USER MOD reduce.3.24.130724 H: found=0, std=0, add=938, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 938 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 87 TYR OH : rot 33:sc= 0.712 USER MOD Set 1.2: A 89 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.045) USER MOD Set 1.3: A 103 SER OG : rot -19:sc= 0.982 USER MOD Set 2.1: A 80 TYR OH : rot 111:sc= 0.258 USER MOD Set 2.2: A 114 GLN : amide:sc= 0.602 K(o=0.86,f=-5.1!) USER MOD Set 3.1: A 48 LYS NZ :NH3+ 144:sc= 1.18 (180deg=1.17) USER MOD Set 3.2: A 49 SER OG : rot 180:sc= 0.396 USER MOD Set 4.1: A 45 TYR OH : rot -47:sc= 1.02 USER MOD Set 4.2: A 61 GLN : amide:sc= 1.01 K(o=2,f=-0.75) USER MOD Set 5.1: A 25 ASN : amide:sc= 1.28 K(o=2.9,f=2.3) USER MOD Set 5.2: A 42 SER OG : rot -134:sc= 1.3 USER MOD Set 5.3: A 44 THR OG1 : rot 180:sc= 0.34 USER MOD Set 6.1: A 17 GLN : amide:sc= -0.0137 X(o=-1.2,f=-1.2) USER MOD Set 6.2: A 19 ASN : amide:sc= -1.2 X(o=-1.2,f=-1.1) USER MOD Set 7.1: A 12 SER OG : rot 180:sc= 0 USER MOD Set 7.2: A 21 MET CE :methyl -138:sc= 0 (180deg=-0.216) USER MOD Set 7.3: A 139 THR OG1 : rot 180:sc= -0.0212 USER MOD Single : A 1 ALA N :NH3+ -164:sc= 1.23 (180deg=0.997) USER MOD Single : A 2 THR OG1 : rot 180:sc= -0.499 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 160:sc= -0.303 USER MOD Single : A 6 THR OG1 : rot -160:sc= 0 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 GLN : amide:sc= -0.0277 X(o=-0.028,f=-0.31) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 161:sc= 0.937 (180deg=0.279) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0.234 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0.224 K(o=0.22,f=-1.6) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN :FLIP amide:sc= -0.595 F(o=-1.7!,f=-0.6) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot -135:sc= 1.28 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.157 K(o=-0.16,f=-2.1!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot -100:sc= 0.124 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN :FLIP amide:sc= -0.597 F(o=-1.1,f=-0.6) USER MOD Single : A 126 SER OG : rot -60:sc= 1.24 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 SER OG : rot 180:sc= -0.0129 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 3.772 -24.552 -1.899 1.00 0.00 N ATOM 2 CA ALA A 1 3.073 -23.822 -2.960 1.00 0.00 C ATOM 3 C ALA A 1 1.698 -23.392 -2.471 1.00 0.00 C ATOM 4 O ALA A 1 0.812 -24.231 -2.277 1.00 0.00 O ATOM 5 CB ALA A 1 2.959 -24.654 -4.239 1.00 0.00 C ATOM 0 H1 ALA A 1 4.786 -24.607 -2.125 1.00 0.00 H new ATOM 0 H2 ALA A 1 3.645 -24.055 -0.994 1.00 0.00 H new ATOM 0 H3 ALA A 1 3.382 -25.513 -1.824 1.00 0.00 H new ATOM 0 HA ALA A 1 3.658 -22.936 -3.205 1.00 0.00 H new ATOM 0 HB1 ALA A 1 2.435 -24.078 -5.002 1.00 0.00 H new ATOM 0 HB2 ALA A 1 3.956 -24.908 -4.598 1.00 0.00 H new ATOM 0 HB3 ALA A 1 2.404 -25.569 -4.030 1.00 0.00 H new ATOM 11 N THR A 2 1.491 -22.086 -2.295 1.00 0.00 N ATOM 12 CA THR A 2 0.174 -21.503 -2.072 1.00 0.00 C ATOM 13 C THR A 2 0.121 -20.200 -2.850 1.00 0.00 C ATOM 14 O THR A 2 1.105 -19.449 -2.886 1.00 0.00 O ATOM 15 CB THR A 2 -0.120 -21.260 -0.578 1.00 0.00 C ATOM 16 OG1 THR A 2 1.016 -20.797 0.122 1.00 0.00 O ATOM 17 CG2 THR A 2 -0.617 -22.516 0.128 1.00 0.00 C ATOM 0 H THR A 2 2.244 -21.398 -2.304 1.00 0.00 H new ATOM 0 HA THR A 2 -0.592 -22.198 -2.415 1.00 0.00 H new ATOM 0 HB THR A 2 -0.899 -20.498 -0.566 1.00 0.00 H new ATOM 0 HG1 THR A 2 0.785 -20.655 1.064 1.00 0.00 H new ATOM 0 HG21 THR A 2 -0.809 -22.292 1.177 1.00 0.00 H new ATOM 0 HG22 THR A 2 -1.537 -22.859 -0.344 1.00 0.00 H new ATOM 0 HG23 THR A 2 0.140 -23.297 0.057 1.00 0.00 H new ATOM 25 N SER A 3 -1.027 -19.913 -3.448 1.00 0.00 N ATOM 26 CA SER A 3 -1.311 -18.653 -4.104 1.00 0.00 C ATOM 27 C SER A 3 -2.554 -18.070 -3.451 1.00 0.00 C ATOM 28 O SER A 3 -3.327 -18.794 -2.823 1.00 0.00 O ATOM 29 CB SER A 3 -1.532 -18.887 -5.597 1.00 0.00 C ATOM 30 OG SER A 3 -0.496 -19.649 -6.184 1.00 0.00 O ATOM 0 H SER A 3 -1.805 -20.571 -3.489 1.00 0.00 H new ATOM 0 HA SER A 3 -0.478 -17.958 -4.001 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.483 -19.398 -5.745 1.00 0.00 H new ATOM 0 HB3 SER A 3 -1.605 -17.926 -6.105 1.00 0.00 H new ATOM 0 HG SER A 3 -0.682 -19.774 -7.138 1.00 0.00 H new ATOM 36 N THR A 4 -2.744 -16.764 -3.579 1.00 0.00 N ATOM 37 CA THR A 4 -4.010 -16.124 -3.262 1.00 0.00 C ATOM 38 C THR A 4 -4.165 -14.969 -4.258 1.00 0.00 C ATOM 39 O THR A 4 -3.159 -14.436 -4.744 1.00 0.00 O ATOM 40 CB THR A 4 -4.018 -15.637 -1.793 1.00 0.00 C ATOM 41 OG1 THR A 4 -3.411 -16.547 -0.888 1.00 0.00 O ATOM 42 CG2 THR A 4 -5.446 -15.437 -1.293 1.00 0.00 C ATOM 0 H THR A 4 -2.024 -16.120 -3.906 1.00 0.00 H new ATOM 0 HA THR A 4 -4.850 -16.813 -3.351 1.00 0.00 H new ATOM 0 HB THR A 4 -3.450 -14.707 -1.811 1.00 0.00 H new ATOM 0 HG1 THR A 4 -3.158 -16.073 -0.068 1.00 0.00 H new ATOM 0 HG21 THR A 4 -5.425 -15.095 -0.258 1.00 0.00 H new ATOM 0 HG22 THR A 4 -5.947 -14.692 -1.911 1.00 0.00 H new ATOM 0 HG23 THR A 4 -5.988 -16.381 -1.352 1.00 0.00 H new ATOM 50 N VAL A 5 -5.389 -14.540 -4.549 1.00 0.00 N ATOM 51 CA VAL A 5 -5.645 -13.325 -5.302 1.00 0.00 C ATOM 52 C VAL A 5 -6.511 -12.425 -4.423 1.00 0.00 C ATOM 53 O VAL A 5 -7.736 -12.552 -4.391 1.00 0.00 O ATOM 54 CB VAL A 5 -6.261 -13.662 -6.683 1.00 0.00 C ATOM 55 CG1 VAL A 5 -5.170 -14.057 -7.681 1.00 0.00 C ATOM 56 CG2 VAL A 5 -7.310 -14.792 -6.658 1.00 0.00 C ATOM 0 H VAL A 5 -6.236 -15.033 -4.265 1.00 0.00 H new ATOM 0 HA VAL A 5 -4.728 -12.784 -5.538 1.00 0.00 H new ATOM 0 HB VAL A 5 -6.770 -12.747 -6.985 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -5.625 -14.290 -8.644 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -4.470 -13.230 -7.801 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -4.638 -14.933 -7.310 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -7.687 -14.960 -7.667 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -6.850 -15.707 -6.285 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -8.135 -14.508 -6.005 1.00 0.00 H new ATOM 66 N THR A 6 -5.877 -11.459 -3.759 1.00 0.00 N ATOM 67 CA THR A 6 -6.530 -10.387 -3.023 1.00 0.00 C ATOM 68 C THR A 6 -6.142 -9.066 -3.676 1.00 0.00 C ATOM 69 O THR A 6 -4.969 -8.841 -3.999 1.00 0.00 O ATOM 70 CB THR A 6 -6.196 -10.419 -1.517 1.00 0.00 C ATOM 71 OG1 THR A 6 -4.808 -10.309 -1.265 1.00 0.00 O ATOM 72 CG2 THR A 6 -6.716 -11.686 -0.843 1.00 0.00 C ATOM 0 H THR A 6 -4.859 -11.403 -3.720 1.00 0.00 H new ATOM 0 HA THR A 6 -7.611 -10.516 -3.072 1.00 0.00 H new ATOM 0 HB THR A 6 -6.699 -9.550 -1.094 1.00 0.00 H new ATOM 0 HG1 THR A 6 -4.611 -10.644 -0.365 1.00 0.00 H new ATOM 0 HG21 THR A 6 -6.459 -11.667 0.216 1.00 0.00 H new ATOM 0 HG22 THR A 6 -7.799 -11.738 -0.952 1.00 0.00 H new ATOM 0 HG23 THR A 6 -6.262 -12.560 -1.311 1.00 0.00 H new ATOM 80 N GLY A 7 -7.133 -8.204 -3.866 1.00 0.00 N