 ATOM 310 CA THR 310 8.033 3.663 12.814 1.00 1.00 ATOM 311 CA ASN 311 8.362 0.011 13.746 1.00 1.00 ATOM 312 CA ILE 312 11.988 -0.204 12.595 1.00 1.00 ATOM 313 CA TYR 313 15.076 -0.841 14.695 1.00 1.00 ATOM 314 CA VAL 314 18.403 0.479 13.402 1.00 1.00 ATOM 315 CA ILE 315 21.166 -1.447 15.118 1.00 1.00 ATOM 316 CA ASP 316 24.765 -0.353 15.367 1.00 1.00 ATOM 317 CA ASP 317 26.936 -3.472 15.614 1.00 1.00 ATOM 318 CA HIS 320 29.952 -1.714 14.095 1.00 1.00 ATOM 319 CA THR 321 32.127 -3.593 16.650 1.00 1.00 ATOM 320 CA PRO 322 31.517 -6.739 14.576 1.00 1.00 ATOM 321 CA ASP 323 34.882 -6.650 12.820 1.00 1.00 ATOM 322 CA GLU 324 35.091 -10.353 12.078 1.00 1.00 ATOM 323 CA ILE 325 32.875 -13.160 10.806 1.00 1.00 ATOM 324 CA ARG 326 32.347 -14.738 14.200 1.00 1.00 ATOM 325 CA ASN 327 31.068 -11.476 15.691 1.00 1.00 ATOM 326 CA LEU 328 28.526 -10.998 12.885 1.00 1.00 ATOM 327 CA LEU 329 27.462 -14.641 13.332 1.00 1.00 ATOM 328 CA GLN 330 26.720 -13.882 16.990 1.00 1.00 ATOM 329 CA THR 331 24.434 -11.046 15.810 1.00 1.00 ATOM 330 CA ALA 332 22.628 -13.129 13.173 1.00 1.00 ATOM 331 CA LYS 333 22.469 -16.455 14.943 1.00 1.00 ATOM 332 CA GLU 334 18.980 -16.710 16.404 1.00 1.00 ATOM 333 CA VAL 335 18.086 -13.160 15.348 1.00 1.00 ATOM 335 CA PHE 336 13.199 -10.043 12.607 1.00 1.00 ATOM 336 CA GLU 337 9.497 -9.427 11.948 1.00 1.00 ATOM 337 CA ASN 338 9.911 -8.101 8.431 1.00 1.00 ATOM 338 CA GLU 339 13.055 -7.837 6.322 1.00 1.00 ATOM 339 CA LYS 340 16.613 -7.641 7.658 1.00 1.00 ATOM 340 CA ILE 341 18.605 -5.040 5.832 1.00 1.00 ATOM 341 CA VAL 342 22.136 -6.199 6.573 1.00 1.00 ATOM 342 CA VAL 343 25.125 -3.931 5.909 1.00 1.00 ATOM 343 CA ILE 344 28.396 -5.741 5.355 1.00 1.00 ATOM 344 CA PHE 345 31.690 -4.243 4.291 1.00 1.00 ATOM 345 CA LYS 362 35.179 -2.945 4.824 1.00 1.00 ATOM 346 CA ALA 363 38.522 -4.658 5.070 1.00 1.00 ATOM 347 CA LEU 364 37.853 -8.356 5.533 1.00 1.00 ATOM 348 CA GLN 365 41.491 -9.108 6.435 1.00 1.00 ATOM 349 CA LEU 366 41.462 -12.172 4.121 1.00 1.00 ATOM 350 CA ALA 367 38.663 -13.859 6.045 1.00 1.00 ATOM 351 CA ASP 368 36.431 -16.533 4.570 1.00 1.00 ATOM 352 CA GLU 369 32.954 -14.945 4.669 1.00 1.00 ATOM 353 CA VAL 370 31.151 -18.137 3.679 1.00 1.00 ATOM 354 CA VAL 371 30.144 -19.013 7.262 1.00 1.00 ATOM 355 CA VAL 372 27.659 -16.125 7.017 1.00 1.00 ATOM 356 CA THR 373 25.871 -17.722 4.046 1.00 1.00 ATOM 357 CA GLU 374 23.663 -20.000 6.161 1.00 1.00 ATOM 358 CA VAL 375 22.102 -16.982 7.832 1.00 1.00 ATOM 359 CA TYR 376 21.157 -15.208 4.637 1.00 1.00 ATOM 362 CA ASP 377 12.643 -13.941 1.420 1.00 1.00 ATOM 363 CA ALA 378 13.329 -11.570 4.293 1.00 1.00 ATOM 364 CA PHE 379 16.985 -10.660 3.865 1.00 1.00 ATOM 365 CA GLU 380 18.643 -7.871 1.936 1.00 1.00 ATOM 366 CA GLU 381 22.439 -7.345 1.805 1.00 1.00 ATOM 367 CA LYS 382 24.103 -3.992 1.217 1.00 1.00 ATOM 368 CA LYS 383 27.841 -4.517 0.771 1.00 1.00 ATOM 369 CA ASN 384 30.479 -1.798 0.667 1.00 1.00 ATOM 370 CA GLY 385 34.109 -0.912 1.273 1.00 1.00 ATOM 371 CA ILE 386 37.155 -2.835 0.162 1.00 1.00 ATOM 372 CA SER 387 35.600 -6.294 0.191 1.00 1.00 ATOM 373 CA GLY 388 32.077 -5.277 -0.784 1.00 1.00 ATOM 374 CA LYS 389 32.047 -7.514 -3.889 1.00 1.00 ATOM 375 CA MET 390 33.062 -10.668 -2.009 1.00 1.00 ATOM 376 CA ILE 391 30.414 -9.940 0.597 1.00 1.00 ATOM 377 CA TRP 392 27.701 -9.419 -2.040 1.00 1.00 ATOM 378 CA ASP 393 28.689 -12.736 -3.634 1.00 1.00 ATOM 379 CA SER 394 27.443 -14.433 -0.467 1.00 1.00 ATOM 380 CA LEU 395 24.005 -14.279 -2.012 1.00 1.00 ATOM 381 CA LEU 424 24.053 -12.301 -5.229 1.00 1.00 ATOM 382 CA PHE 425 20.291 -12.202 -5.832 1.00 1.00 ATOM 383 CA VAL 426 19.588 -10.348 -2.581 1.00 1.00 ATOM 384 CA GLY 427 22.710 -8.158 -2.484 1.00 1.00 ATOM 385 CA ALA 428 23.548 -4.582 -3.461 1.00 1.00 ATOM 386 CA GLY 429 27.122 -3.322 -3.589 1.00 1.00 ATOM 387 CA ASP 430 28.134 0.305 -3.127 1.00 1.00 ATOM 388 CA ILE 431 31.425 2.025 -2.520 1.00 1.00 ATOM 389 CA ILE 432 30.487 3.531 0.811 1.00 1.00 ATOM 390 CA TYR 433 28.308 2.819 3.805 1.00 1.00 ATOM 391 CA SER 434 26.537 6.128 3.224 1.00 1.00 ATOM 392 CA SER 435 25.557 5.128 -0.321 1.00 1.00 ATOM 393 CA ARG 436 24.354 1.762 1.041 1.00 1.00 ATOM 394 CA ARG 437 22.210 3.473 3.739 1.00 1.00 ATOM 395 CA PHE 438 20.616 5.880 1.245 1.00 1.00 ATOM 396 CA VAL 439 19.987 2.901 -1.019 1.00 1.00 ATOM 397 CA GLU 440 18.306 0.747 1.624 1.00 1.00 ATOM 398 CA ARG 441 16.402 3.526 3.436 1.00 1.00 ATOM 399 CA TYR 442 13.573 3.934 0.807 1.00 1.00 ATOM 400 CA GLN 443 12.995 0.180 1.004 1.00 1.00 ATOM 401 CA SER 444 12.612 -0.049 4.787 1.00 1.00 ATOM 402 CA SER 445 9.107 -1.043 5.969 1.00 1.00 ATOM 403 CA LYS 446 7.572 -1.275 9.515 1.00 1.00 ATOM 404 CA SER 447 8.774 -4.506 11.142 1.00 1.00 ATOM 405 CA SER 448 12.119 -4.412 9.302 1.00 1.00 ATOM 406 CA PRO 449 15.531 -4.336 10.959 1.00 1.00 ATOM 407 CA SER 450 18.520 -2.345 9.691 1.00 1.00 ATOM 408 CA ARG 451 21.707 -3.961 11.040 1.00 1.00 ATOM 409 CA VAL 452 25.268 -2.689 10.609 1.00 1.00 ATOM 410 CA LEU 453 27.257 -5.841 11.422 1.00 1.00 TER END ################################ # # # END # # # ################################ From mailer@bialko.llnl.gov Wed Aug 21 10:53:09 2002 Date: Wed, 21 Aug 2002 10:53:02 -0700 (PDT) From: Automatic Reply To: karplus@soe.ucsc.edu Subject: T0185 TS samt02.pdb 2 X-SpamBouncer: 1.4 (10/07/01) X-SBPass: NoBounce X-SBClass: OK # # Protein Structure Prediction Center, LLNL, Livermore, CA # Verification system Wed Aug 21 10:24:54 PDT 2002 by Adam Zemla # # The PIN number of your submission is: PIN_401671_29771 # (PIN number is not an ACCESSION CODE) # Thank you for your submission. Your prediction has been accepted with an ACCESSION CODE: T0185TS189_2 Current information on models submitted in prediction T0185TS189 MODEL_INDEX PIN CODE DATE E-mail T0185TS189_2 PIN_401671_29771 5035-2079-5263 08/21/02 10:24:54 casp5@bialko.llnl.gov PLEASE NOTE: Submission of a duplicate prediction (same target, format, model index) will REPLACE an existing submission (ACCESSION CODE), provided it is received before the target has expired. The current status of models accepted for target T0185 MODEL_INDEX PIN CODE DATE E-mail T0185TS189_2 PIN_401671_29771 5035-2079-5263 08/21/02 10:24:54 casp5@bialko.llnl.gov For more information on accepted models submitted to CASP5 see: http://PredictionCenter.llnl.gov/casp5/models/casp5-models.html Please check below if the verified data of your submission is correct. # Reading prediction format TS PFRMAT TS TARGET T0185 AUTHOR 5035-2079-5263 # Reading MODEL 2 PARENT 1E8C_A # Loading PARENT structure: 1e8c (chain: A) # Number of residues in PARENT structure: 482 # Reading prediction format TS (DONE) # Checking the TS prediction MODEL 2 # IMPORTANT NOTE! Not complete main chain atoms for residue N 25 # !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! # # It is requested that coordinate data be supplied for at least # # all non-hydrogen main chain atoms, i.e. the N, CA, C and O # # atoms of every residue. Specifically, if only CA atoms are # # predicted by the method, predictors are encouraged to build # # the main chain atoms for every residue before submission to # # CASP. If only CA atoms were submitted it would not be possible # # to run most of the analysis software, which would severely # # limit the evaluation of that prediction. # # !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! # # IMPORTANT NOTE! Not complete main chain atoms for residue D 26 # IMPORTANT NOTE! Not complete main chain atoms for residue V 27 # IMPORTANT NOTE! Not complete main chain atoms for residue G 29 # IMPORTANT NOTE! Not complete main chain atoms for residue S 30 # IMPORTANT NOTE! Not complete main chain atoms for residue N 31 # IMPORTANT NOTE! Not complete main chain atoms for residue I 32 # IMPORTANT NOTE! Not complete main chain atoms for residue E 33 # IMPORTANT NOTE! Not complete main chain atoms for residue E 34 # IMPORTANT NOTE! Not complete main chain atoms for residue T 35 # IMPORTANT NOTE! Not complete main chain atoms for residue E 36 # IMPORTANT NOTE! Not complete main chain atoms for residue R 37 # IMPORTANT NOTE! Not complete main chain atoms for residue T 38 # IMPORTANT NOTE! Not complete main chain atoms for residue A 39 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 40 # IMPORTANT NOTE! Not complete main chain atoms for residue L 41 # IMPORTANT NOTE! Not complete main chain atoms for residue R 42 # IMPORTANT NOTE! Not complete main chain atoms for residue K 43 # IMPORTANT NOTE! Not complete main chain atoms for residue L 44 # IMPORTANT NOTE! Not complete main chain atoms for residue G 45 # IMPORTANT NOTE! Not complete main chain atoms for residue I 46 # IMPORTANT NOTE! Not complete main chain atoms for residue P 47 # IMPORTANT NOTE! Not complete main chain atoms for residue I 48 # IMPORTANT NOTE! Not complete main chain atoms for residue F 49 # IMPORTANT NOTE! Not complete main chain atoms for residue V 50 # IMPORTANT NOTE! Not complete main chain atoms for residue P 51 # IMPORTANT NOTE! Not complete main chain atoms for residue H 52 # IMPORTANT NOTE! Not complete main chain atoms for residue S 53 # IMPORTANT NOTE! Not complete main chain atoms for residue A 54 # IMPORTANT NOTE! Not complete main chain atoms for residue D 55 # IMPORTANT NOTE! Not complete main chain atoms for residue N 56 # IMPORTANT NOTE! Not complete main chain atoms for residue W 57 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 58 # IMPORTANT NOTE! Not complete main chain atoms for residue D 59 # IMPORTANT NOTE! Not complete main chain atoms for residue P 60 # IMPORTANT NOTE! Not complete main chain atoms for residue D 61 # IMPORTANT NOTE! Not complete main chain atoms for residue L 62 # IMPORTANT NOTE! Not complete main chain atoms for residue V 63 # IMPORTANT NOTE! Not complete main chain atoms for residue I 64 # IMPORTANT NOTE! Not complete main chain atoms for residue K 65 # IMPORTANT NOTE! Not complete main chain atoms for residue T 66 # IMPORTANT NOTE! Not complete main chain atoms for residue P 67 # IMPORTANT NOTE! Not complete main chain atoms for residue A 68 # IMPORTANT NOTE! Not complete main chain atoms for residue V 69 # IMPORTANT NOTE! Not complete main chain atoms for residue R 70 # IMPORTANT NOTE! Not complete main chain atoms for residue D 71 # IMPORTANT NOTE! Not complete main chain atoms for residue N 73 # IMPORTANT NOTE! Not complete main chain atoms for residue P 74 # IMPORTANT NOTE! Not complete main chain atoms for residue E 75 # IMPORTANT NOTE! Not complete main chain atoms for residue I 76 # IMPORTANT NOTE! Not complete main chain atoms for residue V 77 # IMPORTANT NOTE! Not complete main chain atoms for residue R 78 # IMPORTANT NOTE! Not complete main chain atoms for residue A 79 # IMPORTANT NOTE! Not complete main chain atoms for residue R 80 # IMPORTANT NOTE! Not complete main chain atoms for residue M 81 # IMPORTANT NOTE! Not complete main chain atoms for residue E 82 # IMPORTANT NOTE! Not complete main chain atoms for residue R 83 # IMPORTANT NOTE! Not complete main chain atoms for residue V 84 # IMPORTANT NOTE! Not complete main chain atoms for residue P 85 # IMPORTANT NOTE! Not complete main chain atoms for residue I 86 # IMPORTANT NOTE! Not complete main chain atoms for residue E 87 # IMPORTANT NOTE! Not complete main chain atoms for residue N 88 # IMPORTANT NOTE! Not complete main chain atoms for residue R 89 # IMPORTANT NOTE! Not complete main chain atoms for residue L 90 # IMPORTANT NOTE! Not complete main chain atoms for residue H 91 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 92 # IMPORTANT NOTE! Not complete main chain atoms for residue F 93 # IMPORTANT NOTE! Not complete main chain atoms for residue R 94 # IMPORTANT NOTE! Not complete main chain atoms for residue D 95 # IMPORTANT NOTE! Not complete main chain atoms for residue T 96 # IMPORTANT NOTE! Not complete main chain atoms for residue L 97 # IMPORTANT NOTE! Not complete main chain atoms for residue K 98 # IMPORTANT NOTE! Not complete main chain atoms for residue R 99 # IMPORTANT NOTE! Not complete main chain atoms for residue E 100 # IMPORTANT NOTE! Not complete main chain atoms for residue K 101 # IMPORTANT NOTE! Not complete main chain atoms for residue K 102 # IMPORTANT NOTE! Not complete main chain atoms for residue E 103 # IMPORTANT NOTE! Not complete main chain atoms for residue E 104 # IMPORTANT NOTE! Not complete main chain atoms for residue F 105 # IMPORTANT NOTE! Not complete main chain atoms for residue A 106 # IMPORTANT NOTE! Not complete main chain atoms for residue V 107 # IMPORTANT NOTE! Not complete main chain atoms for residue T 108 # IMPORTANT NOTE! Not complete main chain atoms for residue G 109 # IMPORTANT NOTE! Not complete main chain atoms for residue T 110 # IMPORTANT NOTE! Not complete main chain atoms for residue D 111 # IMPORTANT NOTE! Not complete main chain atoms for residue G 112 # IMPORTANT NOTE! Not complete main chain atoms for residue K 113 # IMPORTANT NOTE! Not complete main chain atoms for residue T 114 # IMPORTANT NOTE! Not complete main chain atoms for residue T 115 # IMPORTANT NOTE! Not complete main chain atoms for residue T 116 # IMPORTANT NOTE! Not complete main chain atoms for residue T 117 # IMPORTANT NOTE! Not complete main chain atoms for residue A 118 # IMPORTANT NOTE! Not complete main chain atoms for residue M 119 # IMPORTANT NOTE! Not complete main chain atoms for residue V 120 # IMPORTANT NOTE! Not complete main chain atoms for residue A 121 # IMPORTANT NOTE! Not complete main chain atoms for residue H 122 # IMPORTANT NOTE! Not complete main chain atoms for residue V 123 # IMPORTANT NOTE! Not complete main chain atoms for residue L 124 # IMPORTANT NOTE! Not complete main chain atoms for residue K 125 # IMPORTANT NOTE! Not complete main chain atoms for residue H 126 # IMPORTANT NOTE! Not complete main chain atoms for residue L 127 # IMPORTANT NOTE! Not complete main chain atoms for residue R 128 # IMPORTANT NOTE! Not complete main chain atoms for residue K 129 # IMPORTANT NOTE! Not complete main chain atoms for residue S 130 # IMPORTANT NOTE! Not complete main chain atoms for residue P 131 # IMPORTANT NOTE! Not complete main chain atoms for residue T 132 # IMPORTANT NOTE! Not complete main chain atoms for residue V 133 # IMPORTANT NOTE! Not complete main chain atoms for residue L 135 # IMPORTANT NOTE! Not complete main chain atoms for residue G 136 # IMPORTANT NOTE! Not complete main chain atoms for residue G 137 # IMPORTANT NOTE! Not complete main chain atoms for residue I 138 # IMPORTANT NOTE! Not complete main chain atoms for residue M 139 # IMPORTANT NOTE! Not complete main chain atoms for residue D 140 # IMPORTANT NOTE! Not complete main chain atoms for residue S 141 # IMPORTANT NOTE! Not complete main chain atoms for residue L 142 # IMPORTANT NOTE! Not complete main chain atoms for residue E 143 # IMPORTANT NOTE! Not complete main chain atoms for residue H 144 # IMPORTANT NOTE! Not complete main chain atoms for residue G 145 # IMPORTANT NOTE! Not complete main chain atoms for residue N 146 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 147 # IMPORTANT NOTE! Not complete main chain atoms for residue E 148 # IMPORTANT NOTE! Not complete main chain atoms for residue K 149 # IMPORTANT NOTE! Not complete main chain atoms for residue G 150 # IMPORTANT NOTE! Not complete main chain atoms for residue N 151 # IMPORTANT NOTE! Not complete main chain atoms for residue G 152 # IMPORTANT NOTE! Not complete main chain atoms for residue P 153 # IMPORTANT NOTE! Not complete main chain atoms for residue V 154 # IMPORTANT NOTE! Not complete main chain atoms for residue V 155 # IMPORTANT NOTE! Not complete main chain atoms for residue E 157 # IMPORTANT NOTE! Not complete main chain atoms for residue L 158 # IMPORTANT NOTE! Not complete main chain atoms for residue D 159 # IMPORTANT NOTE! Not complete main chain atoms for residue E 160 # IMPORTANT NOTE! Not complete main chain atoms for residue S 161 # IMPORTANT NOTE! Not complete main chain atoms for residue E 162 # IMPORTANT NOTE! Not complete main chain atoms for residue E 163 # IMPORTANT NOTE! Not complete main chain atoms for residue F 164 # IMPORTANT NOTE! Not complete main chain atoms for residue F 165 # IMPORTANT NOTE! Not complete main chain atoms for residue S 166 # IMPORTANT NOTE! Not complete main chain atoms for residue E 167 # IMPORTANT NOTE! Not complete main chain atoms for residue F 168 # IMPORTANT NOTE! Not complete main chain atoms for residue S 169 # IMPORTANT NOTE! Not complete main chain atoms for residue P 170 # IMPORTANT NOTE! Not complete main chain atoms for residue N 171 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 172 # IMPORTANT NOTE! Not complete main chain atoms for residue L 173 # IMPORTANT NOTE! Not complete main chain atoms for residue I 174 # IMPORTANT NOTE! Not complete main chain atoms for residue I 175 # IMPORTANT NOTE! Not complete main chain atoms for residue T 176 # IMPORTANT NOTE! Not complete main chain atoms for residue N 177 # IMPORTANT NOTE! Not complete main chain atoms for residue A 178 # IMPORTANT NOTE! Not complete main chain atoms for residue R 179 # IMPORTANT NOTE! Not complete main chain atoms for residue G 180 # IMPORTANT NOTE! Not complete main chain atoms for residue D 181 # IMPORTANT NOTE! Not complete main chain atoms for residue H 182 # IMPORTANT NOTE! Not complete main chain atoms for residue L 183 # IMPORTANT NOTE! Not complete main chain atoms for residue E 184 # IMPORTANT NOTE! Not complete main chain atoms for residue N 185 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 186 # IMPORTANT NOTE! Not complete main chain atoms for residue G 187 # IMPORTANT NOTE! Not complete main chain atoms for residue S 189 # IMPORTANT NOTE! Not complete main chain atoms for residue T 191 # IMPORTANT NOTE! Not complete main chain atoms for residue R 192 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 193 # IMPORTANT NOTE! Not complete main chain atoms for residue R 194 # IMPORTANT NOTE! Not complete main chain atoms for residue S 195 # IMPORTANT NOTE! Not complete main chain atoms for residue A 196 # IMPORTANT NOTE! Not complete main chain atoms for residue E 198 # IMPORTANT NOTE! Not complete main chain atoms for residue K 199 # IMPORTANT NOTE! Not complete main chain atoms for residue I 200 # IMPORTANT NOTE! Not complete main chain atoms for residue S 201 # IMPORTANT NOTE! Not complete main chain atoms for residue R 202 # IMPORTANT NOTE! Not complete main chain atoms for residue N 203 # IMPORTANT NOTE! Not complete main chain atoms for residue T 204 # IMPORTANT NOTE! Not complete main chain atoms for residue D 205 # IMPORTANT NOTE! Not complete main chain atoms for residue L 206 # IMPORTANT NOTE! Not complete main chain atoms for residue V 207 # IMPORTANT NOTE! Not complete main chain atoms for residue V 208 # IMPORTANT NOTE! Not complete main chain atoms for residue T 209 # IMPORTANT NOTE! Not complete main chain atoms for residue F 210 # IMPORTANT NOTE! Not complete main chain atoms for residue A 211 # IMPORTANT NOTE! Not complete main chain atoms for residue E 212 # IMPORTANT NOTE! Not complete main chain atoms for residue D 213 # IMPORTANT NOTE! Not complete main chain atoms for residue E 214 # IMPORTANT NOTE! Not complete main chain atoms for residue L 215 # IMPORTANT NOTE! Not complete main chain atoms for residue T 216 # IMPORTANT NOTE! Not complete main chain atoms for residue S 217 # IMPORTANT NOTE! Not complete main chain atoms for residue H 218 # IMPORTANT NOTE! Not complete main chain atoms for residue L 219 # IMPORTANT NOTE! Not complete main chain atoms for residue G 220 # IMPORTANT NOTE! Not complete main chain atoms for residue D 221 # IMPORTANT NOTE! Not complete main chain atoms for residue V 222 # IMPORTANT NOTE! Not complete main chain atoms for residue T 223 # IMPORTANT NOTE! Not complete main chain atoms for residue F 224 # IMPORTANT NOTE! Not complete main chain atoms for residue G 225 # IMPORTANT NOTE! Not complete main chain atoms for residue K 227 # IMPORTANT NOTE! Not complete main chain atoms for residue K 228 # IMPORTANT NOTE! Not complete main chain atoms for residue G 229 # IMPORTANT NOTE! Not complete main chain atoms for residue T 230 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 231 # IMPORTANT NOTE! Not complete main chain atoms for residue T 232 # IMPORTANT NOTE! Not complete main chain atoms for residue L 233 # IMPORTANT NOTE! Not complete main chain atoms for residue E 234 # IMPORTANT NOTE! Not complete main chain atoms for residue M 235 # IMPORTANT NOTE! Not complete main chain atoms for residue R 236 # IMPORTANT NOTE! Not complete main chain atoms for residue S 237 # IMPORTANT NOTE! Not complete main chain atoms for residue A 238 # IMPORTANT NOTE! Not complete main chain atoms for residue S 239 # IMPORTANT NOTE! Not complete main chain atoms for residue R 240 # IMPORTANT NOTE! Not complete main chain atoms for residue A 241 # IMPORTANT NOTE! Not complete main chain atoms for residue E 242 # IMPORTANT NOTE! Not complete main chain atoms for residue Q 243 # IMPORTANT NOTE! Not complete main chain atoms for residue K 244 # IMPORTANT NOTE! Not complete main chain atoms for residue A 245 # IMPORTANT NOTE! Not complete main chain atoms for residue M 246 # IMPORTANT NOTE! Not complete main chain atoms for residue V 247 # IMPORTANT NOTE! Not complete main chain atoms for residue E 248 # IMPORTANT NOTE! Not complete main chain atoms for residue K 249 # IMPORTANT NOTE! Not complete main chain atoms for residue N 250 # IMPORTANT NOTE! Not complete main chain atoms for residue G 251 # IMPORTANT NOTE! Not complete main chain atoms for residue K 252 # IMPORTANT NOTE! Not complete main chain atoms for residue R 253 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 254 # IMPORTANT NOTE! Not complete main chain atoms for residue E 256 # IMPORTANT NOTE! Not complete main chain atoms for residue L 257 # IMPORTANT NOTE! Not complete main chain atoms for residue K 258 # IMPORTANT NOTE! Not complete main chain atoms for residue L 259 # IMPORTANT NOTE! Not complete main chain atoms for residue K 260 # IMPORTANT NOTE! Not complete main chain atoms for residue V 261 # IMPORTANT NOTE! Not complete main chain atoms for residue G 263 # IMPORTANT NOTE! Not complete main chain atoms for residue F 264 # IMPORTANT NOTE! Not complete main chain atoms for residue H 265 # IMPORTANT NOTE! Not complete main chain atoms for residue N 266 # IMPORTANT NOTE! Not complete main chain atoms for residue V 267 # IMPORTANT NOTE! Not complete main chain atoms for residue L 268 # IMPORTANT NOTE! Not complete main chain atoms for residue N 269 # IMPORTANT NOTE! Not complete main chain atoms for residue A 270 # IMPORTANT NOTE! Not complete main chain atoms for residue L 271 # IMPORTANT NOTE! Not complete main chain atoms for residue A 272 # IMPORTANT NOTE! Not complete main chain atoms for residue V 273 # IMPORTANT NOTE! Not complete main chain atoms for residue I 274 # IMPORTANT NOTE! Not complete main chain atoms for residue A 275 # IMPORTANT NOTE! Not complete main chain atoms for residue L 276 # IMPORTANT NOTE! Not complete main chain atoms for residue F 277 # IMPORTANT NOTE! Not complete main chain atoms for residue D 278 # IMPORTANT NOTE! Not complete main chain atoms for residue S 279 # IMPORTANT NOTE! Not complete main chain atoms for residue L 280 # IMPORTANT NOTE! Not complete main chain atoms for residue G 281 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 282 # IMPORTANT NOTE! Not complete main chain atoms for residue D 283 # IMPORTANT NOTE! Not complete main chain atoms for residue L 284 # IMPORTANT NOTE! Not complete main chain atoms for residue A 285 # IMPORTANT NOTE! Not complete main chain atoms for residue P 286 # IMPORTANT NOTE! Not complete main chain atoms for residue V 287 # IMPORTANT NOTE! Not complete main chain atoms for residue L 288 # IMPORTANT NOTE! Not complete main chain atoms for residue E 289 # IMPORTANT NOTE! Not complete main chain atoms for residue A 290 # IMPORTANT NOTE! Not complete main chain atoms for residue L 291 # IMPORTANT NOTE! Not complete main chain atoms for residue E 292 # IMPORTANT NOTE! Not complete main chain atoms for residue E 293 # IMPORTANT NOTE! Not complete main chain atoms for residue F 294 # IMPORTANT NOTE! Not complete main chain atoms for residue R 295 # IMPORTANT NOTE! Not complete main chain atoms for residue G 296 # IMPORTANT NOTE! Not complete main chain atoms for residue V 297 # IMPORTANT NOTE! Not complete main chain atoms for residue H 298 # IMPORTANT NOTE! Not complete main chain atoms for residue R 299 # IMPORTANT NOTE! Not complete main chain atoms for residue R 300 # IMPORTANT NOTE! Not complete main chain atoms for residue S 302 # IMPORTANT NOTE! Not