PFRMAT TS TARGET T0169 AUTHOR 4069-6308-1312 METHOD The SAM-T02 human predictions start with the same method as the METHOD SAM-T02 server: METHOD METHOD Use the SAM-T2K method for finding homologs of the target and METHOD aligning them. METHOD METHOD Make local structure predictions using neural nets and the METHOD multiple alignment. We currently have 5 local-structure METHOD alphabets: METHOD DSSP METHOD STRIDE METHOD STR 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 DSSP_EHL2 CASP's collapse of the DSSP alphabet METHOD METHOD DSSP_EHL2 is not predicted directly by a neural net, but is METHOD computed as a weighted average of the other 4 networks (each METHOD probability vector output is multiplied by conditional METHOD probability matrix P(E|letter) P(H|letter) P(L|letter)). The METHOD weights for the averaging are the mutual information between the METHOD local structure alphabet and the DSSP_EHL2 alphabet in a large METHOD training set. METHOD METHOD METHOD We make four 2-track HMMs (1.0 amino acid + 0.3 local structure) METHOD and use them to score a template library of about 6200 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 [Difference from server: the web server did not include the ALPHA METHOD alphabet in either the DSSP_EHL2 computation or the 2-track HMMS.] METHOD METHOD One-track HMMs built from the template library multiple alignments METHOD were used to score the target sequence. 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. METHOD METHOD Alignments of the target to the top templates were made using METHOD several different alignment methods (all using the SAM hmmscore METHOD program). METHOD METHOD After the large set of alignments were made the "human" methods and METHOD the server diverge significantly. The server just picks the METHOD best-scoring templates (after removing redundancy) and reports the METHOD local posterior-decoding alignments made with the 2-track AA+STR METHOD target HMM. METHOD METHOD The hand method used SAM's "fragfinder" program and the 2-track AA+STR METHOD HMM to find short fragments (9 residues long) for each position in the METHOD sequence (6 fragments were kept for each position). METHOD METHOD Then the "undertaker" program (named because it optimizes burial) is METHOD used to try to combine the alignments and the fragments into a METHOD consistent 3D model. No single alignment or parent template was used, METHOD though in many cases one had much more influence than the others. The METHOD alignment scores were not passed to undertaker, but were used only to METHOD pike the set of alignments and fragments that undertaker would see. METHOD METHOD A genetic algorithm with about 16 different operators were used to METHOD optimize a score function. The score function was hand-tweaked for METHOD each target (mainly by adding constraints to keep beta sheets METHOD together, but also by adjusting what terms were included in the score METHOD function and what weights were used). Undertaker was undergoing METHOD extensive modification during CASP season, so may have had quite METHOD different features available for different targets. METHOD METHOD Bower and Dunbrack's SCWRL was run on some of the intermediate METHOD conformations generated by undertaker, but the final conformation was METHOD chosen entirely by the undertaker score function. METHOD METHOD Optimization was generally done in many passes, with hand inspection METHOD of the best conformation after each pass, followed (often) by tweaking METHOD the score function to move the conformation in a direction we desired. METHOD METHOD In a few cases, when we started getting a decent structure that did METHOD not correspond well to our input alignments, we submitted the METHOD structure to VAST to get structure-structure alignments, to try to METHOD find some other possible templates to use as a base. METHOD METHOD In some cases, when several conformations had good parts, different METHOD conformations were manually cut-and-pasted, with undertaker run to try METHOD to smooth out the transitions. METHOD METHOD Because undertaker does not (yet) handle multimers, we often added METHOD "scaffolding" constraints by hand to try to retain structure in METHOD dimerization interfaces. This is a crude hack that we hope to get rid METHOD of when we have multimers implemented. METHOD METHOD Because undertaker does not (yet) have a hydrogen-bond scoring METHOD function, we often had to add constraints to hold beta sheets METHOD together. In some cases where the register was not obvious, we had to METHOD guess or try several different registers. METHOD METHOD In some cases, when we got desperate for initial starting points, we METHOD threw the Robetta ab-initio models into the undertaker pool, and METHOD optimized from them as well as the ones undertaker started with. METHOD METHOD For multiple-domain models, we generally broke the sequence into METHOD chunks (often somewhat arbitrary overlapping chunks), and did the full METHOD SAM-T02 method for each subchain. The alignments found were all METHOD tossed into the undertaker conformation search. In some cases, we METHOD performed undertaker runs for the subchains, and cut-and-pasted the METHOD pieces into one PDB file (with bad breaks) and let undertaker try to METHOD assemble the pieces. MODEL 1 PARENT N/A ATOM 1 N MET 1 -5.933 -12.711 11.403 1.00 0.00 ATOM 2 CA MET 1 -5.483 -12.151 12.621 1.00 0.00 ATOM 3 CB MET 1 -6.762 -12.848 13.601 1.00 0.00 ATOM 4 CG MET 1 -6.234 -14.029 14.399 1.00 0.00 ATOM 5 SD MET 1 -5.603 -15.352 13.348 1.00 0.00 ATOM 6 CE MET 1 -3.854 -15.279 13.725 1.00 0.00 ATOM 7 O MET 1 -3.487 -11.363 13.625 1.00 0.00 ATOM 8 C MET 1 -4.025 -11.739 12.571 1.00 0.00 ATOM 9 N ASP 2 -3.405 -11.788 11.385 1.00 0.00 ATOM 10 CA ASP 2 -2.007 -11.436 11.233 1.00 0.00 ATOM 11 CB ASP 2 -1.132 -12.662 11.483 1.00 0.00 ATOM 12 CG ASP 2 0.324 -12.304 11.771 1.00 0.00 ATOM 13 OD1 ASP 2 0.657 -11.103 11.930 1.00 0.00 ATOM 14 OD2 ASP 2 1.140 -13.247 11.841 1.00 0.00 ATOM 15 O ASP 2 -2.646 -10.996 8.956 1.00 0.00 ATOM 16 C ASP 2 -1.765 -10.945 9.820 1.00 0.00 ATOM 17 N ILE 3 -0.559 -10.462 9.607 1.00 0.00 ATOM 18 CA ILE 3 -0.157 -9.996 8.265 1.00 0.00 ATOM 19 CB ILE 3 0.226 -8.483 8.289 1.00 0.00 ATOM 20 CG1 ILE 3 -1.063 -7.650 8.306 1.00 0.00 ATOM 21 CG2 ILE 3 1.067 -8.080 7.044 1.00 0.00 ATOM 22 CD1 ILE 3 -0.862 -6.181 8.568 1.00 0.00 ATOM 23 O ILE 3 1.853 -11.196 8.810 1.00 0.00 ATOM 24 C ILE 3 1.093 -10.764 7.917 1.00 0.00 ATOM 25 N ARG 4 1.316 -11.007 6.640 1.00 0.00 ATOM 26 CA ARG 4 2.464 -11.743 6.163 1.00 0.00 ATOM 27 CB ARG 4 2.136 -13.205 5.959 1.00 0.00 ATOM 28 CG ARG 4 0.905 -13.454 5.085 1.00 0.00 ATOM 29 CD ARG 4 0.449 -14.901 5.286 1.00 0.00 ATOM 30 NE ARG 4 1.457 -15.839 4.796 1.00 0.00 ATOM 31 CZ ARG 4 1.360 -17.157 4.916 1.00 0.00 ATOM 32 NH1 ARG 4 0.336 -17.691 5.563 1.00 0.00 ATOM 33 NH2 ARG 4 2.283 -17.955 4.383 1.00 0.00 ATOM 34 O ARG 4 1.938 -10.635 4.097 1.00 0.00 ATOM 35 C ARG 4 2.745 -11.323 4.709 1.00 0.00 ATOM 36 N THR 5 3.886 -11.739 4.176 1.00 0.00 ATOM 37 CA THR 5 4.223 -11.470 2.781 1.00 0.00 ATOM 38 CB THR 5 5.670 -11.895 2.460 1.00 0.00 ATOM 39 CG2 THR 5 6.657 -11.119 3.319 1.00 0.00 ATOM 40 OG1 THR 5 5.828 -13.293 2.719 1.00 0.00 ATOM 41 O THR 5 2.754 -13.308 2.244 1.00 0.00 ATOM 42 C THR 5 3.271 -12.252 1.878 1.00 0.00 ATOM 43 N ILE 6 3.068 -11.733 0.675 1.00 0.00 ATOM 44 CA ILE 6 2.209 -12.371 -0.282 1.00 0.00 ATOM 45 CB ILE 6 2.143 -11.601 -1.639 1.00 0.00 ATOM 46 CG1 ILE 6 1.520 -10.210 -1.441 1.00 0.00 ATOM 47 CG2 ILE 6 1.363 -12.414 -2.683 1.00 0.00 ATOM 48 CD1 ILE 6 0.051 -10.224 -1.081 1.00 0.00 ATOM 49 O ILE 6 4.039 -13.850 -0.735 1.00 0.00 ATOM 50 C ILE 6 2.832 -13.689 -0.737 1.00 0.00 ATOM 51 N THR 7 2.005 -14.638 -1.142 1.00 0.00 ATOM 52 CA THR 7 2.538 -15.913 -1.607 1.00 0.00 ATOM 53 CB THR 7 2.256 -17.046 -0.602 1.00 0.00 ATOM 54 CG2 THR 7 2.845 -16.709 0.757 1.00 0.00 ATOM 55 OG1 THR 7 0.841 -17.225 -0.467 1.00 0.00 ATOM 56 O THR 7 0.850 -15.711 -3.288 1.00 0.00 ATOM 57 C THR 7 1.892 -16.264 -2.929 1.00 0.00 ATOM 58 N SER 8 2.517 -17.199 -3.639 1.00 0.00 ATOM 59 CA SER 8 2.040 -17.677 -4.928 1.00 0.00 ATOM 60 CB SER 8 2.861 -18.882 -5.390 1.00 0.00 ATOM 61 OG SER 8 4.205 -18.519 -5.640 1.00 0.00 ATOM 62 O SER 8 -0.127 -17.870 -5.846 1.00 0.00 ATOM 63 C SER 8 0.599 -18.106 -4.900 1.00 0.00 ATOM 64 N SER 9 0.189 -18.753 -3.814 1.00 0.00 ATOM 65 CA SER 9 -1.200 -19.184 -3.696 1.00 0.00 ATOM 66 CB SER 9 -1.363 -20.143 -2.513 1.00 