ATOM 81 CA GLY A 7 -7.001 -6.847 -4.351 1.00 0.00 C ATOM 82 C GLY A 7 -8.298 -6.120 -4.039 1.00 0.00 C ATOM 83 O GLY A 7 -9.278 -6.754 -3.641 1.00 0.00 O ATOM 0 H GLY A 7 -8.103 -8.453 -3.673 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.158 -6.349 -3.872 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.807 -6.841 -5.424 1.00 0.00 H new ATOM 87 N GLY A 8 -8.335 -4.802 -4.177 1.00 0.00 N ATOM 88 CA GLY A 8 -9.510 -4.072 -3.751 1.00 0.00 C ATOM 89 C GLY A 8 -9.330 -2.575 -3.856 1.00 0.00 C ATOM 90 O GLY A 8 -8.385 -2.081 -4.479 1.00 0.00 O ATOM 0 H GLY A 8 -7.585 -4.233 -4.570 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -10.363 -4.376 -4.358 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -9.743 -4.335 -2.719 1.00 0.00 H new ATOM 94 N TYR A 9 -10.286 -1.859 -3.269 1.00 0.00 N ATOM 95 CA TYR A 9 -10.400 -0.415 -3.343 1.00 0.00 C ATOM 96 C TYR A 9 -9.661 0.205 -2.156 1.00 0.00 C ATOM 97 O TYR A 9 -9.457 -0.460 -1.140 1.00 0.00 O ATOM 98 CB TYR A 9 -11.893 -0.048 -3.358 1.00 0.00 C ATOM 99 CG TYR A 9 -12.154 1.418 -3.630 1.00 0.00 C ATOM 100 CD1 TYR A 9 -11.660 1.988 -4.813 1.00 0.00 C ATOM 101 CD2 TYR A 9 -12.840 2.221 -2.698 1.00 0.00 C ATOM 102 CE1 TYR A 9 -11.782 3.363 -5.037 1.00 0.00 C ATOM 103 CE2 TYR A 9 -12.983 3.603 -2.924 1.00 0.00 C ATOM 104 CZ TYR A 9 -12.420 4.187 -4.082 1.00 0.00 C ATOM 105 OH TYR A 9 -12.496 5.534 -4.280 1.00 0.00 O ATOM 0 H TYR A 9 -11.025 -2.288 -2.711 1.00 0.00 H new ATOM 0 HA TYR A 9 -9.944 -0.024 -4.253 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -12.398 -0.645 -4.117 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -12.334 -0.315 -2.397 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -11.184 1.363 -5.553 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -13.258 1.775 -1.807 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -11.387 3.797 -5.944 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -13.521 4.215 -2.215 1.00 0.00 H new ATOM 0 HH TYR A 9 -12.968 5.949 -3.528 1.00 0.00 H new ATOM 115 N ALA A 10 -9.267 1.476 -2.284 1.00 0.00 N ATOM 116 CA ALA A 10 -8.452 2.182 -1.305 1.00 0.00 C ATOM 117 C ALA A 10 -9.147 3.448 -0.815 1.00 0.00 C ATOM 118 O ALA A 10 -10.174 3.880 -1.347 1.00 0.00 O ATOM 119 CB ALA A 10 -7.085 2.536 -1.914 1.00 0.00 C ATOM 0 H ALA A 10 -9.514 2.050 -3.090 1.00 0.00 H new ATOM 0 HA ALA A 10 -8.307 1.523 -0.449 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -6.483 3.064 -1.174 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -6.573 1.622 -2.214 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -7.229 3.174 -2.786 1.00 0.00 H new ATOM 125 N GLN A 11 -8.538 4.071 0.186 1.00 0.00 N ATOM 126 CA GLN A 11 -8.676 5.479 0.488 1.00 0.00 C ATOM 127 C GLN A 11 -7.351 5.948 1.082 1.00 0.00 C ATOM 128 O GLN A 11 -7.066 5.674 2.249 1.00 0.00 O ATOM 129 CB GLN A 11 -9.877 5.748 1.414 1.00 0.00 C ATOM 130 CG GLN A 11 -10.015 4.794 2.605 1.00 0.00 C ATOM 131 CD GLN A 11 -10.991 5.293 3.665 1.00 0.00 C ATOM 132 OE1 GLN A 11 -12.101 5.745 3.375 1.00 0.00 O ATOM 133 NE2 GLN A 11 -10.609 5.201 4.927 1.00 0.00 N ATOM 0 H GLN A 11 -7.913 3.586 0.830 1.00 0.00 H new ATOM 0 HA GLN A 11 -8.889 6.048 -0.417 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -9.801 6.767 1.793 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -10.790 5.696 0.821 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -10.346 3.820 2.245 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -9.036 4.649 3.061 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -9.688 4.825 5.155 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -11.235 5.505 5.673 1.00 0.00 H new ATOM 142 N SER A 12 -6.544 6.673 0.311 1.00 0.00 N ATOM 143 CA SER A 12 -5.543 7.533 0.913 1.00 0.00 C ATOM 144 C SER A 12 -6.283 8.823 1.232 1.00 0.00 C ATOM 145 O SER A 12 -6.997 9.366 0.389 1.00 0.00 O ATOM 146 CB SER A 12 -4.357 7.778 -0.027 1.00 0.00 C ATOM 147 OG SER A 12 -3.371 8.629 0.558 1.00 0.00 O ATOM 0 H SER A 12 -6.565 6.680 -0.709 1.00 0.00 H new ATOM 0 HA SER A 12 -5.105 7.082 1.803 1.00 0.00 H new ATOM 0 HB2 SER A 12 -3.901 6.824 -0.290 1.00 0.00 H new ATOM 0 HB3 SER A 12 -4.717 8.225 -0.954 1.00 0.00 H new ATOM 0 HG SER A 12 -2.633 8.757 -0.074 1.00 0.00 H new ATOM 153 N ASP A 13 -6.064 9.321 2.436 1.00 0.00 N ATOM 154 CA ASP A 13 -6.452 10.652 2.873 1.00 0.00 C ATOM 155 C ASP A 13 -5.188 11.510 2.872 1.00 0.00 C ATOM 156 O ASP A 13 -4.090 11.013 2.583 1.00 0.00 O ATOM 157 CB ASP A 13 -7.117 10.608 4.259 1.00 0.00 C ATOM 158 CG ASP A 13 -6.233 9.990 5.344 1.00 0.00 C ATOM 159 OD1 ASP A 13 -5.311 10.666 5.853 1.00 0.00 O ATOM 160 OD2 ASP A 13 -6.485 8.813 5.695 1.00 0.00 O ATOM 0 H ASP A 13 -5.592 8.788 3.166 1.00 0.00 H new ATOM 0 HA ASP A 13 -7.194 11.081 2.200 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -7.387 11.622 4.556 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -8.044 10.039 4.190 1.00 0.00 H new ATOM 165 N ALA A 14 -5.354 12.818 3.073 1.00 0.00 N ATOM 166 CA ALA A 14 -4.274 13.696 3.484 1.00 0.00 C ATOM 167 C ALA A 14 -4.851 14.833 4.326 1.00 0.00 C ATOM 168 O ALA A 14 -6.021 15.185 4.133 1.00 0.00 O ATOM 169 CB ALA A 14 -3.560 14.260 2.249 1.00 0.00 C ATOM 0 H ALA A 14 -6.248 13.294 2.953 1.00 0.00 H new ATOM 0 HA ALA A 14 -3.550 13.137 4.077 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -2.751 14.918 2.565 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -3.151 13.440 1.659 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -4.270 14.823 1.644 1.00 0.00 H new ATOM 175 N GLN A 15 -4.030 15.484 5.155 1.00 0.00 N ATOM 176 CA GLN A 15 -4.335 16.794 5.727 1.00 0.00 C ATOM 177 C GLN A 15 -4.539 17.780 4.567 1.00 0.00 C ATOM 178 O GLN A 15 -3.576 18.266 3.967 1.00 0.00 O ATOM 179 CB GLN A 15 -3.239 17.265 6.713 1.00 0.00 C ATOM 180 CG GLN A 15 -3.807 17.988 7.949 1.00 0.00 C ATOM 181 CD GLN A 15 -2.993 19.219 8.373 1.00 0.00 C ATOM 182 OE1 GLN A 15 -1.803 19.361 8.092 1.00 0.00 O ATOM 183 NE2 GLN A 15 -3.638 20.175 9.027 1.00 0.00 N ATOM 0 H GLN A 15 -3.127 15.111 5.449 1.00 0.00 H new ATOM 0 HA GLN A 15 -5.248 16.736 6.320 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -2.658 16.403 7.039 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -2.553 17.933 6.192 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -4.832 18.295 7.740 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -3.848 17.286 8.782 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -4.624 20.058 9.260 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -3.148 21.028 9.297 1.00 0.00 H new ATOM 192 N GLY A 16 -5.794 18.021 4.194 1.00 0.00 N ATOM 193 CA GLY A 16 -6.180 18.864 3.068 1.00 0.00 C ATOM 194 C GLY A 16 -7.304 18.214 2.270 1.00 0.00 C ATOM 195 O GLY A 16 -8.159 18.894 1.692 1.00 0.00 O ATOM 0 H GLY A 16 -6.595 17.622 4.684 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -6.502 19.840 3.431 