PFRMAT TS TARGET T0211 AUTHOR 4204-4258-2837 METHOD The SAM-T04 human predictions for CASP6 use a very similar method to METHOD the SAM-T02 method in CASP5. METHOD METHOD We start with a fully automated method: METHOD METHOD Use the SAM-T2K and SAM-T04 methods for finding homologs of the METHOD target and aligning them. METHOD METHOD Make local structure predictions using neural nets and the METHOD multiple alignments. Different neural nets are used for the METHOD SAM-T2K alignments and the SAM-T04 alignments. METHOD We currently use 7 local-structure alphabets: METHOD DSSP METHOD STRIDE METHOD STR2 an extended version of DSSP that splits the beta strands METHOD into multiple classes (parallel/antiparallel/mixed, METHOD edge/center) METHOD ALPHA an discretization of the alpha torsion angle: METHOD CA(i-i), CA(i), CA(i+1), CA(i+2) METHOD BYS a discretization of Ramachandran plots, due to Bystroff METHOD CB_burial_14_7 a 7-state discretization of the number of C_beta METHOD atoms in a 14 Angstrom radius sphere around the C_beta. METHOD DSSP_EHL2 CASP's collapse of the DSSP alphabet METHOD DSSP_EHL2 is not predicted directly by a METHOD neural net, but is computed as a weighted METHOD average of the other backbone alphabet predictions. METHOD METHOD We make 2-track HMMs with each alphabet (1.0 amino acid + 0.3 local structure) METHOD and use them to score a template library of 6400 (t04) or 9900 (t2k) templates METHOD We also used a single-track HMM to score not just the template METHOD library, but a non-redundant copy of the entire PDB. METHOD METHOD We also made a few 3-track HMMs (AA, str2, CB_burial_14_7) for METHOD finding and aligning more remote homologs. METHOD METHOD One-track HMMs built from the template library multiple alignments METHOD were used to score the target sequence (for early targets, only METHOD t2k template library was searched this way). METHOD METHOD All the logs of e-values were combined in a weighted average (with METHOD rather arbitrary weights, since we did not have time to METHOD optimize them), and the best templates ranked. Ranking was METHOD separate for predictions from the t2k and t04 multiple alignments. METHOD METHOD Alignments of the target to the top templates were made using METHOD several different alignment methods (mainly using the SAM hmmscore METHOD program, but a few alignments were made with Bob Edgar's MUSCLE METHOD profile-profile aligner). METHOD METHOD Generate fragments (short 9-residue alignments for each position) METHOD using SAM's "fragfinder" program and the 3-track HMM. METHOD METHOD Then the "undertaker" program (named because it optimizes burial) METHOD is used to try to combine the alignments and the fragments into METHOD a consistent 3D model. No single alignment or parent template METHOD was used, though in many cases one had much more influence than METHOD the others. The alignment scores were not passed to undertaker, METHOD but were used only to pick the set of alignments and fragments METHOD that undertaker would see. METHOD METHOD After the initial automatic run was finished, the results were METHOD examined by hand, and various tweaks were made to the undertaker METHOD cost function to improve the models. Many of the tweaks consisted of METHOD adding specific Hbonds, SSbonds, or distance constraints, to make the METHOD model look better to us. METHOD METHOD Undertaker uses a genetic algorithm with about 28 different operators METHOD to minimize its cost function. The cost function has many components, METHOD including various definitions of burial and compactness, sidechain METHOD rotamer preferences, steric clashes, chain breaks, predicted local METHOD backbone conformation, hydrogen bonding, disulfide bonds, and user METHOD specified constraints. The relative weights of these components were METHOD tweaked for each target, as we have not found a generally applicable METHOD set of weights. METHOD METHOD Because undertaker does not (yet) handle multimers, we sometimes added METHOD "scaffolding" constraints by hand to try to retain structure in METHOD dimerization interfaces. METHOD METHOD For multiple-domain models, we generally broke the sequence into METHOD chunks (often somewhat arbitrary overlapping chunks), and did the full METHOD method for each subchain. The alignments found were all tossed into METHOD the undertaker conformation search. In some cases, we performed METHOD undertaker runs for the subchains, and cut-and-pasted the pieces into METHOD one PDB file (with bad breaks) and let undertaker try to assemble the METHOD pieces. METHOD METHOD Model 5 is a model created from an alignment to our second best-scoring METHOD template (1eut) with sidechains optimized by SCWRL. METHOD METHOD The alignment was created with a 3-track HMM. METHOD T0211-1eut-t2k-local-str2+CB_burial_14_7-0.4+0.4-adpstyle5 REMARK 6 REMARK 6 T0211 model 5 Sat Jul 17 18:46:26 2004 MODEL 5 PARENT 1eut ATOM 2 N SER 20 10.095 -29.548 -35.525 1.00 0.00 ATOM 3 CA SER 20 9.490 -29.274 -36.815 1.00 0.00 ATOM 4 CB SER 20 10.406 -28.384 -37.657 1.00 0.00 ATOM 5 OG SER 20 11.614 -29.052 -37.979 1.00 0.00 ATOM 6 O SER 20 8.915 -30.430 -38.834 1.00 0.00 ATOM 7 C SER 20 9.212 -30.532 -37.648 1.00 0.00 ATOM 8 N SER 21 9.283 -31.708 -37.022 1.00 0.00 ATOM 9 CA SER 21 9.050 -32.977 -37.724 1.00 0.00 ATOM 10 CB SER 21 10.131 -33.997 -37.359 1.00 0.00 ATOM 11 OG SER 21 9.886 -35.244 -37.986 1.00 0.00 ATOM 12 O SER 21 6.830 -33.734 -38.175 1.00 0.00 ATOM 13 C SER 21 7.705 -33.540 -37.340 1.00 0.00 ATOM 14 N ASP 22 7.579 -33.871 -36.068 1.00 0.00 ATOM 15 CA ASP 22 6.338 -34.396 -35.540 1.00 0.00 ATOM 16 CB ASP 22 6.524 -34.861 -34.095 1.00 0.00 ATOM 17 CG ASP 22 7.318 -36.149 -33.996 1.00 0.00 ATOM 18 OD1 ASP 22 7.513 -36.809 -35.039 1.00 0.00 ATOM 19 OD2 ASP 22 7.745 -36.498 -32.875 1.00 0.00 ATOM 20 O ASP 22 4.049 -33.636 -35.704 1.00 0.00 ATOM 21 C ASP 22 5.238 -33.329 -35.561 1.00 0.00 ATOM 22 N GLU 23 5.646 -32.079 -35.347 1.00 0.00 ATOM 23 CA GLU 23 4.716 -30.942 -35.333 1.00 0.00 ATOM 24 CB GLU 23 4.097 -30.772 -33.944 1.00 0.00 ATOM 25 CG GLU 23 3.326 -31.986 -33.454 1.00 0.00 ATOM 26 CD GLU 23 2.711 -31.773 -32.086 1.00 0.00 ATOM 27 OE1 GLU 23 3.473 -31.583 -31.115 1.00 0.00 ATOM 28 OE2 GLU 23 1.466 -31.795 -31.983 1.00 0.00 ATOM 29 O GLU 23 6.622 -29.604 -35.936 1.00 0.00 ATOM 30 C GLU 23 5.411 -29.639 -35.695 1.00 0.00 ATOM 31 N LYS 24 4.597 -28.595 -35.773 1.00 0.00 ATOM 32 CA LYS 24 5.045 -27.255 -36.089 1.00 0.00 ATOM 33 CB LYS 24 3.953 -26.488 -36.836 1.00 0.00 ATOM 34 CG LYS 24 3.625 -27.052 -38.208 1.00 0.00 ATOM 35 CD LYS 24 2.496 -26.277 -38.868 1.00 0.00 ATOM 36 CE LYS 24 2.179 -26.831 -40.248 1.00 0.00 ATOM 37 NZ LYS 24 1.181 -25.993 -40.967 1.00 0.00 ATOM 38 O LYS 24 4.509 -25.912 -34.153 1.00 0.00 ATOM 39 C LYS 24 5.374 -26.534 -34.776 1.00 0.00 ATOM 40 N HIS 25 6.597 -26.714 -34.311 1.00 0.00 ATOM 41 CA HIS 25 7.025 -26.057 -33.103 1.00 0.00 ATOM 42 CB HIS 25 7.582 -27.075 -32.106 1.00 0.00 ATOM 43 CG HIS 25 6.547 -28.005 -31.553 1.00 0.00 ATOM 44 CD2 HIS 25 5.094 -28.078 -31.583 1.00 0.00 ATOM 45 ND1 HIS 25 6.869 -29.116 -30.804 1.00 0.00 ATOM 46 CE1 HIS 25 5.737 -29.749 -30.450 1.00 0.00 ATOM 47 NE2 HIS 25 4.668 -29.132 -30.913 1.00 0.00 ATOM 48 O HIS 25 9.132 -25.010 -33.003 1.00 0.00 ATOM 49 C HIS 25 8.086 -25.099 -33.573 1.00 0.00 ATOM 50 N PRO 26 7.824 -24.398 -34.655 1.00 0.00 ATOM 51 CA PRO 26 8.775 -23.454 -35.213 1.00 0.00 ATOM 52 CB PRO 26 8.119 -22.997 -36.517 1.00 0.00 ATOM 53 CG PRO 26 7.137 -24.073 -36.840 1.00 0.00 ATOM 54 CD PRO 26 6.621 -24.575 -35.520 1.00 0.00 ATOM 55 O PRO 26 8.276 -21.525 -33.819 1.00 0.00 ATOM 56 C PRO 26 9.128 -22.212 -34.398 1.00 0.00 ATOM 57 N PRO 27 10.407 -21.908 -34.326 1.00 0.00 ATOM 58 CA PRO 27 10.778 -20.656 -33.703 1.00 0.00 ATOM 59 CB PRO 27 12.258 -20.838 -33.360 1.00 0.00 ATOM 60 CG PRO 27 12.760 -21.810 -34.374 1.00 0.00 ATOM 61 CD PRO 27 11.608 -22.726 -34.680 1.00 0.00 ATOM 62 O PRO 27 10.906 -20.171 -36.075 1.00 0.00 ATOM 63 C PRO 27 10.423 -19.847 -34.938 1.00 0.00 ATOM 64 N GLU 28 9.451 -18.967 -34.743 1.00 0.00 ATOM 65 CA GLU 28 8.926 -18.037 -35.761 1.00 0.00 ATOM 66 CB GLU 28 9.238 -18.550 -37.168 1.00 0.00 ATOM 67 CG GLU 28 10.713 -18.508 -37.532 1.00 0.00 ATOM 68 CD GLU 28 10.992 -19.088 -38.904 1.00 0.00 ATOM 69 OE1 GLU 28 10.038 -19.573 -39.548 1.00 0.00 ATOM 70 OE2 GLU 28 12.164 -19.059 -39.334 1.00 0.00 ATOM 71 O GLU 28 6.764 -17.093 -36.013 1.00 0.00 ATOM 72 C GLU 28 7.436 -17.977 -35.527 1.00 0.00 ATOM 73 N ASN 29 6.934 -18.949 -34.769 1.00 0.00 ATOM 74 CA ASN 29 5.535 -18.977 -34.368 1.00 0.00 ATOM 75 CB ASN 29 5.110 -20.401 -34.001 1.00 0.00 ATOM 76 CG ASN 29 5.014 -21.310 -35.211 1.00 0.00 ATOM 77 ND2 ASN 29 5.092 -22.615 -34.976 1.00 0.00 ATOM 78 OD1 ASN 29 4.871 -20.843 -36.341 1.00 0.00 ATOM 79 O ASN 29 4.294 -17.729 -32.696 1.00 0.00 ATOM 80 C ASN 29 5.409 -18.040 -33.137 1.00 0.00 ATOM 81 N ILE 30 6.531 -17.578 -32.581 1.00 0.00 ATOM 82 CA ILE 30 6.441 -16.667 -31.427 1.00 0.00 ATOM 83 CB ILE 30 7.763 -16.622 -30.638 1.00 0.00 ATOM 84 CG1 ILE 30 8.881 -16.041 -31.507 1.00 0.00 ATOM 85 CG2 ILE 30 8.169 -18.019 -30.200 1.00 0.00 ATOM 86 CD1 ILE 30 10.154 -15.745 -30.744 1.00 0.00 ATOM 87 O ILE 30 5.502 -14.490 -31.108 1.00 0.00 ATOM 88 C ILE 30 6.120 -15.231 -31.859 1.00 0.00 ATOM 89 N ILE 31 6.456 -14.889 -33.101 1.00 0.00 ATOM 90 CA ILE 31 6.241 -13.544 -33.652 1.00 0.00 ATOM 91 CB ILE 31 7.509 -13.006 -34.337 1.00 0.00 ATOM 92 CG1 ILE 31 7.948 -13.944 -35.463 1.00 0.00 ATOM 93 CG2 ILE 31 8.649 -12.891 -33.335 1.00 0.00 ATOM 94 CD1 ILE 31 9.007 -13.357 -36.370 1.00 0.00 ATOM 95 O ILE 31 5.252 -12.632 -35.653 1.00 0.00 ATOM 96 C ILE 31 5.128 -13.412 -34.720 1.00 0.00 ATOM 97 N ASP 32 4.031 -14.148 -34.587 1.00 0.00 ATOM 98 CA ASP 32 2.975 -14.035 -35.583 1.00 0.00 ATOM 99 CB ASP 32 2.653 -15.406 -36.181 1.00 0.00 ATOM 100 CG ASP 32 3.861 -16.062 -36.819 1.00 0.00 ATOM 101 OD1 ASP 32 4.488 -15.429 -37.694 1.00 0.00 ATOM 102 OD2 ASP 32 4.181 -17.210 -36.444 1.00 0.00 ATOM 103 O ASP 32 0.679 -13.398 -35.883 1.00 0.00 ATOM 104 C ASP 32 1.630 -13.484 -35.105 1.00 0.00 ATOM 105 N GLY 33 1.552 -13.088 -33.838 1.00 0.00 ATOM 106 CA GLY 33 0.308 -12.552 -33.310 1.00 0.00 ATOM 107 O GLY 33 -1.913 -13.348 -33.025 1.00 0.00 ATOM 108 C GLY 33 -0.736 -13.632 -33.077 1.00 0.00 ATOM 109 N ASN 34 -0.304 -14.869 -32.868 1.00 0.00 ATOM 110 CA ASN 34 -1.244 -15.960 -32.641 1.00 0.00 ATOM 111 CB ASN 34 -1.356 -16.838 -33.890 1.00 0.00 ATOM 112 CG ASN 34 -2.339 -17.979 -33.711 1.00 0.00 ATOM 113 ND2 ASN 34 -2.335 -18.913 -34.654 1.00 0.00 ATOM 114 OD1 ASN 34 -3.090 -18.017 -32.738 1.00 0.00 ATOM 115 O ASN 34 0.145 -17.627 -31.570 1.00 0.00 ATOM 116 C ASN 34 -0.840 -16.880 -31.482 1.00 0.00 ATOM 117 N PRO 35 -1.602 -16.843 -30.387 1.00 0.00 ATOM 118 CA PRO 35 -1.419 -17.626 -29.156 1.00 0.00 ATOM 119 CB PRO 35 -2.519 -17.113 -28.225 1.00 0.00 ATOM 120 CG PRO 35 -3.558 -16.561 -29.143 1.00 0.00 ATOM 121 CD PRO 35 -2.814 -15.966 -30.305 1.00 0.00 ATOM 122 O PRO 35 -1.090 -19.962 -28.624 1.00 0.00 ATOM 123 C PRO 35 -1.566 -19.119 -29.405 1.00 0.00 ATOM 124 N GLU 36 -2.305 -19.422 -30.470 1.00 0.00 ATOM 125 CA GLU 36 -2.610 -20.780 -30.890 1.00 0.00 ATOM 126 CB GLU 36 -3.720 -20.778 -31.943 1.00 0.00 ATOM 127 CG GLU 36 -5.087 -20.390 -31.403 1.00 0.00 ATOM 128 CD GLU 36 -6.145 -20.329 -32.486 1.00 0.00 ATOM 129 OE1 GLU 36 -5.801 -20.553 -33.666 1.00 0.00 ATOM 130 OE2 GLU 36 -7.318 -20.058 -32.156 1.00 0.00 ATOM 131 O GLU 36 -1.372 -22.719 -31.534 1.00 0.00 ATOM 132 C GLU 36 -1.406 -21.486 -31.500 1.00 0.00 ATOM 133 N THR 37 -0.449 -20.707 -32.021 1.00 0.00 ATOM 134 CA THR 37 0.782 -21.265 -32.608 1.00 0.00 ATOM 135 CB THR 37 1.149 -20.558 -33.927 1.00 0.00 ATOM 136 CG2 THR 37 0.030 -20.714 -34.944 1.00 0.00 ATOM 137 OG1 THR 37 1.363 -19.162 -33.680 1.00 0.00 ATOM 138 O THR 37 1.926 -20.019 -30.911 1.00 0.00 ATOM 139 C THR 37 1.893 -21.056 -31.579 1.00 0.00 ATOM 140 N PHE 38 2.841 -21.989 -31.534 1.00 0.00 ATOM 141 CA PHE 38 3.915 -21.949 -30.556 1.00 0.00 ATOM 142 CB PHE 38 3.528 -22.737 -29.303 1.00 0.00 ATOM 143 CG PHE 38 3.312 -24.204 -29.551 1.00 0.00 ATOM 144 CD1 PHE 38 4.350 -25.107 -29.400 1.00 0.00 ATOM 145 CD2 PHE 38 2.070 -24.678 -29.937 1.00 0.00 ATOM 146 CE1 PHE 38 4.150 -26.455 -29.629 1.00 0.00 ATOM 147 CE2 PHE 38 1.872 -26.028 -30.166 1.00 0.00 ATOM 148 CZ PHE 38 2.904 -26.914 -30.012 1.00 0.00 ATOM 149 O PHE 38 5.207 -23.305 -32.048 1.00 0.00 ATOM 150 C PHE 38 5.216 -22.547 -31.076 1.00 0.00 ATOM 151 N TRP 39 6.327 -22.095 -30.499 1.00 0.00 ATOM 152 CA TRP 39 7.663 -22.593 -30.823 1.00 0.00 ATOM 153 CB TRP 39 8.710 -21.501 -30.602 1.00 0.00 ATOM 154 CG TRP 39 10.113 -21.950 -30.876 1.00 0.00 ATOM 155 CD1 TRP 39 10.754 -21.950 -32.081 1.00 0.00 ATOM 156 CD2 TRP 39 11.050 -22.469 -29.923 1.00 0.00 ATOM 157 CE2 TRP 39 12.238 -22.760 -30.623 1.00 0.00 ATOM 158 CE3 TRP 39 11.001 -22.714 -28.547 1.00 0.00 ATOM 159 NE1 TRP 39 12.031 -22.435 -31.939 1.00 0.00 ATOM 160 CZ2 TRP 39 13.366 -23.284 -29.994 1.00 0.00 ATOM 161 CZ3 TRP 39 12.122 -23.234 -27.928 1.00 0.00 ATOM 162 CH2 TRP 39 13.288 -23.515 -28.647 1.00 0.00 ATOM 163 O TRP 39 7.291 -23.642 -28.722 1.00 0.00 ATOM 164 C TRP 39 7.778 -23.740 -29.843 1.00 0.00 ATOM 165 N THR 40 8.385 -24.838 -30.253 1.00 0.00 ATOM 166 CA THR 40 8.521 -25.947 -29.343 1.00 0.00 ATOM 167 CB THR 40 7.518 -27.071 -29.667 1.00 0.00 ATOM 168 CG2 THR 40 7.660 -28.213 -28.676 1.00 0.00 ATOM 169 OG1 THR 40 6.182 -26.558 -29.597 1.00 0.00 ATOM 170 O THR 40 10.503 -26.359 -30.592 1.00 0.00 ATOM 171 C THR 40 9.933 -26.441 -29.508 1.00 0.00 ATOM 172 N THR 41 10.562 -26.792 -28.400 1.00 0.00 ATOM 173 CA THR 41 11.914 -27.303 -28.473 1.00 0.00 ATOM 174 CB THR 41 12.573 -27.357 -27.083 1.00 0.00 ATOM 175 CG2 THR 41 12.638 -25.967 -26.469 1.00 0.00 ATOM 176 OG1 THR 41 11.808 -28.209 -26.221 1.00 0.00 ATOM 177 O THR 41 10.810 -29.403 -28.878 1.00 0.00 ATOM 178 C THR 41 11.827 -28.708 -29.057 1.00 0.00 ATOM 179 N THR 42 12.857 -29.099 -29.800 1.00 0.00 ATOM 180 CA THR 42 12.892 -30.420 -30.410 1.00 0.00 ATOM 181 CB THR 42 14.310 -30.782 -30.894 1.00 0.00 ATOM 182 CG2 THR 42 14.298 -32.114 -31.626 1.00 0.00 ATOM 183 OG1 THR 42 14.787 -29.766 -31.785 1.00 0.00 ATOM 184 O THR 42 13.181 -31.727 -28.454 1.00 0.00 ATOM 185 C THR 42 12.453 -31.435 -29.385 1.00 0.00 ATOM 186 N GLY 43 11.202 -31.858 -29.477 1.00 0.00 ATOM 187 CA GLY 43 10.749 -32.838 -28.528 1.00 0.00 ATOM 188 O GLY 43 11.430 -34.368 -30.221 1.00 0.00 ATOM 189 C GLY 43 10.989 -34.211 -29.070 1.00 0.00 ATOM 190 N MET 44 10.712 -35.191 -28.211 1.00 0.00 ATOM 191 CA MET 44 10.877 -36.597 -28.502 1.00 0.00 ATOM 192 CB MET 44 9.922 -37.435 -27.651 1.00 0.00 ATOM 193 CG MET 44 10.211 -37.387 -26.160 1.00 0.00 ATOM 194 SD MET 44 11.842 -38.036 -25.747 1.00 0.00 ATOM 195 CE MET 44 11.610 -39.778 -26.093 1.00 0.00 ATOM 196 O MET 44 10.064 -36.176 -30.721 1.00 0.00 ATOM 197 C MET 44 10.606 -36.970 -29.941 1.00 0.00 ATOM 198 N PHE 45 17.154 -28.478 -20.781 1.00 0.00 ATOM 199 CA PHE 45 16.832 -27.086 -20.493 1.00 0.00 ATOM 200 CB PHE 45 16.628 -26.883 -18.989 1.00 0.00 ATOM 201 CG PHE 45 17.903 -26.915 -18.195 1.00 0.00 ATOM 202 CD1 PHE 45 18.615 -25.752 -17.957 1.00 0.00 ATOM 203 CD2 PHE 45 18.389 -28.107 -17.686 1.00 0.00 ATOM 204 CE1 PHE 45 19.788 -25.781 -17.225 1.00 0.00 ATOM 205 CE2 PHE 45 19.563 -28.135 -16.956 1.00 0.00 ATOM 206 CZ PHE 45 20.260 -26.978 -16.724 1.00 0.00 ATOM 207 O PHE 45 16.902 -24.729 -20.696 1.00 0.00 ATOM 208 C PHE 45 17.566 -25.775 -20.723 1.00 0.00 ATOM 209 N PRO 46 18.898 -25.741 -20.795 1.00 0.00 ATOM 210 CA PRO 46 19.249 -24.330 -21.053 1.00 0.00 ATOM 211 CB PRO 46 20.765 -24.284 -20.847 1.00 0.00 ATOM 212 CG PRO 46 21.234 -25.651 -21.214 1.00 0.00 ATOM 213 CD PRO 46 20.156 -26.596 -20.762 1.00 0.00 ATOM 214 O PRO 46 19.497 -24.449 -23.474 1.00 0.00 ATOM 215 C PRO 46 18.792 -24.085 -22.528 1.00 0.00 ATOM 216 N GLN 47 17.566 -23.577 -22.698 1.00 0.00 ATOM 217 CA GLN 47 16.954 -23.313 -24.011 1.00 0.00 ATOM 218 CB GLN 47 15.512 -23.825 -24.043 1.00 0.00 ATOM 219 CG GLN 47 15.375 -25.311 -23.754 1.00 0.00 ATOM 220 CD GLN 47 16.048 -26.174 -24.804 1.00 0.00 ATOM 221 OE1 GLN 47 15.819 -26.001 -26.002 1.00 0.00 ATOM 222 NE2 GLN 47 16.879 -27.107 -24.357 1.00 0.00 ATOM 223 O GLN 47 16.979 -21.015 -23.375 1.00 0.00 ATOM 224 C GLN 47 16.945 -21.813 -24.292 1.00 0.00 ATOM 225 N GLU 48 16.882 -21.417 -25.546 1.00 0.00 ATOM 226 CA GLU 48 16.841 -19.993 -25.827 1.00 0.00 ATOM 227 CB GLU 48 18.217 -19.361 -25.601 1.00 0.00 ATOM 228 CG GLU 48 19.277 -19.814 -26.592 1.00 0.00 ATOM 229 CD GLU 48 19.892 -21.148 -26.219 1.00 0.00 ATOM 230 OE1 GLU 48 19.505 -21.710 -25.172 1.00 0.00 ATOM 231 OE2 GLU 48 20.760 -21.633 -26.973 1.00 0.00 ATOM 232 O GLU 48 16.613 -20.446 -28.146 1.00 0.00 ATOM 233 C GLU 48 16.445 -19.641 -27.231 1.00 0.00 ATOM 234 N PHE 49 15.955 -18.410 -27.384 1.00 0.00 ATOM 235 CA PHE 49 15.521 -17.869 -28.675 1.00 0.00 ATOM 236 CB PHE 49 14.011 -18.039 -28.847 1.00 0.00 ATOM 237 CG PHE 49 13.197 -17.306 -27.820 1.00 0.00 ATOM 238 CD1 PHE 49 12.755 -16.016 -28.056 1.00 0.00 ATOM 239 CD2 PHE 49 12.873 -17.907 -26.615 1.00 0.00 ATOM 240 CE1 PHE 49 12.008 -15.342 -27.110 1.00 0.00 ATOM 241 CE2 PHE 49 12.124 -17.232 -25.669 1.00 0.00 ATOM 242 CZ PHE 49 11.692 -15.955 -25.913 1.00 0.00 ATOM 243 O PHE 49 15.678 -15.601 -27.816 1.00 0.00 ATOM 244 C PHE 49 15.854 -16.356 -28.784 1.00 0.00 ATOM 245 N ILE 50 16.338 -15.916 -29.940 1.00 0.00 ATOM 246 CA ILE 50 16.672 -14.515 -30.145 1.00 0.00 ATOM 247 CB ILE 50 18.180 -14.325 -30.395 1.00 0.00 ATOM 248 CG1 ILE 50 18.509 -12.841 -30.566 1.00 0.00 ATOM 249 CG2 ILE 50 18.608 -15.062 -31.654 1.00 0.00 ATOM 250 CD1 ILE 50 19.990 -12.534 -30.512 1.00 0.00 ATOM 251 O ILE 50 15.831 -14.591 -32.370 1.00 0.00 ATOM 252 C ILE 50 15.937 -13.952 -31.336 1.00 0.00 ATOM 253 N ILE 51 15.497 -12.715 -31.205 1.00 0.00 ATOM 254 CA ILE 51 14.769 -12.044 -32.253 1.00 0.00 ATOM 255 CB ILE 51 13.436 -11.470 -31.737 1.00 0.00 ATOM 256 CG1 ILE 51 12.533 -12.596 -31.229 1.00 0.00 ATOM 257 CG2 ILE 51 12.707 -10.732 -32.849 1.00 0.00 ATOM 258 CD1 ILE 51 11.308 -12.107 -30.486 1.00 0.00 ATOM 259 O ILE 51 16.280 -10.222 -32.056 1.00 0.00 ATOM 260 C ILE 51 15.580 -10.906 -32.806 1.00 0.00 ATOM 261 N CYS 52 15.498 -10.734 -34.121 1.00 0.00 ATOM 262 CA CYS 52 16.144 -9.650 -34.831 1.00 0.00 ATOM 263 CB CYS 52 16.659 -10.131 -36.189 1.00 0.00 ATOM 264 SG CYS 52 17.537 -8.871 -37.144 1.00 0.00 ATOM 265 O CYS 52 13.917 -9.019 -35.498 1.00 0.00 ATOM 266 C CYS 52 14.956 -8.691 -34.913 1.00 0.00 ATOM 267 N PHE 53 15.065 -7.570 -34.206 1.00 0.00 ATOM 268 CA PHE 53 14.007 -6.560 -34.151 1.00 0.00 ATOM 269 CB PHE 53 14.341 -5.490 -33.108 1.00 0.00 ATOM 270 CG PHE 53 14.309 -5.994 -31.692 1.00 0.00 ATOM 271 CD1 PHE 53 13.707 -7.202 -31.386 1.00 0.00 ATOM 272 CD2 PHE 53 14.879 -5.258 -30.668 1.00 0.00 ATOM 273 CE1 PHE 53 13.678 -7.666 -30.085 1.00 0.00 ATOM 274 CE2 PHE 53 14.849 -5.721 -29.367 1.00 0.00 ATOM 275 CZ PHE 53 14.253 -6.919 -29.073 1.00 0.00 ATOM 276 O PHE 53 12.752 -5.219 -35.684 1.00 0.00 ATOM 277 C PHE 53 13.791 -5.833 -35.478 1.00 0.00 ATOM 278 N HIS 54 14.767 -5.924 -36.376 1.00 0.00 ATOM 279 CA HIS 54 14.639 -5.295 -37.672 1.00 0.00 ATOM 280 CB HIS 54 13.172 -5.250 -38.103 1.00 0.00 ATOM 281 CG HIS 54 12.537 -6.600 -38.227 1.00 0.00 ATOM 282 CD2 HIS 54 11.546 -7.354 -37.473 1.00 0.00 ATOM 283 ND1 HIS 54 12.848 -7.478 -39.242 1.00 0.00 ATOM 284 CE1 HIS 54 12.120 -8.600 -39.088 1.00 0.00 ATOM 285 NE2 HIS 54 11.338 -8.532 -38.029 1.00 0.00 ATOM 286 O HIS 54 14.732 -3.075 -38.601 1.00 0.00 ATOM 287 C HIS 54 15.144 -3.867 -37.730 1.00 0.00 ATOM 288 N LYS 55 16.031 -3.538 -36.787 1.00 0.00 ATOM 289 CA LYS 55 16.616 -2.208 -36.698 1.00 0.00 ATOM 290 CB LYS 55 15.701 -1.176 -37.362 1.00 0.00 ATOM 291 CG LYS 55 14.372 -0.977 -36.654 1.00 0.00 ATOM 292 CD LYS 55 13.511 0.047 -37.375 1.00 0.00 ATOM 293 CE LYS 55 12.187 0.258 -36.659 1.00 0.00 ATOM 294 NZ LYS 55 11.335 1.263 -37.351 1.00 0.00 ATOM 295 O LYS 55 16.264 -2.621 -34.401 1.00 0.00 ATOM 296 C LYS 55 16.780 -1.886 -35.236 1.00 0.00 ATOM 297 N HIS 56 17.503 -0.815 -34.921 1.00 0.00 ATOM 298 CA HIS 56 17.731 -0.409 -33.536 1.00 0.00 ATOM 299 CB HIS 56 18.947 0.516 -33.442 1.00 0.00 ATOM 300 CG HIS 56 20.228 -0.126 -33.873 1.00 0.00 ATOM 301 CD2 HIS 56 20.626 -1.453 -34.321 1.00 0.00 ATOM 302 ND1 HIS 56 21.426 0.556 -33.917 1.00 0.00 ATOM 303 CE1 HIS 56 22.390 -0.280 -34.340 1.00 0.00 ATOM 304 NE2 HIS 56 21.919 -1.487 -34.584 1.00 0.00 ATOM 305 O HIS 56 15.999 1.235 -33.629 1.00 0.00 ATOM 306 C HIS 56 16.517 0.338 -32.983 1.00 0.00 ATOM 307 N VAL 57 16.037 -0.071 -31.811 1.00 0.00 ATOM 308 CA VAL 57 14.878 0.543 -31.172 1.00 0.00 ATOM 309 CB VAL 57 13.627 -0.346 -31.299 1.00 0.00 ATOM 310 CG1 VAL 57 13.251 -0.528 -32.761 1.00 0.00 ATOM 311 CG2 VAL 57 13.883 -1.717 -30.693 1.00 0.00 ATOM 312 O VAL 57 16.156 0.139 -29.200 1.00 0.00 ATOM 313 C VAL 57 15.199 0.739 -29.712 1.00 0.00 ATOM 314 N ARG 58 14.450 1.619 -29.060 1.00 0.00 ATOM 315 CA ARG 58 14.653 1.847 -27.651 1.00 0.00 ATOM 316 CB ARG 58 14.420 3.319 -27.308 1.00 0.00 ATOM 317 CG ARG 58 15.392 4.275 -27.979 1.00 0.00 ATOM 318 CD ARG 58 15.044 5.723 -27.672 1.00 0.00 ATOM 319 NE ARG 58 15.943 6.657 -28.348 1.00 0.00 ATOM 320 CZ ARG 58 15.884 7.979 -28.213 1.00 0.00 ATOM 321 NH1 ARG 58 16.742 8.749 -28.867 1.00 0.00 ATOM 322 NH2 ARG 58 14.968 8.525 -27.425 1.00 0.00 ATOM 323 O ARG 58 12.446 1.198 -27.115 1.00 0.00 ATOM 324 C ARG 58 13.642 0.952 -27.013 1.00 0.00 ATOM 325 N ILE 59 14.125 -0.146 -26.448 1.00 0.00 ATOM 326 CA ILE 59 13.262 -1.130 -25.820 1.00 0.00 ATOM 327 CB ILE 59 13.584 -2.555 -26.308 1.00 0.00 ATOM 328 CG1 ILE 59 12.644 -3.567 -25.649 1.00 0.00 ATOM 329 CG2 ILE 59 15.016 -2.929 -25.956 1.00 0.00 ATOM 330 CD1 ILE 59 12.709 -4.948 -26.263 1.00 0.00 ATOM 331 O ILE 59 14.450 -0.836 -23.748 1.00 0.00 ATOM 332 C ILE 59 13.397 -1.145 -24.299 1.00 0.00 ATOM 333 N GLU 60 12.290 -1.460 -23.636 1.00 0.00 ATOM 334 CA GLU 60 12.208 -1.518 -22.192 1.00 0.00 ATOM 335 CB GLU 60 11.599 -0.227 -21.638 1.00 0.00 ATOM 336 CG GLU 60 10.182 0.047 -22.118 1.00 0.00 ATOM 337 CD GLU 60 9.680 1.412 -21.696 1.00 0.00 ATOM 338 OE1 GLU 60 10.379 2.088 -20.912 1.00 0.00 ATOM 339 OE2 GLU 60 8.585 1.809 -22.149 1.00 0.00 ATOM 340 O GLU 60 10.783 -2.604 -20.581 1.00 0.00 ATOM 341 C GLU 60 11.342 -2.677 -21.679 1.00 0.00 ATOM 342 N ARG 61 11.248 -3.757 -22.440 1.00 0.00 ATOM 343 CA ARG 61 10.451 -4.856 -21.952 1.00 0.00 ATOM 344 CB ARG 61 9.092 -4.354 -21.459 1.00 0.00 ATOM 345 CG ARG 61 9.166 -3.474 -20.222 1.00 0.00 ATOM 346 CD ARG 61 7.786 -3.002 -19.796 1.00 0.00 ATOM 347 NE ARG 61 7.203 -2.073 -20.763 1.00 0.00 ATOM 348 CZ ARG 61 5.958 -1.613 -20.698 1.00 0.00 ATOM 349 NH1 ARG 61 5.514 -0.770 -21.621 1.00 0.00 ATOM 350 NH2 ARG 61 5.159 -1.996 -19.711 1.00 0.00 ATOM 351 O ARG 61 10.340 -5.787 -24.137 1.00 0.00 ATOM 352 C ARG 61 10.140 -5.940 -22.941 1.00 0.00 ATOM 353 N LEU 62 9.612 -7.030 -22.423 1.00 0.00 ATOM 354 CA LEU 62 9.264 -8.157 -23.238 1.00 0.00 ATOM 355 CB LEU 62 10.458 -9.104 -23.378 1.00 0.00 ATOM 356 CG LEU 62 10.214 -10.389 -24.172 1.00 0.00 ATOM 357 CD1 LEU 62 9.975 -10.077 -25.642 1.00 0.00 ATOM 358 CD2 LEU 62 11.414 -11.318 -24.073 1.00 0.00 ATOM 359 O LEU 62 8.119 -8.970 -21.324 1.00 0.00 ATOM 360 C LEU 62 8.123 -8.856 -22.550 1.00 0.00 ATOM 361 N VAL 63 7.151 -9.295 -23.347 1.00 0.00 ATOM 362 CA VAL 63 5.995 -10.045 -22.855 1.00 0.00 ATOM 363 CB VAL 63 4.676 -9.313 -23.160 1.00 0.00 ATOM 364 CG1 VAL 63 3.488 -10.137 -22.691 1.00 0.00 ATOM 365 CG2 VAL 63 4.637 -7.967 -22.452 1.00 0.00 ATOM 366 O VAL 63 6.348 -11.519 -24.722 1.00 0.00 ATOM 367 C VAL 63 5.992 -11.409 -23.553 1.00 0.00 ATOM 368 N ILE 64 5.645 -12.453 -22.816 1.00 0.00 ATOM 369 CA ILE 64 5.557 -13.789 -23.393 1.00 0.00 ATOM 370 CB ILE 64 6.769 -14.654 -22.998 1.00 0.00 ATOM 371 CG1 ILE 64 8.065 -14.023 -23.510 1.00 0.00 ATOM 372 CG2 ILE 64 6.643 -16.049 -23.591 1.00 0.00 ATOM 373 CD1 ILE 64 9.317 -14.713 -23.014 1.00 0.00 ATOM 374 O ILE 64 3.852 -14.208 -21.766 1.00 0.00 ATOM 375 C ILE 64 4.294 -14.455 -22.889 1.00 0.00 ATOM 376 N GLN 65 3.669 -15.212 -23.781 1.00 0.00 ATOM 377 CA GLN 65 2.453 -15.933 -23.468 1.00 0.00 ATOM 378 CB GLN 65 1.392 -15.685 -24.544 1.00 0.00 ATOM 379 CG GLN 65 0.970 -14.231 -24.675 1.00 0.00 ATOM 380 CD GLN 65 0.011 -14.005 -25.826 1.00 0.00 ATOM 381 OE1 GLN 65 -0.207 -14.894 -26.650 1.00 0.00 ATOM 382 NE2 GLN 65 -0.567 -12.811 -25.887 1.00 0.00 ATOM 383 O GLN 65 3.557 -17.875 -24.293 1.00 0.00 ATOM 384 C GLN 65 2.855 -17.396 -23.426 1.00 0.00 ATOM 388 N PHE 68 6.338 -25.222 -20.060 1.00 0.00 ATOM 389 CA PHE 68 6.189 -23.872 -19.549 1.00 0.00 ATOM 390 CB PHE 68 5.142 -23.832 -18.434 1.00 0.00 ATOM 391 CG PHE 68 3.733 -24.009 -18.921 1.00 0.00 ATOM 392 CD1 PHE 