0.00 ATOM 67 OG SER 9 -1.134 -19.480 -1.284 1.00 0.00 ATOM 68 O SER 9 -3.391 -18.329 -3.502 1.00 0.00 ATOM 69 C SER 9 -2.196 -18.065 -3.472 1.00 0.00 ATOM 70 N ASP 10 -1.740 -16.819 -3.261 1.00 0.00 ATOM 71 CA ASP 10 -2.692 -15.701 -3.031 1.00 0.00 ATOM 72 CB ASP 10 -1.991 -14.529 -2.340 1.00 0.00 ATOM 73 CG ASP 10 -1.616 -14.840 -0.905 1.00 0.00 ATOM 74 OD1 ASP 10 -1.616 -13.904 -0.076 1.00 0.00 ATOM 75 OD2 ASP 10 -1.321 -16.017 -0.609 1.00 0.00 ATOM 76 O ASP 10 -4.153 -14.269 -4.285 1.00 0.00 ATOM 77 C ASP 10 -3.317 -15.144 -4.343 1.00 0.00 ATOM 78 N TYR 11 -2.937 -15.651 -5.511 1.00 0.00 ATOM 79 CA TYR 11 -3.470 -15.072 -6.754 1.00 0.00 ATOM 80 CB TYR 11 -3.295 -16.076 -7.905 1.00 0.00 ATOM 81 CG TYR 11 -3.900 -15.603 -9.202 1.00 0.00 ATOM 82 CD1 TYR 11 -3.190 -14.765 -10.056 1.00 0.00 ATOM 83 CD2 TYR 11 -5.200 -15.944 -9.544 1.00 0.00 ATOM 84 CE1 TYR 11 -3.765 -14.277 -11.208 1.00 0.00 ATOM 85 CE2 TYR 11 -5.781 -15.455 -10.691 1.00 0.00 ATOM 86 CZ TYR 11 -5.060 -14.621 -11.520 1.00 0.00 ATOM 87 OH TYR 11 -5.642 -14.111 -12.661 1.00 0.00 ATOM 88 O TYR 11 -5.290 -13.581 -7.056 1.00 0.00 ATOM 89 C TYR 11 -4.954 -14.710 -6.828 1.00 0.00 ATOM 90 N GLU 12 -5.844 -15.667 -6.651 1.00 0.00 ATOM 91 CA GLU 12 -7.275 -15.402 -6.699 1.00 0.00 ATOM 92 CB GLU 12 -8.066 -16.639 -6.272 1.00 0.00 ATOM 93 CG GLU 12 -9.574 -16.456 -6.305 1.00 0.00 ATOM 94 CD GLU 12 -10.322 -17.720 -5.926 1.00 0.00 ATOM 95 OE1 GLU 12 -9.660 -18.736 -5.630 1.00 0.00 ATOM 96 OE2 GLU 12 -11.570 -17.691 -5.920 1.00 0.00 ATOM 97 O GLU 12 -8.252 -13.287 -6.268 1.00 0.00 ATOM 98 C GLU 12 -7.702 -14.277 -5.801 1.00 0.00 ATOM 99 N MET 13 -7.454 -14.439 -4.504 1.00 0.00 ATOM 100 CA MET 13 -7.886 -13.452 -3.532 1.00 0.00 ATOM 101 CB MET 13 -7.480 -14.008 -2.100 1.00 0.00 ATOM 102 CG MET 13 -8.134 -15.316 -1.666 1.00 0.00 ATOM 103 SD MET 13 -7.971 -15.635 0.095 1.00 0.00 ATOM 104 CE MET 13 -6.469 -16.380 0.159 1.00 0.00 ATOM 105 O MET 13 -8.038 -11.092 -3.407 1.00 0.00 ATOM 106 C MET 13 -7.329 -12.052 -3.645 1.00 0.00 ATOM 107 N VAL 14 -6.064 -11.963 -4.017 1.00 0.00 ATOM 108 CA VAL 14 -5.344 -10.721 -4.199 1.00 0.00 ATOM 109 CB VAL 14 -3.815 -10.873 -4.363 1.00 0.00 ATOM 110 CG1 VAL 14 -3.430 -11.532 -5.676 1.00 0.00 ATOM 111 CG2 VAL 14 -3.129 -9.525 -4.233 1.00 0.00 ATOM 112 O VAL 14 -6.135 -8.839 -5.401 1.00 0.00 ATOM 113 C VAL 14 -5.865 -10.024 -5.440 1.00 0.00 ATOM 114 N THR 15 -6.026 -10.737 -6.544 1.00 0.00 ATOM 115 CA THR 15 -6.560 -10.064 -7.730 1.00 0.00 ATOM 116 CB THR 15 -6.635 -11.019 -8.935 1.00 0.00 ATOM 117 CG2 THR 15 -7.234 -10.310 -10.138 1.00 0.00 ATOM 118 OG1 THR 15 -5.318 -11.474 -9.271 1.00 0.00 ATOM 119 O THR 15 -8.383 -8.469 -7.806 1.00 0.00 ATOM 120 C THR 15 -7.954 -9.568 -7.395 1.00 0.00 ATOM 121 N SER 16 -8.672 -10.361 -6.617 1.00 0.00 ATOM 122 CA SER 16 -10.004 -9.968 -6.244 1.00 0.00 ATOM 123 CB SER 16 -10.685 -11.078 -5.443 1.00 0.00 ATOM 124 OG SER 16 -10.891 -12.232 -6.242 1.00 0.00 ATOM 125 O SER 16 -10.829 -7.808 -5.598 1.00 0.00 ATOM 126 C SER 16 -10.004 -8.695 -5.372 1.00 0.00 ATOM 127 N VAL 17 -9.107 -8.563 -4.393 1.00 0.00 ATOM 128 CA VAL 17 -9.178 -7.338 -3.596 1.00 0.00 ATOM 129 CB VAL 17 -7.928 -7.495 -2.475 1.00 0.00 ATOM 130 CG1 VAL 17 -7.990 -6.645 -1.203 1.00 0.00 ATOM 131 CG2 VAL 17 -7.582 -8.928 -2.080 1.00 0.00 ATOM 132 O VAL 17 -8.951 -4.990 -4.027 1.00 0.00 ATOM 133 C VAL 17 -8.550 -6.120 -4.299 1.00 0.00 ATOM 134 N LEU 18 -7.633 -6.363 -5.249 1.00 0.00 ATOM 135 CA LEU 18 -6.985 -5.295 -6.011 1.00 0.00 ATOM 136 CB LEU 18 -5.611 -5.898 -6.462 1.00 0.00 ATOM 137 CG LEU 18 -4.830 -5.068 -7.484 1.00 0.00 ATOM 138 CD1 LEU 18 -4.342 -3.755 -6.868 1.00 0.00 ATOM 139 CD2 LEU 18 -3.678 -5.890 -8.038 1.00 0.00 ATOM 140 O LEU 18 -7.760 -3.543 -7.427 1.00 0.00 ATOM 141 C LEU 18 -7.958 -4.682 -6.995 1.00 0.00 ATOM 142 N ASN 19 -9.004 -5.439 -7.340 1.00 0.00 ATOM 143 CA ASN 19 -10.013 -4.955 -8.284 1.00 0.00 ATOM 144 CB ASN 19 -11.108 -6.005 -8.482 1.00 0.00 ATOM 145 CG ASN 19 -12.073 -5.639 -9.591 1.00 0.00 ATOM 146 ND2 ASN 19 -13.343 -5.479 -9.240 1.00 0.00 ATOM 147 OD1 ASN 19 -11.677 -5.504 -10.750 1.00 0.00 ATOM 148 O ASN 19 -11.111 -2.836 -8.510 1.00 0.00 ATOM 149 C ASN 19 -10.653 -3.678 -7.759 1.00 0.00 ATOM 150 N GLU 20 -10.701 -3.571 -6.453 1.00 0.00 ATOM 151 CA GLU 20 -11.283 -2.430 -5.758 1.00 0.00 ATOM 152 CB GLU 20 -11.459 -2.784 -4.268 1.00 0.00 ATOM 153 CG GLU 20 -12.126 -1.700 -3.389 1.00 0.00 ATOM 154 CD GLU 20 -13.578 -1.371 -3.748 1.00 0.00 ATOM 155 OE1 GLU 20 -14.241 -0.712 -2.916 1.00 0.00 ATOM 156 OE2 GLU 20 -14.071 -1.736 -4.846 1.00 0.00 ATOM 157 O GLU 20 -10.960 -0.059 -6.070 1.00 0.00 ATOM 158 C GLU 20 -10.474 -1.170 -6.111 1.00 0.00 ATOM 159 N TRP 21 -9.222 -1.369 -6.468 1.00 0.00 ATOM 160 CA TRP 21 -8.350 -0.269 -6.793 1.00 0.00 ATOM 161 CB TRP 21 -6.880 -0.550 -6.427 1.00 0.00 ATOM 162 CG TRP 21 -5.999 0.665 -6.547 1.00 0.00 ATOM 163 CD1 TRP 21 -5.760 1.616 -5.602 1.00 0.00 ATOM 164 CD2 TRP 21 -5.232 1.041 -7.695 1.00 0.00 ATOM 165 CE2 TRP 21 -4.555 2.233 -7.377 1.00 0.00 ATOM 166 CE3 TRP 21 -5.057 0.469 -8.963 1.00 0.00 ATOM 167 NE1 TRP 21 -4.890 2.570 -6.090 1.00 0.00 ATOM 168 CZ2 TRP 21 -3.718 2.871 -8.291 1.00 0.00 ATOM 169 CZ3 TRP 21 -4.227 1.101 -9.869 1.00 0.00 ATOM 170 CH2 TRP 21 -3.570 2.288 -9.521 1.00 0.00 ATOM 171 O TRP 21 -8.633 1.182 -8.664 1.00 0.00 ATOM 172 C TRP 21 -8.466 0.042 -8.278 1.00 0.00 ATOM 173 N TRP 22 -8.400 -0.969 -9.122 1.00 0.00 ATOM 174 CA TRP 22 -8.446 -0.713 -10.541 1.00 0.00 ATOM 175 CB TRP 22 -7.130 -0.013 -11.035 1.00 0.00 ATOM 176 CG TRP 22 -7.365 0.896 -12.224 1.00 0.00 ATOM 177 CD1 TRP 22 -6.827 0.834 -13.472 1.00 0.00 ATOM 178 CD2 TRP 22 -8.242 2.032 -12.243 1.00 0.00 ATOM 179 CE2 TRP 22 -8.181 2.602 -13.524 1.00 0.00 ATOM 180 CE3 TRP 22 -9.070 2.615 -11.275 1.00 0.00 ATOM 181 NE1 TRP 22 -7.303 1.854 -14.274 1.00 0.00 ATOM 182 CZ2 TRP 22 -8.926 3.734 -13.865 1.00 0.00 ATOM 183 CZ3 TRP 22 -9.806 3.736 -11.625 1.00 0.00 ATOM 184 CH2 TRP 22 -9.736 4.293 -12.908 1.00 0.00 ATOM 185 O TRP 22 -9.183 -2.955 -10.786 1.00 0.00 ATOM 186 C TRP 22 -8.632 -2.000 -11.310 1.00 0.00 ATOM 187 N GLY 23 -8.165 -2.012 -12.560 1.00 0.00 ATOM 188 CA GLY 23 -8.255 -3.177 -13.423 1.00 0.00 ATOM 189 O GLY 23 -5.885 -3.624 -13.311 1.00 0.00 ATOM 190 C GLY 23 -7.037 -4.071 -13.227 1.00 0.00 ATOM 191 N GLY 24 -7.291 -5.347 -12.957 1.00 0.00 ATOM 192 CA GLY 24 -6.188 -6.274 -12.735 1.00 0.00 ATOM 193 O GLY 24 -4.762 -7.465 -14.250 1.00 0.00 ATOM 194 C GLY 24 -5.919 -7.152 -13.950 1.00 0.00 ATOM 195 N ARG 25 -6.974 -7.545 -14.653 1.00 0.00 ATOM 196 CA ARG 25 -6.789 -8.355 -15.839 1.00 0.00 ATOM 197 CB ARG 25 -5.595 -7.851 -16.650 1.00 0.00 ATOM 198 CG ARG 25 -5.781 -6.460 -17.235 1.00 0.00 ATOM 199 CD ARG 25 -4.550 -6.016 -18.009 1.00 0.00 ATOM 200 NE ARG 25 -4.707 -4.672 -18.562 1.00 0.00 ATOM 201 CZ ARG 25 -3.748 -4.012 -19.200 1.00 0.00 ATOM 202 NH1 ARG 25 -3.982 -2.794 -19.670 1.00 0.00 ATOM 203 NH2 ARG 25 -2.557 -4.568 -19.369 1.00 0.00 ATOM 204 O ARG 25 -6.649 -10.412 -14.556 1.00 0.00 ATOM 205 C ARG 25 -6.523 -9.841 -15.646 1.00 0.00 ATOM 206 N GLN 26 -6.166 -10.484 -16.747 1.00 0.00 ATOM 207 CA GLN 26 -5.874 -11.913 -16.765 1.00 0.00 ATOM 208 CB GLN 26 -6.010 -12.471 -18.184 1.00 0.00 ATOM 209 CG GLN 26 -5.806 -13.973 -18.280 1.00 0.00 ATOM 210 CD GLN 26 -6.012 -14.501 -19.688 1.00 0.00 ATOM 211 OE1 GLN 26 -6.302 -13.739 -20.609 1.00 0.00 ATOM 212 NE2 GLN 26 -5.870 -15.811 -19.855 1.00 0.00 ATOM 213 O GLN 26 -3.520 -11.494 -16.749 1.00 0.00 ATOM 214 C GLN 26 -4.452 -12.141 -16.277 1.00 0.00 ATOM 215 N LEU 27 -4.264 -13.049 -15.332 1.00 0.00 ATOM 216 CA LEU 27 -2.944 -13.363 -14.820 1.00 0.00 ATOM 217 CB LEU 27 -2.837 -13.054 -13.320 1.00 0.00 ATOM 218 CG LEU 27 -2.855 -11.600 -12.842 1.00 0.00 ATOM 219 CD1 LEU 27 -2.817 -11.556 -11.318 1.00 0.00 ATOM 220 CD2 LEU 27 -1.668 -10.864 -13.390 1.00 0.00 ATOM 221 O LEU 27 -3.786 -15.592 -15.070 1.00 0.00 ATOM 222 C LEU 27 -2.801 -14.874 -14.904 1.00 0.00 ATOM 223 N LYS 28 -1.579 -15.350 -14.809 1.00 0.00 ATOM 224 CA LYS 28 -1.329 -16.793 -14.850 1.00 0.00 ATOM 225 CB LYS 28 -0.708 -17.230 -16.210 1.00 0.00 ATOM 226 CG LYS 28 -1.340 -16.677 -17.489 1.00 0.00 ATOM 227 CD LYS 28 -0.505 -17.039 -18.708 1.00 0.00 ATOM 228 CE LYS 28 -0.697 -16.038 -19.836 1.00 0.00 ATOM 229 NZ LYS 28 -0.195 -14.681 -19.459 1.00 0.00 ATOM 230 O LYS 28 0.355 -16.302 -13.153 1.00 0.00 ATOM 231 C LYS 28 -0.380 -17.173 -13.691 1.00 0.00 ATOM 232 N GLU 29 -0.443 -18.458 -13.345 1.00 0.00 ATOM 233 CA GLU 29 0.451 -19.022 -12.332 1.00 0.00 ATOM 234 CB GLU 29 0.443 -20.551 -12.405 1.00 0.00 ATOM 235 CG GLU 29 -0.869 -21.188 -11.986 1.00 0.00 ATOM 236 CD GLU 29 -0.856 -22.698 -12.120 1.00 0.00 ATOM 237 OE1 GLU 29 0.166 -23.241 -12.590 1.00 0.00 ATOM 238 OE2 GLU 29 -1.864 -23.337 -11.754 1.00 0.00 ATOM 239 O GLU 29 2.641 -18.434 -11.535 1.00 0.00 ATOM 240 C GLU 29 1.891 -18.563 -12.508 1.00 0.00 ATOM 241 N LYS 30 2.296 -18.318 -13.737 1.00 0.00 ATOM 242 CA LYS 30 3.676 -17.896 -13.971 1.00 0.00 ATOM 243 CB LYS 30 4.033 -18.018 -15.454 1.00 0.00 ATOM 244 CG LYS 30 5.469 -17.650 -15.781 1.00 0.00 ATOM 245 CD LYS 30 5.767 -17.846 -17.257 1.00 0.00 ATOM 246 CE LYS 30 7.202 -17.462 -17.585 1.00 0.00 ATOM 247 NZ LYS 30 7.513 -17.659 -19.028 1.00 0.00 ATOM 248 O LYS 30 4.886 -16.133 -12.902 1.00 0.00 ATOM 249 C LYS 30 3.907 -16.455 -13.560 1.00 0.00 ATOM 250 N LEU 31 3.000 -15.589 -13.980 1.00 0.00 ATOM 251 CA LEU 31 3.127 -14.154 -13.622 1.00 0.00 ATOM 252 CB LEU 31 2.298 -13.291 -14.546 1.00 0.00 ATOM 253 CG LEU 31 3.006 -12.810 -15.845 1.00 0.00 ATOM 254 CD1 LEU 31 3.277 -13.974 -16.787 1.00 0.00 ATOM 255 CD2 LEU 31 2.251 -11.655 -16.462 1.00 0.00 ATOM 256 O LEU 31 3.709 -13.382 -11.489 1.00 0.00 ATOM 257 C LEU 31 2.837 -13.950 -12.148 1.00 0.00 ATOM 258 N PRO 32 1.715 -14.349 -11.577 1.00 0.00 ATOM 259 CA PRO 32 1.520 -14.183 -10.136 1.00 0.00 ATOM 260 CB PRO 32 0.130 -14.690 -9.792 1.00 0.00 ATOM 261 CG PRO 32 -0.560 -14.968 -11.132 1.00 0.00 ATOM 262 CD PRO 32 0.513 -14.912 -12.225 1.00 0.00 ATOM 263 O PRO 32 3.033 -14.212 -8.314 1.00 0.00 ATOM 264 C PRO 32 2.625 -14.797 -9.302 1.00 0.00 ATOM 265 N ARG 33 3.120 -15.992 -9.637 1.00 0.00 ATOM 266 CA ARG 33 4.211 -16.604 -8.871 1.00 0.00 ATOM 267 CB ARG 33 4.540 -17.991 -9.425 1.00 0.00 ATOM 268 CG ARG 33 3.470 -19.038 -9.153 1.00 0.00 ATOM 269 CD ARG 33 3.850 -20.383 -9.746 1.00 0.00 ATOM 270 NE ARG 33 2.825 -21.395 -9.509 1.00 0.00 ATOM 271 CZ ARG 33 2.866 -22.631 -10.002 1.00 0.00 ATOM 272 NH1 ARG 33 1.887 -23.484 -9.732 1.00 0.00 ATOM 273 NH2 ARG 33 3.885 -23.010 -10.760 1.00 0.00 ATOM 274 O ARG 33 6.250 -15.649 -8.007 1.00 0.00 ATOM 275 C ARG 33 5.472 -15.737 -8.958 1.00 0.00 ATOM 276 N LEU 34 5.685 -15.118 -10.109 1.00 0.00 ATOM 277 CA LEU 34 6.836 -14.244 -10.273 1.00 0.00 ATOM 278 CB LEU 34 7.012 -13.861 -11.745 1.00 0.00 ATOM 279 CG LEU 34 7.476 -14.978 -12.685 1.00 0.00 ATOM 280 CD1 LEU 34 7.485 -14.497 -14.129 1.00 0.00 ATOM 281 CD2 LEU 34 8.884 -15.429 -12.326 1.00 0.00 ATOM 282 O LEU 34 7.401 -12.535 -8.703 1.00 0.00 ATOM 283 C LEU 34 6.535 -13.019 -9.421 1.00 0.00 ATOM 284 N PHE 35 5.312 -12.504 -9.504 1.00 0.00 ATOM 285 CA PHE 35 4.914 -11.345 -8.707 1.00 0.00 ATOM 286 CB PHE 35 3.246 -11.372 -8.650 1.00 0.00 ATOM 287 CG PHE 35 2.593 -10.006 -8.387 1.00 0.00 ATOM 288 CD1 PHE 35 2.468 -9.094 -9.414 1.00 0.00 ATOM 289 CD2 PHE 35 2.135 -9.686 -7.117 1.00 0.00 ATOM 290 CE1 PHE 35 1.871 -7.848 -9.199 1.00 0.00 ATOM 291 CE2 PHE 35 1.555 -8.453 -6.881 1.00 0.00 ATOM 292 CZ PHE 35 1.449 -7.558 -7.918 1.00 0.00 ATOM 293 O PHE 35 5.495 -10.898 -6.417 1.00 0.00 ATOM 294 C PHE 35 4.989 -11.694 -7.223 1.00 0.00 ATOM 295 N PHE 36 4.481 -12.868 -6.822 1.00 0.00 ATOM 296 CA PHE 36 4.512 -13.264 -5.416 1.00 0.00 ATOM 297 CB PHE 36 3.545 -14.426 -5.183 1.00 0.00 ATOM 298 CG PHE 36 2.106 -14.081 -5.513 1.00 0.00 ATOM 299 CD1 PHE 36 1.572 -14.306 -6.791 1.00 0.00 ATOM 300 CD2 PHE 36 1.288 -13.519 -4.531 1.00 0.00 ATOM 301 CE1 PHE 36 0.218 -13.973 -7.068 1.00 0.00 ATOM 302 CE2 PHE 36 -0.042 -13.185 -4.799 1.00 0.00 ATOM 303 CZ PHE 36 -0.584 -13.414 -6.079 1.00 0.00 ATOM 304 O PHE 36 6.322 -13.245 -3.848 1.00 0.00 ATOM 305 C PHE 36 5.916 -13.616 -4.956 1.00 0.00 ATOM 306 N GLU 37 6.646 -14.346 -5.803 1.00 0.00 ATOM 307 CA GLU 37 8.023 -14.701 -5.500 1.00 0.00 ATOM 308 CB GLU 37 8.702 -15.342 -6.714 1.00 0.00 ATOM 309 CG GLU 37 10.111 -15.790 -6.391 1.00 0.00 ATOM 310 CD GLU 37 10.909 -16.242 -7.602 1.00 0.00 ATOM 311 OE1 GLU 37 10.379 -16.976 -8.459 1.00 0.00 ATOM 312 OE2 GLU 37 12.093 -15.873 -7.667 1.00 0.00 ATOM 313 O GLU 37 9.541 -13.691 -3.917 1.00 0.00 ATOM 314 C GLU 37 8.906 -13.556 -4.969 1.00 0.00 ATOM 315 N HIS 38 8.961 -12.431 -5.667 1.00 0.00 ATOM 316 CA HIS 38 9.794 -11.310 -5.257 1.00 0.00 ATOM 317 CB HIS 38 10.981 -11.146 -6.220 1.00 0.00 ATOM 318 CG HIS 38 12.137 -12.034 -5.872 1.00 0.00 ATOM 319 CD2 HIS 38 12.584 -13.170 -6.468 1.00 0.00 ATOM 320 ND1 HIS 38 12.905 -11.888 -4.731 1.00 0.00 ATOM 321 CE1 HIS 38 13.751 -12.914 -4.658 1.00 0.00 ATOM 322 NE2 HIS 38 13.593 -13.714 -5.690 1.00 0.00 ATOM 323 O HIS 38 9.679 -8.917 -5.051 1.00 0.00 ATOM 324 C HIS 38 9.056 -9.983 -5.043 1.00 0.00 ATOM 325 N PHE 39 7.738 -10.032 -4.857 1.00 0.00 ATOM 326 CA PHE 39 6.982 -8.798 -4.601 1.00 0.00 ATOM 327 CB PHE 39 5.848 -8.463 -4.995 1.00 0.00 ATOM 328 CG PHE 39 6.129 -7.614 -6.234 1.00 0.00 ATOM 329 CD1 PHE 39 7.294 -6.912 -6.446 1.00 0.00 ATOM 330 CD2 PHE 39 5.156 -7.521 -7.227 1.00 0.00 ATOM 331 CE1 PHE 39 7.459 -6.134 -7.570 1.00 0.00 ATOM 332 CE2 PHE 39 5.318 -6.739 -8.351 1.00 0.00 ATOM 333 CZ PHE 39 6.471 -6.023 -8.531 1.00 0.00 ATOM 334 O PHE 39 7.199 -9.237 -2.237 1.00 0.00 ATOM 335 C PHE 39 7.254 -8.393 -3.156 1.00 0.00 ATOM 336 N GLN 40 7.583 -7.131 -2.979 1.00 0.00 ATOM 337 CA GLN 40 7.892 -6.589 -1.631 1.00 0.00 ATOM 338 CB GLN 40 7.985 -4.914 -1.998 1.00 0.00 ATOM 339 CG GLN 40 8.324 -4.507 -3.459 1.00 0.00 ATOM 340 CD GLN 40 9.805 -4.641 -3.746 1.00 0.00 ATOM 341 OE1 GLN 40 10.646 -4.293 -2.902 1.00 0.00 ATOM 342 NE2 GLN 40 10.159 -5.075 -4.952 1.00 0.00 ATOM 343 O GLN 40 6.933 -6.696 0.561 1.00 0.00 ATOM 344 C GLN 40 6.724 -6.595 -0.659 1.00 0.00 ATOM 345 N ASP 41 5.340 -6.878 -0.445 1.00 0.00 ATOM 346 CA ASP 41 3.900 -7.079 -0.700 1.00 0.00 ATOM 347 CB ASP 41 3.887 -6.728 -2.302 1.00 0.00 ATOM 348 CG ASP 41 3.922 -7.994 -3.129 1.00 0.00 ATOM 349 OD1 ASP 41 4.210 -9.100 -2.632 1.00 0.00 ATOM 350 OD2 ASP 41 3.539 -7.823 -4.301 1.00 0.00 ATOM 351 O ASP 41 3.341 -9.033 0.488 1.00 0.00 ATOM 352 C ASP 41 3.205 -7.833 0.370 1.00 0.00 ATOM 353 N THR 42 2.424 -7.098 1.138 1.00 0.00 ATOM 354 CA THR 42 1.730 -7.657 2.273 1.00 0.00 ATOM 355 CB THR 42 1.791 -6.712 3.488 1.00 0.00 ATOM 356 CG2 THR 42 3.234 -6.459 3.896 1.00 0.00 ATOM 357 OG1 THR 42 1.175 -5.465 3.160 1.00 0.00 ATOM 358 O THR 42 -0.362 -7.278 1.269 1.00 0.00 ATOM 359 C THR 42 0.272 -7.932 2.050 1.00 0.00 ATOM 360 N SER 43 -0.244 -8.947 2.727 1.00 0.00 ATOM 361 CA SER 43 -1.667 -9.174 2.714 1.00 0.00 ATOM 362 CB SER 43 -2.039 -10.403 1.908 1.00 0.00 ATOM 363 OG SER 43 -3.239 -11.010 2.359 1.00 0.00 ATOM 364 O SER 43 -1.265 -9.864 4.987 1.00 0.00 ATOM 365 C SER 43 -2.029 -9.275 4.190 1.00 0.00 ATOM 366 N PHE 44 -3.159 -8.663 4.570 1.00 0.00 ATOM 367 CA PHE 44 -3.647 -8.813 5.911 1.00 0.00 ATOM 368 CB PHE 44 -4.241 -7.495 6.413 1.00 0.00 ATOM 369 CG PHE 44 -4.781 -7.568 7.814 1.00 0.00 ATOM 370 CD1 PHE 44 -3.929 -7.535 8.904 1.00 0.00 ATOM 371 CD2 PHE 44 -6.142 -7.672 8.041 1.00 0.00 ATOM 372 CE1 PHE 44 -4.424 -7.603 10.193 1.00 0.00 ATOM 373 CE2 PHE 44 -6.640 -7.740 9.328 1.00 0.00 ATOM 374 CZ PHE 44 -5.788 -7.706 10.400 1.00 0.00 ATOM 375 O PHE 44 -5.529 -9.804 4.783 1.00 0.00 ATOM 376 C PHE 44 -4.689 -9.913 5.702 1.00 0.00 ATOM 377 N ILE 45 -4.613 -10.983 6.512 1.00 0.00 ATOM 378 CA ILE 45 -5.521 -12.108 6.384 1.00 0.00 ATOM 379 CB ILE 45 -4.758 -13.431 6.188 1.00 0.00 ATOM 380 CG1 ILE 45 -3.926 -13.380 4.906 1.00 0.00 ATOM 381 CG2 ILE 45 -5.729 -14.595 6.085 1.00 0.00 ATOM 382 CD1 ILE 45 -2.958 -14.533 4.758 1.00 0.00 ATOM 383 O ILE 45 -6.007 -12.292 8.715 1.00 0.00 ATOM 384 C ILE 45 -6.435 -12.361 7.554 1.00 0.00 ATOM 385 N THR 46 -7.689 -12.669 7.248 1.00 0.00 ATOM 386 CA THR 46 -8.633 -13.030 8.302 1.00 0.00 ATOM 387 CB THR 46 -10.090 -12.933 7.810 1.00 0.00 ATOM 388 CG2 THR 46 -11.055 -13.305 8.928 1.00 0.00 ATOM 389 OG1 THR 46 -10.369 -11.592 7.388 1.00 0.00 ATOM 390 O THR 46 -8.425 -15.402 7.867 1.00 0.00 ATOM 391 C THR 46 -8.273 -14.484 8.673 1.00 0.00 ATOM 392 N SER 47 -7.771 -14.669 9.886 1.00 0.00 ATOM 393 CA SER 47 -7.368 -15.967 10.361 1.00 0.00 ATOM 394 CB SER 47 -6.673 -15.883 11.742 1.00 0.00 ATOM 395 OG SER 47 -7.537 -15.340 12.714 1.00 0.00 ATOM 396 O SER 47 -8.323 -18.176 10.179 1.00 0.00 ATOM 397 C SER 47 -8.528 -16.981 10.350 1.00 0.00 ATOM 398 N GLU 48 -9.736 -16.481 10.529 1.00 0.00 ATOM 399 CA GLU 48 -10.951 -17.294 10.584 1.00 0.00 ATOM 400 CB GLU 48 -12.193 -16.404 10.617 1.00 0.00 ATOM 401 CG GLU 48 -12.374 -15.637 11.919 1.00 0.00 ATOM 402 CD GLU 48 -13.586 -14.727 11.899 1.00 0.00 ATOM 403 OE1 GLU 48 -14.256 -14.655 10.844 1.00 0.00 ATOM 404 OE2 GLU 48 -13.865 -14.085 12.930 1.00 0.00 ATOM 405 O GLU 48 -11.663 -19.362 9.617 1.00 0.00 ATOM 406 C GLU 48 -11.185 -18.257 9.432 1.00 0.00 ATOM 407 N HIS 49 -10.873 -17.797 8.229 1.00 0.00 ATOM 408 CA HIS 49 -11.105 -18.562 7.025 1.00 0.00 ATOM 409 CB HIS 49 -12.393 -18.104 6.341 1.00 0.00 ATOM 410 CG HIS 49 -13.612 -18.233 7.196 1.00 0.00 ATOM 411 CD2 HIS 49 -14.520 -19.314 7.557 1.00 0.00 ATOM 412 ND1 HIS 49 -14.152 -17.170 7.890 1.00 0.00 ATOM 413 CE1 HIS 49 -15.237 -17.592 8.567 1.00 0.00 ATOM 414 NE2 HIS 49 -15.462 -18.878 8.369 1.00 0.00 ATOM 415 O HIS 49 -10.064 -18.652 4.895 1.00 0.00 ATOM 416 C HIS 49 -9.942 -18.364 6.075 1.00 0.00 ATOM 417 N ASN 50 -8.822 -17.885 6.598 1.00 0.00 ATOM 418 CA ASN 50 -7.671 -17.593 5.756 1.00 0.00 ATOM 419 CB ASN 50 -6.985 -18.890 5.311 1.00 0.00 ATOM 420 CG ASN 50 -6.375 -19.650 6.472 1.00 0.00 ATOM 421 ND2 ASN 50 -6.909 -20.835 6.749 1.00 0.00 ATOM 422 OD1 ASN 50 -5.434 -19.178 7.108 1.00 0.00 ATOM 423 O ASN 50 -7.659 -17.184 3.360 1.00 0.00 ATOM 424 C ASN 50 -8.059 -16.809 4.470 1.00 0.00 ATOM 425 N SER 51 -8.833 -15.726 4.627 1.00 0.00 ATOM 426 CA SER 51 -9.245 -14.913 3.490 1.00 0.00 ATOM 427 CB SER 51 -10.754 -14.671 3.522 1.00 0.00 ATOM 428 OG SER 51 -11.469 -15.883 3.364 1.00 0.00 ATOM 429 O SER 51 -8.381 -13.014 4.624 1.00 0.00 ATOM 430 C SER 51 -8.526 -13.593 3.553 1.00 0.00 ATOM 431 N MET 52 -8.050 -13.147 2.398 1.00 0.00 ATOM 432 CA MET 52 -7.296 -11.903 2.273 1.00 0.00 ATOM 433 CB MET 52 -6.677 -11.788 0.879 1.00 0.00 ATOM 434 CG MET 52 -5.787 -10.569 0.692 1.00 0.00 ATOM 435 SD MET 52 -5.068 -10.480 -0.958 1.00 0.00 ATOM 436 CE MET 52 -3.919 -11.854 -0.902 1.00 0.00 ATOM 437 O MET 52 -9.194 -10.570 1.792 1.00 0.00 ATOM 438 C MET 52 -8.225 -10.734 2.497 1.00 0.00 ATOM 439 N THR 53 -7.939 -9.953 3.534 1.00 0.00 ATOM 440 CA THR 53 -8.797 -8.824 3.854 1.00 0.00 ATOM 441 CB THR 53 -8.594 -8.668 5.575 1.00 0.00 ATOM 442 CG2 THR 53 -9.702 -8.074 6.437 1.00 0.00 ATOM 443 OG1 THR 53 -8.150 -9.889 6.181 1.00 0.00 ATOM 444 O THR 53 -9.016 -6.579 3.109 1.00 0.00 ATOM 445 C THR 53 -8.257 -7.517 3.259 1.00 0.00 ATOM 446 N GLY 54 -6.972 -7.499 2.878 1.00 0.00 ATOM 447 CA GLY 54 -6.329 -6.301 2.356 1.00 0.00 ATOM 448 O GLY 54 -4.275 -7.492 2.338 1.00 0.00 ATOM 449 C GLY 54 -4.906 -6.557 1.900 1.00 0.00 ATOM 450 N PHE 55 -4.412 -5.729 0.989 1.00 0.00 ATOM 451 CA PHE 55 -3.053 -5.862 0.503 1.00 0.00 ATOM 452 CB PHE 55 -3.113 -6.485 -0.898 1.00 0.00 ATOM 453 CG PHE 55 -1.744 -6.482 -1.578 1.00 0.00 ATOM 454 CD1 PHE 55 -0.747 -7.364 -1.167 1.00 0.00 ATOM 455 CD2 PHE 55 -1.480 -5.609 -2.628 1.00 0.00 ATOM 456 CE1 PHE 55 0.500 -7.363 -1.791 1.00 0.00 ATOM 457 CE2 PHE 55 -0.238 -5.592 -3.261 1.00 0.00 ATOM 458 CZ PHE 55 0.748 -6.476 -2.837 1.00 0.00 ATOM 459 O PHE 55 -3.255 -3.492 0.132 1.00 0.00 ATOM 460 C PHE 55 -2.509 -4.459 0.322 1.00 0.00 ATOM 461 N LEU 56 -1.199 -4.362 0.407 1.00 0.00 ATOM 462 CA LEU 56 -0.490 -3.112 0.255 1.00 0.00 ATOM 463 CB LEU 56 -0.131 -2.538 1.612 1.00 0.00 ATOM 464 CG LEU 56 -1.204 -1.752 2.344 1.00 0.00 ATOM 465 CD1 LEU 56 -0.695 -1.486 3.745 1.00 0.00 ATOM 466 CD2 LEU 56 -1.510 -0.448 1.605 1.00 0.00 ATOM 467 O LEU 56 1.372 -4.582 0.425 1.00 0.00 ATOM 468 C LEU 56 0.966 -3.505 0.021 1.00 0.00 ATOM 469 N ILE 57 1.748 -2.650 -0.634 1.00 0.00 ATOM 470 CA ILE 57 3.169 -2.932 -0.910 1.00 0.00 ATOM 471 CB ILE 57 3.372 -3.220 -2.415 1.00 0.00 ATOM 472 CG1 ILE 57 4.860 -3.608 -2.665 1.00 0.00 ATOM 473 CG2 ILE 57 2.899 -2.004 -3.273 1.00 0.00 ATOM 474 CD1 ILE 57 5.086 -4.084 -4.139 1.00 0.00 ATOM 475 O ILE 57 3.538 -0.575 -0.511 1.00 0.00 ATOM 476 C ILE 57 4.025 -1.713 -0.551 1.00 0.00 ATOM 477 N GLY 58 5.287 -1.942 -0.235 1.00 0.00 ATOM 478 CA GLY 58 6.171 -0.815 -0.026 1.00 0.00 ATOM 479 O GLY 58 8.017 -2.264 -0.491 1.00 0.00 ATOM 480 C GLY 58 7.446 -1.215 -0.734 1.00 0.00 ATOM 481 N PHE 59 7.825 -0.389 -1.689 1.00 0.00 ATOM 482 CA PHE 59 8.977 -0.595 -2.495 1.00 0.00 ATOM 483 CB PHE 59 8.698 -0.191 -3.944 1.00 0.00 ATOM 484 CG PHE 59 9.872 -0.375 -4.863 1.00 0.00 ATOM 485 CD1 PHE 59 10.210 -1.628 -5.336 1.00 0.00 ATOM 486 CD2 PHE 59 10.639 0.710 -5.254 1.00 0.00 ATOM 487 CE1 PHE 59 11.290 -1.799 -6.181 1.00 0.00 ATOM 488 CE2 PHE 59 11.717 0.542 -6.097 1.00 0.00 ATOM 489 CZ PHE 59 12.047 -0.705 -6.562 1.00 0.00 ATOM 490 O PHE 59 9.966 1.423 -1.678 1.00 0.00 ATOM 491 C PHE 59 10.128 0.236 -1.974 1.00 0.00 ATOM 492 N GLN 60 11.294 -0.383 -1.867 1.00 0.00 ATOM 493 CA GLN 60 12.472 0.300 -1.353 1.00 0.00 ATOM 494 CB GLN 60 12.934 -0.346 -0.044 1.00 0.00 ATOM 495 CG GLN 60 14.159 0.310 0.571 1.00 0.00 ATOM 496 CD GLN 60 14.550 -0.315 1.897 1.00 0.00 ATOM 497 OE1 GLN 60 13.911 -1.258 2.363 1.00 0.00 ATOM 498 NE2 GLN 60 15.603 0.214 2.510 1.00 0.00 ATOM 499 O GLN 60 14.018 -0.870 -2.753 1.00 0.00 ATOM 500 C GLN 60 13.609 0.226 -2.355 1.00 0.00 ATOM 501 N SER 61 14.110 1.384 -2.767 1.00 0.00 ATOM 502 CA SER 61 15.202 1.489 -3.721 1.00 0.00 ATOM 503 CB SER 61 14.805 2.520 -4.784 1.00 0.00 ATOM 504 OG SER 61 15.813 2.711 -5.758 1.00 0.00 ATOM 505 O SER 61 16.451 2.867 -2.219 1.00 0.00 ATOM 506 C SER 61 16.484 1.905 -3.008 1.00 0.00 ATOM 507 N GLN 62 17.597 1.198 -3.245 1.00 0.00 ATOM 508 CA GLN 62 18.861 1.489 -2.571 1.00 0.00 ATOM 509 CB GLN 62 19.497 -0.151 -2.965 1.00 0.00 ATOM 510 CG GLN 62 18.441 -1.256 -3.162 1.00 0.00 ATOM 511 CD GLN 62 19.102 -2.582 -3.521 1.00 0.00 ATOM 512 OE1 GLN 62 19.606 -2.752 -4.630 1.00 0.00 ATOM 513 NE2 GLN 62 19.211 -3.475 -2.531 1.00 0.00 ATOM 514 O GLN 62 20.399 3.333 -2.468 1.00 0.00 ATOM 515 C GLN 62 19.505 2.773 -3.101 1.00 0.00 ATOM 516 N SER 63 19.069 3.250 -4.261 1.00 0.00 ATOM 517 CA SER 63 19.615 4.452 -4.877 1.00 0.00 ATOM 518 CB SER 63 18.831 4.724 -6.172 1.00 0.00 ATOM 519 OG SER 63 19.252 5.942 -6.773 1.00 0.00 ATOM 520 O SER 63 20.738 6.339 -3.750 1.00 0.00 ATOM 521 C SER 63 19.672 5.745 -4.024 1.00 0.00 ATOM 522 N ASP 64 18.510 6.112 -3.516 1.00 0.00 ATOM 523 CA ASP 64 18.381 7.349 -2.754 1.00 0.00 ATOM 524 CB ASP 64 17.477 8.370 -3.556 1.00 0.00 ATOM 525 CG ASP 64 15.995 7.992 -3.555 1.00 0.00 ATOM 526 OD1 ASP 64 15.507 7.259 -2.677 1.00 0.00 ATOM 527 OD2 ASP 64 15.291 8.487 -4.447 1.00 0.00 ATOM 528 O ASP 64 17.690 6.097 -0.811 1.00 0.00 ATOM 529 C ASP 64 18.252 7.115 -1.235 1.00 0.00 ATOM 530 N PRO 65 18.797 7.996 -0.422 1.00 0.00 ATOM 531 CA PRO 65 18.701 7.825 1.060 1.00 0.00 ATOM 532 CB PRO 65 19.668 8.834 1.546 1.00 0.00 ATOM 533 CG PRO 65 20.312 9.530 0.357 1.00 0.00 ATOM 534 CD PRO 65 19.404 9.246 -0.820 1.00 0.00 ATOM 535 O PRO 65 16.537 8.789 0.992 1.00 0.00 ATOM 536 C PRO 65 17.320 8.030 1.569 1.00 0.00 ATOM 537 N GLU 66 17.846 5.560 1.784 1.00 0.00 ATOM 538 CA GLU 66 16.774 4.695 1.352 1.00 0.00 ATOM 539 CB GLU 66 16.510 3.569 1.924 1.00 0.00 ATOM 540 CG GLU 66 17.362 3.300 3.170 1.00 0.00 ATOM 541 CD GLU 66 18.536 2.338 2.975 1.00 0.00 ATOM 542 OE1 GLU 66 19.325 2.628 1.935 1.00 0.00 ATOM 543 OE2 GLU 66 18.729 1.386 3.743 1.00 0.00 ATOM 544 O GLU 66 15.170 6.197 2.375 1.00 0.00 ATOM 545 C GLU 66 15.454 5.473 1.411 1.00 0.00 ATOM 546 N THR 67 14.646 5.327 0.368 1.00 0.00 ATOM 547 CA THR 67 13.353 5.960 0.384 1.00 0.00 ATOM 548 CB THR 67 13.250 7.061 -0.688 1.00 0.00 ATOM 549 CG2 THR 67 11.880 7.719 -0.646 1.00 0.00 ATOM 550 OG1 THR 67 14.251 8.060 -0.450 1.00 0.00 ATOM 551 O THR 67 12.441 4.114 -0.866 1.00 0.00 ATOM 552 C THR 67 12.321 4.872 0.108 1.00 0.00 ATOM 553 N ALA 68 11.322 4.799 0.956 1.00 0.00 ATOM 554 CA ALA 68 10.261 3.825 0.754 1.00 0.00 ATOM 555 CB ALA 68 9.615 3.430 2.099 1.00 0.00 ATOM 556 O ALA 68 8.783 5.609 -0.016 1.00 0.00 ATOM 557 C ALA 68 9.084 4.409 -0.070 1.00 0.00 ATOM 558 N TYR 69 8.425 3.565 -0.849 1.00 0.00 ATOM 559 CA TYR 69 7.327 4.017 -1.668 1.00 0.00 ATOM 560 CB TYR 69 7.653 3.886 -3.160 1.00 0.00 ATOM 561 CG TYR 69 8.788 4.772 -3.645 1.00 0.00 ATOM 562 CD1 TYR 69 10.111 4.333 -3.604 1.00 0.00 ATOM 563 CD2 TYR 69 8.534 6.042 -4.169 1.00 0.00 ATOM 564 CE1 TYR 69 11.153 5.134 -4.083 1.00 0.00 ATOM 565 CE2 TYR 69 9.572 6.852 -4.647 1.00 0.00 ATOM 566 CZ TYR 69 10.876 6.388 -4.599 1.00 0.00 ATOM 567 OH TYR 69 11.901 7.176 -5.069 1.00 0.00 ATOM 568 O TYR 69 6.130 1.932 -1.824 1.00 0.00 ATOM 569 C TYR 69 6.136 3.088 -1.417 1.00 0.00 ATOM 570 N ILE 70 5.121 3.588 -0.744 1.00 0.00 ATOM 571 CA ILE 70 3.944 2.757 -0.515 1.00 0.00 ATOM 572 CB ILE 70 3.249 3.105 0.843 1.00 0.00 ATOM 573 CG1 ILE 70 2.268 1.996 1.249 1.00 0.00 ATOM 574 CG2 ILE 70 2.514 4.453 0.725 1.00 0.00 ATOM 575 CD1 ILE 70 1.732 2.152 2.657 1.00 0.00 ATOM 576 O ILE 70 2.712 3.793 -2.253 1.00 0.00 ATOM 577 C ILE 70 3.066 2.750 -1.765 