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -5.319 19.033 2.422 1.00 0.00 H new ATOM 199 N GLN A 17 -7.342 16.881 2.263 1.00 0.00 N ATOM 200 CA GLN A 17 -8.379 16.122 1.606 1.00 0.00 C ATOM 201 C GLN A 17 -8.548 14.790 2.353 1.00 0.00 C ATOM 202 O GLN A 17 -7.974 13.762 1.995 1.00 0.00 O ATOM 203 CB GLN A 17 -7.952 15.977 0.127 1.00 0.00 C ATOM 204 CG GLN A 17 -6.494 15.513 -0.094 1.00 0.00 C ATOM 205 CD GLN A 17 -6.183 15.197 -1.548 1.00 0.00 C ATOM 206 OE1 GLN A 17 -6.967 14.530 -2.222 1.00 0.00 O ATOM 207 NE2 GLN A 17 -5.038 15.634 -2.044 1.00 0.00 N ATOM 0 H GLN A 17 -6.640 16.301 2.722 1.00 0.00 H new ATOM 0 HA GLN A 17 -9.357 16.603 1.623 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -8.620 15.267 -0.360 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -8.090 16.937 -0.370 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -5.815 16.290 0.256 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -6.305 14.627 0.513 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -4.407 16.185 -1.462 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -4.785 15.420 -3.009 1.00 0.00 H new ATOM 216 N MET A 18 -9.491 14.767 3.297 1.00 0.00 N ATOM 217 CA MET A 18 -9.883 13.572 4.037 1.00 0.00 C ATOM 218 C MET A 18 -10.981 12.887 3.229 1.00 0.00 C ATOM 219 O MET A 18 -12.175 12.928 3.520 1.00 0.00 O ATOM 220 CB MET A 18 -10.217 13.870 5.505 1.00 0.00 C ATOM 221 CG MET A 18 -11.340 14.876 5.759 1.00 0.00 C ATOM 222 SD MET A 18 -12.319 14.447 7.222 1.00 0.00 S ATOM 223 CE MET A 18 -13.971 14.565 6.498 1.00 0.00 C ATOM 0 H MET A 18 -10.013 15.599 3.572 1.00 0.00 H new ATOM 0 HA MET A 18 -9.053 12.872 4.137 1.00 0.00 H new ATOM 0 HB2 MET A 18 -10.483 12.932 5.991 1.00 0.00 H new ATOM 0 HB3 MET A 18 -9.314 14.237 5.993 1.00 0.00 H new ATOM 0 HG2 MET A 18 -10.913 15.871 5.888 1.00 0.00 H new ATOM 0 HG3 MET A 18 -11.992 14.919 4.887 1.00 0.00 H new ATOM 0 HE1 MET A 18 -14.718 14.332 7.257 1.00 0.00 H new ATOM 0 HE2 MET A 18 -14.134 15.577 6.127 1.00 0.00 H new ATOM 0 HE3 MET A 18 -14.058 13.857 5.673 1.00 0.00 H new ATOM 233 N ASN A 19 -10.523 12.361 2.104 1.00 0.00 N ATOM 234 CA ASN A 19 -11.281 11.846 0.984 1.00 0.00 C ATOM 235 C ASN A 19 -10.678 10.511 0.566 1.00 0.00 C ATOM 236 O ASN A 19 -9.747 10.021 1.200 1.00 0.00 O ATOM 237 CB ASN A 19 -11.280 12.865 -0.169 1.00 0.00 C ATOM 238 CG ASN A 19 -10.099 12.730 -1.128 1.00 0.00 C ATOM 239 OD1 ASN A 19 -10.312 12.538 -2.317 1.00 0.00 O ATOM 240 ND2 ASN A 19 -8.866 12.829 -0.665 1.00 0.00 N ATOM 0 H ASN A 19 -9.519 12.278 1.941 1.00 0.00 H new ATOM 0 HA ASN A 19 -12.322 11.686 1.266 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -12.206 12.757 -0.734 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -11.278 13.871 0.251 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -8.074 12.745 -1.302 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -8.706 12.989 0.330 1.00 0.00 H new ATOM 247 N LYS A 20 -11.224 9.909 -0.487 1.00 0.00 N ATOM 248 CA LYS A 20 -10.553 8.817 -1.175 1.00 0.00 C ATOM 249 C LYS A 20 -9.715 9.458 -2.282 1.00 0.00 C ATOM 250 O LYS A 20 -10.243 9.753 -3.345 1.00 0.00 O ATOM 251 CB LYS A 20 -11.547 7.780 -1.743 1.00 0.00 C ATOM 252 CG LYS A 20 -12.499 7.199 -0.689 1.00 0.00 C ATOM 253 CD LYS A 20 -13.869 7.876 -0.711 1.00 0.00 C ATOM 254 CE LYS A 20 -14.735 7.338 0.432 1.00 0.00 C ATOM 255 NZ LYS A 20 -16.073 7.961 0.454 1.00 0.00 N ATOM 0 H LYS A 20 -12.130 10.161 -0.881 1.00 0.00 H new ATOM 0 HA LYS A 20 -9.927 8.257 -0.480 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -12.135 8.248 -2.533 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -10.987 6.966 -2.202 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -12.621 6.130 -0.863 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -12.056 7.313 0.300 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -13.752 8.955 -0.614 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -14.359 7.693 -1.667 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -14.840 6.258 0.330 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.234 7.521 1.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -16.626 7.568 1.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -15.975 8.989 0.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -16.562 7.765 -0.443 1.00 0.00 H new ATOM 269 N MET A 21 -8.424 9.696 -2.064 1.00 0.00 N ATOM 270 CA MET A 21 -7.465 9.415 -3.122 1.00 0.00 C ATOM 271 C MET A 21 -7.390 7.889 -3.239 1.00 0.00 C ATOM 272 O MET A 21 -7.731 7.184 -2.282 1.00 0.00 O ATOM 273 CB MET A 21 -6.089 10.004 -2.805 1.00 0.00 C ATOM 274 CG MET A 21 -6.010 11.496 -3.090 1.00 0.00 C ATOM 275 SD MET A 21 -4.418 12.239 -2.681 1.00 0.00 S ATOM 276 CE MET A 21 -4.472 12.168 -0.870 1.00 0.00 C ATOM 0 H MET A 21 -8.031 10.068 -1.199 1.00 0.00 H new ATOM 0 HA MET A 21 -7.781 9.872 -4.060 1.00 0.00 H new ATOM 0 HB2 MET A 21 -5.855 9.826 -1.755 1.00 0.00 H new ATOM 0 HB3 MET A 21 -5.332 9.485 -3.393 1.00 0.00 H new ATOM 0 HG2 MET A 21 -6.217 11.665 -4.147 1.00 0.00 H new ATOM 0 HG3 MET A 21 -6.792 12.005 -2.527 1.00 0.00 H new ATOM 0 HE1 MET A 21 -4.087 13.101 -0.458 1.00 0.00 H new ATOM 0 HE2 MET A 21 -5.501 12.024 -0.542 1.00 0.00 H new ATOM 0 HE3 MET A 21 -3.860 11.337 -0.520 1.00 0.00 H new ATOM 286 N GLY A 22 -6.927 7.376 -4.380 1.00 0.00 N ATOM 287 CA GLY A 22 -6.746 5.950 -4.576 1.00 0.00 C ATOM 288 C GLY A 22 -7.512 5.448 -5.787 1.00 0.00 C ATOM 289 O GLY A 22 -7.863 6.215 -6.697 1.00 0.00 O ATOM 0 H GLY A 22 -6.669 7.942 -5.188 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -5.685 5.731 -4.700 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -7.080 5.415 -3.687 1.00 0.00 H new ATOM 293 N GLY A 23 -7.705 4.133 -5.814 1.00 0.00 N ATOM 294 CA GLY A 23 -8.020 3.380 -7.001 1.00 0.00 C ATOM 295 C GLY A 23 -8.079 1.904 -6.649 1.00 0.00 C ATOM 296 O GLY A 23 -8.580 1.556 -5.577 1.00 0.00 O ATOM 0 H GLY A 23 -7.642 3.553 -4.978 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.975 3.707 -7.412 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.266 3.554 -7.769 1.00 0.00 H new ATOM 300 N PHE A 24 -7.570 1.041 -7.523 1.00 0.00 N ATOM 301 CA PHE A 24 -7.514 -0.404 -7.332 1.00 0.00 C ATOM 302 C PHE A 24 -6.070 -0.830 -7.019 1.00 0.00 C ATOM 303 O PHE A 24 -5.117 -0.133 -7.374 1.00 0.00 O ATOM 304 CB PHE A 24 -8.095 -1.122 -8.564 1.00 0.00 C ATOM 305 CG PHE A 24 -9.607 -1.322 -8.526 1.00 0.00 C ATOM 306 CD1 PHE A 24 -10.486 -0.230 -8.381 1.00 0.00 C ATOM 307 CD2 PHE A 24 -10.146 -2.619 -8.630 1.00 0.00 C ATOM 308 CE1 PHE A 24 -11.874 -0.442 -8.311 1.00 0.00 C ATOM 309 CE2 PHE A 24 -11.533 -2.831 -8.565 1.00 0.00 C ATOM 310 CZ PHE A 24 -12.400 -1.740 -8.402 1.00 0.00 C ATOM 0 H PHE A 24 -7.172 1.339 -8.414 1.00 0.00 H new ATOM 0 HA PHE A 24 -8.128 -0.694 -6.479 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -7.839 -0.550 -9.456 