complete main chain atoms for residue I 303 # IMPORTANT NOTE! Not complete main chain atoms for residue A 304 # IMPORTANT NOTE! Not complete main chain atoms for residue D 307 # IMPORTANT NOTE! Not complete main chain atoms for residue P 308 # IMPORTANT NOTE! Not complete main chain atoms for residue E 309 # IMPORTANT NOTE! Not complete main chain atoms for residue T 310 # IMPORTANT NOTE! Not complete main chain atoms for residue N 311 # IMPORTANT NOTE! Not complete main chain atoms for residue I 312 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 313 # IMPORTANT NOTE! Not complete main chain atoms for residue V 314 # IMPORTANT NOTE! Not complete main chain atoms for residue I 315 # IMPORTANT NOTE! Not complete main chain atoms for residue D 316 # IMPORTANT NOTE! Not complete main chain atoms for residue D 317 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 318 # IMPORTANT NOTE! Not complete main chain atoms for residue A 319 # IMPORTANT NOTE! Not complete main chain atoms for residue H 320 # IMPORTANT NOTE! Not complete main chain atoms for residue T 321 # IMPORTANT NOTE! Not complete main chain atoms for residue P 322 # IMPORTANT NOTE! Not complete main chain atoms for residue D 323 # IMPORTANT NOTE! Not complete main chain atoms for residue E 324 # IMPORTANT NOTE! Not complete main chain atoms for residue I 325 # IMPORTANT NOTE! Not complete main chain atoms for residue R 326 # IMPORTANT NOTE! Not complete main chain atoms for residue N 327 # IMPORTANT NOTE! Not complete main chain atoms for residue L 328 # IMPORTANT NOTE! Not complete main chain atoms for residue L 329 # IMPORTANT NOTE! Not complete main chain atoms for residue Q 330 # IMPORTANT NOTE! Not complete main chain atoms for residue T 331 # IMPORTANT NOTE! Not complete main chain atoms for residue A 332 # IMPORTANT NOTE! Not complete main chain atoms for residue K 333 # IMPORTANT NOTE! Not complete main chain atoms for residue E 334 # IMPORTANT NOTE! Not complete main chain atoms for residue V 335 # IMPORTANT NOTE! Not complete main chain atoms for residue F 336 # IMPORTANT NOTE! Not complete main chain atoms for residue E 337 # IMPORTANT NOTE! Not complete main chain atoms for residue N 338 # IMPORTANT NOTE! Not complete main chain atoms for residue E 339 # IMPORTANT NOTE! Not complete main chain atoms for residue K 340 # IMPORTANT NOTE! Not complete main chain atoms for residue I 341 # IMPORTANT NOTE! Not complete main chain atoms for residue V 342 # IMPORTANT NOTE! Not complete main chain atoms for residue V 343 # IMPORTANT NOTE! Not complete main chain atoms for residue I 344 # IMPORTANT NOTE! Not complete main chain atoms for residue F 345 # IMPORTANT NOTE! Not complete main chain atoms for residue A 363 # IMPORTANT NOTE! Not complete main chain atoms for residue L 364 # IMPORTANT NOTE! Not complete main chain atoms for residue Q 365 # IMPORTANT NOTE! Not complete main chain atoms for residue L 366 # IMPORTANT NOTE! Not complete main chain atoms for residue A 367 # IMPORTANT NOTE! Not complete main chain atoms for residue D 368 # IMPORTANT NOTE! Not complete main chain atoms for residue A 378 # IMPORTANT NOTE! Not complete main chain atoms for residue F 379 # IMPORTANT NOTE! Not complete main chain atoms for residue E 380 # IMPORTANT NOTE! Not complete main chain atoms for residue E 381 # IMPORTANT NOTE! Not complete main chain atoms for residue K 382 # IMPORTANT NOTE! Not complete main chain atoms for residue K 383 # IMPORTANT NOTE! Not complete main chain atoms for residue G 385 # IMPORTANT NOTE! Not complete main chain atoms for residue I 386 # IMPORTANT NOTE! Not complete main chain atoms for residue S 387 # IMPORTANT NOTE! Not complete main chain atoms for residue G 388 # IMPORTANT NOTE! Not complete main chain atoms for residue K 389 # IMPORTANT NOTE! Not complete main chain atoms for residue M 390 # IMPORTANT NOTE! Not complete main chain atoms for residue I 391 # IMPORTANT NOTE! Not complete main chain atoms for residue W 392 # IMPORTANT NOTE! Not complete main chain atoms for residue D 393 # IMPORTANT NOTE! Not complete main chain atoms for residue S 394 # IMPORTANT NOTE! Not complete main chain atoms for residue L 395 # IMPORTANT NOTE! Not complete main chain atoms for residue K 396 # IMPORTANT NOTE! Not complete main chain atoms for residue S 397 # IMPORTANT NOTE! Not complete main chain atoms for residue L 398 # IMPORTANT NOTE! Not complete main chain atoms for residue G 399 # IMPORTANT NOTE! Not complete main chain atoms for residue K 400 # IMPORTANT NOTE! Not complete main chain atoms for residue E 401 # IMPORTANT NOTE! Not complete main chain atoms for residue A 402 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 403 # IMPORTANT NOTE! Not complete main chain atoms for residue F 404 # IMPORTANT NOTE! Not complete main chain atoms for residue V 405 # IMPORTANT NOTE! Not complete main chain atoms for residue E 406 # IMPORTANT NOTE! Not complete main chain atoms for residue K 407 # IMPORTANT NOTE! Not complete main chain atoms for residue L 408 # IMPORTANT NOTE! Not complete main chain atoms for residue P 409 # IMPORTANT NOTE! Not complete main chain atoms for residue E 410 # IMPORTANT NOTE! Not complete main chain atoms for residue L 411 # IMPORTANT NOTE! Not complete main chain atoms for residue E 412 # IMPORTANT NOTE! Not complete main chain atoms for residue K 413 # IMPORTANT NOTE! Not complete main chain atoms for residue V 414 # IMPORTANT NOTE! Not complete main chain atoms for residue I 415 # IMPORTANT NOTE! Not complete main chain atoms for residue S 416 # IMPORTANT NOTE! Not complete main chain atoms for residue V 417 # IMPORTANT NOTE! Not complete main chain atoms for residue E 419 # IMPORTANT NOTE! Not complete main chain atoms for residue N 420 # IMPORTANT NOTE! Not complete main chain atoms for residue T 421 # IMPORTANT NOTE! Not complete main chain atoms for residue V 422 # IMPORTANT NOTE! Not complete main chain atoms for residue F 423 # IMPORTANT NOTE! Not complete main chain atoms for residue L 424 # IMPORTANT NOTE! Not complete main chain atoms for residue F 425 # IMPORTANT NOTE! Not complete main chain atoms for residue V 426 # IMPORTANT NOTE! Not complete main chain atoms for residue A 428 # IMPORTANT NOTE! Not complete main chain atoms for residue G 429 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 433 # IMPORTANT NOTE! Not complete main chain atoms for residue S 434 # IMPORTANT NOTE! Not complete main chain atoms for residue S 435 # IMPORTANT NOTE! Not complete main chain atoms for residue R 436 # IMPORTANT NOTE! Not complete main chain atoms for residue R 437 # IMPORTANT NOTE! Not complete main chain atoms for residue F 438 # IMPORTANT NOTE! Not complete main chain atoms for residue V 439 # IMPORTANT NOTE! Not complete main chain atoms for residue E 440 # IMPORTANT NOTE! Not complete main chain atoms for residue R 441 # IMPORTANT NOTE! Not complete main chain atoms for residue Q 443 # IMPORTANT NOTE! Not complete main chain atoms for residue S 444 # IMPORTANT NOTE! Not complete main chain atoms for residue S 445 # IMPORTANT NOTE! Not complete main chain atoms for residue K 446 # IMPORTANT NOTE! Not complete main chain atoms for residue S 447 # IMPORTANT NOTE! Not complete main chain atoms for residue S 448 # IMPORTANT NOTE! Not complete main chain atoms for residue P 449 # IMPORTANT NOTE! Not complete main chain atoms for residue S 450 # IMPORTANT NOTE! Not complete main chain atoms for residue R 451 # IMPORTANT NOTE! Not complete main chain atoms for residue V 452 # IMPORTANT NOTE! Not complete main chain atoms for residue L 453 # IMPORTANT NOTE! Not complete main chain atoms for residue G 454 # IMPORTANT NOTE! Not complete main chain atoms for residue S 455 # IMPORTANT NOTE! Not complete main chain atoms for residue N 456 # IMPORTANT NOTE! Not complete main chain atoms for residue K 457 # Checking the TS prediction MODEL 2 (DONE) # MODEL index: 2 # Target name: T0185 # Total number of residues in target: 457 # Total number of residues in model: 387 # Total number of atoms in model: 387 # Number of atoms with 1.0 occupancy: 387 # Number of fragments in model: 1 # Number of METHOD records: 1 # No errors. # Number of Warnings: 387 ################################ # # # SUBMISSION # # # ################################ # # # BEGIN # # # ################################ PFRMAT TS TARGET T0185 AUTHOR 5035-2079-5263 METHOD CAFASP MODEL 2 PARENT 1E8C_A ATOM 21 CA ASN 25 -0.477 27.594 91.523 1.00 1.00 ATOM 22 CA ASP 26 -1.579 28.588 95.034 1.00 1.00 ATOM 23 CA VAL 27 -0.424 32.171 95.647 1.00 1.00 ATOM 25 CA GLY 29 4.499 36.597 95.411 1.00 1.00 ATOM 26 CA SER 30 7.467 38.843 94.595 1.00 1.00 ATOM 27 CA ASN 31 9.300 37.952 97.829 1.00 1.00 ATOM 28 CA ILE 32 11.067 34.578 98.103 1.00 1.00 ATOM 29 CA GLU 33 10.993 34.825 101.915 1.00 1.00 ATOM 30 CA GLU 34 7.221 34.288 101.852 1.00 1.00 ATOM 31 CA THR 35 6.922 32.009 98.815 1.00 1.00 ATOM 32 CA GLU 36 5.526 28.720 100.122 1.00 1.00 ATOM 33 CA ARG 37 5.157 25.283 98.558 1.00 1.00 ATOM 34 CA THR 38 3.023 25.452 95.430 1.00 1.00 ATOM 35 CA ALA 39 3.231 29.228 95.001 1.00 1.00 ATOM 36 CA TYR 40 4.352 31.238 91.974 1.00 1.00 ATOM 37 CA LEU 41 7.520 33.243 92.676 1.00 1.00 ATOM 38 CA ARG 42 8.033 36.352 90.528 1.00 1.00 ATOM 39 CA LYS 43 11.674 37.476 90.235 1.00 1.00 ATOM 40 CA LEU 44 12.323 41.079 89.179 1.00 1.00 ATOM 41 CA GLY 45 15.220 43.528 89.230 1.00 1.00 ATOM 42 CA ILE 46 14.755 46.080 91.995 1.00 1.00 ATOM 43 CA PRO 47 16.489 49.253 93.163 1.00 1.00 ATOM 44 CA ILE 48 18.767 47.368 95.545 1.00 1.00 ATOM 45 CA PHE 49 18.825 43.702 94.563 1.00 1.00 ATOM 46 CA VAL 50 18.003 41.204 91.828 1.00 1.00 ATOM 47 CA PRO 51 15.123 38.886 92.682 1.00 1.00 ATOM 48 CA HIS 52 16.457 36.257 90.273 1.00 1.00 ATOM 49 CA SER 53 19.327 35.565 92.669 1.00 1.00 ATOM 50 CA ALA 54 16.751 34.117 95.081 1.00 1.00 ATOM 53 CA ASP 55 16.003 29.429 97.451 1.00 1.00 ATOM 54 CA ASN 56 12.451 29.686 96.113 1.00 1.00 ATOM 55 CA TRP 57 12.809 26.326 94.357 1.00 1.00 ATOM 57 CA TYR 58 11.212 26.072 99.277 1.00 1.00 ATOM 58 CA ASP 59 8.967 24.161 96.893 1.00 1.00 ATOM 59 CA PRO 60 7.395 26.849 94.703 1.00 1.00 ATOM 60 CA ASP 61 5.425 25.475 91.757 1.00 1.00 ATOM 61 CA LEU 62 6.676 27.909 89.130 1.00 1.00 ATOM 62 CA VAL 63 8.739 31.005 88.491 1.00 1.00 ATOM 63 CA ILE 64 8.327 34.004 86.214 1.00 1.00 ATOM 64 CA LYS 65 11.572 35.940 85.855 1.00 1.00 ATOM 65 CA THR 66 12.862 39.095 84.182 1.00 1.00 ATOM 66 CA PRO 67 14.501 38.247 80.855 1.00 1.00 ATOM 67 CA ALA 68 17.046 41.096 80.809 1.00 1.00 ATOM 75 CA VAL 69 10.693 28.591 78.879 1.00 1.00 ATOM 76 CA ARG 70 13.245 26.707 80.969 1.00 1.00 ATOM 77 CA ASP 71 13.158 24.153 83.763 1.00 1.00 ATOM 79 CA ASN 73 14.962 21.036 89.331 1.00 1.00 ATOM 80 CA PRO 74 11.630 20.156 87.746 1.00 1.00 ATOM 81 CA GLU 75 10.277 23.692 88.224 1.00 1.00 ATOM 82 CA ILE 76 9.126 25.731 85.172 1.00 1.00 ATOM 83 CA VAL 77 10.898 29.080 84.807 1.00 1.00 ATOM 84 CA ARG 78 9.373 31.529 82.319 1.00 1.00 ATOM 85 CA ALA 79 11.291 34.669 81.317 1.00 1.00 ATOM 86 CA ARG 80 9.469 37.874 80.350 1.00 1.00 ATOM 87 CA MET 81 10.884 41.214 79.201 1.00 1.00 ATOM 88 CA GLU 82 9.906 44.477 80.939 1.00 1.00 ATOM 89 CA ARG 83 8.434 42.389 83.744 1.00 1.00 ATOM 90 CA VAL 84 8.041 45.292 86.192 1.00 1.00 ATOM 91 CA PRO 85 5.658 47.045 83.780 1.00 1.00 ATOM 92 CA ILE 86 3.457 43.746 83.380 1.00 1.00 ATOM 93 CA GLU 87 3.275 42.837 87.022 1.00 1.00 ATOM 94 CA ASN 88 -0.052 44.540 87.733 1.00 1.00 ATOM 95 CA ARG 89 -1.636 42.986 84.626 1.00 1.00 ATOM 96 CA LEU 90 -0.209 39.557 85.464 1.00 1.00 ATOM 97 CA HIS 91 -1.405 39.757 89.074 1.00 1.00 ATOM 98 CA TYR 92 -4.790 40.927 87.810 1.00 1.00 ATOM 99 CA PHE 93 -5.284 37.824 85.673 1.00 1.00 ATOM 100 CA ARG 94 -3.998 35.685 88.522 1.00 1.00 ATOM 101 CA ASP 95 -6.534 37.040 91.025 1.00 1.00 ATOM 102 CA THR 96 -9.363 37.423 88.504 1.00 1.00 ATOM 103 CA LEU 97 -9.584 41.210 88.091 1.00 1.00 ATOM 104 CA LYS 98 -10.539 42.189 91.696 1.00 1.00 ATOM 105 CA ARG 99 -11.063 45.860 90.894 1.00 1.00 ATOM 106 CA GLU 100 -14.112 44.885 88.828 1.00 1.00 ATOM 107 CA LYS 101 -15.805 43.459 91.932 1.00 1.00 ATOM 108 CA LYS 102 -15.824 46.565 94.084 1.00 1.00 ATOM 109 CA GLU 103 -15.787 50.293 93.397 1.00 1.00 ATOM 110 CA GLU 104 -12.178 51.386 93.648 1.00 1.00 ATOM 111 CA PHE 105 -11.234 55.016 94.233 1.00 1.00 ATOM 112 CA ALA 106 -7.611 56.122 94.013 1.00 1.00 ATOM 113 