1.00 0.00 ATOM 578 N HIS 71 2.753 1.569 -2.284 1.00 0.00 ATOM 579 CA HIS 71 1.972 1.418 -3.510 1.00 0.00 ATOM 580 CB HIS 71 2.853 0.904 -4.650 1.00 0.00 ATOM 581 CG HIS 71 3.963 1.837 -5.022 1.00 0.00 ATOM 582 CD2 HIS 71 5.156 1.751 -5.853 1.00 0.00 ATOM 583 ND1 HIS 71 4.033 3.132 -4.558 1.00 0.00 ATOM 584 CE1 HIS 71 5.135 3.717 -5.062 1.00 0.00 ATOM 585 NE2 HIS 71 5.813 2.894 -5.837 1.00 0.00 ATOM 586 O HIS 71 0.833 -0.398 -2.432 1.00 0.00 ATOM 587 C HIS 71 0.817 0.432 -3.349 1.00 0.00 ATOM 588 N PHE 72 -0.153 0.513 -4.271 1.00 0.00 ATOM 589 CA PHE 72 -1.285 -0.409 -4.347 1.00 0.00 ATOM 590 CB PHE 72 -0.848 -1.749 -4.943 1.00 0.00 ATOM 591 CG PHE 72 -0.336 -1.648 -6.351 1.00 0.00 ATOM 592 CD1 PHE 72 1.023 -1.589 -6.604 1.00 0.00 ATOM 593 CD2 PHE 72 -1.214 -1.613 -7.421 1.00 0.00 ATOM 594 CE1 PHE 72 1.495 -1.494 -7.901 1.00 0.00 ATOM 595 CE2 PHE 72 -0.742 -1.519 -8.716 1.00 0.00 ATOM 596 CZ PHE 72 0.605 -1.460 -8.959 1.00 0.00 ATOM 597 O PHE 72 -2.133 -2.007 -2.743 1.00 0.00 ATOM 598 C PHE 72 -2.031 -0.821 -3.086 1.00 0.00 ATOM 599 N SER 73 -2.567 0.175 -2.399 1.00 0.00 ATOM 600 CA SER 73 -3.285 -0.088 -1.184 1.00 0.00 ATOM 601 CB SER 73 -3.503 1.152 -0.507 1.00 0.00 ATOM 602 OG SER 73 -2.375 1.221 0.347 1.00 0.00 ATOM 603 O SER 73 -5.375 0.257 -2.097 1.00 0.00 ATOM 604 C SER 73 -4.688 -0.475 -1.459 1.00 0.00 ATOM 605 N GLY 74 -5.141 -1.616 -0.965 1.00 0.00 ATOM 606 CA GLY 74 -6.524 -1.986 -1.226 1.00 0.00 ATOM 607 O GLY 74 -6.492 -3.820 0.355 1.00 0.00 ATOM 608 C GLY 74 -7.078 -2.801 -0.070 1.00 0.00 ATOM 609 N VAL 75 -8.188 -2.320 0.462 1.00 0.00 ATOM 610 CA VAL 75 -8.879 -3.011 1.511 1.00 0.00 ATOM 611 CB VAL 75 -9.428 -2.033 2.564 1.00 0.00 ATOM 612 CG1 VAL 75 -10.209 -2.784 3.633 1.00 0.00 ATOM 613 CG2 VAL 75 -8.291 -1.282 3.239 1.00 0.00 ATOM 614 O VAL 75 -10.746 -3.188 -0.011 1.00 0.00 ATOM 615 C VAL 75 -10.022 -3.753 0.801 1.00 0.00 ATOM 616 N HIS 76 -10.162 -5.040 1.081 1.00 0.00 ATOM 617 CA HIS 76 -11.188 -5.832 0.419 1.00 0.00 ATOM 618 CB HIS 76 -11.095 -7.296 0.855 1.00 0.00 ATOM 619 CG HIS 76 -12.023 -8.208 0.113 1.00 0.00 ATOM 620 CD2 HIS 76 -13.333 -8.787 0.369 1.00 0.00 ATOM 621 ND1 HIS 76 -11.725 -8.718 -1.132 1.00 0.00 ATOM 622 CE1 HIS 76 -12.744 -9.500 -1.540 1.00 0.00 ATOM 623 NE2 HIS 76 -13.713 -9.545 -0.646 1.00 0.00 ATOM 624 O HIS 76 -12.759 -4.777 1.879 1.00 0.00 ATOM 625 C HIS 76 -12.558 -5.302 0.781 1.00 0.00 ATOM 626 N PRO 77 -13.491 -5.419 -0.147 1.00 0.00 ATOM 627 CA PRO 77 -14.837 -4.885 0.051 1.00 0.00 ATOM 628 CB PRO 77 -15.592 -5.301 -1.212 1.00 0.00 ATOM 629 CG PRO 77 -14.535 -5.416 -2.257 1.00 0.00 ATOM 630 CD PRO 77 -13.329 -5.991 -1.566 1.00 0.00 ATOM 631 O PRO 77 -16.334 -4.589 1.901 1.00 0.00 ATOM 632 C PRO 77 -15.618 -5.374 1.267 1.00 0.00 ATOM 633 N ASP 78 -15.499 -6.649 1.605 1.00 0.00 ATOM 634 CA ASP 78 -16.242 -7.145 2.772 1.00 0.00 ATOM 635 CB ASP 78 -16.404 -8.665 2.697 1.00 0.00 ATOM 636 CG ASP 78 -17.349 -9.097 1.593 1.00 0.00 ATOM 637 OD1 ASP 78 -18.030 -10.128 1.764 1.00 0.00 ATOM 638 OD2 ASP 78 -17.404 -8.404 0.554 1.00 0.00 ATOM 639 O ASP 78 -15.989 -7.168 5.169 1.00 0.00 ATOM 640 C ASP 78 -15.519 -6.813 4.078 1.00 0.00 ATOM 641 N PHE 79 -14.381 -6.136 3.970 1.00 0.00 ATOM 642 CA PHE 79 -13.601 -5.852 5.146 1.00 0.00 ATOM 643 CB PHE 79 -12.195 -6.441 5.013 1.00 0.00 ATOM 644 CG PHE 79 -12.178 -7.936 4.862 1.00 0.00 ATOM 645 CD1 PHE 79 -12.065 -8.519 3.612 1.00 0.00 ATOM 646 CD2 PHE 79 -12.271 -8.757 5.972 1.00 0.00 ATOM 647 CE1 PHE 79 -12.046 -9.893 3.475 1.00 0.00 ATOM 648 CE2 PHE 79 -12.252 -10.133 5.834 1.00 0.00 ATOM 649 CZ PHE 79 -12.141 -10.702 4.590 1.00 0.00 ATOM 650 O PHE 79 -12.714 -3.993 6.290 1.00 0.00 ATOM 651 C PHE 79 -13.444 -4.398 5.406 1.00 0.00 ATOM 652 N ARG 80 -14.139 -3.592 4.629 1.00 0.00 ATOM 653 CA ARG 80 -14.025 -2.158 4.797 1.00 0.00 ATOM 654 CB ARG 80 -15.042 -1.459 3.932 1.00 0.00 ATOM 655 CG ARG 80 -15.061 0.031 4.156 1.00 0.00 ATOM 656 CD ARG 80 -15.948 0.699 3.132 1.00 0.00 ATOM 657 NE ARG 80 -15.447 0.499 1.774 1.00 0.00 ATOM 658 CZ ARG 80 -14.566 1.299 1.183 1.00 0.00 ATOM 659 NH1 ARG 80 -14.088 2.356 1.824 1.00 0.00 ATOM 660 NH2 ARG 80 -14.161 1.037 -0.050 1.00 0.00 ATOM 661 O ARG 80 -15.364 -2.458 6.730 1.00 0.00 ATOM 662 C ARG 80 -14.573 -1.743 6.116 1.00 0.00 ATOM 663 N LYS 81 -14.133 -0.571 6.536 1.00 0.00 ATOM 664 CA LYS 81 -14.547 0.008 7.790 1.00 0.00 ATOM 665 CB LYS 81 -16.073 0.101 7.861 1.00 0.00 ATOM 666 CG LYS 81 -16.691 0.965 6.777 1.00 0.00 ATOM 667 CD LYS 81 -18.205 1.023 6.914 1.00 0.00 ATOM 668 CE LYS 81 -18.826 1.887 5.829 1.00 0.00 ATOM 669 NZ LYS 81 -20.311 1.943 5.944 1.00 0.00 ATOM 670 O LYS 81 -14.708 -0.404 10.081 1.00 0.00 ATOM 671 C LYS 81 -14.146 -0.713 9.060 1.00 0.00 ATOM 672 N MET 82 -13.219 -1.663 9.034 1.00 0.00 ATOM 673 CA MET 82 -12.830 -2.345 10.248 1.00 0.00 ATOM 674 CB MET 82 -12.667 -3.877 9.909 1.00 0.00 ATOM 675 CG MET 82 -13.956 -4.559 9.458 1.00 0.00 ATOM 676 SD MET 82 -13.748 -6.070 8.500 1.00 0.00 ATOM 677 CE MET 82 -13.567 -7.182 9.747 1.00 0.00 ATOM 678 O MET 82 -10.902 -0.964 10.544 1.00 0.00 ATOM 679 C MET 82 -11.734 -1.702 11.067 1.00 0.00 ATOM 680 N GLN 83 -10.448 -0.294 10.693 1.00 0.00 ATOM 681 CA GLN 83 -9.039 -0.041 10.913 1.00 0.00 ATOM 682 CB GLN 83 -9.045 0.120 12.686 1.00 0.00 ATOM 683 CG GLN 83 -8.544 -1.225 13.202 1.00 0.00 ATOM 684 CD GLN 83 -9.724 -2.192 13.427 1.00 0.00 ATOM 685 OE1 GLN 83 -10.697 -2.127 12.661 1.00 0.00 ATOM 686 NE2 GLN 83 -9.665 -3.058 14.442 1.00 0.00 ATOM 687 O GLN 83 -6.923 -0.862 10.302 1.00 0.00 ATOM 688 C GLN 83 -8.115 -0.921 10.111 1.00 0.00 ATOM 689 N ILE 84 -8.654 -1.751 9.221 1.00 0.00 ATOM 690 CA ILE 84 -7.813 -2.646 8.451 1.00 0.00 ATOM 691 CB ILE 84 -8.663 -3.517 7.508 1.00 0.00 ATOM 692 CG1 ILE 84 -9.561 -4.467 8.275 1.00 0.00 ATOM 693 CG2 ILE 84 -7.778 -4.259 6.518 1.00 0.00 ATOM 694 CD1 ILE 84 -10.629 -5.183 7.506 1.00 0.00 ATOM 695 O ILE 84 -5.614 -2.200 7.572 1.00 0.00 ATOM 696 C ILE 84 -6.774 -1.859 7.679 1.00 0.00 ATOM 697 N GLY 85 -7.234 -0.755 7.083 1.00 0.00 ATOM 698 CA GLY 85 -6.281 0.053 6.262 1.00 0.00 ATOM 699 O GLY 85 -4.027 0.676 6.853 1.00 0.00 ATOM 700 C GLY 85 -5.236 0.692 7.135 1.00 0.00 ATOM 701 N LYS 86 -5.606 1.291 8.269 1.00 0.00 ATOM 702 CA LYS 86 -4.603 1.904 9.145 1.00 0.00 ATOM 703 CB LYS 86 -5.224 2.353 10.454 1.00 0.00 ATOM 704 CG LYS 86 -5.184 3.849 10.713 1.00 0.00 ATOM 705 CD LYS 86 -4.690 4.170 12.139 1.00 0.00 ATOM 706 CE LYS 86 -5.347 3.301 13.228 1.00 0.00 ATOM 707 NZ LYS 86 -6.347 4.018 14.053 1.00 0.00 ATOM 708 O LYS 86 -2.347 1.232 9.743 1.00 0.00 ATOM 709 C LYS 86 -3.558 0.945 9.633 1.00 0.00 ATOM 710 N GLN 87 -4.013 -0.279 9.981 1.00 0.00 ATOM 711 CA GLN 87 -3.084 -1.282 10.499 1.00 0.00 ATOM 712 CB GLN 87 -3.590 -2.694 10.041 1.00 0.00 ATOM 713 CG GLN 87 -3.106 -3.940 10.672 1.00 0.00 ATOM 714 CD GLN 87 -3.989 -5.090 10.193 1.00 0.00 ATOM 715 OE1 GLN 87 -4.269 -5.226 8.971 1.00 0.00 ATOM 716 NE2 GLN 87 -4.468 -5.879 11.120 1.00 0.00 ATOM 717 O GLN 87 -0.935 -1.898 9.660 1.00 0.00 ATOM 718 C GLN 87 -2.117 -1.722 9.399 1.00 0.00 ATOM 719 N LEU 88 -2.591 -1.913 8.177 1.00 0.00 ATOM 720 CA LEU 88 -1.689 -2.314 7.085 1.00 0.00 ATOM 721 CB LEU 88 -2.404 -2.533 5.790 1.00 0.00 ATOM 722 CG LEU 88 -3.490 -3.612 5.893 1.00 0.00 ATOM 723 CD1 LEU 88 -4.169 -3.773 4.549 1.00 0.00 ATOM 724 CD2 LEU 88 -2.915 -4.935 6.387 1.00 0.00 ATOM 725 O LEU 88 0.607 -1.584 6.761 1.00 0.00 ATOM 726 C LEU 88 -0.597 -1.262 6.834 1.00 0.00 ATOM 727 N TYR 89 -1.018 -0.012 6.726 1.00 0.00 ATOM 728 CA TYR 89 -0.089 1.080 6.510 1.00 0.00 ATOM 729 CB TYR 89 -0.718 2.433 6.489 1.00 0.00 ATOM 730 CG TYR 89 -1.587 2.685 5.277 1.00 0.00 ATOM 731 CD1 TYR 89 -1.197 2.262 4.004 1.00 0.00 ATOM 732 CD2 TYR 89 -2.810 3.346 5.407 1.00 0.00 ATOM 733 CE1 TYR 89 -2.008 2.498 2.890 1.00 0.00 ATOM 734 CE2 TYR 89 -3.619 3.585 4.310 1.00 0.00 ATOM 735 CZ TYR 89 -3.220 3.162 3.057 1.00 0.00 ATOM 736 OH TYR 89 -4.040 3.409 1.977 1.00 0.00 ATOM 737 O TYR 89 2.100 1.145 7.487 1.00 0.00 ATOM 738 C TYR 89 0.887 1.110 7.685 1.00 0.00 ATOM 739 N ASP 90 0.388 2.207 10.003 1.00 0.00 ATOM 740 CA ASP 90 1.252 1.657 11.043 1.00 0.00 ATOM 741 CB ASP 90 0.417 0.977 12.132 1.00 0.00 ATOM 742 CG ASP 90 -0.343 1.969 12.987 1.00 0.00 ATOM 743 OD1 ASP 90 -0.940 1.548 13.998 1.00 0.00 ATOM 744 OD2 ASP 90 -0.341 3.172 12.647 1.00 0.00 ATOM 745 O ASP 90 3.366 0.635 10.877 1.00 0.00 ATOM 746 C ASP 90 2.197 0.649 10.506 1.00 0.00 ATOM 747 N VAL 91 1.710 -0.223 9.629 1.00 0.00 ATOM 748 CA VAL 91 2.569 -1.223 9.001 1.00 0.00 ATOM 749 CB VAL 91 1.805 -2.251 8.144 1.00 0.00 ATOM 