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -7.615 -2.096 -8.661 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -10.092 0.774 -8.323 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -9.484 -3.462 -8.762 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -12.540 0.399 -8.186 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -11.931 -3.832 -8.640 1.00 0.00 H new ATOM 0 HZ PHE A 24 -13.467 -1.898 -8.347 1.00 0.00 H new ATOM 320 N ASN A 25 -5.938 -1.962 -6.322 1.00 0.00 N ATOM 321 CA ASN A 25 -4.709 -2.591 -5.829 1.00 0.00 C ATOM 322 C ASN A 25 -4.825 -4.092 -6.080 1.00 0.00 C ATOM 323 O ASN A 25 -5.949 -4.596 -6.029 1.00 0.00 O ATOM 324 CB ASN A 25 -4.599 -2.392 -4.303 1.00 0.00 C ATOM 325 CG ASN A 25 -3.636 -1.294 -3.887 1.00 0.00 C ATOM 326 OD1 ASN A 25 -2.517 -1.577 -3.465 1.00 0.00 O ATOM 327 ND2 ASN A 25 -4.047 -0.043 -3.911 1.00 0.00 N ATOM 0 H ASN A 25 -6.760 -2.509 -6.066 1.00 0.00 H new ATOM 0 HA ASN A 25 -3.845 -2.155 -6.330 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -5.588 -2.163 -3.905 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -4.282 -3.330 -3.847 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -3.435 0.701 -3.577 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -4.978 0.181 -4.263 1.00 0.00 H new ATOM 334 N LEU A 26 -3.714 -4.820 -6.225 1.00 0.00 N ATOM 335 CA LEU A 26 -3.643 -6.287 -6.230 1.00 0.00 C ATOM 336 C LEU A 26 -2.273 -6.690 -5.681 1.00 0.00 C ATOM 337 O LEU A 26 -1.274 -6.035 -5.983 1.00 0.00 O ATOM 338 CB LEU A 26 -3.814 -6.861 -7.655 1.00 0.00 C ATOM 339 CG LEU A 26 -5.252 -7.265 -8.032 1.00 0.00 C ATOM 340 CD1 LEU A 26 -5.464 -7.312 -9.550 1.00 0.00 C ATOM 341 CD2 LEU A 26 -5.619 -8.629 -7.442 1.00 0.00 C ATOM 0 H LEU A 26 -2.799 -4.386 -6.347 1.00 0.00 H new ATOM 0 HA LEU A 26 -4.451 -6.686 -5.616 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.462 -6.120 -8.372 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -3.170 -7.734 -7.757 1.00 0.00 H new ATOM 0 HG LEU A 26 -5.900 -6.496 -7.612 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -6.493 -7.601 -9.765 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -5.268 -6.328 -9.975 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -4.783 -8.040 -9.990 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -6.640 -8.886 -7.726 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -4.935 -9.387 -7.824 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -5.544 -8.587 -6.355 1.00 0.00 H new ATOM 353 N LYS A 27 -2.234 -7.763 -4.887 1.00 0.00 N ATOM 354 CA LYS A 27 -1.049 -8.325 -4.231 1.00 0.00 C ATOM 355 C LYS A 27 -0.834 -9.723 -4.800 1.00 0.00 C ATOM 356 O LYS A 27 -1.830 -10.423 -5.011 1.00 0.00 O ATOM 357 CB LYS A 27 -1.340 -8.352 -2.712 1.00 0.00 C ATOM 358 CG LYS A 27 -0.535 -9.356 -1.865 1.00 0.00 C ATOM 359 CD LYS A 27 -1.046 -9.416 -0.413 1.00 0.00 C ATOM 360 CE LYS A 27 -0.474 -8.290 0.457 1.00 0.00 C ATOM 361 NZ LYS A 27 -1.370 -7.910 1.568 1.00 0.00 N ATOM 0 H LYS A 27 -3.078 -8.294 -4.672 1.00 0.00 H new ATOM 0 HA LYS A 27 -0.144 -7.742 -4.402 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -1.161 -7.353 -2.315 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -2.400 -8.565 -2.574 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -0.601 -10.347 -2.315 1.00 0.00 H new ATOM 0 HG3 LYS A 27 0.518 -9.073 -1.869 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -2.134 -9.355 -0.411 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -0.780 -10.379 0.023 1.00 0.00 H new ATOM 0 HE2 LYS A 27 0.487 -8.604 0.864 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -0.286 -7.416 -0.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -0.827 -7.399 2.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -2.129 -7.297 1.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -1.786 -8.766 1.987 1.00 0.00 H new ATOM 375 N TYR A 28 0.416 -10.182 -4.937 1.00 0.00 N ATOM 376 CA TYR A 28 0.744 -11.545 -5.333 1.00 0.00 C ATOM 377 C TYR A 28 1.826 -12.038 -4.384 1.00 0.00 C ATOM 378 O TYR A 28 2.965 -11.581 -4.441 1.00 0.00 O ATOM 379 CB TYR A 28 1.211 -11.611 -6.802 1.00 0.00 C ATOM 380 CG TYR A 28 0.294 -12.411 -7.707 1.00 0.00 C ATOM 381 CD1 TYR A 28 -0.945 -11.873 -8.092 1.00 0.00 C ATOM 382 CD2 TYR A 28 0.678 -13.687 -8.167 1.00 0.00 C ATOM 383 CE1 TYR A 28 -1.803 -12.603 -8.929 1.00 0.00 C ATOM 384 CE2 TYR A 28 -0.169 -14.417 -9.022 1.00 0.00 C ATOM 385 CZ TYR A 28 -1.420 -13.876 -9.399 1.00 0.00 C ATOM 386 OH TYR A 28 -2.235 -14.559 -10.248 1.00 0.00 O ATOM 0 H TYR A 28 1.238 -9.601 -4.771 1.00 0.00 H new ATOM 0 HA TYR A 28 -0.139 -12.181 -5.270 1.00 0.00 H new ATOM 0 HB2 TYR A 28 1.294 -10.596 -7.192 1.00 0.00 H new ATOM 0 HB3 TYR A 28 2.209 -12.048 -6.836 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -1.238 -10.894 -7.743 1.00 0.00 H new ATOM 0 HD2 TYR A 28 1.626 -14.106 -7.862 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -2.759 -12.189 -9.214 1.00 0.00 H new ATOM 0 HE2 TYR A 28 0.135 -15.386 -9.389 1.00 0.00 H new ATOM 0 HH TYR A 28 -1.823 -15.418 -10.477 1.00 0.00 H new ATOM 396 N ARG A 29 1.504 -12.991 -3.516 1.00 0.00 N ATOM 397 CA ARG A 29 2.476 -13.626 -2.630 1.00 0.00 C ATOM 398 C ARG A 29 2.982 -14.878 -3.330 1.00 0.00 C ATOM 399 O ARG A 29 2.284 -15.423 -4.188 1.00 0.00 O ATOM 400 CB ARG A 29 1.790 -13.976 -1.292 1.00 0.00 C ATOM 401 CG ARG A 29 0.821 -15.173 -1.386 1.00 0.00 C ATOM 402 CD ARG A 29 -0.392 -15.032 -0.464 1.00 0.00 C ATOM 403 NE ARG A 29 -0.151 -15.471 0.918 1.00 0.00 N ATOM 404 CZ ARG A 29 -0.312 -16.729 1.355 1.00 0.00 C ATOM 405 NH1 ARG A 29 -0.386 -17.752 0.508 1.00 0.00 N ATOM 406 NH2 ARG A 29 -0.417 -16.966 2.651 1.00 0.00 N ATOM 0 H ARG A 29 0.555 -13.348 -3.406 1.00 0.00 H new ATOM 0 HA ARG A 29 3.314 -12.963 -2.414 1.00 0.00 H new ATOM 0 HB2 ARG A 29 2.556 -14.197 -0.548 1.00 0.00 H new ATOM 0 HB3 ARG A 29 1.242 -13.104 -0.936 1.00 0.00 H new ATOM 0 HG2 ARG A 29 0.478 -15.276 -2.416 1.00 0.00 H new ATOM 0 HG3 ARG A 29 1.357 -16.088 -1.135 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -0.706 -13.988 -0.452 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -1.219 -15.609 -0.878 1.00 0.00 H new ATOM 0 HE ARG A 29 0.160 -14.771 1.591 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -0.320 -17.588 -0.497 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -0.509 -18.700 0.863 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -0.376 -16.193 3.316 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -0.540 -17.921 2.986 1.00 0.00 H new ATOM 420 N TYR A 30 4.160 -15.365 -2.955 1.00 0.00 N ATOM 421 CA TYR A 30 4.584 -16.707 -3.333 1.00 0.00 C ATOM 422 C TYR A 30 5.377 -17.355 -2.205 1.00 0.00 C ATOM 423 O TYR A 30 5.869 -16.653 -1.314 1.00 0.00 O ATOM 424 CB TYR A 30 5.333 -16.699 -4.670 1.00 0.00 C ATOM 425 CG TYR A 30 6.533 -15.777 -4.765 1.00 0.00 C ATOM 426 CD1 TYR A 30 7.808 -16.248 -4.405 1.00 0.00 C