CA VAL 107 -6.363 59.280 95.702 1.00 1.00 ATOM 114 CA THR 108 -3.053 60.946 94.895 1.00 1.00 ATOM 115 CA GLY 109 -1.549 64.261 95.976 1.00 1.00 ATOM 116 CA THR 110 1.212 65.589 98.218 1.00 1.00 ATOM 117 CA ASP 111 -0.949 65.976 101.333 1.00 1.00 ATOM 118 CA GLY 112 -4.228 64.508 102.512 1.00 1.00 ATOM 119 CA LYS 113 -4.360 61.144 100.743 1.00 1.00 ATOM 120 CA THR 114 -4.949 59.332 104.047 1.00 1.00 ATOM 121 CA THR 115 -7.671 61.574 105.426 1.00 1.00 ATOM 122 CA THR 116 -9.417 61.702 102.055 1.00 1.00 ATOM 123 CA THR 117 -9.358 57.908 101.569 1.00 1.00 ATOM 124 CA ALA 118 -10.561 57.316 105.137 1.00 1.00 ATOM 125 CA MET 119 -13.427 59.811 104.694 1.00 1.00 ATOM 126 CA VAL 120 -14.471 58.119 101.455 1.00 1.00 ATOM 127 CA ALA 121 -14.475 54.708 103.152 1.00 1.00 ATOM 128 CA HIS 122 -16.381 55.933 106.209 1.00 1.00 ATOM 129 CA VAL 123 -19.006 57.856 104.246 1.00 1.00 ATOM 130 CA LEU 124 -19.631 55.133 101.650 1.00 1.00 ATOM 131 CA LYS 125 -20.197 52.625 104.437 1.00 1.00 ATOM 132 CA HIS 126 -22.770 54.907 106.070 1.00 1.00 ATOM 133 CA LEU 127 -24.421 54.861 102.642 1.00 1.00 ATOM 134 CA ARG 128 -24.859 51.088 102.524 1.00 1.00 ATOM 135 CA LYS 129 -21.448 49.877 101.342 1.00 1.00 ATOM 136 CA SER 130 -19.036 47.487 103.088 1.00 1.00 ATOM 137 CA PRO 131 -15.880 49.589 102.828 1.00 1.00 ATOM 138 CA THR 132 -12.133 49.124 102.936 1.00 1.00 ATOM 139 CA VAL 133 -9.011 51.286 102.802 1.00 1.00 ATOM 141 CA LEU 135 -2.798 53.426 102.550 1.00 1.00 ATOM 142 CA GLY 136 -0.243 54.748 105.021 1.00 1.00 ATOM 143 CA GLY 137 -2.341 53.887 108.097 1.00 1.00 ATOM 144 CA ILE 138 -2.903 50.326 106.865 1.00 1.00 ATOM 145 CA MET 139 -4.920 48.030 104.624 1.00 1.00 ATOM 146 CA ASP 140 -8.203 46.248 105.333 1.00 1.00 ATOM 147 CA SER 141 -11.911 46.634 106.015 1.00 1.00 ATOM 148 CA LEU 142 -12.762 49.644 108.164 1.00 1.00 ATOM 168 CA GLU 143 -8.064 43.573 96.679 1.00 1.00 ATOM 169 CA HIS 144 -8.982 39.953 95.911 1.00 1.00 ATOM 170 CA GLY 145 -8.787 39.283 99.642 1.00 1.00 ATOM 171 CA ASN 146 -10.999 42.265 100.482 1.00 1.00 ATOM 172 CA TYR 147 -13.520 41.172 97.831 1.00 1.00 ATOM 173 CA GLU 148 -13.713 37.691 99.383 1.00 1.00 ATOM 174 CA LYS 149 -14.356 39.317 102.777 1.00 1.00 ATOM 175 CA GLY 150 -17.356 41.096 101.283 1.00 1.00 ATOM 176 CA ASN 151 -15.895 44.537 100.532 1.00 1.00 ATOM 177 CA GLY 152 -17.794 46.476 97.869 1.00 1.00 ATOM 178 CA PRO 153 -15.927 49.784 98.087 1.00 1.00 ATOM 179 CA VAL 154 -12.245 50.611 98.617 1.00 1.00 ATOM 180 CA VAL 155 -10.405 53.940 98.790 1.00 1.00 ATOM 182 CA GLU 157 -3.764 55.960 98.391 1.00 1.00 ATOM 183 CA LEU 158 -1.812 56.127 95.134 1.00 1.00 ATOM 184 CA ASP 159 1.691 57.535 95.634 1.00 1.00 ATOM 185 CA GLU 160 3.789 59.239 92.958 1.00 1.00 ATOM 186 CA SER 161 6.386 56.524 93.616 1.00 1.00 ATOM 187 CA GLU 162 3.720 53.894 93.006 1.00 1.00 ATOM 191 CA GLU 163 3.725 50.701 87.752 1.00 1.00 ATOM 192 CA PHE 164 2.296 49.513 91.099 1.00 1.00 ATOM 193 CA PHE 165 -1.353 50.127 90.097 1.00 1.00 ATOM 194 CA SER 166 -0.918 49.901 86.292 1.00 1.00 ATOM 195 CA GLU 167 -3.798 47.512 85.533 1.00 1.00 ATOM 196 CA PHE 168 -6.330 48.547 88.206 1.00 1.00 ATOM 197 CA SER 169 -9.758 49.777 87.143 1.00 1.00 ATOM 198 CA PRO 170 -10.580 52.883 89.156 1.00 1.00 ATOM 199 CA ASN 171 -14.167 54.106 89.487 1.00 1.00 ATOM 200 CA TYR 172 -12.670 57.532 90.294 1.00 1.00 ATOM 201 CA LEU 173 -9.280 59.274 90.712 1.00 1.00 ATOM 202 CA ILE 174 -8.854 62.174 93.140 1.00 1.00 ATOM 203 CA ILE 175 -6.112 64.825 93.129 1.00 1.00 ATOM 204 CA THR 176 -5.684 66.671 96.432 1.00 1.00 ATOM 205 CA ASN 177 -2.744 69.016 95.826 1.00 1.00 ATOM 206 CA ALA 178 0.929 69.297 94.866 1.00 1.00 ATOM 207 CA ARG 179 3.666 70.990 96.900 1.00 1.00 ATOM 208 CA GLY 180 7.342 70.521 97.685 1.00 1.00 ATOM 209 CA ASP 181 8.307 67.012 98.749 1.00 1.00 ATOM 210 CA HIS 182 9.939 63.837 97.385 1.00 1.00 ATOM 211 CA LEU 183 12.447 65.726 95.242 1.00 1.00 ATOM 212 CA GLU 184 15.104 63.349 96.530 1.00 1.00 ATOM 213 CA ASN 185 13.268 60.831 94.340 1.00 1.00 ATOM 214 CA TYR 186 11.808 62.900 91.502 1.00 1.00 ATOM 215 CA GLY 187 14.545 65.527 91.224 1.00 1.00 ATOM 216 CA SER 189 12.379 68.581 90.566 1.00 1.00 ATOM 218 CA THR 191 8.314 69.191 86.896 1.00 1.00 ATOM 219 CA ARG 192 9.068 65.466 87.137 1.00 1.00 ATOM 220 CA TYR 193 7.050 65.147 90.345 1.00 1.00 ATOM 221 CA ARG 194 4.005 66.620 88.587 1.00 1.00 ATOM 222 CA SER 195 4.548 64.349 85.561 1.00 1.00 ATOM 223 CA ALA 196 4.551 61.308 87.860 1.00 1.00 ATOM 225 CA GLU 198 -0.214 63.023 85.945 1.00 1.00 ATOM 226 CA LYS 199 0.370 59.369 84.989 1.00 1.00 ATOM 227 CA ILE 200 -2.775 58.435 86.939 1.00 1.00 ATOM 228 CA SER 201 -4.918 60.392 84.473 1.00 1.00 ATOM 229 CA ARG 202 -2.944 59.754 81.300 1.00 1.00 ATOM 230 CA ASN 203 -1.751 56.147 81.634 1.00 1.00 ATOM 231 CA THR 204 -4.332 54.417 83.860 1.00 1.00 ATOM 234 CA ASP 205 -12.480 56.605 85.706 1.00 1.00 ATOM 235 CA LEU 206 -13.996 59.894 86.862 1.00 1.00 ATOM 236 CA VAL 207 -11.567 62.694 87.673 1.00 1.00 ATOM 237 CA VAL 208 -12.042 64.762 90.856 1.00 1.00 ATOM 238 CA THR 209 -9.591 67.687 90.997 1.00 1.00 ATOM 239 CA PHE 210 -8.824 70.263 93.683 1.00 1.00 ATOM 240 CA ALA 211 -9.125 73.577 91.819 1.00 1.00 ATOM 241 CA GLU 212 -7.410 75.566 94.582 1.00 1.00 ATOM 242 CA ASP 213 -4.068 74.108 93.475 1.00 1.00 ATOM 243 CA GLU 214 -2.356 75.840 90.529 1.00 1.00 ATOM 244 CA LEU 215 -1.507 72.377 89.170 1.00 1.00 ATOM 245 CA THR 216 -5.120 71.248 89.548 1.00 1.00 ATOM 246 CA SER 217 -6.312 74.226 87.494 1.00 1.00 ATOM 247 CA HIS 218 -3.971 73.400 84.625 1.00 1.00 ATOM 248 CA LEU 219 -5.096 69.757 84.764 1.00 1.00 ATOM 254 CA GLY 220 -15.389 65.756 82.076 1.00 1.00 ATOM 255 CA ASP 221 -13.633 66.243 85.432 1.00 1.00 ATOM 256 CA VAL 222 -15.221 67.549 88.631 1.00 1.00 ATOM 257 CA THR 223 -13.647 70.742 89.991 1.00 1.00 ATOM 258 CA PHE 224 -13.631 71.262 93.747 1.00 1.00 ATOM 259 CA GLY 225 -12.779 74.544 95.435 1.00 1.00 ATOM 261 CA LYS 227 -11.022 79.386 97.878 1.00 1.00 ATOM 269 CA LYS 228 -15.768 73.457 84.759 1.00 1.00 ATOM 270 CA GLY 229 -18.470 71.029 83.608 1.00 1.00 ATOM 272 CA THR 230 -18.090 71.406 90.303 1.00 1.00 ATOM 273 CA TYR 231 -18.469 71.724 94.048 1.00 1.00 ATOM 274 CA THR 232 -17.451 74.713 96.131 1.00 1.00 ATOM 275 CA LEU 233 -17.621 75.913 99.701 1.00 1.00 ATOM 276 CA GLU 234 -19.445 79.232 99.948 1.00 1.00 ATOM 277 CA MET 235 -19.192 79.710 103.715 1.00 1.00 ATOM 278 CA ARG 236 -17.050 78.038 106.371 1.00 1.00 ATOM 279 CA SER 237 -17.223 78.684 110.112 1.00 1.00 ATOM 280 CA ALA 238 -14.622 77.105 112.403 1.00 1.00 ATOM 281 CA SER 239 -15.201 76.323 116.076 1.00 1.00 ATOM 282 CA ARG 240 -14.736 73.399 118.498 1.00 1.00 ATOM 283 CA ALA 241 -12.085 71.545 116.465 1.00 1.00 ATOM 284 CA GLU 242 -14.765 71.251 113.787 1.00 1.00 ATOM 285 CA GLN 243 -16.506 73.369 111.163 1.00 1.00 ATOM 286 CA LYS 244 -19.805 74.308 109.550 1.00 1.00 ATOM 287 CA ALA 245 -19.561 74.134 105.765 1.00 1.00 ATOM 288 CA MET 246 -22.010 75.696 103.326 1.00 1.00 ATOM 289 CA VAL 247 -21.573 74.618 99.736 1.00 1.00 ATOM 290 CA GLU 248 -23.031 74.789 96.268 1.00 1.00 ATOM 291 CA LYS 249 -22.519 72.211 93.531 1.00 1.00 ATOM 292 CA ASN 250 -23.744 70.842 90.214 1.00 1.00 ATOM 293 CA GLY 251 -25.756 68.350 92.278 1.00 1.00 ATOM 294 CA LYS 252 -27.354 70.916 94.579 1.00 1.00 ATOM 295 CA ARG 253 -26.551 72.930 97.709 1.00 1.00 ATOM 296 CA TYR 254 -26.497 72.244 101.447 1.00 1.00 ATOM 297 CA GLU 256 -24.858 72.609 104.871 1.00 1.00 ATOM 298 CA LEU 257 -22.419 70.180 106.496 1.00 1.00 ATOM 299 CA LYS 258 -21.397 69.903 110.144 1.00 1.00 ATOM 300 CA LEU 259 -17.883 68.490 110.158 1.00 1.00 ATOM 301 CA LYS 260 -16.011 67.239 113.203 1.00 1.00 ATOM 302 CA VAL 261 -12.590 67.527 111.546 1.00 1.00 ATOM 304 CA GLY 263 -8.864 73.092 110.120 1.00 1.00 ATOM 305 CA PHE 264 -9.280 74.424 106.591 1.00 1.00 ATOM 306 CA HIS 265 -7.099 71.645 105.180 1.00 1.00 ATOM 307 CA ASN 266 -9.640 69.081 106.359 1.00 1.00 ATOM 308 CA VAL 267 -12.487 71.077 104.856 1.00 1.00 ATOM 309 CA LEU 268 -10.797 70.551 101.491 1.00 1.00 ATOM 310 CA ASN 269 -10.332 66.812 102.106 1.00 1.00 ATOM 311 CA ALA 270 -14.001 66.383 103.044 1.00 1.00 ATOM 312 CA LEU 271 -15.131 68.410 100.014 1.00 1.00 ATOM 313 CA ALA 272 -13.068 66.162 97.759 1.00 1.00 ATOM 314 CA VAL 273 -14.646 63.070 99.311 1.00 1.00 ATOM 315 CA ILE 274 -18.137 64.560 98.908 1.00 1.00 ATOM 316 CA ALA 275 -17.658 65.494 95.249 1.00 1.00 ATOM 317 CA LEU 276 -16.343 61.990 94.522 1.00 1.00 ATOM 318 CA PHE 277 -19.330 60.223 96.069 1.00 1.00 ATOM 319 CA ASP 278 -21.783 62.539 94.293 1.00 1.00 ATOM 320 CA SER 279 -19.928 61.963 91.023 1.00 1.00 ATOM 321 CA LEU 280 -20.221 58.230 91.763 1.00 1.00 ATOM 322 CA GLY 281 -24.000 58.476 92.037 1.00 1.00 ATOM 323 CA TYR 282 -24.619 58.570 95.806 1.00 1.00 ATOM 324 CA ASP 283 -27.634 60.806 96.674 1.00 1.00 ATOM 325 CA LEU 284 -26.810 64.234 98.123 1.00 1.00 ATOM 326 CA ALA 285 -29.666 63.979 100.626 1.00 1.00 ATOM 327 CA PRO 286 -28.208 60.809 102.150 1.00 1.00 ATOM 328 CA VAL 287 -24.649 62.175 102.144 1.00 1.00 ATOM 329 CA LEU 288 -25.816 65.214 104.131 1.00 1.00 ATOM 330 CA GLU 289 -27.680 63.107 106.704 1.00 1.00 ATOM 331 CA ALA 290 -24.541 61.108 107.509 1.00 1.00 ATOM 332 CA LEU 291 -21.831 63.796 107.268 1.00 1.00 ATOM 333 CA GLU 292 -21.948 64.449 111.020 1.00 1.00 ATOM 334 CA GLU 293 -20.832 60.903 111.832 1.00 1.00 ATOM 335 CA PHE 294 -17.561 61.187 109.885 1.00 1.00 ATOM 336 CA ARG 295 -14.505 60.672 112.124 1.00 1.00 ATOM 337 CA GLY 296 -10.991 62.148 111.902 1.00 1.00 ATOM 338 CA VAL 297 -8.014 59.824 111.259 1.00 1.00 ATOM 339 CA HIS 298 -5.471 58.984 113.965 1.00 1.00 ATOM 340 CA ARG 299 -2.228 60.935 113.747 1.00 1.00 ATOM 341 CA ARG 300 -3.944 63.687 111.809 1.00 1.00 ATOM 343 CA SER 302 -5.543 64.518 116.673 1.00 1.00 ATOM 344 CA ILE 303 -6.441 66.761 119.622 1.00 1.00 ATOM 345 CA ALA 304 -5.582 65.811 123.217 1.00 1.00 ATOM 346 CA ASP 307 -7.244 67.853 125.964 1.00 1.00 ATOM 347 CA PRO 308 -7.066 67.404 129.728 1.00 1.00 ATOM 348 CA GLU 309 -7.798 69.803 132.599 1.00 1.00 ATOM 349 CA THR 310 -4.751 71.602 133.960 1.00 1.00 ATOM 350 CA ASN 311 -2.752 70.824 130.834 1.00 1.00 ATOM 351 CA ILE 312 -2.100 72.477 127.456 1.00 1.00 ATOM 352 CA TYR 313 -4.029 71.233 124.439 1.00 1.00 ATOM 353 CA VAL 314 -1.783 69.008 122.340 1.00 1.00 ATOM 354 CA ILE 315 -2.241 68.359 118.635 1.00 1.00 ATOM 355 CA ASP 316 -0.449 65.473 116.949 1.00 1.00 ATOM 356 CA ASP 317 -0.207 65.816 113.169 1.00 1.00 ATOM 357 CA TYR 318 1.558 64.117 110.262 1.00 1.00 ATOM 358 CA ALA 319 2.578 67.392 108.552 1.00 1.00 ATOM 359 CA HIS 320 6.094 66.744 107.236 1.00 1.00 ATOM 360 CA THR 321 6.186 69.163 104.276 1.00 1.00 ATOM 361 CA PRO 322 6.528 72.986 104.322 1.00 1.00 ATOM 362 CA ASP 323 2.973 73.432 103.029 1.00 1.00 ATOM 363 CA GLU 324 1.406 70.938 105.453 1.00 1.00 ATOM 364 CA ILE 325 3.136 72.505 108.459 1.00 1.00 ATOM 365 CA ARG 326 1.879 75.983 107.509 1.00 1.00 ATOM 366 CA ASN 327 -1.727 74.783 107.318 1.00 1.00 ATOM 367 CA LEU 328 -1.403 72.812 110.556 1.00 1.00 ATOM 368 CA LEU 329 -0.016 75.788 112.490 1.00 1.00 ATOM 369 CA GLN 330 -2.631 78.137 111.009 1.00 1.00 ATOM 370 CA THR 331 -5.396 75.788 112.133 1.00 1.00 ATOM 371 CA ALA 332 -3.785 75.224 115.523 1.00 1.00 ATOM 372 CA LYS 333 -3.719 78.952 116.219 1.00 1.00 ATOM 373 CA GLU 334 -7.438 79.377 115.548 1.00 1.00 ATOM 374 CA VAL 335 -8.258 77.720 118.889 1.00 1.00 ATOM 375 CA PHE 336 -5.139 78.993 120.647 1.00 1.00 ATOM 376 CA GLU 337 -5.685 81.743 123.233 1.00 1.00 ATOM 377 CA ASN 338 -2.190 81.456 124.668 1.00 1.00 ATOM 378 CA GLU 339 1.092 80.669 122.926 1.00 1.00 ATOM 379 CA LYS 340 1.463 78.166 120.094 1.00 1.00 ATOM 380 CA ILE 341 4.395 75.748 120.372 1.00 1.00 ATOM 381 CA VAL 342 5.692 73.726 117.445 1.00 1.00 ATOM 382 CA VAL 343 7.734 70.580 118.069 1.00 1.00 ATOM 383 CA ILE 344 9.077 69.138 114.822 1.00 1.00 ATOM 384 CA PHE 345 12.001 67.784 112.839 1.00 1.00 ATOM 385 CA ALA 363 12.871 66.537 109.355 1.00 1.00 ATOM 386 CA LEU 364 13.636 63.090 107.983 1.00 1.00 ATOM 387 CA GLN 365 17.157 61.954 107.243 1.00 1.00 ATOM 388 CA LEU 366 18.079 60.559 103.832 1.00 1.00 ATOM 389 CA ALA 367 15.400 62.662 102.169 1.00 1.00 ATOM 390 CA ASP 368 14.726 65.992 100.441 1.00 1.00 ATOM 391 CA ALA 378 17.233 68.299 102.142 1.00 1.00 ATOM 392 CA PHE 379 15.822 71.351 100.372 1.00 1.00 ATOM 393 CA GLU 380 12.544 71.413 102.297 1.00 1.00 ATOM 394 CA GLU 381 14.419 71.659 105.614 1.00 1.00 ATOM 395 CA LYS 382 15.187 75.412 105.429 