750 CG1 VAL 91 2.775 -3.158 7.374 1.00 0.00 ATOM 751 CG2 VAL 91 0.884 -3.120 9.072 1.00 0.00 ATOM 752 O VAL 91 4.833 -0.922 8.251 1.00 0.00 ATOM 753 C VAL 91 3.666 -0.531 8.195 1.00 0.00 ATOM 754 N PHE 92 3.287 0.507 7.458 1.00 0.00 ATOM 755 CA PHE 92 4.233 1.267 6.650 1.00 0.00 ATOM 756 CB PHE 92 3.736 2.463 5.979 1.00 0.00 ATOM 757 CG PHE 92 4.729 3.035 5.017 1.00 0.00 ATOM 758 CD1 PHE 92 5.022 2.374 3.832 1.00 0.00 ATOM 759 CD2 PHE 92 5.434 4.185 5.324 1.00 0.00 ATOM 760 CE1 PHE 92 6.008 2.842 2.974 1.00 0.00 ATOM 761 CE2 PHE 92 6.424 4.658 4.468 1.00 0.00 ATOM 762 CZ PHE 92 6.710 3.981 3.288 1.00 0.00 ATOM 763 O PHE 92 6.536 1.691 7.235 1.00 0.00 ATOM 764 C PHE 92 5.355 1.863 7.521 1.00 0.00 ATOM 765 N ILE 93 4.965 2.555 8.585 1.00 0.00 ATOM 766 CA ILE 93 5.917 3.191 9.491 1.00 0.00 ATOM 767 CB ILE 93 5.158 3.997 10.586 1.00 0.00 ATOM 768 CG1 ILE 93 4.439 5.181 9.934 1.00 0.00 ATOM 769 CG2 ILE 93 6.120 4.497 11.666 1.00 0.00 ATOM 770 CD1 ILE 93 3.621 6.027 10.902 1.00 0.00 ATOM 771 O ILE 93 8.068 2.379 10.186 1.00 0.00 ATOM 772 C ILE 93 6.856 2.174 10.138 1.00 0.00 ATOM 773 N GLU 94 6.295 1.072 10.619 1.00 0.00 ATOM 774 CA GLU 94 7.086 0.032 11.261 1.00 0.00 ATOM 775 CB GLU 94 6.157 -1.028 11.862 1.00 0.00 ATOM 776 CG GLU 94 6.656 -1.641 13.162 1.00 0.00 ATOM 777 CD GLU 94 6.795 -0.618 14.274 1.00 0.00 ATOM 778 OE1 GLU 94 7.946 -0.299 14.647 1.00 0.00 ATOM 779 OE2 GLU 94 5.757 -0.130 14.778 1.00 0.00 ATOM 780 O GLU 94 9.200 -0.928 10.628 1.00 0.00 ATOM 781 C GLU 94 8.055 -0.631 10.282 1.00 0.00 ATOM 782 N THR 95 7.599 -0.862 9.054 1.00 0.00 ATOM 783 CA THR 95 8.433 -1.507 8.051 1.00 0.00 ATOM 784 CB THR 95 7.597 -1.910 6.814 1.00 0.00 ATOM 785 CG2 THR 95 8.466 -2.631 5.782 1.00 0.00 ATOM 786 OG1 THR 95 6.545 -2.793 7.219 1.00 0.00 ATOM 787 O THR 95 10.727 -1.064 7.482 1.00 0.00 ATOM 788 C THR 95 9.589 -0.608 7.624 1.00 0.00 ATOM 789 N VAL 96 9.313 0.676 7.416 1.00 0.00 ATOM 790 CA VAL 96 10.353 1.603 7.019 1.00 0.00 ATOM 791 CB VAL 96 9.754 2.923 6.518 1.00 0.00 ATOM 792 CG1 VAL 96 10.805 3.964 6.295 1.00 0.00 ATOM 793 CG2 VAL 96 9.079 2.691 5.203 1.00 0.00 ATOM 794 O VAL 96 12.636 1.679 7.868 1.00 0.00 ATOM 795 C VAL 96 11.414 1.697 8.122 1.00 0.00 ATOM 796 N LYS 97 11.005 1.787 9.382 1.00 0.00 ATOM 797 CA LYS 97 11.978 1.841 10.482 1.00 0.00 ATOM 798 CB LYS 97 11.256 2.096 11.814 1.00 0.00 ATOM 799 CG LYS 97 10.687 3.505 11.944 1.00 0.00 ATOM 800 CD LYS 97 11.797 4.544 12.083 1.00 0.00 ATOM 801 CE LYS 97 11.252 5.949 12.102 1.00 0.00 ATOM 802 NZ LYS 97 12.300 6.994 12.080 1.00 0.00 ATOM 803 O LYS 97 14.064 0.619 10.782 1.00 0.00 ATOM 804 C LYS 97 12.830 0.571 10.559 1.00 0.00 ATOM 805 N GLN 98 12.216 -0.601 10.400 1.00 0.00 ATOM 806 CA GLN 98 12.964 -1.855 10.463 1.00 0.00 ATOM 807 CB GLN 98 12.028 -3.056 10.305 1.00 0.00 ATOM 808 CG GLN 98 11.120 -3.322 11.494 1.00 0.00 ATOM 809 CD GLN 98 10.144 -4.450 11.297 1.00 0.00 ATOM 810 OE1 GLN 98 9.734 -4.782 10.187 1.00 0.00 ATOM 811 NE2 GLN 98 9.737 -5.079 12.398 1.00 0.00 ATOM 812 O GLN 98 15.163 -2.382 9.655 1.00 0.00 ATOM 813 C GLN 98 14.029 -1.912 9.378 1.00 0.00 ATOM 814 N ARG 99 13.705 -1.484 8.155 1.00 0.00 ATOM 815 CA ARG 99 14.574 -1.590 6.999 1.00 0.00 ATOM 816 CB ARG 99 13.718 -2.348 5.882 1.00 0.00 ATOM 817 CG ARG 99 13.391 -3.762 6.343 1.00 0.00 ATOM 818 CD ARG 99 12.880 -4.646 5.215 1.00 0.00 ATOM 819 NE ARG 99 13.252 -4.195 3.887 1.00 0.00 ATOM 820 CZ ARG 99 12.449 -3.778 2.913 1.00 0.00 ATOM 821 NH1 ARG 99 11.137 -3.739 3.083 1.00 0.00 ATOM 822 NH2 ARG 99 12.963 -3.397 1.744 1.00 0.00 ATOM 823 O ARG 99 16.238 -0.382 5.779 1.00 0.00 ATOM 824 C ARG 99 15.483 -0.394 6.767 1.00 0.00 ATOM 825 N GLY 100 15.497 0.614 7.581 1.00 0.00 ATOM 826 CA GLY 100 16.344 1.783 7.478 1.00 0.00 ATOM 827 O GLY 100 16.590 3.701 6.124 1.00 0.00 ATOM 828 C GLY 100 15.831 2.854 6.513 1.00 0.00 ATOM 829 N CYS 101 14.569 2.813 6.108 1.00 0.00 ATOM 830 CA CYS 101 14.055 3.845 5.226 1.00 0.00 ATOM 831 CB CYS 101 12.645 3.452 4.693 1.00 0.00 ATOM 832 SG CYS 101 12.606 1.983 3.629 1.00 0.00 ATOM 833 O CYS 101 13.876 5.247 7.161 1.00 0.00 ATOM 834 C CYS 101 14.130 5.180 5.961 1.00 0.00 ATOM 835 N THR 102 14.515 6.223 5.245 1.00 0.00 ATOM 836 CA THR 102 14.599 7.560 5.810 1.00 0.00 ATOM 837 CB THR 102 16.060 7.694 6.560 1.00 0.00 ATOM 838 CG2 THR 102 16.248 9.077 7.230 1.00 0.00 ATOM 839 OG1 THR 102 16.132 6.710 7.621 1.00 0.00 ATOM 840 O THR 102 13.562 9.681 5.322 1.00 0.00 ATOM 841 C THR 102 13.531 8.459 5.182 1.00 0.00 ATOM 842 N ARG 103 12.581 7.854 4.491 1.00 0.00 ATOM 843 CA ARG 103 11.520 8.619 3.850 1.00 0.00 ATOM 844 CB ARG 103 11.965 9.291 2.550 1.00 0.00 ATOM 845 CG ARG 103 13.016 10.366 2.786 1.00 0.00 ATOM 846 CD ARG 103 13.063 11.420 1.699 1.00 0.00 ATOM 847 NE ARG 103 13.352 10.828 0.403 1.00 0.00 ATOM 848 CZ ARG 103 13.243 11.415 -0.770 1.00 0.00 ATOM 849 NH1 ARG 103 12.897 12.682 -0.905 1.00 0.00 ATOM 850 NH2 ARG 103 13.575 10.725 -1.875 1.00 0.00 ATOM 851 O ARG 103 10.513 6.501 3.291 1.00 0.00 ATOM 852 C ARG 103 10.364 7.720 3.443 1.00 0.00 ATOM 853 N VAL 104 9.212 8.357 3.265 1.00 0.00 ATOM 854 CA VAL 104 8.026 7.669 2.842 1.00 0.00 ATOM 855 CB VAL 104 6.984 7.542 3.949 1.00 0.00 ATOM 856 CG1 VAL 104 5.718 6.936 3.396 1.00 0.00 ATOM 857 CG2 VAL 104 7.533 6.778 5.119 1.00 0.00 ATOM 858 O VAL 104 7.294 9.725 1.831 1.00 0.00 ATOM 859 C VAL 104 7.433 8.497 1.726 1.00 0.00 ATOM 860 N LYS 105 7.119 7.834 0.638 1.00 0.00 ATOM 861 CA LYS 105 6.542 8.528 -0.519 1.00 0.00 ATOM 862 CB LYS 105 7.127 8.855 -1.594 1.00 0.00 ATOM 863 CG LYS 105 6.284 8.909 -2.851 1.00 0.00 ATOM 864 CD LYS 105 7.055 9.511 -4.017 1.00 0.00 ATOM 865 CE LYS 105 6.226 10.545 -4.760 1.00 0.00 ATOM 866 NZ LYS 105 6.069 10.229 -6.206 1.00 0.00 ATOM 867 O LYS 105 5.003 6.734 -0.805 1.00 0.00 ATOM 868 C LYS 105 5.153 7.957 -0.754 1.00 0.00 ATOM 869 N CYS 106 4.163 8.821 -0.867 1.00 0.00 ATOM 870 CA CYS 106 2.796 8.363 -1.109 1.00 0.00 ATOM 871 CB CYS 106 2.107 7.895 0.147 1.00 0.00 ATOM 872 SG CYS 106 0.417 7.276 -0.113 1.00 0.00 ATOM 873 O CYS 106 2.227 9.856 -2.859 1.00 0.00 ATOM 874 C CYS 106 2.240 8.694 -2.450 1.00 0.00 ATOM 875 N VAL 107 1.716 7.679 -3.113 1.00 0.00 ATOM 876 CA VAL 107 1.115 7.856 -4.421 1.00 0.00 ATOM 877 CB VAL 107 1.758 6.866 -5.407 1.00 0.00 ATOM 878 CG1 VAL 107 1.302 7.082 -6.852 1.00 0.00 ATOM 879 CG2 VAL 107 3.285 6.957 -5.421 1.00 0.00 ATOM 880 O VAL 107 -0.733 6.332 -4.071 1.00 0.00 ATOM 881 C VAL 107 -0.364 7.501 -4.328 1.00 0.00 ATOM 882 N THR 108 -1.854 8.783 -3.650 1.00 0.00 ATOM 883 CA THR 108 -3.287 8.612 -3.427 1.00 0.00 ATOM 884 CB THR 108 -3.894 8.539 -2.291 1.00 0.00 ATOM 885 CG2 THR 108 -5.383 8.951 -2.432 1.00 0.00 ATOM 886 OG1 THR 108 -3.783 7.139 -1.996 1.00 0.00 ATOM 887 O THR 108 -3.928 10.402 -4.810 1.00 0.00 ATOM 888 C THR 108 -4.092 9.213 -4.572 1.00 0.00 ATOM 889 N SER 109 -4.908 8.424 -5.263 1.00 0.00 ATOM 890 CA SER 109 -5.757 8.933 -6.348 1.00 0.00 ATOM 891 CB SER 109 -5.598 8.060 -7.577 1.00 0.00 ATOM 892 OG SER 109 -6.104 6.761 -7.387 1.00 0.00 ATOM 893 O SER 109 -7.508 8.008 -4.980 1.00 0.00 ATOM 894 C SER 109 -7.217 8.715 -5.942 1.00 0.00 ATOM 895 N PRO 110 -8.162 9.315 -6.646 1.00 0.00 ATOM 896 CA PRO 110 -9.570 9.262 -6.230 1.00 0.00 ATOM 897 CB PRO 110 -10.192 10.485 -6.913 1.00 0.00 ATOM 898 CG PRO 110 -9.316 10.717 -8.093 1.00 0.00 ATOM 899 CD PRO 110 -7.947 10.193 -7.803 1.00 0.00 ATOM 900 O PRO 110 -10.862 7.865 -7.720 1.00 0.00 ATOM 901 C PRO 110 -10.240 7.949 -6.668 1.00 0.00 ATOM 902 N VAL 111 -10.031 6.954 -5.812 1.00 0.00 ATOM 903 CA VAL 111 -10.481 5.598 -6.097 1.00 0.00 ATOM 904 CB VAL 111 -9.270 4.624 -6.049 1.00 0.00 ATOM 905 CG1 VAL 111 -9.748 3.185 -6.113 1.00 0.00 ATOM 906 CG2 VAL 111 -8.347 4.919 -7.219 1.00 0.00 ATOM 907 O VAL 111 -11.158 5.580 -3.787 1.00 0.00 ATOM 908 C VAL 111 -11.264 5.048 -4.902 1.00 0.00 ATOM 909 N ASN 112 -12.014 3.982 -5.138 1.00 0.00 ATOM 910 CA ASN 112 -12.748 3.313 -4.077 1.00 0.00 ATOM 911 CB ASN 112 -13.978 2.463 -4.585 1.00 0.00 ATOM 912 CG ASN 112 -15.147 3.269 -5.116 1.00 0.00 ATOM 913 ND2 ASN 112 -15.960 2.624 -5.939 1.00 0.00 ATOM 914 OD1 ASN 112 -15.206 4.520 -4.989 1.00 0.00 ATOM 915 O ASN 112 -12.008 2.625 -1.852 1.00 0.00 ATOM 916 C ASN 112 -11.790 2.611 -3.096 1.00 0.00 ATOM 917 N LYS 113 -10.755 1.992 -3.682 1.00 0.00 ATOM 918 CA LYS 113 -9.787 1.220 -2.890 1.00 0.00 ATOM 919 CB LYS 113 -8.716 0.543 -3.858 1.00 0.00 ATOM 920 CG LYS 113 -7.974 -0.672 -3.325 1.00 0.00 ATOM 921 CD LYS 113 -7.258 -1.418 -4.429 1.00 0.00 ATOM 922 CE LYS 113 -6.872 -2.825 -3.980 1.00 0.00 ATOM 923 NZ LYS 113 -8.061 -3.696 -3.701 1.00 0.00 ATOM 924 O LYS 113 -7.953 1.742 -1.390 1.00 0.00 ATOM 925 C LYS 113 -8.743 2.141 -2.260 1.00 0.00 ATOM 926 N VAL 114 -8.769 3.403 -2.619 1.00 0.00 ATOM 927 CA VAL 114 -7.814 4.369 -2.101 1.00 0.00 ATOM 928 CB VAL 114 -6.826 4.796 -3.232 1.00 0.00 ATOM 929 CG1 VAL 114 -5.758 5.727 -2.695 1.00 0.00 ATOM 930 CG2 VAL 114 -6.216 3.516 -3.833 1.00 0.00 ATOM 931 O VAL 114 -9.369 6.216 -2.133 1.00 0.00 ATOM 932 C VAL 114 -8.598 5.515 -1.457 1.00 0.00 ATOM 933 N SER 115 -8.348 5.660 -0.134 1.00 0.00 ATOM 934 CA SER 115 -8.986 6.791 0.539 1.00 0.00 ATOM 935 CB SER 115 -9.732 6.318 1.790 1.00 0.00 ATOM 936 OG SER 115 -10.270 7.417 2.506 1.00 0.00 ATOM 937 O SER 115 -6.895 7.434 1.522 1.00 0.00 ATOM 938 C SER 115 -7.911 7.788 0.945 1.00 0.00 ATOM 939 N ILE 116 -8.164 9.044 0.554 1.00 0.00 ATOM 940 CA ILE 116 -7.243 10.127 0.923 1.00 0.00 ATOM 941 CB ILE 116 -7.727 11.469 0.339 1.00 0.00 ATOM 942 CG1 ILE 116 -7.817 11.457 -1.181 1.00 0.00 ATOM 943 CG2 ILE 116 -6.855 12.620 0.868 1.00 0.00 ATOM 944 CD1 ILE 116 -8.650 12.545 -1.797 1.00 0.00 ATOM 945 O ILE 116 -6.033 10.314 3.007 1.00 0.00 ATOM 946 C ILE 116 -7.128 10.229 2.435 1.00 0.00 ATOM 947 N ALA 117 -8.662 10.252 3.150 1.00 0.00 ATOM 948 CA ALA 117 -8.622 10.478 4.591 1.00 0.00 ATOM 949 CB ALA 117 -10.015 10.259 5.213 1.00 0.00 ATOM 950 O ALA 117 -6.806 10.018 6.073 1.00 0.00 ATOM 951 C ALA 117 -7.583 9.557 5.252 1.00 0.00 ATOM 952 N TYR 118 -7.560 8.266 4.905 1.00 0.00 ATOM 953 CA TYR 118 -6.578 7.370 5.510 1.00 0.00 ATOM 954 CB TYR 118 -6.852 5.928 5.077 1.00 0.00 ATOM 955 CG TYR 118 -7.965 5.291 5.894 1.00 0.00 ATOM 956 CD1 TYR 118 -9.201 4.993 5.370 1.00 0.00 ATOM 957 CD2 TYR 118 -7.676 4.986 7.226 1.00 0.00 ATOM 958 CE1 TYR 118 -10.167 4.345 6.157 1.00 0.00 ATOM 959 CE2 TYR 118 -8.610 4.298 7.990 1.00 0.00 ATOM 960 CZ TYR 118 -9.830 4.007 7.446 1.00 0.00 ATOM 961 OH TYR 118 -10.725 3.301 8.246 1.00 0.00 ATOM 962 O TYR 118 -4.245 7.683 6.033 1.00 0.00 ATOM 963 C TYR 118 -5.145 7.757 5.218 1.00 0.00 ATOM 964 N HIS 119 -4.846 8.069 3.920 1.00 0.00 ATOM 965 CA HIS 119 -3.472 8.450 3.622 1.00 0.00 ATOM 966 CB HIS 119 -3.250 8.633 2.100 1.00 0.00 ATOM 967 CG HIS 119 -3.246 7.327 1.370 1.00 0.00 ATOM 968 CD2 HIS 119 -2.980 6.060 1.801 1.00 0.00 ATOM 969 ND1 HIS 119 -3.558 7.224 0.023 1.00 0.00 ATOM 970 CE1 HIS 119 -3.462 5.946 -0.341 1.00 0.00 ATOM 971 NE2 HIS 119 -3.072 5.230 0.712 1.00 0.00 ATOM 972 O HIS 119 -1.940 9.674 4.962 1.00 0.00 ATOM 973 C HIS 119 -3.029 9.674 4.389 1.00 0.00 ATOM 974 N THR 120 -3.843 10.718 4.447 1.00 0.00 ATOM 975 CA THR 120 -3.504 11.942 5.167 1.00 0.00 ATOM 976 CB THR 120 -4.572 13.029 4.940 1.00 0.00 ATOM 977 CG2 THR 120 -4.595 13.462 3.485 1.00 0.00 ATOM 978 OG1 THR 120 -5.860 12.518 5.306 1.00 0.00 ATOM 979 O THR 120 -2.777 12.405 7.410 1.00 0.00 ATOM 980 C THR 120 -3.410 11.659 6.663 1.00 0.00 ATOM 981 N LYS 121 -4.026 10.564 7.096 1.00 0.00 ATOM 982 CA LYS 121 -4.023 10.180 8.495 1.00 0.00 ATOM 983 CB LYS 121 -5.175 9.180 8.774 1.00 0.00 ATOM 984 CG LYS 121 -5.372 8.979 10.294 1.00 0.00 ATOM 985 CD LYS 121 -6.686 8.326 10.651 1.00 0.00 ATOM 986 CE LYS 121 -6.824 8.216 12.165 1.00 0.00 ATOM 987 NZ LYS 121 -8.132 7.627 12.563 1.00 0.00 ATOM 988 O LYS 121 -2.344 9.730 10.129 1.00 0.00 ATOM 989 C LYS 121 -2.636 9.802 8.946 1.00 0.00 ATOM 990 N LEU 122 -1.794 9.483 8.003 1.00 0.00 ATOM 991 CA LEU 122 -0.415 9.113 8.309 1.00 0.00 ATOM 992 CB LEU 122 -0.078 7.841 7.532 1.00 0.00 ATOM 993 CG LEU 122 -0.780 6.560 8.027 1.00 0.00 ATOM 994 CD1 LEU 122 -0.561 5.485 6.976 1.00 0.00 ATOM 995 CD2 LEU 122 -0.251 6.006 9.340 1.00 0.00 ATOM 996 O LEU 122 1.662 10.266 8.646 1.00 0.00 ATOM 997 C LEU 122 0.452 10.356 8.493 1.00 0.00 ATOM 998 N GLY 123 -0.075 11.533 8.275 1.00 0.00 ATOM 999 CA GLY 123 0.557 12.828 8.421 1.00 0.00 ATOM 1000 O GLY 123 2.251 14.086 7.289 1.00 0.00 ATOM 1001 C GLY 123 1.375 13.234 7.201 1.00 0.00 ATOM 1002 N PHE 124 1.089 12.624 6.057 1.00 0.00 ATOM 1003 CA PHE 124 1.827 12.953 4.863 1.00 0.00 ATOM 1004 CB PHE 124 1.739 11.844 3.800 1.00 0.00 ATOM 1005 CG PHE 124 2.159 10.464 4.213 1.00 0.00 ATOM 1006 CD1 PHE 124 3.134 10.240 5.176 1.00 0.00 ATOM 1007 CD2 PHE 124 1.592 9.348 3.600 1.00 0.00 ATOM 1008 CE1 PHE 124 3.494 8.955 5.527 1.00 0.00 ATOM 1009 CE2 PHE 124 1.952 8.063 3.944 1.00 0.00 ATOM 1010 CZ PHE 124 2.914 7.855 4.920 1.00 0.00 ATOM 1011 O PHE 124 0.024 14.493 4.413 1.00 0.00 ATOM 1012 C PHE 124 1.194 14.163 4.153 1.00 0.00 ATOM 1013 N ASP 125 1.984 14.823 3.304 1.00 0.00 ATOM 1014 CA ASP 125 1.572 15.991 2.548 1.00 0.00 ATOM 1015 CB ASP 125 2.466 16.569 1.733 1.00 0.00 ATOM 1016 CG ASP 125 2.557 17.956 2.320 1.00 0.00 ATOM 1017 OD1 ASP 125 1.940 18.243 3.357 1.00 0.00 ATOM 1018 OD2 ASP 125 3.293 18.766 1.699 1.00 0.00 ATOM 1019 O ASP 125 0.577 14.818 0.712 1.00 0.00 ATOM 1020 C ASP 125 0.432 15.672 1.587 1.00 0.00 ATOM 1021 N ILE 126 -0.667 16.408 1.689 1.00 0.00 ATOM 1022 CA ILE 126 -1.796 16.171 0.811 1.00 0.00 ATOM 1023 CB ILE 126 -2.922 17.172 1.056 1.00 0.00 ATOM 1024 CG1 ILE 126 -4.187 16.677 0.366 1.00 0.00 ATOM 1025 CG2 ILE 126 -2.548 18.561 0.608 1.00 0.00 ATOM 1026 CD1 ILE 126 -4.813 15.531 1.125 1.00 0.00 ATOM 1027 O ILE 126 -1.780 15.491 -1.477 1.00 0.00 ATOM 1028 C ILE 126 -1.414 16.322 -0.650 1.00 0.00 ATOM 1029 N GLU 127 -0.670 17.376 -0.964 1.00 0.00 ATOM 1030 CA GLU 127 -0.239 17.627 -2.332 1.00 0.00 ATOM 1031 CB GLU 127 0.631 18.879 -2.374 1.00 0.00 ATOM 1032 CG GLU 127 -0.199 20.139 -2.148 1.00 0.00 ATOM 1033 CD GLU 127 0.602 21.418 -2.065 1.00 0.00 ATOM 1034 OE1 GLU 127 1.852 21.348 -2.062 1.00 0.00 ATOM 1035 OE2 GLU 127 -0.031 22.497 -1.997 1.00 0.00 ATOM 1036 O GLU 127 0.251 16.130 -4.125 1.00 0.00 ATOM 1037 C GLU 127 0.507 16.470 -2.976 1.00 0.00 ATOM 1038 N LYS 128 1.442 15.880 -2.242 1.00 0.00 ATOM 1039 CA LYS 128 2.201 14.751 -2.770 1.00 0.00 ATOM 1040 CB LYS 128 3.362 14.557 -1.434 1.00 0.00 ATOM 1041 CG LYS 128 4.891 14.315 -1.688 1.00 0.00 ATOM 1042 CD LYS 128 5.571 14.921 -2.940 1.00 0.00 ATOM 1043 CE LYS 128 6.823 14.070 -3.191 1.00 0.00 ATOM 1044 NZ LYS 128 7.352 14.186 -4.548 1.00 0.00 ATOM 1045 O LYS 128 1.348 12.863 -3.977 1.00 0.00 ATOM 1046 C LYS 128 1.305 13.540 -2.944 1.00 0.00 ATOM 1047 N GLY 129 2.654 16.943 -6.843 1.00 0.00 ATOM 1048 CA GLY 129 1.635 17.543 -7.672 1.00 0.00 ATOM 1049 O GLY 129 0.922 17.058 -9.903 1.00 0.00 ATOM 1050 C GLY 129 1.128 16.611 -8.791 1.00 0.00 ATOM 1051 N THR 130 0.907 15.332 -8.489 1.00 0.00 ATOM 1052 CA THR 130 0.380 14.434 -9.509 1.00 0.00 ATOM 1053 CB THR 130 1.182 13.643 -10.349 1.00 0.00 ATOM 1054 CG2 THR 130 0.281 12.895 -11.338 1.00 0.00 ATOM 1055 OG1 THR 130 2.056 14.527 -11.085 1.00 0.00 ATOM 1056 O THR 130 -1.207 13.356 -8.057 1.00 0.00 ATOM 1057 C THR 130 -0.849 13.591 -9.209 1.00 0.00 ATOM 1058 N LYS 131 -1.473 13.132 -10.290 1.00 0.00 ATOM 1059 CA LYS 131 -2.623 12.238 -10.237 1.00 0.00 ATOM 1060 CB LYS 131 -3.770 12.790 -10.965 1.00 0.00 ATOM 1061 CG LYS 131 -3.591 13.322 -12.363 1.00 0.00 ATOM 1062 CD LYS 131 -4.174 14.711 -12.429 1.00 0.00 ATOM 1063 CE LYS 131 -5.051 14.938 -13.641 1.00 0.00 ATOM 1064 NZ LYS 131 -5.907 16.151 -13.414 1.00 0.00 ATOM 1065 O LYS 131 -1.114 11.057 -11.668 1.00 0.00 ATOM 1066 C LYS 131 -2.094 10.982 -10.928 1.00 0.00 ATOM 1067 N THR 132 -2.705 9.838 -10.698 1.00 0.00 ATOM 1068 CA THR 132 -2.263 8.571 -11.281 1.00 0.00 ATOM 1069 CB THR 132 -2.741 7.283 -10.495 1.00 0.00 ATOM 1070 CG2 THR 132 -2.491 7.439 -9.006 1.00 0.00 ATOM 1071 OG1 THR 132 -4.132 7.026 -10.738 1.00 0.00 ATOM 1072 O THR 132 -1.954 7.960 -13.578 1.00 0.00 ATOM 1073 C THR 132 -2.695 8.477 -12.740 1.00 0.00 ATOM 1074 N VAL 133 -3.888 8.967 -13.067 1.00 0.00 ATOM 1075 CA VAL 133 -4.404 8.842 -14.435 1.00 0.00 ATOM 1076 CB VAL 133 -5.235 7.502 -14.599 1.00 0.00 ATOM 1077 CG1 VAL 133 -4.435 6.296 -14.148 1.00 0.00 ATOM 1078 CG2 VAL 133 -6.495 7.635 -13.772 1.00 0.00 ATOM 1079 O VAL 133 -5.956 10.638 -14.137 1.00 0.00 ATOM 1080 C VAL 133 -5.049 10.182 -14.827 1.00 0.00 ATOM 1081 N ASN 134 -4.492 10.799 -15.851 1.00 0.00 ATOM 1082 CA ASN 134 -5.062 12.013 -16.448 1.00 0.00 ATOM 1083 CB ASN 134 -6.382 11.640 -17.190 1.00 0.00 ATOM 1084 CG ASN 134 -6.103 10.560 -18.236 1.00 0.00 ATOM 1085 ND2 ASN 134 -7.087 9.702 -18.488 1.00 0.00 ATOM 1086 OD1 ASN 134 -5.015 10.468 -18.792 1.00 0.00 ATOM 1087 O ASN 134 -6.196 14.007 -15.635 1.00 0.00 ATOM 1088 C ASN 134 -5.321 13.139 -15.438 1.00 0.00 ATOM 1089 N GLY 135 -4.540 13.131 -14.360 1.00 0.00 ATOM 1090 CA GLY 135 -4.686 14.158 -13.348 1.00 0.00 ATOM 1091 O GLY 135 -6.432 14.978 -11.928 1.00 