ATOM 427 CD2 TYR A 30 6.385 -14.471 -5.274 1.00 0.00 C ATOM 428 CE1 TYR A 30 8.936 -15.434 -4.587 1.00 0.00 C ATOM 429 CE2 TYR A 30 7.513 -13.656 -5.477 1.00 0.00 C ATOM 430 CZ TYR A 30 8.797 -14.146 -5.152 1.00 0.00 C ATOM 431 OH TYR A 30 9.909 -13.405 -5.399 1.00 0.00 O ATOM 0 H TYR A 30 4.837 -14.851 -2.391 1.00 0.00 H new ATOM 0 HA TYR A 30 3.699 -17.324 -3.490 1.00 0.00 H new ATOM 0 HB2 TYR A 30 5.665 -17.715 -4.881 1.00 0.00 H new ATOM 0 HB3 TYR A 30 4.628 -16.424 -5.455 1.00 0.00 H new ATOM 0 HD1 TYR A 30 7.919 -17.238 -3.988 1.00 0.00 H new ATOM 0 HD2 TYR A 30 5.401 -14.094 -5.509 1.00 0.00 H new ATOM 0 HE1 TYR A 30 9.912 -15.792 -4.295 1.00 0.00 H new ATOM 0 HE2 TYR A 30 7.398 -12.660 -5.879 1.00 0.00 H new ATOM 0 HH TYR A 30 9.649 -12.544 -5.789 1.00 0.00 H new ATOM 441 N GLU A 31 5.447 -18.690 -2.202 1.00 0.00 N ATOM 442 CA GLU A 31 6.345 -19.440 -1.336 1.00 0.00 C ATOM 443 C GLU A 31 7.207 -20.363 -2.189 1.00 0.00 C ATOM 444 O GLU A 31 6.729 -21.341 -2.766 1.00 0.00 O ATOM 445 CB GLU A 31 5.576 -20.212 -0.247 1.00 0.00 C ATOM 446 CG GLU A 31 4.368 -21.024 -0.722 1.00 0.00 C ATOM 447 CD GLU A 31 3.708 -21.797 0.414 1.00 0.00 C ATOM 448 OE1 GLU A 31 3.712 -21.331 1.577 1.00 0.00 O ATOM 449 OE2 GLU A 31 3.029 -22.794 0.104 1.00 0.00 O ATOM 0 H GLU A 31 4.875 -19.279 -2.807 1.00 0.00 H new ATOM 0 HA GLU A 31 6.995 -18.742 -0.808 1.00 0.00 H new ATOM 0 HB2 GLU A 31 6.271 -20.890 0.249 1.00 0.00 H new ATOM 0 HB3 GLU A 31 5.236 -19.499 0.504 1.00 0.00 H new ATOM 0 HG2 GLU A 31 3.638 -20.353 -1.175 1.00 0.00 H new ATOM 0 HG3 GLU A 31 4.684 -21.722 -1.498 1.00 0.00 H new ATOM 456 N GLU A 32 8.502 -20.081 -2.239 1.00 0.00 N ATOM 457 CA GLU A 32 9.484 -21.055 -2.688 1.00 0.00 C ATOM 458 C GLU A 32 9.813 -21.986 -1.495 1.00 0.00 C ATOM 459 O GLU A 32 9.518 -21.642 -0.344 1.00 0.00 O ATOM 460 CB GLU A 32 10.701 -20.291 -3.249 1.00 0.00 C ATOM 461 CG GLU A 32 11.170 -20.836 -4.603 1.00 0.00 C ATOM 462 CD GLU A 32 11.503 -22.311 -4.459 1.00 0.00 C ATOM 463 OE1 GLU A 32 12.525 -22.606 -3.803 1.00 0.00 O ATOM 464 OE2 GLU A 32 10.642 -23.160 -4.785 1.00 0.00 O ATOM 0 H GLU A 32 8.897 -19.179 -1.972 1.00 0.00 H new ATOM 0 HA GLU A 32 9.117 -21.690 -3.494 1.00 0.00 H new ATOM 0 HB2 GLU A 32 10.445 -19.237 -3.355 1.00 0.00 H new ATOM 0 HB3 GLU A 32 11.522 -20.349 -2.535 1.00 0.00 H new ATOM 0 HG2 GLU A 32 10.392 -20.698 -5.353 1.00 0.00 H new ATOM 0 HG3 GLU A 32 12.045 -20.285 -4.947 1.00 0.00 H new ATOM 471 N ASP A 33 10.433 -23.142 -1.729 1.00 0.00 N ATOM 472 CA ASP A 33 10.625 -24.230 -0.753 1.00 0.00 C ATOM 473 C ASP A 33 12.040 -24.262 -0.166 1.00 0.00 C ATOM 474 O ASP A 33 12.417 -25.205 0.540 1.00 0.00 O ATOM 475 CB ASP A 33 10.270 -25.581 -1.412 1.00 0.00 C ATOM 476 CG ASP A 33 8.830 -26.018 -1.149 1.00 0.00 C ATOM 477 OD1 ASP A 33 8.215 -25.610 -0.135 1.00 0.00 O ATOM 478 OD2 ASP A 33 8.258 -26.743 -1.986 1.00 0.00 O ATOM 0 H ASP A 33 10.835 -23.362 -2.641 1.00 0.00 H new ATOM 0 HA ASP A 33 9.955 -24.043 0.086 1.00 0.00 H new ATOM 0 HB2 ASP A 33 10.430 -25.506 -2.488 1.00 0.00 H new ATOM 0 HB3 ASP A 33 10.949 -26.349 -1.041 1.00 0.00 H new ATOM 483 N ASN A 34 12.847 -23.241 -0.455 1.00 0.00 N ATOM 484 CA ASN A 34 14.263 -23.203 -0.093 1.00 0.00 C ATOM 485 C ASN A 34 14.578 -22.237 1.059 1.00 0.00 C ATOM 486 O ASN A 34 15.736 -22.138 1.461 1.00 0.00 O ATOM 487 CB ASN A 34 15.099 -22.939 -1.355 1.00 0.00 C ATOM 488 CG ASN A 34 16.030 -24.100 -1.636 1.00 0.00 C ATOM 489 OD1 ASN A 34 17.162 -24.113 -1.163 1.00 0.00 O ATOM 490 ND2 ASN A 34 15.579 -25.079 -2.399 1.00 0.00 N ATOM 0 H ASN A 34 12.532 -22.408 -0.953 1.00 0.00 H new ATOM 0 HA ASN A 34 14.539 -24.178 0.308 1.00 0.00 H new ATOM 0 HB2 ASN A 34 14.439 -22.782 -2.208 1.00 0.00 H new ATOM 0 HB3 ASN A 34 15.679 -22.025 -1.228 1.00 0.00 H new ATOM 0 HD21 ASN A 34 16.177 -25.877 -2.611 1.00 0.00 H new ATOM 0 HD22 ASN A 34 14.632 -25.037 -2.776 1.00 0.00 H new ATOM 497 N SER A 35 13.573 -21.528 1.586 1.00 0.00 N ATOM 498 CA SER A 35 13.600 -20.778 2.845 1.00 0.00 C ATOM 499 C SER A 35 12.142 -20.564 3.281 1.00 0.00 C ATOM 500 O SER A 35 11.326 -20.244 2.410 1.00 0.00 O ATOM 501 CB SER A 35 14.258 -19.400 2.640 1.00 0.00 C ATOM 502 OG SER A 35 15.449 -19.259 3.392 1.00 0.00 O ATOM 0 H SER A 35 12.669 -21.459 1.118 1.00 0.00 H new ATOM 0 HA SER A 35 14.170 -21.329 3.593 1.00 0.00 H new ATOM 0 HB2 SER A 35 14.479 -19.259 1.582 1.00 0.00 H new ATOM 0 HB3 SER A 35 13.555 -18.617 2.926 1.00 0.00 H new ATOM 0 HG SER A 35 15.834 -18.372 3.231 1.00 0.00 H new ATOM 508 N PRO A 36 11.774 -20.671 4.572 1.00 0.00 N ATOM 509 CA PRO A 36 10.442 -20.307 5.040 1.00 0.00 C ATOM 510 C PRO A 36 10.353 -18.777 5.097 1.00 0.00 C ATOM 511 O PRO A 36 10.601 -18.152 6.132 1.00 0.00 O ATOM 512 CB PRO A 36 10.282 -20.995 6.398 1.00 0.00 C ATOM 513 CG PRO A 36 11.712 -21.045 6.930 1.00 0.00 C ATOM 514 CD PRO A 36 12.579 -21.177 5.673 1.00 0.00 C ATOM 0 HA PRO A 36 9.630 -20.630 4.388 1.00 0.00 H new ATOM 0 HB2 PRO A 36 9.625 -20.432 7.060 1.00 0.00 H new ATOM 0 HB3 PRO A 36 9.854 -21.992 6.297 1.00 0.00 H new ATOM 0 HG2 PRO A 36 11.959 -20.144 7.491 1.00 0.00 H new ATOM 0 HG3 PRO A 36 11.857 -21.890 7.604 1.00 0.00 H new ATOM 0 HD2 PRO A 36 13.502 -20.607 5.775 1.00 0.00 H new ATOM 0 HD3 PRO A 36 12.863 -22.216 5.503 1.00 0.00 H new ATOM 522 N LEU A 37 10.108 -18.154 3.948 1.00 0.00 N ATOM 523 CA LEU A 37 9.963 -16.719 3.763 1.00 0.00 C ATOM 524 C LEU A 37 9.017 -16.489 2.581 1.00 0.00 C ATOM 525 O LEU A 37 8.801 -17.394 1.765 1.00 0.00 O ATOM 526 CB LEU A 37 11.343 -16.062 3.564 1.00 0.00 C ATOM 527 CG LEU A 37 11.353 -14.537 3.783 1.00 0.00 C ATOM 528 CD1 LEU A 37 11.060 -14.171 5.244 1.00 0.00 C ATOM 529 CD2 LEU A 37 12.714 -13.958 3.386 1.00 0.00 C ATOM 0 H LEU A 37 10.000 -18.669 3.074 1.00 0.00 H new ATOM 0 HA LEU A 37 9.532 -16.250 4.647 1.00 0.00 H new ATOM 0 HB2 LEU A 37 12.054 -16.521 4.251 1.00 0.00 H new ATOM 0 HB3 LEU A 37 11.692 -16.275 2.554 1.00 0.00 H new ATOM 0 HG LEU A 37 10.568 -14.113 3.157 1.00 0.00 H new ATOM 0 HD11 LEU A 37 11.076 -13.087 5.358 1.00 0.00 H new ATOM 0 HD12 LEU A 37 10.078 -14.551 5.524 1.00 0.00 H new ATOM 0 HD13 LEU A 37 11.818 -14.615 5.889 1.00 0.00 H new ATOM 0 HD21 LEU A 37 12.711 -12.880 3.544 1.00 0.00 H new ATOM 0 HD22 LEU A 37 13.495 -14.412 3.996 1.00 0.00 H new ATOM 0 HD23 LEU A 37 12.907 -14.170 2.334 1.00 0.00 H new ATOM 541 N GLY A 38 8.372 -15.326 2.519 1.00 0.00 N ATOM 542 CA GLY A 38 7.575 -14.909 1.371 1.00 0.00 C ATOM 543 C GLY A 38 7.871 -13.481 0.980 1.00 0.00 C ATOM 544 O GLY A 38 8.719 -12.847 1.599 1.00 0.00 O ATOM 0 H GLY A 38 8.389 -14.640 3.274 1.00 0.00 H new ATOM 0 HA2 GLY A 38 7.779 -15.568 0.527 1.00 0.00 H new ATOM 0 HA3 GLY A 38 6.516 -15.011 1.606 1.00 0.00 H new ATOM 548 N VAL A 39 7.159 -12.991 -0.035 1.00 0.00 N ATOM 549 CA VAL A 39 7.471 -11.773 -0.775 1.00 0.00 C ATOM 550 C VAL A 39 6.159 -11.081 -1.131 1.00 0.00 C ATOM 551 O VAL A 39 5.240 -11.770 -1.577 1.00 0.00 O ATOM 552 CB VAL A 39 8.199 -12.177 -2.074 1.00 0.00 C ATOM 553 CG1 VAL A 39 8.653 -10.950 -2.852 1.00 0.00 C ATOM 554 CG2 VAL A 39 9.411 -13.071 -1.819 1.00 0.00 C ATOM 0 H VAL A 39 6.316 -13.452 -0.376 1.00 0.00 H new ATOM 0 HA VAL A 39 8.097 -11.104 -0.184 1.00 0.00 H new ATOM 0 HB VAL A 39 7.472 -12.743 -2.657 1.00 0.00 H new ATOM 0 HG11 VAL A 39 9.163 -11.265 -3.763 1.00 0.00 H new ATOM 0 HG12 VAL A 39 7.786 -10.343 -3.113 1.00 0.00 H new ATOM 0 HG13 VAL A 39 9.336 -10.362 -2.238 1.00 0.00 H new ATOM 0 HG21 VAL A 39 9.883 -13.323 -2.768 1.00 0.00 H new ATOM 0 HG22 VAL A 39 10.126 -12.544 -1.187 1.00 0.00 H new ATOM 0 HG23 VAL A 39 9.090 -13.985 -1.319 1.00 0.00 H new ATOM 564 N ILE A 40 6.068 -9.754 -0.996 1.00 0.00 N ATOM 565 CA ILE A 40 4.877 -8.962 -1.292 1.00 0.00 C ATOM 566 C ILE A 40 5.277 -7.658 -1.978 1.00 0.00 C ATOM 567 O ILE A 40 6.202 -6.982 -1.526 1.00 0.00 O ATOM 568 CB ILE A 40 4.147 -8.652 0.040 1.00 0.00 C ATOM 569 CG1 ILE A 40 3.620 -9.921 0.732 1.00 0.00 C ATOM 570 CG2 ILE A 40 3.003 -7.626 -0.082 1.00 0.00 C ATOM 571 CD1 ILE A 40 2.550 -10.699 -0.044 1.00 0.00 C ATOM 0 H ILE A 40 6.849 -9.186 -0.667 1.00 0.00 H new ATOM 0 HA ILE A 40 4.218 -9.518 -1.958 1.00 0.00 H new ATOM 0 HB ILE A 40 4.922 -8.198 0.657 1.00 0.00 H new ATOM 0 HG12 ILE A 40 4.462 -10.587 0.922 1.00 0.00 H new ATOM 0 HG13 ILE A 40 3.209 -9.641 1.702 1.00 0.00 H new ATOM 0 HG21 ILE A 40 2.549 -7.470 0.896 1.00 0.00 H new ATOM 0 HG22 ILE A 40 3.400 -6.681 -0.453 1.00 0.00 H new ATOM 0 HG23 ILE A 40 2.250 -8.001 -0.776 1.00 0.00 H new ATOM 0 HD11 ILE A 40 2.248 -11.574 0.531 1.00 0.00 H new ATOM 0 HD12 ILE A 40 1.684 -10.058 -0.212 1.00 0.00 H new ATOM 0 HD13 ILE A 40 2.957 -11.018 -1.004 1.00 0.00 H new ATOM 583 N GLY A 41 4.473 -7.242 -2.957 1.00 0.00 N ATOM 584 CA GLY A 41 4.172 -5.850 -3.244 1.00 0.00 C ATOM 585 C GLY A 41 2.648 -5.707 -3.314 1.00 0.00 C ATOM 586 O GLY A 41 1.914 -6.696 -3.282 1.00 0.00 O ATOM 0 H GLY A 41 4.001 -7.889 -3.589 1.00 0.00 H new ATOM 0 HA2 GLY A 41 4.582 -5.203 -2.469 1.00 0.00 H new ATOM 0 HA3 GLY A 41 4.628 -5.547 -4.186 1.00 0.00 H new ATOM 590 N SER A 42 2.124 -4.485 -3.323 1.00 0.00 N ATOM 591 CA SER A 42 0.937 -4.130 -4.100 1.00 0.00 C ATOM 592 C SER A 42 1.305 -2.902 -4.938 1.00 0.00 C ATOM 593 O SER A 42 2.255 -2.197 -4.583 1.00 0.00 O ATOM 594 CB SER A 42 -0.320 -4.005 -3.230 1.00 0.00 C ATOM 595 OG SER A 42 -1.500 -3.915 -4.000 1.00 0.00 O ATOM 0 H SER A 42 2.512 -3.707 -2.789 1.00 0.00 H new ATOM 0 HA SER A 42 0.648 -4.927 -4.786 1.00 0.00 H new ATOM 0 HB2 SER A 42 -0.387 -4.867 -2.567 1.00 0.00 H new ATOM 0 HB3 SER A 42 -0.234 -3.122 -2.597 1.00 0.00 H new ATOM 0 HG SER A 42 -2.065 -3.195 -3.650 1.00 0.00 H new ATOM 601 N PHE A 43 0.637 -2.662 -6.064 1.00 0.00 N ATOM 602 CA PHE A 43 0.705 -1.375 -6.762 1.00 0.00 C ATOM 603 C PHE A 43 -0.526 -0.552 -6.376 1.00 0.00 C ATOM 604 O PHE A 43 -1.602 -1.119 -6.205 1.00 0.00 O ATOM 605 CB PHE A 43 0.758 -1.610 -8.276 1.00 0.00 C ATOM 606 CG PHE A 43 2.155 -1.897 -8.793 1.00 0.00 C ATOM 607 CD1 PHE A 43 2.805 -3.102 -8.462 1.00 0.00 C ATOM 608 CD2 PHE A 43 2.826 -0.930 -9.567 1.00 0.00 C ATOM 609 CE1 PHE A 43 4.123 -3.334 -8.891 1.00 0.00 C ATOM 610 CE2 PHE A 43 4.138 -1.172 -10.010 1.00 0.00 C ATOM 611 CZ PHE A 43 4.785 -2.369 -9.669 1.00 0.00 C ATOM 0 H PHE A 43 0.035 -3.349 -6.519 1.00 0.00 H new ATOM 0 HA PHE A 43 1.605 -0.831 -6.476 1.00 0.00 H new ATOM 0 HB2 PHE A 43 0.106 -2.446 -8.529 1.00 0.00 H new ATOM 0 HB3 PHE A 43 0.363 -0.732 -8.787 1.00 0.00 H new ATOM 0 HD1 PHE A 43 2.289 -3.849 -7.877 1.00 0.00 H new ATOM 0 HD2 PHE A 43 2.333 -0.003 -9.820 1.00 0.00 H new ATOM 0 HE1 PHE A 43 4.626 -4.252 -8.623 1.00 0.00 H new ATOM 0 HE2 PHE A 43 4.648 -0.436 -10.613 1.00 0.00 H new ATOM 0 HZ PHE A 43 5.795 -2.550 -10.005 1.00 0.00 H new ATOM 621 N THR A 44 -0.374 0.768 -6.240 1.00 0.00 N ATOM 622 CA THR A 44 -1.459 1.711 -5.978 1.00 0.00 C ATOM 623 C THR A 44 -1.391 2.829 -7.024 1.00 0.00 C ATOM 624 O THR A 44 -0.305 3.359 -7.288 1.00 0.00 O ATOM 625 CB THR A 44 -1.333 2.241 -4.538 1.00 0.00 C ATOM 626 OG1 THR A 44 -1.424 1.186 -3.603 1.00 0.00 O ATOM 627 CG2 THR A 44 -2.443 3.224 -4.156 1.00 0.00 C ATOM 0 H THR A 44 0.537 1.222 -6.312 1.00 0.00 H new ATOM 0 HA THR A 44 -2.434 1.230 -6.060 1.00 0.00 H new ATOM 0 HB THR A 44 -0.364 2.740 -4.511 1.00 0.00 H new ATOM 0 HG1 THR A 44 -1.340 1.545 -2.695 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.295 3.559 -3.129 1.00 0.00 H new ATOM 0 HG22 THR A 44 -2.414 4.083 -4.826 1.00 0.00 H new ATOM 0 HG23 THR A 44 -3.411 2.730 -4.241 1.00 0.00 H new ATOM 635 N TYR A 45 -2.531 3.197 -7.615 1.00 0.00 N ATOM 636 CA TYR A 45 -2.621 4.132 -8.731 1.00 0.00 C ATOM 637 C TYR A 45 -3.870 5.001 -8.535 1.00 0.00 C ATOM 638 O TYR A 45 -4.967 4.469 -8.354 1.00 0.00 O ATOM 639 CB TYR A 45 -2.641 3.305 -10.023 1.00 0.00 C ATOM 640 CG TYR A 45 -2.854 4.084 -11.303 1.00 0.00 C ATOM 641 CD1 TYR A 45 -1.764 4.704 -11.939 1.00 0.00 C ATOM 642 CD2 TYR A 45 -4.136 4.160 -11.876 1.00 0.00 C ATOM 643 CE1 TYR A 45 -1.958 5.421 -13.129 1.00 0.00 C ATOM 644 CE2 TYR A 45 -4.339 4.883 -13.062 1.00 0.00 C ATOM 645 CZ TYR A 45 -3.250 5.519 -13.691 1.00 0.00 C ATOM 646 OH TYR A 45 -3.433 6.202 -14.848 1.00 0.00 O ATOM 0 H TYR A 45 -3.440 2.841 -7.319 1.00 0.00 H new ATOM 0 HA TYR A 45 -1.772 4.813 -8.787 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -1.697 2.766 -10.101 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -3.429 2.557 -9.940 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -0.776 4.628 -11.511 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -4.968 3.660 -11.402 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -1.120 5.898 -13.615 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -5.328 4.952 -13.491 1.00 0.00 H new ATOM 0 HH TYR A 45 -2.974 7.066 -14.794 1.00 0.00 H new ATOM 656 N THR A 46 -3.716 6.328 -8.510 1.00 0.00 N ATOM 657 CA THR A 46 -4.738 7.233 -7.992 1.00 0.00 C ATOM 658 C THR A 46 -5.531 7.816 -9.166 1.00 0.00 C ATOM 659 O THR A 46 -4.948 8.339 -10.115 1.00 0.00 O ATOM 660 CB THR A 46 -4.064 8.287 -7.084 1.00 0.00 C ATOM 661 OG1 THR A 46 -4.964 8.803 -6.123 1.00 0.00 O ATOM 662 CG2 THR A 46 -3.398 9.467 -7.805 1.00 0.00 C ATOM 0 H THR A 46 -2.879 6.802 -8.849 1.00 0.00 H new ATOM 0 HA THR A 46 -5.464 6.714 -7.366 1.00 0.00 H new ATOM 0 HB THR A 46 -3.263 7.720 -6.610 1.00 0.00 H new ATOM 0 HG1 THR A 46 -4.504 9.465 -5.566 1.00 0.00 H new ATOM 0 HG21 THR A 46 -2.959 10.142 -7.070 1.00 0.00 H new ATOM 0 HG22 THR A 46 -2.617 9.094 -8.468 1.00 0.00 H new ATOM 0 HG23 THR A 46 -4.145 10.004 -8.390 1.00 0.00 H new ATOM 670 N GLU A 47 -6.862 7.697 -9.122 1.00 0.00 N ATOM 671 CA GLU A 47 -7.734 8.103 -10.228 1.00 0.00 C ATOM 672 C GLU A 47 -9.012 8.815 -9.734 1.00 0.00 