1.00 1.00 ATOM 396 CA LYS 383 11.610 76.122 104.325 1.00 1.00 ATOM 398 CA GLY 385 12.342 76.170 109.779 1.00 1.00 ATOM 399 CA ILE 386 11.165 79.451 108.273 1.00 1.00 ATOM 400 CA SER 387 7.541 78.350 108.562 1.00 1.00 ATOM 401 CA GLY 388 7.819 77.357 112.232 1.00 1.00 ATOM 402 CA LYS 389 9.586 80.614 113.127 1.00 1.00 ATOM 403 CA MET 390 6.876 82.695 111.447 1.00 1.00 ATOM 404 CA ILE 391 3.647 80.886 112.319 1.00 1.00 ATOM 405 CA TRP 392 4.518 79.580 115.783 1.00 1.00 ATOM 406 CA ASP 393 5.393 81.465 118.968 1.00 1.00 ATOM 407 CA SER 394 7.844 78.811 120.160 1.00 1.00 ATOM 408 CA LEU 395 9.792 76.524 117.827 1.00 1.00 ATOM 409 CA LYS 396 11.273 73.342 119.284 1.00 1.00 ATOM 410 CA SER 397 13.500 71.676 116.700 1.00 1.00 ATOM 411 CA LEU 398 14.217 68.016 117.419 1.00 1.00 ATOM 412 CA GLY 399 14.743 64.767 115.516 1.00 1.00 ATOM 413 CA LYS 400 12.205 62.972 113.306 1.00 1.00 ATOM 414 CA GLU 401 13.526 59.899 111.450 1.00 1.00 ATOM 415 CA ALA 402 17.313 60.591 111.200 1.00 1.00 ATOM 416 CA TYR 403 18.021 57.310 109.407 1.00 1.00 ATOM 417 CA PHE 404 21.666 57.387 108.288 1.00 1.00 ATOM 418 CA VAL 405 22.212 61.169 108.570 1.00 1.00 ATOM 419 CA GLU 406 23.791 62.972 111.543 1.00 1.00 ATOM 420 CA LYS 407 20.953 64.225 113.764 1.00 1.00 ATOM 421 CA LEU 408 22.401 67.710 114.086 1.00 1.00 ATOM 422 CA PRO 409 23.403 68.072 110.671 1.00 1.00 ATOM 423 CA GLU 410 19.689 67.802 109.847 1.00 1.00 ATOM 424 CA LEU 411 18.856 70.330 112.554 1.00 1.00 ATOM 425 CA GLU 412 21.420 72.832 111.261 1.00 1.00 ATOM 426 CA LYS 413 19.810 72.740 107.810 1.00 1.00 ATOM 427 CA VAL 414 16.430 73.572 109.354 1.00 1.00 ATOM 428 CA ILE 415 17.815 76.472 111.412 1.00 1.00 ATOM 429 CA SER 416 19.622 77.807 108.329 1.00 1.00 ATOM 430 CA VAL 417 16.237 78.791 106.928 1.00 1.00 ATOM 432 CA GLU 419 15.819 84.735 110.091 1.00 1.00 ATOM 433 CA ASN 420 17.175 84.137 113.603 1.00 1.00 ATOM 434 CA THR 421 18.260 80.600 114.536 1.00 1.00 ATOM 435 CA VAL 422 19.226 81.365 118.131 1.00 1.00 ATOM 436 CA PHE 423 15.569 82.090 118.877 1.00 1.00 ATOM 437 CA LEU 424 14.597 78.436 118.346 1.00 1.00 ATOM 438 CA PHE 425 14.848 75.867 121.131 1.00 1.00 ATOM 439 CA VAL 426 16.943 72.960 119.881 1.00 1.00 ATOM 441 CA ALA 428 17.877 66.207 120.309 1.00 1.00 ATOM 442 CA GLY 429 15.874 63.237 121.529 1.00 1.00 ATOM 443 CA TYR 433 12.290 63.537 120.352 1.00 1.00 ATOM 444 CA SER 434 10.703 61.936 123.427 1.00 1.00 ATOM 445 CA SER 435 12.486 64.456 125.660 1.00 1.00 ATOM 446 CA ARG 436 11.556 67.385 123.403 1.00 1.00 ATOM 447 CA ARG 437 7.834 66.574 123.366 1.00 1.00 ATOM 448 CA PHE 438 7.862 66.109 127.151 1.00 1.00 ATOM 449 CA VAL 439 9.642 69.410 127.796 1.00 1.00 ATOM 450 CA GLU 440 7.254 71.326 125.535 1.00 1.00 ATOM 451 CA ARG 441 4.115 69.731 126.970 1.00 1.00 ATOM 453 CA GLN 443 6.446 73.849 130.028 1.00 1.00 ATOM 454 CA SER 444 3.397 74.951 128.022 1.00 1.00 ATOM 455 CA SER 445 0.543 76.505 130.003 1.00 1.00 ATOM 456 CA LYS 446 -3.093 75.380 130.108 1.00 1.00 ATOM 457 CA SER 447 -4.305 77.928 127.544 1.00 1.00 ATOM 458 CA SER 448 -1.397 77.081 125.235 1.00 1.00 ATOM 459 CA PRO 449 -1.391 74.695 122.280 1.00 1.00 ATOM 460 CA SER 450 1.461 72.363 121.390 1.00 1.00 ATOM 461 CA ARG 451 1.630 71.084 117.809 1.00 1.00 ATOM 462 CA VAL 452 3.677 67.896 117.595 1.00 1.00 ATOM 463 CA LEU 453 4.330 67.410 113.889 1.00 1.00 ATOM 464 CA GLY 454 6.141 65.137 111.486 1.00 1.00 ATOM 465 CA SER 455 5.236 61.642 112.801 1.00 1.00 ATOM 466 CA ASN 456 1.486 61.475 113.010 1.00 1.00 ATOM 467 CA LYS 457 0.416 57.820 113.393 1.00 1.00 TER END ################################ # # # END # # # ################################ From mailer@bialko.llnl.gov Wed Aug 21 10:55:30 2002 Date: Wed, 21 Aug 2002 10:55:24 -0700 (PDT) From: Automatic Reply To: karplus@soe.ucsc.edu Subject: T0185 TS samt02.pdb 3 X-SpamBouncer: 1.4 (10/07/01) X-SBPass: NoBounce X-SBClass: OK # # Protein Structure Prediction Center, LLNL, Livermore, CA # Verification system Wed Aug 21 10:27:24 PDT 2002 by Adam Zemla # # The PIN number of your submission is: PIN_427473_29779 # (PIN number is not an ACCESSION CODE) # Thank you for your submission. Your prediction has been accepted with an ACCESSION CODE: T0185TS189_3 Current information on models submitted in prediction T0185TS189 MODEL_INDEX PIN CODE DATE E-mail T0185TS189_3 PIN_427473_29779 5035-2079-5263 08/21/02 10:27:24 casp5@bialko.llnl.gov T0185TS189_2 PIN_401671_29771 5035-2079-5263 08/21/02 10:24:54 casp5@bialko.llnl.gov PLEASE NOTE: Submission of a duplicate prediction (same target, format, model index) will REPLACE an existing submission (ACCESSION CODE), provided it is received before the target has expired. The current status of models accepted for target T0185 MODEL_INDEX PIN CODE DATE E-mail T0185TS189_2 PIN_401671_29771 5035-2079-5263 08/21/02 10:24:54 casp5@bialko.llnl.gov T0185TS189_3 PIN_427473_29779 5035-2079-5263 08/21/02 10:27:24 casp5@bialko.llnl.gov For more information on accepted models submitted to CASP5 see: http://PredictionCenter.llnl.gov/casp5/models/casp5-models.html Please check below if the verified data of your submission is correct. # Reading prediction format TS PFRMAT TS TARGET T0185 AUTHOR 5035-2079-5263 # Reading MODEL 3 PARENT 1GG4_A # Loading PARENT structure: 1gg4 (chain: A) # Number of residues in PARENT structure: 430 # Reading prediction format TS (DONE) # Checking the TS prediction MODEL 3 # IMPORTANT NOTE! Not complete main chain atoms for residue D 26 # !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! # # It is requested that coordinate data be supplied for at least # # all non-hydrogen main chain atoms, i.e. the N, CA, C and O # # atoms of every residue. Specifically, if only CA atoms are # # predicted by the method, predictors are encouraged to build # # the main chain atoms for every residue before submission to # # CASP. If only CA atoms were submitted it would not be possible # # to run most of the analysis software, which would severely # # limit the evaluation of that prediction. # # !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! # # IMPORTANT NOTE! Not complete main chain atoms for residue V 27 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 28 # IMPORTANT NOTE! Not complete main chain atoms for residue G 29 # IMPORTANT NOTE! Not complete main chain atoms for residue S 30 # IMPORTANT NOTE! Not complete main chain atoms for residue N 31 # IMPORTANT NOTE! Not complete main chain atoms for residue I 32 # IMPORTANT NOTE! Not complete main chain atoms for residue E 33 # IMPORTANT NOTE! Not complete main chain atoms for residue E 34 # IMPORTANT NOTE! Not complete main chain atoms for residue T 35 # IMPORTANT NOTE! Not complete main chain atoms for residue E 36 # IMPORTANT NOTE! Not complete main chain atoms for residue R 37 # IMPORTANT NOTE! Not complete main chain atoms for residue T 38 # IMPORTANT NOTE! Not complete main chain atoms for residue A 39 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 40 # IMPORTANT NOTE! Not complete main chain atoms for residue L 41 # IMPORTANT NOTE! Not complete main chain atoms for residue R 42 # IMPORTANT NOTE! Not complete main chain atoms for residue K 43 # IMPORTANT NOTE! Not complete main chain atoms for residue L 44 # IMPORTANT NOTE! Not complete main chain atoms for residue G 45 # IMPORTANT NOTE! Not complete main chain atoms for residue I 46 # IMPORTANT NOTE! Not complete main chain atoms for residue P 47 # IMPORTANT NOTE! Not complete main chain atoms for residue I 48 # IMPORTANT NOTE! Not complete main chain atoms for residue F 49 # IMPORTANT NOTE! Not complete main chain atoms for residue V 50 # IMPORTANT NOTE! Not complete main chain atoms for residue P 51 # IMPORTANT NOTE! Not complete main chain atoms for residue H 52 # IMPORTANT NOTE! Not complete main chain atoms for residue S 53 # IMPORTANT NOTE! Not complete main chain atoms for residue A 54 # IMPORTANT NOTE! Not complete main chain atoms for residue D 55 # IMPORTANT NOTE! Not complete main chain atoms for residue N 56 # IMPORTANT NOTE! Not complete main chain atoms for residue W 57 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 58 # IMPORTANT NOTE! Not complete main chain atoms for residue D 59 # IMPORTANT NOTE! Not complete main chain atoms for residue P 60 # IMPORTANT NOTE! Not complete main chain atoms for residue D 61 # IMPORTANT NOTE! Not complete main chain atoms for residue L 62 # IMPORTANT NOTE! Not complete main chain atoms for residue V 63 # IMPORTANT NOTE! Not complete main chain atoms for residue I 64 # IMPORTANT NOTE! Not complete main chain atoms for residue K 65 # IMPORTANT NOTE! Not complete main chain atoms for residue T 66 # IMPORTANT NOTE! Not complete main chain atoms for residue P 67 # IMPORTANT NOTE! Not complete main chain atoms for residue A 68 # IMPORTANT NOTE! Not complete main chain atoms for residue V 69 # IMPORTANT NOTE! Not complete main chain atoms for residue R 70 # IMPORTANT NOTE! Not complete main chain atoms for residue D 71 # IMPORTANT NOTE! Not complete main chain atoms for residue D 72 # IMPORTANT NOTE! Not complete main chain atoms for residue N 73 # IMPORTANT NOTE! Not complete main chain atoms for residue P 74 # IMPORTANT NOTE! Not complete main chain atoms for residue E 75 # IMPORTANT NOTE! Not complete main chain atoms for residue I 76 # IMPORTANT NOTE! Not complete main chain atoms for residue V 77 # IMPORTANT NOTE! Not complete main chain atoms for residue E 82 # IMPORTANT NOTE! Not complete main chain atoms for residue R 83 # IMPORTANT NOTE! Not complete main chain atoms for residue V 84 # IMPORTANT NOTE! Not complete main chain atoms for residue P 85 # IMPORTANT NOTE! Not complete main chain atoms for residue I 86 # IMPORTANT NOTE! Not complete main chain atoms for residue E 87 # IMPORTANT NOTE! Not complete main chain atoms for residue N 88 # IMPORTANT NOTE! Not complete main chain atoms for residue R 89 # IMPORTANT NOTE! Not complete main chain atoms for residue L 90 # IMPORTANT NOTE! Not complete main chain atoms for residue H 91 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 92 # IMPORTANT NOTE! Not complete main chain atoms for residue F 93 # IMPORTANT NOTE! Not complete main chain atoms for residue R 94 # IMPORTANT NOTE! Not complete main chain atoms for residue D 95 # IMPORTANT NOTE! Not complete main chain atoms for residue T 96 # IMPORTANT NOTE! Not complete main chain atoms for residue L 97 # IMPORTANT NOTE! Not complete main chain atoms for residue K 98 # IMPORTANT NOTE! Not complete main chain atoms for residue R 99 # IMPORTANT NOTE! Not complete main chain atoms for residue E 100 # IMPORTANT NOTE! Not complete main chain atoms for residue K 101 # IMPORTANT NOTE! Not complete main chain atoms for residue K 102 # IMPORTANT NOTE! Not complete main chain atoms for residue E 103 # IMPORTANT NOTE! Not complete main chain atoms for residue E 104 # IMPORTANT NOTE! Not complete main chain atoms for residue F 105 # IMPORTANT NOTE! Not complete main chain atoms for residue A 106 # IMPORTANT NOTE! Not complete main chain atoms for residue V 107 # IMPORTANT NOTE! Not complete main chain atoms for residue T 108 # IMPORTANT NOTE! Not complete main chain atoms for residue G 109 # IMPORTANT NOTE! Not complete main chain atoms for residue T 110 # IMPORTANT NOTE! Not complete main chain atoms for residue D 111 # IMPORTANT NOTE! Not complete main chain atoms for residue G 112 # IMPORTANT NOTE! Not complete main chain atoms for residue K 113 # IMPORTANT NOTE! Not complete main chain atoms for residue T 114 # IMPORTANT NOTE! Not complete main chain atoms for residue T 115 # IMPORTANT NOTE! Not complete main chain atoms for residue T 116 # IMPORTANT NOTE! Not complete main chain atoms for residue T 117 # IMPORTANT NOTE! Not complete main chain atoms for residue A 118 # IMPORTANT NOTE! Not complete main chain atoms for residue V 120 # IMPORTANT NOTE! Not complete main chain atoms for residue A 121 # IMPORTANT NOTE! Not complete main chain atoms for residue H 122 # IMPORTANT NOTE! Not complete main chain atoms for residue V 123 # IMPORTANT NOTE! Not complete main chain atoms for residue L 124 # IMPORTANT NOTE! Not complete main chain atoms for residue K 125 # IMPORTANT NOTE! Not complete main chain atoms for residue H 126 # IMPORTANT NOTE! Not complete main chain atoms for residue L 127 # IMPORTANT NOTE! Not complete main chain atoms for residue R 128 # IMPORTANT NOTE! Not