68 3.084 -25.223 -18.778 1.00 0.00 ATOM 393 CD2 PHE 68 3.056 -22.963 -19.521 1.00 0.00 ATOM 394 CE1 PHE 68 1.786 -25.387 -19.226 1.00 0.00 ATOM 395 CE2 PHE 68 1.757 -23.126 -19.970 1.00 0.00 ATOM 396 CZ PHE 68 1.123 -24.332 -19.825 1.00 0.00 ATOM 397 O PHE 68 8.026 -23.869 -18.037 1.00 0.00 ATOM 398 C PHE 68 7.474 -23.294 -18.966 1.00 0.00 ATOM 399 N VAL 69 7.924 -22.140 -19.466 1.00 0.00 ATOM 400 CA VAL 69 9.148 -21.505 -18.961 1.00 0.00 ATOM 401 CB VAL 69 9.523 -20.265 -19.791 1.00 0.00 ATOM 402 CG1 VAL 69 10.705 -19.541 -19.163 1.00 0.00 ATOM 403 CG2 VAL 69 9.904 -20.667 -21.208 1.00 0.00 ATOM 404 O VAL 69 7.959 -20.560 -17.090 1.00 0.00 ATOM 405 C VAL 69 9.012 -21.038 -17.498 1.00 0.00 ATOM 406 N GLN 70 10.028 -21.289 -16.677 1.00 0.00 ATOM 407 CA GLN 70 9.993 -20.832 -15.287 1.00 0.00 ATOM 408 CB GLN 70 10.256 -21.999 -14.333 1.00 0.00 ATOM 409 CG GLN 70 10.170 -21.630 -12.861 1.00 0.00 ATOM 410 CD GLN 70 10.336 -22.827 -11.948 1.00 0.00 ATOM 411 OE1 GLN 70 10.576 -23.943 -12.410 1.00 0.00 ATOM 412 NE2 GLN 70 10.208 -22.600 -10.646 1.00 0.00 ATOM 413 O GLN 70 10.852 -18.635 -15.504 1.00 0.00 ATOM 414 C GLN 70 11.080 -19.797 -15.200 1.00 0.00 ATOM 415 N THR 71 12.284 -20.213 -14.861 1.00 0.00 ATOM 416 CA THR 71 13.352 -19.246 -14.766 1.00 0.00 ATOM 417 CB THR 71 14.558 -19.812 -13.992 1.00 0.00 ATOM 418 CG2 THR 71 15.678 -18.786 -13.929 1.00 0.00 ATOM 419 OG1 THR 71 14.158 -20.145 -12.657 1.00 0.00 ATOM 420 O THR 71 14.094 -19.576 -17.042 1.00 0.00 ATOM 421 C THR 71 13.902 -18.781 -16.116 1.00 0.00 ATOM 422 N LEU 72 14.129 -17.474 -16.227 1.00 0.00 ATOM 423 CA LEU 72 14.624 -16.896 -17.455 1.00 0.00 ATOM 424 CB LEU 72 13.463 -16.373 -18.306 1.00 0.00 ATOM 425 CG LEU 72 12.533 -15.362 -17.632 1.00 0.00 ATOM 426 CD1 LEU 72 13.135 -13.967 -17.669 1.00 0.00 ATOM 427 CD2 LEU 72 11.187 -15.317 -18.340 1.00 0.00 ATOM 428 O LEU 72 15.548 -15.209 -16.053 1.00 0.00 ATOM 429 C LEU 72 15.554 -15.750 -17.160 1.00 0.00 ATOM 430 N LYS 73 16.235 -15.308 -18.210 1.00 0.00 ATOM 431 CA LYS 73 17.175 -14.197 -18.188 1.00 0.00 ATOM 432 CB LYS 73 18.592 -14.700 -17.907 1.00 0.00 ATOM 433 CG LYS 73 19.618 -13.593 -17.725 1.00 0.00 ATOM 434 CD LYS 73 20.980 -14.159 -17.357 1.00 0.00 ATOM 435 CE LYS 73 21.983 -13.049 -17.082 1.00 0.00 ATOM 436 NZ LYS 73 23.328 -13.588 -16.741 1.00 0.00 ATOM 437 O LYS 73 17.033 -14.255 -20.550 1.00 0.00 ATOM 438 C LYS 73 17.102 -13.546 -19.558 1.00 0.00 ATOM 439 N ILE 74 17.129 -12.213 -19.619 1.00 0.00 ATOM 440 CA ILE 74 17.087 -11.517 -20.908 1.00 0.00 ATOM 441 CB ILE 74 16.055 -10.373 -20.897 1.00 0.00 ATOM 442 CG1 ILE 74 14.670 -10.907 -20.526 1.00 0.00 ATOM 443 CG2 ILE 74 15.969 -9.721 -22.270 1.00 0.00 ATOM 444 CD1 ILE 74 14.140 -11.948 -21.487 1.00 0.00 ATOM 445 O ILE 74 19.152 -10.523 -20.308 1.00 0.00 ATOM 446 C ILE 74 18.452 -10.923 -21.219 1.00 0.00 ATOM 447 N GLU 75 18.827 -10.913 -22.503 1.00 0.00 ATOM 448 CA GLU 75 20.094 -10.342 -23.028 1.00 0.00 ATOM 449 CB GLU 75 21.079 -11.460 -23.380 1.00 0.00 ATOM 450 CG GLU 75 21.505 -12.308 -22.193 1.00 0.00 ATOM 451 CD GLU 75 22.510 -13.378 -22.573 1.00 0.00 ATOM 452 OE1 GLU 75 22.853 -13.473 -23.770 1.00 0.00 ATOM 453 OE2 GLU 75 22.953 -14.122 -21.673 1.00 0.00 ATOM 454 O GLU 75 18.924 -9.979 -25.042 1.00 0.00 ATOM 455 C GLU 75 19.758 -9.543 -24.268 1.00 0.00 ATOM 456 N LYS 76 20.413 -8.401 -24.486 1.00 0.00 ATOM 457 CA LYS 76 20.185 -7.614 -25.707 1.00 0.00 ATOM 458 CB LYS 76 19.665 -6.218 -25.357 1.00 0.00 ATOM 459 CG LYS 76 18.292 -6.213 -24.704 1.00 0.00 ATOM 460 CD LYS 76 17.871 -4.805 -24.316 1.00 0.00 ATOM 461 CE LYS 76 16.499 -4.799 -23.664 1.00 0.00 ATOM 462 NZ LYS 76 16.079 -3.428 -23.263 1.00 0.00 ATOM 463 O LYS 76 22.558 -7.824 -25.958 1.00 0.00 ATOM 464 C LYS 76 21.498 -7.483 -26.465 1.00 0.00 ATOM 465 N SER 77 21.411 -7.025 -27.700 1.00 0.00 ATOM 466 CA SER 77 22.580 -6.843 -28.523 1.00 0.00 ATOM 467 CB SER 77 23.091 -8.191 -29.037 1.00 0.00 ATOM 468 OG SER 77 22.166 -8.777 -29.935 1.00 0.00 ATOM 469 O SER 77 21.017 -5.823 -30.010 1.00 0.00 ATOM 470 C SER 77 22.194 -5.969 -29.683 1.00 0.00 ATOM 471 N THR 78 23.183 -5.358 -30.303 1.00 0.00 ATOM 472 CA THR 78 22.908 -4.546 -31.466 1.00 0.00 ATOM 473 CB THR 78 23.103 -3.047 -31.168 1.00 0.00 ATOM 474 CG2 THR 78 22.192 -2.607 -30.032 1.00 0.00 ATOM 475 OG1 THR 78 24.464 -2.806 -30.790 1.00 0.00 ATOM 476 O THR 78 23.564 -4.527 -33.784 1.00 0.00 ATOM 477 C THR 78 23.831 -4.898 -32.636 1.00 0.00 ATOM 478 N SER 79 24.911 -5.622 -32.352 1.00 0.00 ATOM 479 CA SER 79 25.781 -6.057 -33.439 1.00 0.00 ATOM 480 CB SER 79 27.242 -6.062 -32.984 1.00 0.00 ATOM 481 OG SER 79 27.673 -4.757 -32.642 1.00 0.00 ATOM 482 O SER 79 25.530 -7.940 -34.944 1.00 0.00 ATOM 483 C SER 79 25.329 -7.481 -33.816 1.00 0.00 ATOM 484 N LYS 80 24.613 -8.104 -32.874 1.00 0.00 ATOM 485 CA LYS 80 24.046 -9.433 -33.035 1.00 0.00 ATOM 486 CB LYS 80 23.640 -9.671 -34.491 1.00 0.00 ATOM 487 CG LYS 80 24.809 -9.727 -35.460 1.00 0.00 ATOM 488 CD LYS 80 24.332 -9.947 -36.886 1.00 0.00 ATOM 489 CE LYS 80 25.502 -10.017 -37.855 1.00 0.00 ATOM 490 NZ LYS 80 25.050 -10.235 -39.257 1.00 0.00 ATOM 491 O LYS 80 24.534 -11.754 -32.706 1.00 0.00 ATOM 492 C LYS 80 24.946 -10.588 -32.678 1.00 0.00 ATOM 493 N GLU 81 26.172 -10.265 -32.306 1.00 0.00 ATOM 494 CA GLU 81 27.128 -11.293 -31.977 1.00 0.00 ATOM 495 CB GLU 81 28.394 -11.138 -32.820 1.00 0.00 ATOM 496 CG GLU 81 28.182 -11.369 -34.308 1.00 0.00 ATOM 497 CD GLU 81 29.428 -11.087 -35.124 1.00 0.00 ATOM 498 OE1 GLU 81 30.436 -10.644 -34.535 1.00 0.00 ATOM 499 OE2 GLU 81 29.395 -11.308 -36.354 1.00 0.00 ATOM 500 O GLU 81 27.698 -12.277 -29.839 1.00 0.00 ATOM 501 C GLU 81 27.533 -11.229 -30.500 1.00 0.00 ATOM 502 N PRO 82 27.685 -10.005 -29.989 1.00 0.00 ATOM 503 CA PRO 82 28.038 -9.811 -28.596 1.00 0.00 ATOM 504 CB PRO 82 29.068 -8.681 -28.629 1.00 0.00 ATOM 505 CG PRO 82 28.705 -7.879 -29.833 1.00 0.00 ATOM 506 CD PRO 82 28.028 -8.832 -30.779 1.00 0.00 ATOM 507 O PRO 82 26.154 -8.385 -28.092 1.00 0.00 ATOM 508 C PRO 82 26.765 -9.434 -27.853 1.00 0.00 ATOM 509 N VAL 83 26.361 -10.343 -26.980 1.00 0.00 ATOM 510 CA VAL 83 25.179 -10.177 -26.194 1.00 0.00 ATOM 511 CB VAL 83 24.438 -11.513 -26.001 1.00 0.00 ATOM 512 CG1 VAL 83 