C ATOM 673 O GLU A 47 -9.866 9.222 -10.526 1.00 0.00 O ATOM 674 CB GLU A 47 -8.012 6.853 -11.089 1.00 0.00 C ATOM 675 CG GLU A 47 -8.738 7.074 -12.427 1.00 0.00 C ATOM 676 CD GLU A 47 -8.010 8.045 -13.357 1.00 0.00 C ATOM 677 OE1 GLU A 47 -8.008 9.273 -13.109 1.00 0.00 O ATOM 678 OE2 GLU A 47 -7.464 7.616 -14.397 1.00 0.00 O ATOM 0 H GLU A 47 -7.364 7.317 -8.320 1.00 0.00 H new ATOM 0 HA GLU A 47 -7.240 8.852 -10.846 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -7.059 6.366 -11.297 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -8.603 6.156 -10.494 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -8.853 6.115 -12.932 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -9.741 7.453 -12.230 1.00 0.00 H new ATOM 685 N LYS A 48 -9.182 8.990 -8.419 1.00 0.00 N ATOM 686 CA LYS A 48 -10.345 9.662 -7.833 1.00 0.00 C ATOM 687 C LYS A 48 -10.176 11.175 -7.981 1.00 0.00 C ATOM 688 O LYS A 48 -9.184 11.721 -7.492 1.00 0.00 O ATOM 689 CB LYS A 48 -10.452 9.267 -6.349 1.00 0.00 C ATOM 690 CG LYS A 48 -11.877 8.955 -5.854 1.00 0.00 C ATOM 691 CD LYS A 48 -12.758 10.197 -5.675 1.00 0.00 C ATOM 692 CE LYS A 48 -13.601 10.459 -6.927 1.00 0.00 C ATOM 693 NZ LYS A 48 -14.098 11.846 -6.958 1.00 0.00 N ATOM 0 H LYS A 48 -8.509 8.665 -7.725 1.00 0.00 H new ATOM 0 HA LYS A 48 -11.259 9.362 -8.345 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -9.825 8.392 -6.176 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -10.044 10.076 -5.744 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -12.357 8.280 -6.562 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -11.813 8.427 -4.903 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.412 10.062 -4.814 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.132 11.064 -5.466 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -13.003 10.265 -7.818 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -14.444 9.768 -6.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -14.106 12.190 -7.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -15.063 11.878 -6.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -13.476 12.450 -6.384 1.00 0.00 H new ATOM 707 N SER A 49 -11.117 11.880 -8.608 1.00 0.00 N ATOM 708 CA SER A 49 -11.018 13.329 -8.736 1.00 0.00 C ATOM 709 C SER A 49 -11.147 14.001 -7.368 1.00 0.00 C ATOM 710 O SER A 49 -11.882 13.523 -6.499 1.00 0.00 O ATOM 711 CB SER A 49 -12.086 13.852 -9.711 1.00 0.00 C ATOM 712 OG SER A 49 -13.394 13.602 -9.230 1.00 0.00 O ATOM 0 H SER A 49 -11.950 11.472 -9.032 1.00 0.00 H new ATOM 0 HA SER A 49 -10.036 13.578 -9.140 1.00 0.00 H new ATOM 0 HB2 SER A 49 -11.951 14.923 -9.860 1.00 0.00 H new ATOM 0 HB3 SER A 49 -11.957 13.376 -10.683 1.00 0.00 H new ATOM 0 HG SER A 49 -14.050 13.948 -9.871 1.00 0.00 H new ATOM 718 N ARG A 50 -10.536 15.177 -7.225 1.00 0.00 N ATOM 719 CA ARG A 50 -10.892 16.176 -6.229 1.00 0.00 C ATOM 720 C ARG A 50 -10.957 17.492 -6.988 1.00 0.00 C ATOM 721 O ARG A 50 -10.004 17.858 -7.678 1.00 0.00 O ATOM 722 CB ARG A 50 -9.858 16.248 -5.091 1.00 0.00 C ATOM 723 CG ARG A 50 -10.069 15.247 -3.944 1.00 0.00 C ATOM 724 CD ARG A 50 -10.734 15.861 -2.705 1.00 0.00 C ATOM 725 NE ARG A 50 -12.151 16.176 -2.929 1.00 0.00 N ATOM 726 CZ ARG A 50 -12.678 17.364 -3.237 1.00 0.00 C ATOM 727 NH1 ARG A 50 -11.945 18.479 -3.274 1.00 0.00 N ATOM 728 NH2 ARG A 50 -13.966 17.410 -3.542 1.00 0.00 N ATOM 0 H ARG A 50 -9.758 15.465 -7.818 1.00 0.00 H new ATOM 0 HA ARG A 50 -11.839 15.932 -5.747 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -8.866 16.087 -5.513 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -9.868 17.256 -4.677 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -10.682 14.421 -4.303 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -9.105 14.827 -3.658 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -10.646 15.168 -1.868 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -10.202 16.770 -2.423 1.00 0.00 H new ATOM 0 HE ARG A 50 -12.807 15.400 -2.839 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -10.948 18.441 -3.063 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -12.382 19.369 -3.513 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -14.522 16.555 -3.537 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -14.402 18.300 -3.782 1.00 0.00 H new ATOM 807 N TYR A 57 -7.186 21.662 -8.099 1.00 0.00 N ATOM 808 CA TYR A 57 -7.476 20.571 -9.020 1.00 0.00 C ATOM 809 C TYR A 57 -6.548 19.387 -8.748 1.00 0.00 C ATOM 810 O TYR A 57 -5.333 19.573 -8.764 1.00 0.00 O ATOM 811 CB TYR A 57 -7.249 21.115 -10.438 1.00 0.00 C ATOM 812 CG TYR A 57 -7.587 20.167 -11.570 1.00 0.00 C ATOM 813 CD1 TYR A 57 -8.889 20.151 -12.099 1.00 0.00 C ATOM 814 CD2 TYR A 57 -6.585 19.363 -12.143 1.00 0.00 C ATOM 815 CE1 TYR A 57 -9.181 19.376 -13.232 1.00 0.00 C ATOM 816 CE2 TYR A 57 -6.872 18.570 -13.267 1.00 0.00 C ATOM 817 CZ TYR A 57 -8.169 18.589 -13.827 1.00 0.00 C ATOM 818 OH TYR A 57 -8.467 17.833 -14.921 1.00 0.00 O ATOM 0 HA TYR A 57 -8.500 20.218 -8.898 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -7.843 22.021 -10.559 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -6.203 21.405 -10.532 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -9.667 20.737 -11.632 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -5.592 19.355 -11.718 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -10.177 19.381 -13.649 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -6.103 17.948 -13.701 1.00 0.00 H new ATOM 0 HH TYR A 57 -7.666 17.350 -15.213 1.00 0.00 H new ATOM 828 N ASN A 58 -7.079 18.175 -8.530 1.00 0.00 N ATOM 829 CA ASN A 58 -6.260 16.957 -8.462 1.00 0.00 C ATOM 830 C ASN A 58 -5.569 16.719 -9.804 1.00 0.00 C ATOM 831 O ASN A 58 -6.231 16.321 -10.768 1.00 0.00 O ATOM 832 CB ASN A 58 -7.078 15.717 -8.047 1.00 0.00 C ATOM 833 CG ASN A 58 -6.233 14.439 -8.035 1.00 0.00 C ATOM 834 OD1 ASN A 58 -5.006 14.481 -8.054 1.00 0.00 O ATOM 835 ND2 ASN A 58 -6.822 13.256 -8.047 1.00 0.00 N ATOM 0 H ASN A 58 -8.077 18.012 -8.397 1.00 0.00 H new ATOM 0 HA ASN A 58 -5.509 17.112 -7.687 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -7.501 15.879 -7.056 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -7.915 15.590 -8.734 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -6.259 12.406 -8.071 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -7.840 13.193 -8.032 1.00 0.00 H new ATOM 842 N LYS A 59 -4.248 16.908 -9.863 1.00 0.00 N ATOM 843 CA LYS A 59 -3.443 16.872 -11.085 1.00 0.00 C ATOM 844 C LYS A 59 -2.354 15.801 -10.992 1.00 0.00 C ATOM 845 O LYS A 59 -2.099 15.276 -9.901 1.00 0.00 O ATOM 846 CB LYS A 59 -2.846 18.281 -11.285 1.00 0.00 C ATOM 847 CG LYS A 59 -2.870 18.734 -12.748 1.00 0.00 C ATOM 848 CD LYS A 59 -2.777 20.261 -12.838 1.00 0.00 C ATOM 849 CE LYS A 59 -3.192 20.761 -14.223 1.00 0.00 C ATOM 850 NZ LYS A 59 -2.143 20.560 -15.234 1.00 0.00 N ATOM 0 H LYS A 59 -3.690 17.097 -9.030 1.00 0.00 H new ATOM 0 HA LYS A 59 -4.058 16.605 -11.944 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.403 18.996 -10.679 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -1.818 18.289 -10.924 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -2.039 18.281 -13.289 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -3.787 18.391 -13.226 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -3.416 20.712 -12.079 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -1.756 20.579 -12.625 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -4.098 20.242 -14.536 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -3.437 21.822 -14.