complete main chain atoms for residue K 129 # IMPORTANT NOTE! Not complete main chain atoms for residue S 130 # IMPORTANT NOTE! Not complete main chain atoms for residue P 131 # IMPORTANT NOTE! Not complete main chain atoms for residue T 132 # IMPORTANT NOTE! Not complete main chain atoms for residue V 133 # IMPORTANT NOTE! Not complete main chain atoms for residue F 134 # IMPORTANT NOTE! Not complete main chain atoms for residue L 135 # IMPORTANT NOTE! Not complete main chain atoms for residue G 136 # IMPORTANT NOTE! Not complete main chain atoms for residue G 137 # IMPORTANT NOTE! Not complete main chain atoms for residue I 138 # IMPORTANT NOTE! Not complete main chain atoms for residue M 139 # IMPORTANT NOTE! Not complete main chain atoms for residue D 140 # IMPORTANT NOTE! Not complete main chain atoms for residue S 141 # IMPORTANT NOTE! Not complete main chain atoms for residue L 142 # IMPORTANT NOTE! Not complete main chain atoms for residue H 144 # IMPORTANT NOTE! Not complete main chain atoms for residue G 145 # IMPORTANT NOTE! Not complete main chain atoms for residue N 146 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 147 # IMPORTANT NOTE! Not complete main chain atoms for residue E 148 # IMPORTANT NOTE! Not complete main chain atoms for residue K 149 # IMPORTANT NOTE! Not complete main chain atoms for residue G 150 # IMPORTANT NOTE! Not complete main chain atoms for residue N 151 # IMPORTANT NOTE! Not complete main chain atoms for residue G 152 # IMPORTANT NOTE! Not complete main chain atoms for residue P 153 # IMPORTANT NOTE! Not complete main chain atoms for residue V 154 # IMPORTANT NOTE! Not complete main chain atoms for residue V 155 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 156 # IMPORTANT NOTE! Not complete main chain atoms for residue E 157 # IMPORTANT NOTE! Not complete main chain atoms for residue L 158 # IMPORTANT NOTE! Not complete main chain atoms for residue D 159 # IMPORTANT NOTE! Not complete main chain atoms for residue E 160 # IMPORTANT NOTE! Not complete main chain atoms for residue S 161 # IMPORTANT NOTE! Not complete main chain atoms for residue E 162 # IMPORTANT NOTE! Not complete main chain atoms for residue E 163 # IMPORTANT NOTE! Not complete main chain atoms for residue F 164 # IMPORTANT NOTE! Not complete main chain atoms for residue F 165 # IMPORTANT NOTE! Not complete main chain atoms for residue S 166 # IMPORTANT NOTE! Not complete main chain atoms for residue E 167 # IMPORTANT NOTE! Not complete main chain atoms for residue F 168 # IMPORTANT NOTE! Not complete main chain atoms for residue S 169 # IMPORTANT NOTE! Not complete main chain atoms for residue P 170 # IMPORTANT NOTE! Not complete main chain atoms for residue N 171 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 172 # IMPORTANT NOTE! Not complete main chain atoms for residue L 173 # IMPORTANT NOTE! Not complete main chain atoms for residue I 174 # IMPORTANT NOTE! Not complete main chain atoms for residue I 175 # IMPORTANT NOTE! Not complete main chain atoms for residue T 176 # IMPORTANT NOTE! Not complete main chain atoms for residue N 177 # IMPORTANT NOTE! Not complete main chain atoms for residue A 178 # IMPORTANT NOTE! Not complete main chain atoms for residue R 179 # IMPORTANT NOTE! Not complete main chain atoms for residue S 189 # IMPORTANT NOTE! Not complete main chain atoms for residue L 190 # IMPORTANT NOTE! Not complete main chain atoms for residue T 191 # IMPORTANT NOTE! Not complete main chain atoms for residue R 192 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 193 # IMPORTANT NOTE! Not complete main chain atoms for residue R 194 # IMPORTANT NOTE! Not complete main chain atoms for residue S 195 # IMPORTANT NOTE! Not complete main chain atoms for residue A 196 # IMPORTANT NOTE! Not complete main chain atoms for residue F 197 # IMPORTANT NOTE! Not complete main chain atoms for residue E 198 # IMPORTANT NOTE! Not complete main chain atoms for residue K 199 # IMPORTANT NOTE! Not complete main chain atoms for residue I 200 # IMPORTANT NOTE! Not complete main chain atoms for residue S 201 # IMPORTANT NOTE! Not complete main chain atoms for residue R 202 # IMPORTANT NOTE! Not complete main chain atoms for residue N 203 # IMPORTANT NOTE! Not complete main chain atoms for residue T 204 # IMPORTANT NOTE! Not complete main chain atoms for residue D 205 # IMPORTANT NOTE! Not complete main chain atoms for residue L 206 # IMPORTANT NOTE! Not complete main chain atoms for residue V 207 # IMPORTANT NOTE! Not complete main chain atoms for residue V 208 # IMPORTANT NOTE! Not complete main chain atoms for residue F 210 # IMPORTANT NOTE! Not complete main chain atoms for residue A 211 # IMPORTANT NOTE! Not complete main chain atoms for residue E 212 # IMPORTANT NOTE! Not complete main chain atoms for residue D 213 # IMPORTANT NOTE! Not complete main chain atoms for residue E 214 # IMPORTANT NOTE! Not complete main chain atoms for residue L 215 # IMPORTANT NOTE! Not complete main chain atoms for residue T 216 # IMPORTANT NOTE! Not complete main chain atoms for residue S 217 # IMPORTANT NOTE! Not complete main chain atoms for residue H 218 # IMPORTANT NOTE! Not complete main chain atoms for residue L 219 # IMPORTANT NOTE! Not complete main chain atoms for residue G 220 # IMPORTANT NOTE! Not complete main chain atoms for residue D 221 # IMPORTANT NOTE! Not complete main chain atoms for residue V 222 # IMPORTANT NOTE! Not complete main chain atoms for residue T 223 # IMPORTANT NOTE! Not complete main chain atoms for residue F 224 # IMPORTANT NOTE! Not complete main chain atoms for residue G 225 # IMPORTANT NOTE! Not complete main chain atoms for residue V 226 # IMPORTANT NOTE! Not complete main chain atoms for residue K 227 # IMPORTANT NOTE! Not complete main chain atoms for residue K 228 # IMPORTANT NOTE! Not complete main chain atoms for residue G 229 # IMPORTANT NOTE! Not complete main chain atoms for residue T 230 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 231 # IMPORTANT NOTE! Not complete main chain atoms for residue T 232 # IMPORTANT NOTE! Not complete main chain atoms for residue L 233 # IMPORTANT NOTE! Not complete main chain atoms for residue E 234 # IMPORTANT NOTE! Not complete main chain atoms for residue M 235 # IMPORTANT NOTE! Not complete main chain atoms for residue R 236 # IMPORTANT NOTE! Not complete main chain atoms for residue S 237 # IMPORTANT NOTE! Not complete main chain atoms for residue A 238 # IMPORTANT NOTE! Not complete main chain atoms for residue S 239 # IMPORTANT NOTE! Not complete main chain atoms for residue R 240 # IMPORTANT NOTE! Not complete main chain atoms for residue A 241 # IMPORTANT NOTE! Not complete main chain atoms for residue E 242 # IMPORTANT NOTE! Not complete main chain atoms for residue Q 243 # IMPORTANT NOTE! Not complete main chain atoms for residue K 244 # IMPORTANT NOTE! Not complete main chain atoms for residue A 245 # IMPORTANT NOTE! Not complete main chain atoms for residue M 246 # IMPORTANT NOTE! Not complete main chain atoms for residue V 247 # IMPORTANT NOTE! Not complete main chain atoms for residue E 248 # IMPORTANT NOTE! Not complete main chain atoms for residue K 249 # IMPORTANT NOTE! Not complete main chain atoms for residue N 250 # IMPORTANT NOTE! Not complete main chain atoms for residue G 251 # IMPORTANT NOTE! Not complete main chain atoms for residue K 252 # IMPORTANT NOTE! Not complete main chain atoms for residue R 253 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 254 # IMPORTANT NOTE! Not complete main chain atoms for residue E 256 # IMPORTANT NOTE! Not complete main chain atoms for residue L 257 # IMPORTANT NOTE! Not complete main chain atoms for residue K 258 # IMPORTANT NOTE! Not complete main chain atoms for residue L 259 # IMPORTANT NOTE! Not complete main chain atoms for residue K 260 # IMPORTANT NOTE! Not complete main chain atoms for residue V 261 # IMPORTANT NOTE! Not complete main chain atoms for residue P 262 # IMPORTANT NOTE! Not complete main chain atoms for residue G 263 # IMPORTANT NOTE! Not complete main chain atoms for residue F 264 # IMPORTANT NOTE! Not complete main chain atoms for residue H 265 # IMPORTANT NOTE! Not complete main chain atoms for residue N 266 # IMPORTANT NOTE! Not complete main chain atoms for residue V 267 # IMPORTANT NOTE! Not complete main chain atoms for residue L 268 # IMPORTANT NOTE! Not complete main chain atoms for residue N 269 # IMPORTANT NOTE! Not complete main chain atoms for residue A 270 # IMPORTANT NOTE! Not complete main chain atoms for residue L 271 # IMPORTANT NOTE! Not complete main chain atoms for residue A 272 # IMPORTANT NOTE! Not complete main chain atoms for residue V 273 # IMPORTANT NOTE! Not complete main chain atoms for residue I 274 # IMPORTANT NOTE! Not complete main chain atoms for residue A 275 # IMPORTANT NOTE! Not complete main chain atoms for residue L 276 # IMPORTANT NOTE! Not complete main chain atoms for residue F 277 # IMPORTANT NOTE! Not complete main chain atoms for residue S 279 # IMPORTANT NOTE! Not complete main chain atoms for residue L 280 # IMPORTANT NOTE! Not complete main chain atoms for residue G 281 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 282 # IMPORTANT NOTE! Not complete main chain atoms for residue D 283 # IMPORTANT NOTE! Not complete main chain atoms for residue L 284 # IMPORTANT NOTE! Not complete main chain atoms for residue A 285 # IMPORTANT NOTE! Not complete main chain atoms for residue P 286 # IMPORTANT NOTE! Not complete main chain atoms for residue V 287 # IMPORTANT NOTE! Not complete main chain atoms for residue L 288 # IMPORTANT NOTE! Not complete main chain atoms for residue E 289 # IMPORTANT NOTE! Not complete main chain atoms for residue A 290 # IMPORTANT NOTE! Not complete main chain atoms for residue L 291 # IMPORTANT NOTE! Not complete main chain atoms for residue E 292 # IMPORTANT NOTE! Not complete main chain atoms for residue E 293 # IMPORTANT NOTE! Not complete main chain atoms for residue F 294 # IMPORTANT NOTE! Not complete main chain atoms for residue R 295 # IMPORTANT NOTE! Not complete main chain atoms for residue G 296 # IMPORTANT NOTE! Not complete main chain atoms for residue V 297 # IMPORTANT NOTE! Not complete main chain atoms for residue H 298 # IMPORTANT NOTE! Not complete main chain atoms for residue R 299 # IMPORTANT NOTE! Not complete main chain atoms for residue R 300 # IMPORTANT NOTE! Not complete main chain atoms for residue F 301 # IMPORTANT NOTE! Not complete main chain atoms for residue S 302 # IMPORTANT NOTE! Not complete main chain atoms for residue I 303 # IMPORTANT NOTE! Not complete main chain atoms for residue A 304 # IMPORTANT NOTE! Not complete main chain atoms for residue D 307 # IMPORTANT NOTE! Not complete main chain atoms for residue P 308 # IMPORTANT NOTE! Not complete main chain atoms for residue E 309 # IMPORTANT NOTE! Not complete main chain atoms for residue T 310 # IMPORTANT NOTE! Not complete main chain atoms for residue N 311 # IMPORTANT NOTE! Not complete main chain atoms for residue I 312 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 313 # IMPORTANT NOTE! Not complete main chain atoms for residue V 314 # IMPORTANT NOTE! Not complete main chain atoms for residue I 315 # IMPORTANT NOTE! Not complete main chain atoms for residue D 316 # IMPORTANT NOTE! Not complete main chain atoms for residue D 317 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 318 # IMPORTANT NOTE! Not complete main chain atoms for residue A 319 # IMPORTANT NOTE! Not complete main chain atoms for residue H 320 # IMPORTANT NOTE! Not complete main chain atoms for residue T 321 # IMPORTANT NOTE! Not complete main chain atoms for residue P 322 # IMPORTANT NOTE! Not complete main chain atoms for residue D 323 # IMPORTANT NOTE! Not complete main chain atoms for residue E 324 # IMPORTANT NOTE! Not complete main chain atoms for residue R 326 # IMPORTANT NOTE! Not complete main chain atoms for residue N 327 # IMPORTANT NOTE! Not complete main chain atoms for residue L 328 # IMPORTANT NOTE! Not complete main chain atoms for residue L 329 # IMPORTANT NOTE! Not complete main chain atoms for residue Q 330 # IMPORTANT NOTE! Not complete main chain atoms for residue T 331 # IMPORTANT NOTE! Not complete main chain atoms for residue A 332 # IMPORTANT NOTE! Not complete main chain atoms for