23.228 -11.326 -25.099 1.00 0.00 ATOM 513 CG2 VAL 83 23.962 -12.057 -27.338 1.00 0.00 ATOM 514 O VAL 83 26.498 -10.008 -24.225 1.00 0.00 ATOM 515 C VAL 83 25.503 -9.639 -24.831 1.00 0.00 ATOM 516 N ASP 84 24.696 -8.704 -24.370 1.00 0.00 ATOM 517 CA ASP 84 24.920 -8.187 -23.053 1.00 0.00 ATOM 518 CB ASP 84 25.296 -6.705 -23.117 1.00 0.00 ATOM 519 CG ASP 84 25.729 -6.156 -21.772 1.00 0.00 ATOM 520 OD1 ASP 84 26.021 -6.964 -20.866 1.00 0.00 ATOM 521 OD2 ASP 84 25.777 -4.916 -21.624 1.00 0.00 ATOM 522 O ASP 84 22.561 -8.153 -22.531 1.00 0.00 ATOM 523 C ASP 84 23.711 -8.289 -22.124 1.00 0.00 ATOM 527 N LEU 93 15.970 -10.809 -15.058 1.00 0.00 ATOM 528 CA LEU 93 15.944 -12.170 -14.560 1.00 0.00 ATOM 529 CB LEU 93 17.210 -12.469 -13.755 1.00 0.00 ATOM 530 CG LEU 93 17.405 -13.921 -13.312 1.00 0.00 ATOM 531 CD1 LEU 93 17.634 -14.823 -14.516 1.00 0.00 ATOM 532 CD2 LEU 93 18.608 -14.045 -12.390 1.00 0.00 ATOM 533 O LEU 93 14.297 -11.322 -13.066 1.00 0.00 ATOM 534 C LEU 93 14.728 -12.291 -13.684 1.00 0.00 ATOM 535 N VAL 94 14.160 -13.485 -13.663 1.00 0.00 ATOM 536 CA VAL 94 13.000 -13.723 -12.842 1.00 0.00 ATOM 537 CB VAL 94 11.896 -12.684 -13.109 1.00 0.00 ATOM 538 CG1 VAL 94 12.387 -11.286 -12.769 1.00 0.00 ATOM 539 CG2 VAL 94 11.487 -12.707 -14.573 1.00 0.00 ATOM 540 O VAL 94 13.187 -15.855 -13.892 1.00 0.00 ATOM 541 C VAL 94 12.506 -15.097 -13.188 1.00 0.00 ATOM 542 N HIS 95 11.349 -15.434 -12.643 1.00 0.00 ATOM 543 CA HIS 95 10.707 -16.698 -12.918 1.00 0.00 ATOM 544 CB HIS 95 10.779 -17.612 -11.694 1.00 0.00 ATOM 545 CG HIS 95 12.175 -17.934 -11.261 1.00 0.00 ATOM 546 CD2 HIS 95 13.112 -17.391 -10.288 1.00 0.00 ATOM 547 ND1 HIS 95 12.905 -18.967 -11.809 1.00 0.00 ATOM 548 CE1 HIS 95 14.114 -19.009 -11.221 1.00 0.00 ATOM 549 NE2 HIS 95 14.245 -18.067 -10.308 1.00 0.00 ATOM 550 O HIS 95 8.622 -15.715 -12.427 1.00 0.00 ATOM 551 C HIS 95 9.290 -16.337 -13.251 1.00 0.00 ATOM 552 N THR 96 8.829 -16.621 -14.460 1.00 0.00 ATOM 553 CA THR 96 7.450 -16.284 -14.649 1.00 0.00 ATOM 554 CB THR 96 7.147 -15.953 -16.122 1.00 0.00 ATOM 555 CG2 THR 96 8.033 -14.815 -16.606 1.00 0.00 ATOM 556 OG1 THR 96 7.388 -17.108 -16.934 1.00 0.00 ATOM 557 O THR 96 6.905 -18.514 -14.004 1.00 0.00 ATOM 558 C THR 96 6.507 -17.382 -14.264 1.00 0.00 ATOM 559 N GLU 97 5.270 -16.962 -14.050 1.00 0.00 ATOM 560 CA GLU 97 4.219 -17.847 -13.640 1.00 0.00 ATOM 561 CB GLU 97 3.045 -17.053 -13.062 1.00 0.00 ATOM 562 CG GLU 97 3.371 -16.309 -11.778 1.00 0.00 ATOM 563 CD GLU 97 2.201 -15.493 -11.263 1.00 0.00 ATOM 564 OE1 GLU 97 1.151 -15.470 -11.939 1.00 0.00 ATOM 565 OE2 GLU 97 2.335 -14.877 -10.186 1.00 0.00 ATOM 566 O GLU 97 4.059 -18.820 -15.867 1.00 0.00 ATOM 567 C GLU 97 3.609 -18.732 -14.728 1.00 0.00 ATOM 568 N GLY 98 2.536 -19.351 -14.297 1.00 0.00 ATOM 569 CA GLY 98 1.711 -20.271 -15.020 1.00 0.00 ATOM 570 O GLY 98 -0.338 -20.142 -16.328 1.00 0.00 ATOM 571 C GLY 98 0.546 -19.523 -15.720 1.00 0.00 ATOM 572 N GLN 99 0.611 -18.188 -15.702 1.00 0.00 ATOM 573 CA GLN 99 -0.410 -17.317 -16.296 1.00 0.00 ATOM 574 CB GLN 99 -0.046 -15.845 -16.088 1.00 0.00 ATOM 575 CG GLN 99 -1.100 -14.869 -16.582 1.00 0.00 ATOM 576 CD GLN 99 -0.764 -13.429 -16.247 1.00 0.00 ATOM 577 OE1 GLN 99 0.293 -13.143 -15.685 1.00 0.00 ATOM 578 NE2 GLN 99 -1.665 -12.516 -16.592 1.00 0.00 ATOM 579 O GLN 99 0.401 -17.578 -18.556 1.00 0.00 ATOM 580 C GLN 99 -0.576 -17.531 -17.806 1.00 0.00 ATOM 581 N LEU 100 -1.830 -17.677 -18.233 1.00 0.00 ATOM 582 CA LEU 100 -2.162 -17.865 -19.641 1.00 0.00 ATOM 583 CB LEU 100 -3.585 -18.407 -19.789 1.00 0.00 ATOM 584 CG LEU 100 -3.843 -19.801 -19.215 1.00 0.00 ATOM 585 CD1 LEU 100 -5.313 -20.171 -19.342 1.00 0.00 ATOM 586 CD2 LEU 100 -3.024 -20.848 -19.955 1.00 0.00 ATOM 587 O LEU 100 -1.997 -16.578 -21.642 1.00 0.00 ATOM 588 C LEU 100 -2.077 -16.563 -20.413 1.00 0.00 ATOM 589 N GLN 101 -2.174 -15.442 -19.697 1.00 0.00 ATOM 590 CA GLN 101 -2.092 -14.132 -20.312 1.00 0.00 ATOM 591 CB GLN 101 -2.796 -13.087 -19.445 1.00 0.00 ATOM 592 CG GLN 101 -4.284 -13.337 -19.256 1.00 0.00 ATOM 593 CD GLN 101 -5.046 -13.334 -20.566 1.00 0.00 ATOM 594 OE1 GLN 101 -4.971 -12.376 -21.336 1.00 0.00 ATOM 595 NE2 GLN 101 -5.783 -14.407 -20.824 1.00 0.00 ATOM 596 O GLN 101 0.244 -14.521 -19.990 1.00 0.00 ATOM 597 C GLN 101 -0.604 -13.776 -20.456 1.00 0.00 ATOM 598 N ASN 102 -0.272 -12.653 -21.131 1.00 0.00 ATOM 599 CA ASN 102 1.132 -12.261 -21.291 1.00 0.00 ATOM 600 CB ASN 102 1.251 -11.069 -22.244 1.00 0.00 ATOM 601 CG ASN 102 0.488 -9.854 -21.755 1.00 0.00 ATOM 602 ND2 ASN 102 1.205 -8.758 -21.528 1.00 0.00 ATOM 603 OD1 ASN 102 -0.729 -9.902 -21.583 1.00 0.00 ATOM 604 O ASN 102 1.190 -11.240 -19.110 1.00 0.00 ATOM 605 C ASN 102 1.809 -11.847 -19.978 1.00 0.00 ATOM 606 N GLU 103 3.089 -12.160 -19.855 1.00 0.00 ATOM 607 CA GLU 103 3.850 -11.848 -18.666 1.00 0.00 ATOM 608 CB GLU 103 4.393 -13.126 -18.026 1.00 0.00 ATOM 609 CG GLU 103 3.316 -14.068 -17.513 1.00 0.00 ATOM 610 CD GLU 103 3.890 -15.330 -16.898 1.00 0.00 ATOM 611 OE1 GLU 103 4.668 -16.025 -17.585 1.00 0.00 ATOM 612 OE2 GLU 103 3.563 -15.623 -15.729 1.00 0.00 ATOM 613 O GLU 103 5.768 -11.164 -19.946 1.00 0.00 ATOM 614 C GLU 103 5.024 -10.948 -18.996 1.00 0.00 ATOM 615 N GLU 104 5.178 -9.928 -18.169 1.00 0.00 ATOM 616 CA GLU 104 6.182 -8.916 -18.380 1.00 0.00 ATOM 617 CB GLU 104 5.681 -7.555 -17.894 1.00 0.00 ATOM 618 CG GLU 104 4.462 -7.039 -18.640 1.00 0.00 ATOM 619 CD GLU 104 4.000 -5.685 -18.137 1.00 0.00 ATOM 620 OE1 GLU 104 4.615 -5.165 -17.182 1.00 0.00 ATOM 621 OE2 GLU 104 3.024 -5.143 -18.698 1.00 0.00 ATOM 622 O GLU 104 7.658 -9.460 -16.553 1.00 0.00 ATOM 623 C GLU 104 7.531 -9.057 -17.715 1.00 0.00 ATOM 624 N ILE 105 8.530 -8.748 -18.541 1.00 0.00 ATOM 625 CA ILE 105 9.947 -8.759 -18.235 1.00 0.00 ATOM 626 CB ILE 105 10.705 -9.781 -19.103 1.00 0.00 ATOM 627 CG1 ILE 105 10.141 -11.186 -18.888 1.00 0.00 ATOM 628 CG2 ILE 105 12.183 -9.794 -18.743 1.00 0.00 ATOM 629 CD1 ILE 105 10.698 -12.220 -19.841 1.00 0.00 ATOM 630 O ILE 105 10.481 -6.960 -19.701 1.00 0.00 ATOM 631 C ILE 105 10.323 -7.332 -18.551 1.00 0.00 ATOM 632 N VAL 106 10.327 -6.504 -17.525 1.00 0.00 ATOM 633 CA VAL 106 10.631 -5.101 -17.688 1.00 0.00 ATOM 634 CB VAL 106 9.719 -4.220 -16.815 1.00 0.00 ATOM 635 CG1 VAL 106 10.118 -2.757 -16.934 1.00 0.00 ATOM 636 CG2 VAL 106 8.268 -4.358 -17.253 1.00 0.00 ATOM 637 O VAL 106 12.635 -5.355 -16.414 1.00 0.00 ATOM 638 C VAL 106 12.054 -4.754 -17.310 1.00 0.00 ATOM 639 N ALA 107 12.611 -3.776 -18.008 1.00 0.00 ATOM 640 CA ALA 107 13.944 -3.316 -17.725 1.00 0.00 ATOM 641 CB ALA 107 14.963 -4.138 -18.498 1.00 0.00 ATOM 642 O ALA 107 13.340 -1.237 -18.805 1.00 0.00 ATOM 643 C ALA 107 14.158 -1.836 -18.110 1.00 0.00 ATOM 644 N HIS 108 15.150 -1.169 -17.502 1.00 0.00 ATOM 645 CA HIS 108 15.339 0.237 -17.875 1.00 0.00 ATOM 646 CB HIS 108 16.516 0.842 -17.108 1.00 0.00 ATOM 647 CG HIS 108 16.600 2.334 -17.208 1.00 0.00 ATOM 648 CD2 HIS 108 16.258 3.454 -16.342 1.00 0.00 ATOM 649 ND1 HIS 108 17.096 2.978 -18.320 1.00 0.00 ATOM 650 CE1 HIS 108 17.045 4.305 -18.116 1.00 0.00 ATOM 651 NE2 HIS 108 16.543 4.599 -16.931 1.00 0.00 ATOM 652 O HIS 108 16.517 -0.299 -19.892 1.00 0.00 ATOM 653 C HIS 108 15.628 0.368 -19.375 1.00 0.00 ATOM 654 N ASP 109 14.858 1.212 -20.059 1.00 0.00 ATOM 655 CA ASP 109 15.010 1.463 -21.494 1.00 0.00 ATOM 656 CB ASP 109 14.437 2.832 -21.864 1.00 0.00 ATOM 657 CG ASP 109 14.480 3.099 -23.356 1.00 0.00 ATOM 658 OD1 ASP 109 14.938 2.212 -24.105 1.00 0.00 ATOM 659 OD2 ASP 109 14.057 4.198 -23.774 1.00 0.00 ATOM 660 O ASP 109 17.381 1.902 -21.254 1.00 0.00 ATOM 661 C ASP 109 16.457 1.451 -21.956 1.00 0.00 ATOM 662 N GLY 110 16.625 0.942 -23.166 1.00 0.00 ATOM 663 CA GLY 110 17.925 0.801 -23.780 1.00 0.00 ATOM 664 O GLY 110 16.699 0.031 -25.709 1.00 0.00 ATOM 665 C GLY 110 17.752 0.504 -25.268 1.00 0.00 ATOM 666 N SER 111 18.803 0.745 -26.033 1.00 0.00 ATOM 667 CA SER 111 18.772 0.476 -27.457 1.00 0.00 ATOM 668 CB SER 111 19.627 1.496 -28.213 1.00 0.00 ATOM 669 OG SER 111 19.688 1.185 -29.595 1.00 0.00 ATOM 670 O SER 111 20.299 -1.322 -27.149 1.00 0.00 ATOM 671 C SER 111 19.309 -0.897 -27.732 1.00 0.00 ATOM 672 N ALA 112 18.697 -1.554 -28.697 1.00 0.00 ATOM 673 CA ALA 112 19.094 -2.892 -29.036 1.00 0.00 ATOM 674 CB ALA 112 18.611 -3.871 -27.978 1.00 0.00 ATOM 675 O ALA 112 17.445 -2.645 -30.717 1.00 0.00 ATOM 676 C ALA 112 18.468 -3.214 -30.370 1.00 0.00 ATOM 677 N THR 113 19.096 -4.095 -31.135 1.00 0.00 ATOM 678 CA THR 113 18.557 -4.479 -32.432 1.00 0.00 ATOM 679 CB THR 113 19.635 -4.426 -33.529 1.00 0.00 ATOM 680 CG2 THR 113 20.213 -3.023 -33.641 1.00 0.00 ATOM 681 OG1 THR 113 20.692 -5.339 -33.210 1.00 0.00 ATOM 682 O THR 113 17.217 -6.298 -33.178 1.00 0.00 ATOM 683 C THR 113 18.020 -5.894 -32.356 1.00 0.00 ATOM 684 N TYR 114 18.501 -6.637 -31.362 1.00 0.00 ATOM 685 CA TYR 114 18.112 -8.027 -31.123 1.00 0.00 ATOM 686 CB TYR 114 19.227 -8.978 -31.560 1.00 0.00 ATOM 687 CG TYR 114 19.547 -8.911 -33.037 1.00 0.00 ATOM 688 CD1 TYR 114 20.494 -8.017 -33.519 1.00 0.00 ATOM 689 CD2 TYR 114 18.899 -9.742 -33.943 1.00 0.00 ATOM 690 CE1 TYR 114 20.791 -7.948 -34.868 1.00 0.00 ATOM 691 CE2 TYR 114 19.185 -9.688 -35.293 1.00 0.00 ATOM 692 CZ TYR 114 20.140 -8.781 -35.752 1.00 0.00 ATOM 693 OH TYR 114 20.435 -8.715 -37.094 1.00 0.00 ATOM 694 O TYR 114 18.474 -7.553 -28.809 1.00 0.00 ATOM 695 C TYR 114 17.848 -8.207 -29.645 1.00 0.00 ATOM 696 N LEU 115 16.974 -9.148 -29.320 1.00 0.00 ATOM 697 CA LEU 115 16.676 -9.456 -27.933 1.00 0.00 ATOM 698 CB LEU 115 15.312 -8.885 -27.539 1.00 0.00 ATOM 699 CG LEU 115 14.827 -9.206 -26.123 1.00 0.00 ATOM 700 CD1 LEU 115 15.685 -8.494 -25.087 1.00 0.00 ATOM 701 CD2 LEU 115 13.386 -8.759 -25.935 1.00 0.00 ATOM 702 O LEU 115 16.208 -11.671 -28.730 1.00 0.00 ATOM 703 C LEU 115 16.672 -10.973 -27.826 1.00 0.00 ATOM 704 N ARG 116 17.207 -11.481 -26.731 1.00 0.00 ATOM 705 CA ARG 116 17.271 -12.906 -26.529 1.00 0.00 ATOM 706 CB ARG 116 18.724 -13.385 -26.543 1.00 0.00 ATOM 707 CG ARG 116 18.888 -14.879 -26.312 1.00 0.00 ATOM 708 CD ARG 116 20.340 -15.304 -26.460 1.00 0.00 ATOM 709 NE ARG 116 20.521 -16.730 -26.200 1.00 0.00 ATOM 710 CZ ARG 116 21.679 -17.371 -26.323 1.00 0.00 ATOM 711 NH1 ARG 116 21.749 -18.670 -26.065 1.00 0.00 ATOM 712 NH2 ARG 116 22.765 -16.711 -26.703 1.00 0.00 ATOM 713 O ARG 116 16.831 -12.562 -24.205 1.00 0.00 ATOM 714 C ARG 116 16.656 -13.282 -25.196 1.00 0.00 ATOM 715 N PHE 117 15.875 -14.361 -25.199 1.00 0.00 ATOM 716 CA PHE 117 15.252 -14.904 -23.986 1.00 0.00 ATOM 717 CB PHE 117 13.744 -15.067 -24.184 1.00 0.00 ATOM 718 CG PHE 117 13.028 -15.599 -22.976 1.00 0.00 ATOM 719 CD1 PHE 117 12.800 -14.790 -21.877 1.00 0.00 ATOM 720 CD2 PHE 117 12.581 -16.909 -22.939 1.00 0.00 ATOM 721 CE1 PHE 117 12.140 -15.279 -20.766 1.00 0.00 ATOM 722 CE2 PHE 117 11.922 -17.397 -21.827 1.00 0.00 ATOM 723 CZ PHE 117 11.701 -16.589 -20.744 1.00 0.00 ATOM 724 O PHE 117 16.008 -17.069 -24.701 1.00 0.00 ATOM 725 C PHE 117 15.942 -16.252 -23.782 1.00 0.00 ATOM 726 N ILE 118 16.538 -16.427 -22.611 1.00 0.00 ATOM 727 CA ILE 118 17.224 -17.640 -22.226 1.00 0.00 ATOM 728 CB ILE 118 18.610 -17.339 -21.626 1.00 0.00 ATOM 729 CG1 ILE 118 19.489 -16.619 -22.649 1.00 0.00 ATOM 730 CG2 ILE 118 19.304 -18.628 -21.215 1.00 0.00 ATOM 731 CD1 ILE 118 20.790 -16.097 -22.079 1.00 0.00 ATOM 732 O ILE 118 15.810 -17.497 -20.333 1.00 0.00 ATOM 733 C ILE 118 16.265 -18.223 -21.203 1.00 0.00 ATOM 734 N ILE 119 15.818 -19.463 -21.409 1.00 0.00 ATOM 735 CA ILE 119 14.910 -20.136 -20.475 1.00 0.00 ATOM 736 CB ILE 119 13.772 -20.860 -21.218 1.00 0.00 ATOM 737 CG1 ILE 119 12.940 -19.859 -22.024 1.00 0.00 ATOM 738 CG2 ILE 119 12.854 -21.565 -20.230 1.00 0.00 ATOM 739 CD1 ILE 119 11.940 -20.509 -22.956 1.00 0.00 ATOM 740 O ILE 119 16.473 -21.944 -20.369 1.00 0.00 ATOM 741 C ILE 119 15.808 -21.123 -19.740 1.00 0.00 ATOM 742 N VAL 120 15.878 -20.979 -18.422 1.00 0.00 ATOM 743 CA VAL 120 16.735 -21.790 -17.560 1.00 0.00 ATOM 744 CB VAL 120 17.241 -20.984 -16.350 1.00 0.00 ATOM 745 CG1 VAL 120 18.040 -21.877 -15.412 1.00 0.00 ATOM 746 CG2 VAL 120 18.139 -19.844 -16.807 1.00 0.00 ATOM 747 O VAL 120 16.785 -23.992 -16.629 1.00 0.00 ATOM 748 C VAL 120 16.085 -23.022 -16.974 1.00 0.00 ATOM 749 N SER 121 14.763 -22.961 -16.796 1.00 0.00 ATOM 750 CA SER 121 14.018 -24.070 -16.226 1.00 0.00 ATOM 751 CB SER 121 14.043 -24.002 -14.699 1.00 0.00 ATOM 752 OG SER 121 13.345 -22.864 -14.225 1.00 0.00 