0.00 ATOM 1092 C GLY 135 -5.973 14.021 -12.545 1.00 0.00 ATOM 1093 N ILE 136 -6.557 12.840 -12.546 1.00 0.00 ATOM 1094 CA ILE 136 -7.804 12.617 -11.805 1.00 0.00 ATOM 1095 CB ILE 136 -8.303 11.203 -11.878 1.00 0.00 ATOM 1096 CG1 ILE 136 -9.645 11.085 -11.152 1.00 0.00 ATOM 1097 CG2 ILE 136 -7.275 10.213 -11.336 1.00 0.00 ATOM 1098 CD1 ILE 136 -10.343 9.747 -11.383 1.00 0.00 ATOM 1099 O ILE 136 -8.398 13.416 -9.591 1.00 0.00 ATOM 1100 C ILE 136 -7.561 12.811 -10.315 1.00 0.00 ATOM 1101 N SER 137 -6.464 13.034 -8.221 1.00 0.00 ATOM 1102 CA SER 137 -6.241 12.069 -7.158 1.00 0.00 ATOM 1103 CB SER 137 -7.360 11.005 -7.208 1.00 0.00 ATOM 1104 OG SER 137 -7.329 10.360 -8.473 1.00 0.00 ATOM 1105 O SER 137 -4.788 10.230 -6.675 1.00 0.00 ATOM 1106 C SER 137 -4.901 11.343 -7.181 1.00 0.00 ATOM 1107 N VAL 138 -3.891 11.975 -7.793 1.00 0.00 ATOM 1108 CA VAL 138 -2.556 11.409 -7.852 1.00 0.00 ATOM 1109 CB VAL 138 -2.036 10.561 -8.741 1.00 0.00 ATOM 1110 CG1 VAL 138 -0.532 10.460 -8.568 1.00 0.00 ATOM 1111 CG2 VAL 138 -2.686 9.212 -8.472 1.00 0.00 ATOM 1112 O VAL 138 -1.804 13.538 -7.026 1.00 0.00 ATOM 1113 C VAL 138 -1.837 12.315 -6.861 1.00 0.00 ATOM 1114 N PHE 139 -1.306 11.688 -5.811 1.00 0.00 ATOM 1115 CA PHE 139 -0.639 12.453 -4.741 1.00 0.00 ATOM 1116 CB PHE 139 -1.446 12.381 -3.453 1.00 0.00 ATOM 1117 CG PHE 139 -2.479 13.485 -3.403 1.00 0.00 ATOM 1118 CD1 PHE 139 -2.108 14.816 -3.520 1.00 0.00 ATOM 1119 CD2 PHE 139 -3.808 13.160 -3.199 1.00 0.00 ATOM 1120 CE1 PHE 139 -3.099 15.795 -3.464 1.00 0.00 ATOM 1121 CE2 PHE 139 -4.799 14.136 -3.126 1.00 0.00 ATOM 1122 CZ PHE 139 -4.425 15.455 -3.290 1.00 0.00 ATOM 1123 O PHE 139 0.511 10.394 -4.338 1.00 0.00 ATOM 1124 C PHE 139 0.530 11.600 -4.248 1.00 0.00 ATOM 1125 N ALA 140 1.594 12.205 -3.770 1.00 0.00 ATOM 1126 CA ALA 140 2.748 11.463 -3.281 1.00 0.00 ATOM 1127 CB ALA 140 3.675 11.046 -4.427 1.00 0.00 ATOM 1128 O ALA 140 3.581 13.597 -2.608 1.00 0.00 ATOM 1129 C ALA 140 3.511 12.392 -2.360 1.00 0.00 ATOM 1130 N ASN 141 4.064 11.833 -1.307 1.00 0.00 ATOM 1131 CA ASN 141 4.839 12.585 -0.319 1.00 0.00 ATOM 1132 CB ASN 141 4.337 12.094 0.972 1.00 0.00 ATOM 1133 CG ASN 141 3.494 13.303 1.339 1.00 0.00 ATOM 1134 ND2 ASN 141 2.187 13.167 1.178 1.00 0.00 ATOM 1135 OD1 ASN 141 4.038 14.348 1.708 1.00 0.00 ATOM 1136 O ASN 141 6.167 10.555 -0.095 1.00 0.00 ATOM 1137 C ASN 141 6.104 11.774 0.079 1.00 0.00 ATOM 1138 N TYR 142 7.047 12.534 0.624 1.00 0.00 ATOM 1139 CA TYR 142 8.331 11.989 1.086 1.00 0.00 ATOM 1140 CB TYR 142 9.536 12.517 0.223 1.00 0.00 ATOM 1141 CG TYR 142 9.774 13.984 0.395 1.00 0.00 ATOM 1142 CD1 TYR 142 9.079 14.930 -0.387 1.00 0.00 ATOM 1143 CD2 TYR 142 10.653 14.435 1.400 1.00 0.00 ATOM 1144 CE1 TYR 142 9.288 16.289 -0.222 1.00 0.00 ATOM 1145 CE2 TYR 142 10.863 15.784 1.564 1.00 0.00 ATOM 1146 CZ TYR 142 10.177 16.701 0.766 1.00 0.00 ATOM 1147 OH TYR 142 10.438 18.026 0.970 1.00 0.00 ATOM 1148 O TYR 142 9.468 11.380 3.103 1.00 0.00 ATOM 1149 C TYR 142 8.636 12.120 2.566 1.00 0.00 ATOM 1150 N ASP 143 7.986 13.035 3.229 1.00 0.00 ATOM 1151 CA ASP 143 8.190 13.308 4.670 1.00 0.00 ATOM 1152 CB ASP 143 7.752 14.761 4.736 1.00 0.00 ATOM 1153 CG ASP 143 9.049 15.507 4.779 1.00 0.00 ATOM 1154 OD1 ASP 143 10.115 14.883 4.965 1.00 0.00 ATOM 1155 OD2 ASP 143 9.041 16.768 4.646 1.00 0.00 ATOM 1156 O ASP 143 5.850 12.989 5.249 1.00 0.00 ATOM 1157 C ASP 143 7.023 12.586 5.358 1.00 0.00 ATOM 1158 N GLY 144 7.352 11.465 5.985 1.00 0.00 ATOM 1159 CA GLY 144 6.344 10.638 6.636 1.00 0.00 ATOM 1160 O GLY 144 6.289 12.305 8.380 1.00 0.00 ATOM 1161 C GLY 144 5.716 11.361 7.819 1.00 0.00 ATOM 1162 N PRO 145 4.546 10.927 8.266 1.00 0.00 ATOM 1163 CA PRO 145 3.834 11.551 9.393 1.00 0.00 ATOM 1164 CB PRO 145 2.701 10.581 9.612 1.00 0.00 ATOM 1165 CG PRO 145 3.442 9.281 9.370 1.00 0.00 ATOM 1166 CD PRO 145 4.171 9.569 8.080 1.00 0.00 ATOM 1167 O PRO 145 4.063 12.540 11.571 1.00 0.00 ATOM 1168 C PRO 145 4.592 11.847 10.697 1.00 0.00 ATOM 1169 N GLY 146 5.808 11.327 10.838 1.00 0.00 ATOM 1170 CA GLY 146 6.561 11.577 12.056 1.00 0.00 ATOM 1171 O GLY 146 8.576 12.693 12.730 1.00 0.00 ATOM 1172 C GLY 146 7.800 12.415 11.809 1.00 0.00 ATOM 1173 N GLN 147 7.986 12.814 10.554 1.00 0.00 ATOM 1174 CA GLN 147 9.142 13.608 10.155 1.00 0.00 ATOM 1175 CB GLN 147 9.154 13.767 8.637 1.00 0.00 ATOM 1176 CG GLN 147 10.389 14.459 8.102 1.00 0.00 ATOM 1177 CD GLN 147 11.663 13.827 8.610 1.00 0.00 ATOM 1178 OE1 GLN 147 12.168 14.186 9.678 1.00 0.00 ATOM 1179 NE2 GLN 147 12.186 12.865 7.856 1.00 0.00 ATOM 1180 O GLN 147 8.084 15.569 11.037 1.00 0.00 ATOM 1181 C GLN 147 9.145 14.980 10.816 1.00 0.00 ATOM 1182 N ASP 148 10.335 15.474 11.108 1.00 0.00 ATOM 1183 CA ASP 148 10.479 16.782 11.754 1.00 0.00 ATOM 1184 CB ASP 148 11.926 17.010 12.166 1.00 0.00 ATOM 1185 CG ASP 148 12.369 15.967 13.190 1.00 0.00 ATOM 1186 OD1 ASP 148 11.551 15.599 14.046 1.00 0.00 ATOM 1187 OD2 ASP 148 13.548 15.562 13.092 1.00 0.00 ATOM 1188 O ASP 148 9.249 18.806 11.339 1.00 0.00 ATOM 1189 C ASP 148 9.943 17.882 10.858 1.00 0.00 ATOM 1190 N ARG 149 10.253 17.826 9.571 1.00 0.00 ATOM 1191 CA ARG 149 9.737 18.803 8.617 1.00 0.00 ATOM 1192 CB ARG 149 10.390 18.591 7.246 1.00 0.00 ATOM 1193 CG ARG 149 10.207 19.737 6.257 1.00 0.00 ATOM 1194 CD ARG 149 10.824 21.034 6.777 1.00 0.00 ATOM 1195 NE ARG 149 12.096 20.799 7.462 1.00 0.00 ATOM 1196 CZ ARG 149 13.204 20.356 6.876 1.00 0.00 ATOM 1197 NH1 ARG 149 13.222 20.100 5.575 1.00 0.00 ATOM 1198 NH2 ARG 149 14.293 20.137 7.601 1.00 0.00 ATOM 1199 O ARG 149 7.552 19.760 8.371 1.00 0.00 ATOM 1200 C ARG 149 8.220 18.731 8.476 1.00 0.00 ATOM 1201 N VAL 150 7.700 17.496 8.466 1.00 0.00 ATOM 1202 CA VAL 150 6.231 17.358 8.340 1.00 0.00 ATOM 1203 CB VAL 150 5.765 15.979 8.002 1.00 0.00 ATOM 1204 CG1 VAL 150 4.252 15.860 8.211 1.00 0.00 ATOM 1205 CG2 VAL 150 6.138 15.671 6.552 1.00 0.00 ATOM 1206 O VAL 150 4.571 18.572 9.646 1.00 0.00 ATOM 1207 C VAL 150 5.582 17.848 9.620 1.00 0.00 ATOM 1208 N LEU 151 6.134 17.482 10.790 1.00 0.00 ATOM 1209 CA LEU 151 5.618 17.879 12.071 1.00 0.00 ATOM 1210 CB LEU 151 6.563 17.470 13.197 1.00 0.00 ATOM 1211 CG LEU 151 6.139 17.803 14.632 1.00 0.00 ATOM 1212 CD1 LEU 151 4.743 17.252 14.932 1.00 0.00 ATOM 1213 CD2 LEU 151 7.166 17.204 15.592 1.00 0.00 ATOM 1214 O LEU 151 4.441 19.861 12.704 1.00 0.00 ATOM 1215 C LEU 151 5.475 19.405 12.198 1.00 0.00 ATOM 1216 N PHE 152 6.480 20.164 11.768 1.00 0.00 ATOM 1217 CA PHE 152 6.428 21.624 11.903 1.00 0.00 ATOM 1218 CB PHE 152 7.814 22.181 12.228 1.00 0.00 ATOM 1219 CG PHE 152 8.298 21.839 13.607 1.00 0.00 ATOM 1220 CD1 PHE 152 7.425 21.343 14.558 1.00 0.00 ATOM 1221 CD2 PHE 152 9.627 22.012 13.953 1.00 0.00 ATOM 1222 CE1 PHE 152 7.870 21.027 15.830 1.00 0.00 ATOM 1223 CE2 PHE 152 10.073 21.695 15.223 1.00 0.00 ATOM 1224 CZ PHE 152 9.202 21.205 16.158 1.00 0.00 ATOM 1225 O PHE 152 6.514 23.304 10.196 1.00 0.00 ATOM 1226 C PHE 152 5.945 22.296 10.620 1.00 0.00 ATOM 1227 N VAL 153 4.902 21.768 9.986 1.00 0.00 ATOM 1228 CA VAL 153 4.340 22.310 8.754 1.00 0.00 ATOM 1229 CB VAL 153 4.611 21.358 7.582 1.00 0.00 ATOM 1230 CG1 VAL 153 3.961 21.909 6.319 1.00 0.00 ATOM 1231 CG2 VAL 153 6.131 21.239 7.364 1.00 0.00 ATOM 1232 O VAL 153 2.267 21.294 9.347 1.00 0.00 ATOM 1233 C VAL 153 2.825 22.300 8.922 1.00 0.00 ATOM 1234 N LYS 154 2.167 23.407 8.604 1.00 0.00 ATOM 1235 CA LYS 154 0.727 23.532 8.662 1.00 0.00 ATOM 1236 CB LYS 154 0.215 24.917 8.196 1.00 0.00 ATOM 1237 CG LYS 154 0.649 26.105 9.015 1.00 0.00 ATOM 1238 CD LYS 154 -0.043 27.382 8.518 1.00 0.00 ATOM 1239 CE LYS 154 0.727 28.624 8.953 1.00 0.00 ATOM 1240 NZ LYS 154 -0.044 29.845 8.555 1.00 0.00 ATOM 1241 O LYS 154 -0.925 21.863 8.139 1.00 0.00 ATOM 1242 C LYS 154 0.036 22.515 7.754 1.00 0.00 ATOM 1243 N ASN 155 0.606 22.310 6.564 1.00 0.00 ATOM 1244 CA ASN 155 0.096 21.288 5.660 1.00 0.00 ATOM 1245 CB ASN 155 0.807 21.408 4.299 1.00 0.00 ATOM 1246 CG ASN 155 0.103 22.488 3.480 1.00 0.00 ATOM 1247 ND2 ASN 155 0.561 23.719 3.614 1.00 0.00 ATOM 1248 OD1 ASN 155 -0.853 22.168 2.761 1.00 0.00 ATOM 1249 O ASN 155 -0.556 19.007 5.820 1.00 0.00 ATOM 1250 C ASN 155 0.214 19.897 6.237 1.00 0.00 ATOM 1251 N ILE 156 1.179 19.604 7.099 1.00 0.00 ATOM 1252 CA ILE 156 1.292 18.270 7.674 1.00 0.00 ATOM 1253 CB ILE 156 2.771 17.792 7.652 1.00 0.00 ATOM 1254 CG1 ILE 156 3.490 17.878 6.309 1.00 0.00 ATOM 1255 CG2 ILE 156 2.929 16.371 8.146 1.00 0.00 ATOM 1256 CD1 ILE 156 2.791 17.165 5.169 1.00 0.00 ATOM 1257 O ILE 156 0.919 18.939 9.948 1.00 0.00 ATOM 1258 C ILE 156 0.625 18.143 9.034 1.00 0.00 TER END