residue K 333 # IMPORTANT NOTE! Not complete main chain atoms for residue E 334 # IMPORTANT NOTE! Not complete main chain atoms for residue E 337 # IMPORTANT NOTE! Not complete main chain atoms for residue N 338 # IMPORTANT NOTE! Not complete main chain atoms for residue E 339 # IMPORTANT NOTE! Not complete main chain atoms for residue K 340 # IMPORTANT NOTE! Not complete main chain atoms for residue I 341 # IMPORTANT NOTE! Not complete main chain atoms for residue V 342 # IMPORTANT NOTE! Not complete main chain atoms for residue V 343 # IMPORTANT NOTE! Not complete main chain atoms for residue I 344 # IMPORTANT NOTE! Not complete main chain atoms for residue F 345 # IMPORTANT NOTE! Not complete main chain atoms for residue D 368 # IMPORTANT NOTE! Not complete main chain atoms for residue V 370 # IMPORTANT NOTE! Not complete main chain atoms for residue V 371 # IMPORTANT NOTE! Not complete main chain atoms for residue V 372 # IMPORTANT NOTE! Not complete main chain atoms for residue T 373 # IMPORTANT NOTE! Not complete main chain atoms for residue E 374 # IMPORTANT NOTE! Not complete main chain atoms for residue V 375 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 376 # IMPORTANT NOTE! Not complete main chain atoms for residue D 377 # IMPORTANT NOTE! Not complete main chain atoms for residue A 378 # IMPORTANT NOTE! Not complete main chain atoms for residue F 379 # IMPORTANT NOTE! Not complete main chain atoms for residue E 380 # IMPORTANT NOTE! Not complete main chain atoms for residue E 381 # IMPORTANT NOTE! Not complete main chain atoms for residue K 382 # IMPORTANT NOTE! Not complete main chain atoms for residue K 383 # IMPORTANT NOTE! Not complete main chain atoms for residue N 384 # IMPORTANT NOTE! Not complete main chain atoms for residue G 385 # IMPORTANT NOTE! Not complete main chain atoms for residue I 386 # IMPORTANT NOTE! Not complete main chain atoms for residue S 387 # IMPORTANT NOTE! Not complete main chain atoms for residue G 388 # IMPORTANT NOTE! Not complete main chain atoms for residue K 389 # IMPORTANT NOTE! Not complete main chain atoms for residue M 390 # IMPORTANT NOTE! Not complete main chain atoms for residue I 391 # IMPORTANT NOTE! Not complete main chain atoms for residue W 392 # IMPORTANT NOTE! Not complete main chain atoms for residue D 393 # IMPORTANT NOTE! Not complete main chain atoms for residue S 394 # IMPORTANT NOTE! Not complete main chain atoms for residue L 395 # IMPORTANT NOTE! Not complete main chain atoms for residue K 396 # IMPORTANT NOTE! Not complete main chain atoms for residue S 397 # IMPORTANT NOTE! Not complete main chain atoms for residue L 398 # IMPORTANT NOTE! Not complete main chain atoms for residue G 399 # IMPORTANT NOTE! Not complete main chain atoms for residue K 400 # IMPORTANT NOTE! Not complete main chain atoms for residue E 401 # IMPORTANT NOTE! Not complete main chain atoms for residue A 402 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 403 # IMPORTANT NOTE! Not complete main chain atoms for residue F 404 # IMPORTANT NOTE! Not complete main chain atoms for residue I 415 # IMPORTANT NOTE! Not complete main chain atoms for residue T 421 # IMPORTANT NOTE! Not complete main chain atoms for residue V 422 # IMPORTANT NOTE! Not complete main chain atoms for residue F 423 # IMPORTANT NOTE! Not complete main chain atoms for residue L 424 # IMPORTANT NOTE! Not complete main chain atoms for residue F 425 # IMPORTANT NOTE! Not complete main chain atoms for residue V 426 # IMPORTANT NOTE! Not complete main chain atoms for residue G 427 # IMPORTANT NOTE! Not complete main chain atoms for residue A 428 # IMPORTANT NOTE! Not complete main chain atoms for residue G 429 # IMPORTANT NOTE! Not complete main chain atoms for residue D 430 # IMPORTANT NOTE! Not complete main chain atoms for residue I 431 # IMPORTANT NOTE! Not complete main chain atoms for residue I 432 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 433 # IMPORTANT NOTE! Not complete main chain atoms for residue S 434 # IMPORTANT NOTE! Not complete main chain atoms for residue S 435 # IMPORTANT NOTE! Not complete main chain atoms for residue R 436 # IMPORTANT NOTE! Not complete main chain atoms for residue R 437 # IMPORTANT NOTE! Not complete main chain atoms for residue F 438 # IMPORTANT NOTE! Not complete main chain atoms for residue V 439 # IMPORTANT NOTE! Not complete main chain atoms for residue E 440 # IMPORTANT NOTE! Not complete main chain atoms for residue R 441 # IMPORTANT NOTE! Not complete main chain atoms for residue Y 442 # IMPORTANT NOTE! Not complete main chain atoms for residue Q 443 # IMPORTANT NOTE! Not complete main chain atoms for residue S 444 # IMPORTANT NOTE! Not complete main chain atoms for residue S 445 # IMPORTANT NOTE! Not complete main chain atoms for residue K 446 # IMPORTANT NOTE! Not complete main chain atoms for residue S 447 # IMPORTANT NOTE! Not complete main chain atoms for residue S 448 # IMPORTANT NOTE! Not complete main chain atoms for residue P 449 # IMPORTANT NOTE! Not complete main chain atoms for residue S 450 # IMPORTANT NOTE! Not complete main chain atoms for residue R 451 # IMPORTANT NOTE! Not complete main chain atoms for residue V 452 # IMPORTANT NOTE! Not complete main chain atoms for residue L 453 # IMPORTANT NOTE! Not complete main chain atoms for residue G 454 # IMPORTANT NOTE! Not complete main chain atoms for residue S 455 # Checking the TS prediction MODEL 3 (DONE) # MODEL index: 3 # Target name: T0185 # Total number of residues in target: 457 # Total number of residues in model: 369 # Total number of atoms in model: 369 # Number of atoms with 1.0 occupancy: 369 # Number of fragments in model: 1 # Number of METHOD records: 1 # No errors. # Number of Warnings: 369 ################################ # # # SUBMISSION # # # ################################ # # # BEGIN # # # ################################ PFRMAT TS TARGET T0185 AUTHOR 5035-2079-5263 METHOD CAFASP MODEL 3 PARENT 1GG4_A ATOM 25 CA ASP 26 13.988 110.640 28.822 1.00 1.00 ATOM 26 CA VAL 27 12.900 107.536 26.923 1.00 1.00 ATOM 27 CA TYR 28 14.453 104.974 24.563 1.00 1.00 ATOM 28 CA GLY 29 13.032 102.170 22.416 1.00 1.00 ATOM 29 CA SER 30 13.733 99.705 19.629 1.00 1.00 ATOM 30 CA ASN 31 10.044 99.438 18.622 1.00 1.00 ATOM 31 CA ILE 32 8.207 101.711 16.173 1.00 1.00 ATOM 32 CA GLU 33 4.971 100.713 17.858 1.00 1.00 ATOM 33 CA GLU 34 6.504 102.126 21.039 1.00 1.00 ATOM 34 CA THR 35 7.710 105.650 20.169 1.00 1.00 ATOM 35 CA GLU 36 7.259 108.517 22.650 1.00 1.00 ATOM 36 CA ARG 37 7.540 112.266 21.821 1.00 1.00 ATOM 37 CA THR 38 11.285 112.883 21.418 1.00 1.00 ATOM 38 CA ALA 39 12.612 109.493 22.426 1.00 1.00 ATOM 39 CA TYR 40 15.746 107.710 21.176 1.00 1.00 ATOM 40 CA LEU 41 15.060 105.078 18.564 1.00 1.00 ATOM 41 CA ARG 42 17.762 102.403 18.668 1.00 1.00 ATOM 42 CA LYS 43 18.064 100.844 15.272 1.00 1.00 ATOM 43 CA LEU 44 19.113 97.258 15.861 1.00 1.00 ATOM 44 CA GLY 45 19.907 94.783 13.162 1.00 1.00 ATOM 45 CA ILE 46 18.911 91.198 13.660 1.00 1.00 ATOM 46 CA PRO 47 19.593 88.781 10.789 1.00 1.00 ATOM 47 CA ILE 48 16.140 89.075 9.218 1.00 1.00 ATOM 48 CA PHE 49 15.688 92.797 10.116 1.00 1.00 ATOM 49 CA VAL 50 17.775 95.988 9.915 1.00 1.00 ATOM 50 CA PRO 51 15.806 98.551 11.927 1.00 1.00 ATOM 51 CA HIS 52 17.764 101.260 10.085 1.00 1.00 ATOM 52 CA SER 53 15.225 100.906 7.270 1.00 1.00 ATOM 53 CA ALA 54 12.598 101.813 9.886 1.00 1.00 ATOM 56 CA ASP 55 9.022 105.676 10.316 1.00 1.00 ATOM 57 CA ASN 56 10.489 106.296 13.795 1.00 1.00 ATOM 58 CA TRP 57 10.946 109.946 12.748 1.00 1.00 ATOM 60 CA TYR 58 6.322 108.616 14.864 1.00 1.00 ATOM 61 CA ASP 59 7.954 111.410 16.828 1.00 1.00 ATOM 62 CA PRO 60 11.396 109.958 17.601 1.00 1.00 ATOM 63 CA ASP 61 13.743 112.686 18.884 1.00 1.00 ATOM 64 CA LEU 62 17.043 111.101 17.703 1.00 1.00 ATOM 65 CA VAL 63 18.422 107.844 16.331 1.00 1.00 ATOM 66 CA ILE 64 21.098 105.514 17.812 1.00 1.00 ATOM 67 CA LYS 65 22.491 103.924 14.664 1.00 1.00 ATOM 68 CA THR 66 25.606 102.141 13.295 1.00 1.00 ATOM 69 CA PRO 67 25.861 104.255 10.103 1.00 1.00 ATOM 70 CA ALA 68 24.784 107.740 8.836 1.00 1.00 ATOM 71 CA VAL 69 21.214 107.976 7.495 1.00 1.00 ATOM 72 CA ARG 70 19.482 110.707 5.488 1.00 1.00 ATOM 73 CA ASP 71 16.942 111.377 8.231 1.00 1.00 ATOM 74 CA ASP 72 16.650 114.925 9.525 1.00 1.00 ATOM 75 CA ASN 73 17.198 113.744 13.089 1.00 1.00 ATOM 76 CA PRO 74 20.204 113.973 15.452 1.00 1.00 ATOM 77 CA GLU 75 22.214 110.790 15.082 1.00 1.00 ATOM 78 CA ILE 76 24.565 108.955 17.385 1.00 1.00 ATOM 79 CA VAL 77 26.779 106.817 15.182 1.00 1.00 ATOM 80 CA GLU 82 28.305 103.925 17.166 1.00 1.00 ATOM 81 CA ARG 83 30.268 100.913 15.891 1.00 1.00 ATOM 82 CA VAL 84 27.720 98.318 17.082 1.00 1.00 ATOM 83 CA PRO 85 24.144 99.022 18.186 1.00 1.00 ATOM 84 CA ILE 86 23.553 95.696 19.978 1.00 1.00 ATOM 85 CA GLU 87 26.473 96.589 22.231 1.00 1.00 ATOM 86 CA ASN 88 25.568 100.267 22.585 1.00 1.00 ATOM 87 CA ARG 89 22.009 99.361 23.631 1.00 1.00 ATOM 88 CA LEU 90 23.368 97.084 26.338 1.00 1.00 ATOM 89 CA HIS 91 25.924 99.705 27.305 1.00 1.00 ATOM 90 CA TYR 92 23.264 102.418 27.602 1.00 1.00 ATOM 91 CA PHE 93 21.295 100.019 29.869 1.00 1.00 ATOM 92 CA ARG 94 24.393 99.358 31.939 1.00 1.00 ATOM 93 CA ASP 95 24.855 103.090 32.401 1.00 1.00 ATOM 94 CA THR 96 21.238 103.656 33.382 1.00 1.00 ATOM 95 CA LEU 97 21.405 100.903 35.966 1.00 1.00 ATOM 96 CA LYS 98 24.423 102.572 37.611 1.00 1.00 ATOM 97 CA ARG 99 22.495 105.827 37.896 1.00 1.00 ATOM 98 CA GLU 100 19.626 104.499 40.068 1.00 1.00 ATOM 99 CA LYS 101 19.574 103.435 43.779 1.00 1.00 ATOM 100 CA LYS 102 17.568 100.177 43.299 1.00 1.00 ATOM 101 CA GLU 103 18.796 96.960 44.973 1.00 1.00 ATOM 102 CA GLU 104 19.410 94.932 41.823 1.00 1.00 ATOM 103 CA PHE 105 19.357 91.172 42.054 1.00 1.00 ATOM 104 CA ALA 106 19.616 88.528 39.239 1.00 1.00 ATOM 105 CA VAL 107 18.837 84.872 38.494 1.00 1.00 ATOM 106 CA THR 108 19.234 82.086 35.912 1.00 1.00 ATOM 107 CA GLY 109 18.747 78.322 35.694 1.00 1.00 ATOM 108 CA THR 110 17.495 75.595 33.377 1.00 1.00 ATOM 109 CA ASP 111 14.041 75.498 34.952 1.00 1.00 ATOM 110 CA GLY 112 12.039 77.712 37.316 1.00 1.00 ATOM 111 CA LYS 113 13.513 81.062 36.276 1.00 1.00 ATOM 112 CA THR 114 10.016 82.545 35.988 1.00 1.00 ATOM 113 CA THR 115 8.614 81.262 39.289 1.00 1.00 ATOM 114 CA THR 116 11.686 82.155 41.303 1.00 1.00 ATOM 115 CA THR 117 11.602 85.615 39.644 1.00 1.00 ATOM 116 CA ALA 118 7.904 86.080 40.395 1.00 1.00 ATOM 118 CA VAL 120 11.260 87.058 44.551 1.00 1.00 ATOM 119 CA ALA 121 9.397 90.032 43.041 1.00 1.00 ATOM 120 CA HIS 122 6.272 89.177 45.097 1.00 1.00 ATOM 121 CA VAL 123 8.265 89.253 48.347 1.00 1.00 ATOM 122 CA LEU 124 10.320 92.374 47.671 1.00 1.00 ATOM 123 CA LYS 125 7.052 94.158 46.714 1.00 1.00 ATOM 124 CA HIS 126 6.152 93.944 50.397 1.00 1.00 ATOM 125 CA LEU 127 9.381 95.846 51.044 1.00 1.00 ATOM 126 CA ARG 128 9.218 98.632 48.499 1.00 1.00 ATOM 127 CA LYS 129 8.632 99.560 44.857 1.00 1.00 ATOM 128 CA SER 130 9.918 96.651 42.742 1.00 1.00 ATOM 129 CA PRO 131 10.666 96.000 39.053 1.00 1.00 ATOM 130 CA THR 132 11.087 92.567 37.520 1.00 1.00 ATOM 131 CA VAL 133 11.773 91.167 34.073 1.00 1.00 ATOM 132 CA PHE 134 8.714 91.088 31.828 1.00 1.00 ATOM 133 CA LEU 135 7.935 87.769 30.195 1.00 1.00 ATOM 134 CA GLY 136 11.068 86.027 28.984 1.00 1.00 ATOM 135 CA GLY 137 13.127 89.057 28.106 1.00 1.00 ATOM 136 CA ILE 138 16.385 87.609 29.371 1.00 1.00 ATOM 139 CA MET 139 18.091 92.529 23.886 1.00 1.00 ATOM 140 CA ASP 140 15.652 91.778 26.664 1.00 1.00 ATOM 141 CA SER 141 17.977 92.507 29.566 1.00 1.00 ATOM 142 CA LEU 142 18.873 95.990 28.254 1.00 1.00 ATOM 144 CA HIS 144 14.458 95.477 31.298 1.00 1.00 ATOM 145 CA GLY 145 17.324 97.479 32.762 1.00 1.00 ATOM 146 CA ASN 146 16.377 100.577 30.736 1.00 1.00 ATOM 147 CA TYR 147 13.022 100.669 32.574 1.00 1.00 ATOM 148 CA GLU 148 14.763 101.676 35.773 1.00 1.00 ATOM 149 CA LYS 149 14.044 104.971 37.570 1.00 1.00 ATOM 151 CA GLY 150 11.680 105.522 42.236 1.00 1.00 ATOM 152 CA ASN 151 12.408 101.796 42.125 1.00 1.00 ATOM 153 CA GLY 152 13.568 100.217 45.361 1.00 1.00 ATOM 154 CA PRO 153 14.380 96.728 44.096 1.00 1.00 ATOM 155 CA VAL 154 14.888 95.099 40.722 1.00 1.00 ATOM 156 CA VAL 155 14.721 91.402 39.867 1.00 1.00 ATOM 157 CA TYR 156 16.589 90.710 36.640 1.00 1.00 ATOM 158 CA GLU 157 16.120 87.278 35.025 1.00 1.00 ATOM 159 CA LEU 158 19.010 86.215 32.784 1.00 1.00 ATOM 160 CA ASP 159 18.752 83.497 