ATOM 753 O SER 121 12.095 -22.991 -17.149 1.00 0.00 ATOM 754 C SER 121 12.569 -24.032 -16.684 1.00 0.00 ATOM 755 N ALA 122 11.883 -25.169 -16.528 1.00 0.00 ATOM 756 CA ALA 122 10.471 -25.352 -16.888 1.00 0.00 ATOM 757 CB ALA 122 10.290 -26.625 -17.699 1.00 0.00 ATOM 758 O ALA 122 10.246 -26.064 -14.652 1.00 0.00 ATOM 759 C ALA 122 9.755 -25.433 -15.567 1.00 0.00 ATOM 760 N PHE 123 8.579 -24.825 -15.496 1.00 0.00 ATOM 761 CA PHE 123 7.753 -24.787 -14.300 1.00 0.00 ATOM 762 CB PHE 123 6.317 -24.396 -14.653 1.00 0.00 ATOM 763 CG PHE 123 5.403 -24.307 -13.463 1.00 0.00 ATOM 764 CD1 PHE 123 5.435 -23.203 -12.629 1.00 0.00 ATOM 765 CD2 PHE 123 4.514 -25.327 -13.179 1.00 0.00 ATOM 766 CE1 PHE 123 4.595 -23.121 -11.535 1.00 0.00 ATOM 767 CE2 PHE 123 3.673 -25.245 -12.085 1.00 0.00 ATOM 768 CZ PHE 123 3.711 -24.148 -11.264 1.00 0.00 ATOM 769 O PHE 123 7.836 -26.117 -12.307 1.00 0.00 ATOM 770 C PHE 123 7.643 -26.105 -13.525 1.00 0.00 ATOM 771 N ASP 124 9.889 -30.596 -16.283 1.00 0.00 ATOM 772 CA ASP 124 9.892 -31.410 -17.484 1.00 0.00 ATOM 773 CB ASP 124 8.528 -31.350 -18.175 1.00 0.00 ATOM 774 CG ASP 124 7.472 -32.164 -17.453 1.00 0.00 ATOM 775 OD1 ASP 124 7.829 -32.884 -16.498 1.00 0.00 ATOM 776 OD2 ASP 124 6.289 -32.082 -17.843 1.00 0.00 ATOM 777 O ASP 124 11.640 -29.838 -18.094 1.00 0.00 ATOM 778 C ASP 124 11.000 -30.843 -18.437 1.00 0.00 ATOM 779 N HIS 125 11.291 -31.494 -19.572 1.00 0.00 ATOM 780 CA HIS 125 12.400 -31.049 -20.445 1.00 0.00 ATOM 781 CB HIS 125 13.047 -32.248 -21.141 1.00 0.00 ATOM 782 CG HIS 125 13.727 -33.196 -20.204 1.00 0.00 ATOM 783 CD2 HIS 125 13.486 -34.557 -19.747 1.00 0.00 ATOM 784 ND1 HIS 125 14.876 -32.868 -19.517 1.00 0.00 ATOM 785 CE1 HIS 125 15.247 -33.916 -18.758 1.00 0.00 ATOM 786 NE2 HIS 125 14.417 -34.932 -18.891 1.00 0.00 ATOM 787 O HIS 125 13.287 -29.715 -22.249 1.00 0.00 ATOM 788 C HIS 125 12.280 -30.083 -21.634 1.00 0.00 ATOM 789 N PHE 126 11.083 -29.634 -21.956 1.00 0.00 ATOM 790 CA PHE 126 10.934 -28.756 -23.104 1.00 0.00 ATOM 791 CB PHE 126 9.964 -29.363 -24.119 1.00 0.00 ATOM 792 CG PHE 126 8.563 -29.519 -23.601 1.00 0.00 ATOM 793 CD1 PHE 126 7.642 -28.496 -23.732 1.00 0.00 ATOM 794 CD2 PHE 126 8.166 -30.693 -22.982 1.00 0.00 ATOM 795 CE1 PHE 126 6.354 -28.639 -23.256 1.00 0.00 ATOM 796 CE2 PHE 126 6.876 -30.836 -22.505 1.00 0.00 ATOM 797 CZ PHE 126 5.971 -29.816 -22.639 1.00 0.00 ATOM 798 O PHE 126 9.775 -27.146 -21.798 1.00 0.00 ATOM 799 C PHE 126 10.405 -27.382 -22.815 1.00 0.00 ATOM 800 N ALA 127 10.603 -26.513 -23.793 1.00 0.00 ATOM 801 CA ALA 127 10.137 -25.142 -23.753 1.00 0.00 ATOM 802 CB ALA 127 11.316 -24.181 -23.753 1.00 0.00 ATOM 803 O ALA 127 9.575 -25.363 -26.099 1.00 0.00 ATOM 804 C ALA 127 9.272 -24.903 -24.996 1.00 0.00 ATOM 805 N SER 128 8.177 -24.199 -24.791 1.00 0.00 ATOM 806 CA SER 128 7.257 -23.876 -25.853 1.00 0.00 ATOM 807 CB SER 128 6.090 -24.865 -25.871 1.00 0.00 ATOM 808 OG SER 128 6.544 -26.186 -26.111 1.00 0.00 ATOM 809 O SER 128 6.481 -22.119 -24.409 1.00 0.00 ATOM 810 C SER 128 6.761 -22.461 -25.564 1.00 0.00 ATOM 811 N VAL 129 6.704 -21.617 -26.588 1.00 0.00 ATOM 812 CA VAL 129 6.235 -20.236 -26.397 1.00 0.00 ATOM 813 CB VAL 129 7.399 -19.230 -26.479 1.00 0.00 ATOM 814 CG1 VAL 129 6.886 -17.808 -26.305 1.00 0.00 ATOM 815 CG2 VAL 129 8.421 -19.507 -25.389 1.00 0.00 ATOM 816 O VAL 129 5.496 -20.123 -28.680 1.00 0.00 ATOM 817 C VAL 129 5.224 -19.918 -27.492 1.00 0.00 ATOM 818 N HIS 130 4.031 -19.510 -27.095 1.00 0.00 ATOM 819 CA HIS 130 3.007 -19.156 -28.070 1.00 0.00 ATOM 820 CB HIS 130 1.653 -18.966 -27.382 1.00 0.00 ATOM 821 CG HIS 130 1.055 -20.237 -26.865 1.00 0.00 ATOM 822 CD2 HIS 130 1.309 -21.658 -27.059 1.00 0.00 ATOM 823 ND1 HIS 130 -0.001 -20.258 -25.981 1.00 0.00 ATOM 824 CE1 HIS 130 -0.315 -21.536 -25.702 1.00 0.00 ATOM 825 NE2 HIS 130 0.466 -22.382 -26.347 1.00 0.00 ATOM 826 O HIS 130 3.339 -17.806 -30.054 1.00 0.00 ATOM 827 C HIS 130 3.344 -17.848 -28.807 1.00 0.00 ATOM 828 N SER 131 3.717 -16.823 -28.021 1.00 0.00 ATOM 829 CA SER 131 4.026 -15.474 -28.500 1.00 0.00 ATOM 830 CB SER 131 2.766 -14.607 -28.516 1.00 0.00 ATOM 831 OG SER 131 3.058 -13.289 -28.943 1.00 0.00 ATOM 832 O SER 131 5.127 -14.815 -26.447 1.00 0.00 ATOM 833 C SER 131 5.060 -14.682 -27.674 1.00 0.00 ATOM 834 N VAL 132 5.828 -13.831 -28.373 1.00 0.00 ATOM 835 CA VAL 132 6.808 -12.930 -27.774 1.00 0.00 ATOM 836 CB VAL 132 8.247 -13.328 -28.150 1.00 0.00 ATOM 837 CG1 VAL 132 9.246 -12.355 -27.544 1.00 0.00 ATOM 838 CG2 VAL 132 8.564 -14.725 -27.638 1.00 0.00 ATOM 839 O VAL 132 6.412 -11.300 -29.519 1.00 0.00 ATOM 840 C VAL 132 6.505 -11.527 -28.303 1.00 0.00 ATOM 841 N SER 133 6.402 -10.589 -27.371 1.00 0.00 ATOM 842 CA SER 133 6.121 -9.207 -27.667 1.00 0.00 ATOM 843 CB SER 133 4.799 -8.779 -27.025 1.00 0.00 ATOM 844 OG SER 133 3.706 -9.480 -27.594 1.00 0.00 ATOM 845 O SER 133 7.759 -8.655 -26.027 1.00 0.00 ATOM 846 C SER 133 7.259 -8.367 -27.108 1.00 0.00 ATOM 847 N ALA 134 7.722 -7.388 -27.880 1.00 0.00 ATOM 848 CA ALA 134 8.792 -6.508 -27.430 1.00 0.00 ATOM 849 CB ALA 134 9.893 -6.434 -28.477 1.00 0.00 ATOM 850 O ALA 134 7.487 -4.575 -28.100 1.00 0.00 ATOM 851 C ALA 134 8.178 -5.127 -27.213 1.00 0.00 ATOM 852 N GLU 135 8.370 -4.603 -26.008 1.00 0.00 ATOM 853 CA GLU 135 7.861 -3.283 -25.647 1.00 0.00 ATOM 854 CB GLU 135 7.581 -3.209 -24.145 1.00 0.00 ATOM 855 CG GLU 135 6.418 -4.076 -23.687 1.00 0.00 ATOM 856 CD GLU 135 5.102 -3.660 -24.312 1.00 0.00 ATOM 857 OE1 GLU 135 4.769 -2.458 -24.254 1.00 0.00 ATOM 858 OE2 GLU 135 4.401 -4.537 -24.859 1.00 0.00 ATOM 859 O GLU 135 10.053 -2.370 -25.602 1.00 0.00 ATOM 860 C GLU 135 8.899 -2.255 -26.015 1.00 0.00 ATOM 861 N GLY 136 8.502 -1.268 -26.807 1.00 0.00 ATOM 862 CA GLY 136 9.437 -0.238 -27.222 1.00 0.00 ATOM 863 O GLY 136 7.622 0.890 -28.299 1.00 0.00 ATOM 864 C GLY 136 8.842 0.776 -28.173 1.00 0.00 ATOM 865 N THR 137 9.711 1.527 -28.833 1.00 0.00 ATOM 866 CA THR 137 9.275 2.554 -29.763 1.00 0.00 ATOM 867 CB THR 137 9.994 3.892 -29.505 1.00 0.00 ATOM 868 CG2 THR 137 9.669 4.410 -28.112 1.00 0.00 ATOM 869 OG1 THR 137 11.410 3.704 -29.611 1.00 0.00 ATOM 870 O THR 137 10.673 1.839 -31.585 1.00 0.00 ATOM 871 C THR 137 9.542 2.194 -31.226 1.00 0.00 TER END