30.169 1.00 1.00 ATOM 161 CA GLU 160 21.362 81.803 28.014 1.00 1.00 ATOM 162 CA SER 161 21.401 79.610 24.948 1.00 1.00 ATOM 163 CA GLU 162 25.113 79.573 24.248 1.00 1.00 ATOM 169 CA GLU 163 27.567 89.859 28.821 1.00 1.00 ATOM 170 CA PHE 164 24.209 90.494 30.491 1.00 1.00 ATOM 171 CA PHE 165 25.434 90.288 34.112 1.00 1.00 ATOM 172 CA SER 166 28.157 92.757 33.248 1.00 1.00 ATOM 173 CA GLU 167 25.365 95.159 32.337 1.00 1.00 ATOM 174 CA PHE 168 23.187 94.220 35.316 1.00 1.00 ATOM 175 CA SER 169 25.930 94.144 37.988 1.00 1.00 ATOM 176 CA PRO 170 23.634 92.478 40.583 1.00 1.00 ATOM 177 CA ASN 171 24.265 92.492 44.345 1.00 1.00 ATOM 178 CA TYR 172 23.276 88.831 44.448 1.00 1.00 ATOM 179 CA LEU 173 23.107 86.269 41.658 1.00 1.00 ATOM 180 CA ILE 174 21.343 82.886 41.604 1.00 1.00 ATOM 181 CA ILE 175 21.472 79.694 39.514 1.00 1.00 ATOM 182 CA THR 176 18.243 77.782 40.284 1.00 1.00 ATOM 183 CA ASN 177 19.315 74.514 38.660 1.00 1.00 ATOM 184 CA ALA 178 21.059 72.573 35.877 1.00 1.00 ATOM 185 CA ARG 179 19.613 70.022 33.433 1.00 1.00 ATOM 194 CA SER 189 26.401 68.607 27.264 1.00 1.00 ATOM 195 CA LEU 190 25.355 69.406 30.847 1.00 1.00 ATOM 196 CA THR 191 28.856 70.729 31.767 1.00 1.00 ATOM 197 CA ARG 192 28.484 73.351 29.036 1.00 1.00 ATOM 198 CA TYR 193 25.178 74.540 30.430 1.00 1.00 ATOM 199 CA ARG 194 26.754 74.555 33.902 1.00 1.00 ATOM 200 CA SER 195 29.640 76.641 32.571 1.00 1.00 ATOM 201 CA ALA 196 27.186 79.112 31.025 1.00 1.00 ATOM 202 CA PHE 197 24.867 79.573 34.036 1.00 1.00 ATOM 203 CA GLU 198 27.986 79.742 36.242 1.00 1.00 ATOM 204 CA LYS 199 28.879 82.932 34.396 1.00 1.00 ATOM 205 CA ILE 200 26.192 84.747 36.360 1.00 1.00 ATOM 206 CA SER 201 28.533 84.906 39.371 1.00 1.00 ATOM 207 CA ARG 202 31.054 87.091 37.522 1.00 1.00 ATOM 208 CA ASN 203 28.886 90.181 37.825 1.00 1.00 ATOM 209 CA THR 204 28.805 90.237 41.596 1.00 1.00 ATOM 213 CA ASP 205 28.010 90.270 46.648 1.00 1.00 ATOM 214 CA LEU 206 26.243 87.044 47.574 1.00 1.00 ATOM 215 CA VAL 207 26.393 83.957 45.323 1.00 1.00 ATOM 216 CA VAL 208 23.313 81.713 45.813 1.00 1.00 ATOM 218 CA PHE 210 21.017 75.025 44.755 1.00 1.00 ATOM 219 CA ALA 211 22.483 72.656 47.311 1.00 1.00 ATOM 220 CA GLU 212 20.846 69.772 45.438 1.00 1.00 ATOM 221 CA ASP 213 21.895 70.836 41.966 1.00 1.00 ATOM 222 CA GLU 214 24.951 72.920 41.185 1.00 1.00 ATOM 223 CA LEU 215 28.549 72.906 40.010 1.00 1.00 ATOM 224 CA THR 216 30.309 74.408 43.020 1.00 1.00 ATOM 225 CA SER 217 33.443 72.538 42.020 1.00 1.00 ATOM 226 CA HIS 218 33.912 74.917 39.081 1.00 1.00 ATOM 227 CA LEU 219 31.743 77.815 40.219 1.00 1.00 ATOM 235 CA GLY 220 29.756 85.154 50.455 1.00 1.00 ATOM 236 CA ASP 221 27.838 82.065 49.453 1.00 1.00 ATOM 237 CA VAL 222 24.297 81.009 50.195 1.00 1.00 ATOM 238 CA THR 223 22.742 77.649 49.438 1.00 1.00 ATOM 239 CA PHE 224 19.080 76.686 49.435 1.00 1.00 ATOM 240 CA GLY 225 17.436 73.266 49.704 1.00 1.00 ATOM 241 CA VAL 226 14.591 71.796 51.839 1.00 1.00 ATOM 242 CA LYS 227 16.957 69.596 53.845 1.00 1.00 ATOM 243 CA LYS 228 20.473 69.602 52.392 1.00 1.00 ATOM 244 CA GLY 229 23.143 69.431 55.084 1.00 1.00 ATOM 247 CA THR 230 21.191 77.988 54.470 1.00 1.00 ATOM 248 CA TYR 231 17.516 78.161 53.423 1.00 1.00 ATOM 249 CA THR 232 15.632 75.143 54.753 1.00 1.00 ATOM 250 CA LEU 233 12.056 73.818 54.846 1.00 1.00 ATOM 251 CA GLU 234 10.667 71.823 57.795 1.00 1.00 ATOM 252 CA MET 235 7.229 70.823 59.104 1.00 1.00 ATOM 253 CA ARG 236 6.053 70.415 55.524 1.00 1.00 ATOM 254 CA SER 237 2.352 69.821 55.843 1.00 1.00 ATOM 255 CA ALA 238 0.351 69.796 52.609 1.00 1.00 ATOM 256 CA SER 239 -3.152 71.298 52.987 1.00 1.00 ATOM 257 CA ARG 240 -6.246 71.730 50.770 1.00 1.00 ATOM 258 CA ALA 241 -4.948 75.246 50.143 1.00 1.00 ATOM 259 CA GLU 242 -1.212 74.820 49.692 1.00 1.00 ATOM 260 CA GLN 243 1.899 73.736 51.529 1.00 1.00 ATOM 261 CA LYS 244 2.452 74.930 55.074 1.00 1.00 ATOM 262 CA ALA 245 6.022 74.888 56.376 1.00 1.00 ATOM 263 CA MET 246 8.654 76.416 58.596 1.00 1.00 ATOM 264 CA VAL 247 11.000 78.413 56.368 1.00 1.00 ATOM 265 CA GLU 248 14.413 78.545 58.037 1.00 1.00 ATOM 266 CA LYS 249 16.638 81.377 56.886 1.00 1.00 ATOM 267 CA ASN 250 19.947 82.681 58.329 1.00 1.00 ATOM 268 CA GLY 251 18.036 85.160 60.589 1.00 1.00 ATOM 269 CA LYS 252 15.329 82.880 61.954 1.00 1.00 ATOM 270 CA ARG 253 12.197 81.026 60.882 1.00 1.00 ATOM 271 CA TYR 254 8.632 81.742 59.865 1.00 1.00 ATOM 272 CA GLU 256 5.845 79.300 59.268 1.00 1.00 ATOM 273 CA LEU 257 4.574 80.153 55.800 1.00 1.00 ATOM 274 CA LYS 258 1.784 79.009 53.519 1.00 1.00 ATOM 275 CA LEU 259 2.842 78.405 49.928 1.00 1.00 ATOM 276 CA LYS 260 -0.436 78.422 47.931 1.00 1.00 ATOM 277 CA VAL 261 0.804 76.389 44.959 1.00 1.00 ATOM 278 CA PRO 262 0.356 72.613 44.630 1.00 1.00 ATOM 279 CA GLY 263 3.604 70.710 44.117 1.00 1.00 ATOM 280 CA PHE 264 6.559 70.026 46.404 1.00 1.00 ATOM 281 CA HIS 265 8.844 71.475 43.728 1.00 1.00 ATOM 282 CA ASN 266 7.524 74.920 44.531 1.00 1.00 ATOM 283 CA VAL 267 8.975 74.615 48.025 1.00 1.00 ATOM 284 CA LEU 268 12.513 74.797 46.565 1.00 1.00 ATOM 285 CA ASN 269 11.628 77.761 44.387 1.00 1.00 ATOM 286 CA ALA 270 10.271 79.505 47.482 1.00 1.00 ATOM 287 CA LEU 271 13.635 78.886 49.181 1.00 1.00 ATOM 288 CA ALA 272 15.578 80.336 46.254 1.00 1.00 ATOM 289 CA VAL 273 13.223 83.310 46.217 1.00 1.00 ATOM 290 CA ILE 274 13.609 83.753 49.984 1.00 1.00 ATOM 291 CA ALA 275 17.378 83.709 49.554 1.00 1.00 ATOM 292 CA LEU 276 17.346 86.220 46.711 1.00 1.00 ATOM 293 CA PHE 277 14.946 88.503 48.572 1.00 1.00 ATOM 295 CA SER 279 20.238 89.138 50.089 1.00 1.00 ATOM 296 CA LEU 280 18.842 92.612 49.472 1.00 1.00 ATOM 297 CA GLY 281 17.021 93.067 52.771 1.00 1.00 ATOM 298 CA TYR 282 13.684 91.248 52.747 1.00 1.00 ATOM 299 CA ASP 283 12.416 90.366 56.225 1.00 1.00 ATOM 300 CA LEU 284 10.843 87.042 57.276 1.00 1.00 ATOM 301 CA ALA 285 7.493 88.872 57.474 1.00 1.00 ATOM 302 CA PRO 286 8.032 90.100 53.935 1.00 1.00 ATOM 303 CA VAL 287 8.758 86.579 52.724 1.00 1.00 ATOM 304 CA LEU 288 5.688 85.038 54.351 1.00 1.00 ATOM 305 CA GLU 289 3.402 87.743 52.920 1.00 1.00 ATOM 306 CA ALA 290 5.065 87.616 49.507 1.00 1.00 ATOM 307 CA LEU 291 4.601 83.856 49.108 1.00 1.00 ATOM 308 CA GLU 292 1.018 83.986 50.480 1.00 1.00 ATOM 309 CA GLU 293 -0.365 85.743 47.402 1.00 1.00 ATOM 310 CA PHE 294 1.152 83.672 44.611 1.00 1.00 ATOM 311 CA ARG 295 -1.238 82.600 41.821 1.00 1.00 ATOM 312 CA GLY 296 -0.737 79.528 39.615 1.00 1.00 ATOM 313 CA VAL 297 -0.636 79.413 35.804 1.00 1.00 ATOM 314 CA HIS 298 -3.898 77.958 34.416 1.00 1.00 ATOM 315 CA ARG 299 -3.428 74.404 33.161 1.00 1.00 ATOM 316 CA ARG 300 -0.352 73.871 35.319 1.00 1.00 ATOM 317 CA PHE 301 -1.144 72.511 38.786 1.00 1.00 ATOM 318 CA SER 302 -3.695 75.304 38.927 1.00 1.00 ATOM 319 CA ILE 303 -5.825 74.931 42.091 1.00 1.00 ATOM 320 CA ALA 304 -9.558 75.558 41.750 1.00 1.00 ATOM 321 CA ASP 307 -11.654 75.525 44.908 1.00 1.00 ATOM 322 CA PRO 308 -14.986 73.804 43.947 1.00 1.00 ATOM 323 CA GLU 309 -16.810 74.093 47.266 1.00 1.00 ATOM 324 CA THR 310 -15.506 73.541 50.789 1.00 1.00 ATOM 325 CA ASN 311 -12.871 70.775 50.889 1.00 1.00 ATOM 326 CA ILE 312 -13.476 70.103 47.196 1.00 1.00 ATOM 327 CA TYR 313 -10.247 70.962 45.395 1.00 1.00 ATOM 328 CA VAL 314 -9.724 70.628 41.652 1.00 1.00 ATOM 329 CA ILE 315 -6.141 70.683 40.354 1.00 1.00 ATOM 330 CA ASP 316 -6.089 71.803 36.780 1.00 1.00 ATOM 331 CA ASP 317 -2.991 70.375 35.139 1.00 1.00 ATOM 333 CA TYR 318 -2.141 71.815 29.731 1.00 1.00 ATOM 334 CA ALA 319 0.015 68.826 28.648 1.00 1.00 ATOM 335 CA HIS 320 1.291 65.411 29.760 1.00 1.00 ATOM 336 CA THR 321 4.165 62.977 29.189 1.00 1.00 ATOM 337 CA PRO 322 5.437 60.161 31.475 1.00 1.00 ATOM 338 CA ASP 323 7.505 62.568 33.546 1.00 1.00 ATOM 339 CA GLU 324 4.876 65.231 34.211 1.00 1.00 ATOM 341 CA ARG 326 4.228 60.411 37.038 1.00 1.00 ATOM 342 CA ASN 327 4.936 63.623 38.936 1.00 1.00 ATOM 343 CA LEU 328 1.236 64.616 38.883 1.00 1.00 ATOM 344 CA LEU 329 0.433 61.379 40.760 1.00 1.00 ATOM 345 CA GLN 330 2.928 62.276 43.499 1.00 1.00 ATOM 346 CA THR 331 1.235 65.670 43.917 1.00 1.00 ATOM 347 CA ALA 332 -2.232 64.115 44.166 1.00 1.00 ATOM 348 CA LYS 333 -1.033 61.368 46.517 1.00 1.00 ATOM 349 CA GLU 334 -0.257 63.909 49.241 1.00 1.00 ATOM 351 CA GLU 337 -6.288 65.682 51.417 1.00 1.00 ATOM 352 CA ASN 338 -9.339 63.397 51.314 1.00 1.00 ATOM 353 CA GLU 339 -10.479 60.954 48.639 1.00 1.00 ATOM 354 CA LYS 340 -8.215 61.485 45.631 1.00 1.00 ATOM 355 CA ILE 341 -9.317 61.183 42.002 1.00 1.00 ATOM 356 CA VAL 342 -6.804 61.232 39.114 1.00 1.00 ATOM 357 CA VAL 343 -8.795 62.215 36.018 1.00 1.00 ATOM 358 CA ILE 344 -6.770 61.552 32.893 1.00 1.00 ATOM 359 CA PHE 345 -6.619 61.517 29.100 1.00 1.00 ATOM 360 CA ASP 368 -4.072 60.094 26.626 1.00 1.00 ATOM 362 CA VAL 370 1.603 62.750 24.096 1.00 1.00 ATOM 363 CA VAL 371 3.873 59.667 24.099 1.00 1.00 ATOM 364 CA VAL 372 5.402 58.181 20.968 1.00 1.00 ATOM 365 CA THR 373 5.482 54.677 19.511 1.00 1.00 ATOM 366 CA GLU 374 5.357 51.225 21.097 1.00 1.00 ATOM 367 CA VAL 375 6.603 52.586 24.431 1.00 1.00 ATOM 368 CA TYR 376 3.241 54.470 24.763 1.00 1.00 ATOM 369 CA ASP 377 1.339 51.455 26.108 1.00 1.00 ATOM 370 CA ALA 378 4.108 50.861 28.667 1.00 1.00 ATOM 371 CA PHE 379 4.216 54.540 29.656 1.00 1.00 ATOM 372 CA GLU 380 0.526 54.544 30.490 1.00 1.00 ATOM 373 CA GLU 381 0.925 51.301 32.425 1.00 1.00 ATOM 374 CA LYS 382 3.683 52.877 34.541 1.00 1.00 ATOM 375 CA LYS 383 1.564 55.848 35.470 1.00 1.00 ATOM 376 CA ASN 384 -1.266 53.494 36.379 1.00 1.00 ATOM 377 CA GLY 385 1.107 51.419 38.521 1.00 1.00 ATOM 378 CA ILE 386 2.362 54.670 40.110 1.00 1.00 ATOM 379 CA SER 387 -1.129 55.780 41.171 1.00 1.00 ATOM 380 CA GLY 388 -1.637 52.203 42.362 1.00 1.00 ATOM 381 CA LYS 389 1.470 52.302 44.581 1.00 1.00 ATOM 382 CA MET 390 0.603 55.869 45.621 1.00 1.00 ATOM 383 CA ILE 391 -2.705 54.798 47.112 1.00 1.00 ATOM 384 CA TRP 392 -4.762 56.994 44.789 1.00 1.00 ATOM 385 CA ASP 393 -8.417 56.469 45.689 1.00 1.00 ATOM 386 CA SER 394 -9.741 56.425 42.091 1.00 1.00 ATOM 387 CA LEU 395 -8.712 57.030 38.449 1.00 1.00 ATOM 388 CA LYS 396 -11.355 58.015 35.883 1.00 1.00 ATOM 389 CA SER 397 -9.962 57.918 32.347 1.00 1.00 ATOM 390 CA LEU 398 -10.927 58.704 28.726 1.00 1.00 ATOM 391 CA GLY 399 -8.960 57.895 25.606 1.00 1.00 ATOM 392 CA LYS 400 -7.774 55.014 23.469 1.00 1.00 ATOM 393 CA GLU 401 -4.560 54.639 25.483 1.00 1.00 ATOM 394 CA ALA 402 -5.382 55.994 28.930 1.00 1.00 ATOM 395 CA TYR 403 -7.333 52.877 29.856 1.00 1.00 ATOM 396 CA PHE 404 -3.926 51.382 30.596 1.00 1.00 ATOM 397 CA ILE 415 -3.523 53.820 33.499 1.00 1.00 ATOM 398 CA THR 421 -6.889 53.224 35.216 1.00 1.00 ATOM 399 CA VAL 422 -6.472 49.468 34.559 1.00 1.00 ATOM 400 CA PHE 423 -2.999 49.322 36.104 1.00 1.00 ATOM 401 CA LEU 424 -4.044 51.511 39.027 1.00 1.00 ATOM 402 CA PHE 425 -6.211 48.653 40.304 1.00 1.00 ATOM 403 CA VAL 426 -8.955 51.213 40.769 1.00 1.00 ATOM 404 CA GLY 427 -10.762 53.717 38.584 1.00 1.00 ATOM 405 CA ALA 428 -12.834 53.234 35.432 1.00 1.00 ATOM 406 CA GLY 429 -12.632 54.118 31.742 1.00 1.00 ATOM 407 CA ASP 430 -15.002 56.010 29.392 1.00 1.00 ATOM 408 CA ILE 431 -15.562 56.220 25.636 1.00 1.00 ATOM 409 CA ILE 432 -16.059 60.013 25.751 1.00 1.00 ATOM 410 CA TYR 433 -15.473 62.936 28.113 1.00 1.00 ATOM 411 CA SER 434 -19.207 63.496 28.662 1.00 1.00 ATOM 412 CA SER 435 -19.701 60.154 30.384 1.00 1.00 ATOM 413 CA ARG 436 -16.609 60.915 32.496 1.00 1.00 ATOM 414 CA ARG 437 -17.870 64.345 33.584 1.00 1.00 ATOM 415 CA PHE 438 -21.166 62.814 34.652 1.00 1.00 ATOM 416 CA VAL 439 -19.592 59.994 36.736 1.00 1.00 ATOM 417 CA GLU 440 -17.065 62.530 38.018 1.00 1.00 ATOM 418 CA ARG 441 -19.745 65.013 39.143 1.00 1.00 ATOM 419 CA TYR 442 -21.448 62.175 41.053 1.00 1.00 ATOM 420 CA GLN 443 -18.201 61.203 42.751 1.00 1.00 ATOM 421 CA SER 444 -17.780 64.900 43.736 1.00 1.00 ATOM 422 CA SER 445 -21.294 65.014 45.242 1.00 1.00 ATOM 423 CA LYS 446 -20.677 61.583 46.779 1.00 1.00 ATOM 424 CA SER 447 -17.343 62.562 48.398 1.00 1.00 ATOM 425 CA SER 448 -17.460 65.699 50.554 1.00 1.00 ATOM 428 CA PRO 449 -9.038 66.352 45.586 1.00 1.00 ATOM 429 CA SER 450 -9.238 66.011 41.791 1.00 1.00 ATOM 430 CA ARG 451 -6.347 66.233 39.315 1.00 1.00 ATOM 431 CA VAL 452 -7.277 66.548 35.659 1.00 1.00 ATOM 432 CA LEU 453 -4.417 66.049 33.245 1.00 1.00 ATOM 433 CA GLY 454 -3.864 64.869 29.707 1.00 1.00 ATOM 434 CA SER 455 -1.942 65.773 26.550 1.00 1.00 TER END ################################ # # # END # # # ################################