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -2.474 20.915 -16.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -1.285 21.076 -14.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -1.926 19.546 -15.313 1.00 0.00 H new ATOM 864 N ASN A 60 -1.667 15.534 -12.109 1.00 0.00 N ATOM 865 CA ASN A 60 -0.519 14.621 -12.213 1.00 0.00 C ATOM 866 C ASN A 60 -0.898 13.199 -11.758 1.00 0.00 C ATOM 867 O ASN A 60 -2.076 12.834 -11.758 1.00 0.00 O ATOM 868 CB ASN A 60 0.691 15.221 -11.465 1.00 0.00 C ATOM 869 CG ASN A 60 2.015 14.704 -11.996 1.00 0.00 C ATOM 870 OD1 ASN A 60 2.733 13.890 -11.249 1.00 0.00 O flip ATOM 871 ND2 ASN A 60 2.411 15.044 -13.099 1.00 0.00 N flip ATOM 0 H ASN A 60 -1.904 15.965 -13.002 1.00 0.00 H new ATOM 0 HA ASN A 60 -0.221 14.515 -13.256 1.00 0.00 H new ATOM 0 HB2 ASN A 60 0.667 16.307 -11.553 1.00 0.00 H new ATOM 0 HB3 ASN A 60 0.612 14.985 -10.404 1.00 0.00 H new ATOM 0 HD21 ASN A 60 1.849 15.674 -13.671 1.00 0.00 H new ATOM 0 HD22 ASN A 60 3.304 14.698 -13.449 1.00 0.00 H new ATOM 878 N GLN A 61 0.069 12.363 -11.383 1.00 0.00 N ATOM 879 CA GLN A 61 -0.155 11.033 -10.832 1.00 0.00 C ATOM 880 C GLN A 61 0.640 10.903 -9.531 1.00 0.00 C ATOM 881 O GLN A 61 1.599 11.653 -9.310 1.00 0.00 O ATOM 882 CB GLN A 61 0.251 9.964 -11.865 1.00 0.00 C ATOM 883 CG GLN A 61 -0.795 8.851 -12.031 1.00 0.00 C ATOM 884 CD GLN A 61 -1.872 9.158 -13.074 1.00 0.00 C ATOM 885 OE1 GLN A 61 -2.004 8.454 -14.072 1.00 0.00 O ATOM 886 NE2 GLN A 61 -2.662 10.214 -12.928 1.00 0.00 N ATOM 0 H GLN A 61 1.058 12.602 -11.458 1.00 0.00 H new ATOM 0 HA GLN A 61 -1.211 10.882 -10.608 1.00 0.00 H new ATOM 0 HB2 GLN A 61 0.416 10.445 -12.829 1.00 0.00 H new ATOM 0 HB3 GLN A 61 1.200 9.520 -11.564 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -0.287 7.928 -12.310 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -1.276 8.672 -11.069 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -2.568 10.811 -12.106 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -3.363 10.429 -13.637 1.00 0.00 H new ATOM 895 N TYR A 62 0.239 9.965 -8.670 1.00 0.00 N ATOM 896 CA TYR A 62 0.952 9.598 -7.449 1.00 0.00 C ATOM 897 C TYR A 62 1.406 8.150 -7.611 1.00 0.00 C ATOM 898 O TYR A 62 0.844 7.406 -8.425 1.00 0.00 O ATOM 899 CB TYR A 62 0.065 9.730 -6.197 1.00 0.00 C ATOM 900 CG TYR A 62 -0.225 11.116 -5.628 1.00 0.00 C ATOM 901 CD1 TYR A 62 -0.330 12.275 -6.428 1.00 0.00 C ATOM 902 CD2 TYR A 62 -0.434 11.229 -4.240 1.00 0.00 C ATOM 903 CE1 TYR A 62 -0.634 13.520 -5.849 1.00 0.00 C ATOM 904 CE2 TYR A 62 -0.782 12.460 -3.662 1.00 0.00 C ATOM 905 CZ TYR A 62 -0.884 13.613 -4.464 1.00 0.00 C ATOM 906 OH TYR A 62 -1.173 14.812 -3.890 1.00 0.00 O ATOM 0 H TYR A 62 -0.615 9.426 -8.809 1.00 0.00 H new ATOM 0 HA TYR A 62 1.797 10.272 -7.307 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -0.893 9.262 -6.424 1.00 0.00 H new ATOM 0 HB3 TYR A 62 0.527 9.141 -5.405 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -0.175 12.205 -7.495 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -0.325 10.357 -3.612 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -0.676 14.406 -6.465 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -0.972 12.523 -2.601 1.00 0.00 H new ATOM 0 HH TYR A 62 -1.318 14.688 -2.929 1.00 0.00 H new ATOM 916 N TYR A 63 2.413 7.763 -6.838 1.00 0.00 N ATOM 917 CA TYR A 63 3.106 6.490 -6.903 1.00 0.00 C ATOM 918 C TYR A 63 3.110 5.888 -5.496 1.00 0.00 C ATOM 919 O TYR A 63 2.953 6.622 -4.512 1.00 0.00 O ATOM 920 CB TYR A 63 4.525 6.750 -7.436 1.00 0.00 C ATOM 921 CG TYR A 63 4.610 7.699 -8.628 1.00 0.00 C ATOM 922 CD1 TYR A 63 4.037 7.358 -9.867 1.00 0.00 C ATOM 923 CD2 TYR A 63 5.276 8.933 -8.502 1.00 0.00 C ATOM 924 CE1 TYR A 63 4.080 8.254 -10.952 1.00 0.00 C ATOM 925 CE2 TYR A 63 5.367 9.812 -9.594 1.00 0.00 C ATOM 926 CZ TYR A 63 4.743 9.493 -10.820 1.00 0.00 C ATOM 927 OH TYR A 63 4.811 10.372 -11.860 1.00 0.00 O ATOM 0 H TYR A 63 2.787 8.368 -6.107 1.00 0.00 H new ATOM 0 HA TYR A 63 2.620 5.781 -7.573 1.00 0.00 H new ATOM 0 HB2 TYR A 63 5.131 7.155 -6.626 1.00 0.00 H new ATOM 0 HB3 TYR A 63 4.969 5.796 -7.720 1.00 0.00 H new ATOM 0 HD1 TYR A 63 3.558 6.397 -9.987 1.00 0.00 H new ATOM 0 HD2 TYR A 63 5.721 9.206 -7.557 1.00 0.00 H new ATOM 0 HE1 TYR A 63 3.605 7.993 -11.886 1.00 0.00 H new ATOM 0 HE2 TYR A 63 5.917 10.736 -9.495 1.00 0.00 H new ATOM 0 HH TYR A 63 5.306 11.171 -11.581 1.00 0.00 H new ATOM 937 N GLY A 64 3.259 4.568 -5.380 1.00 0.00 N ATOM 938 CA GLY A 64 3.318 3.885 -4.096 1.00 0.00 C ATOM 939 C GLY A 64 4.179 2.644 -4.247 1.00 0.00 C ATOM 940 O GLY A 64 3.662 1.578 -4.591 1.00 0.00 O ATOM 0 H GLY A 64 3.342 3.943 -6.182 1.00 0.00 H new ATOM 0 HA2 GLY A 64 3.735 4.545 -3.335 1.00 0.00 H new ATOM 0 HA3 GLY A 64 2.316 3.612 -3.766 1.00 0.00 H new ATOM 944 N ILE A 65 5.489 2.776 -4.041 1.00 0.00 N ATOM 945 CA ILE A 65 6.424 1.661 -4.098 1.00 0.00 C ATOM 946 C ILE A 65 6.370 1.001 -2.720 1.00 0.00 C ATOM 947 O ILE A 65 6.773 1.581 -1.711 1.00 0.00 O ATOM 948 CB ILE A 65 7.837 2.105 -4.545 1.00 0.00 C ATOM 949 CG1 ILE A 65 7.944 2.333 -6.072 1.00 0.00 C ATOM 950 CG2 ILE A 65 8.882 1.016 -4.236 1.00 0.00 C ATOM 951 CD1 ILE A 65 7.074 3.440 -6.672 1.00 0.00 C ATOM 0 H ILE A 65 5.932 3.670 -3.828 1.00 0.00 H new ATOM 0 HA ILE A 65 6.148 0.934 -4.861 1.00 0.00 H new ATOM 0 HB ILE A 65 8.019 3.032 -4.001 1.00 0.00 H new ATOM 0 HG12 ILE A 65 8.985 2.554 -6.309 1.00 0.00 H new ATOM 0 HG13 ILE A 65 7.695 1.397 -6.572 1.00 0.00 H new ATOM 0 HG21 ILE A 65 9.866 1.354 -4.560 1.00 0.00 H new ATOM 0 HG22 ILE A 65 8.900 0.823 -3.163 1.00 0.00 H new ATOM 0 HG23 ILE A 65 8.620 0.100 -4.765 1.00 0.00 H new ATOM 0 HD11 ILE A 65 7.245 3.494 -7.747 1.00 0.00 H new ATOM 0 HD12 ILE A 65 6.023 3.220 -6.482 1.00 0.00 H new ATOM 0 HD13 ILE A 65 7.334 4.395 -6.215 1.00 0.00 H new ATOM 963 N THR A 66 5.869 -0.223 -2.680 1.00 0.00 N ATOM 964 CA THR A 66 5.664 -1.014 -1.495 1.00 0.00 C ATOM 965 C THR A 66 6.270 -2.376 -1.803 1.00 0.00 C ATOM 966 O THR A 66 5.976 -2.949 -2.859 1.00 0.00 O ATOM 967 CB THR A 66 4.160 -1.085 -1.196 1.00 0.00 C ATOM 968 OG1 THR A 66 3.572 0.208 -1.115 1.00 0.00 O ATOM 969 CG2 THR A 66 3.880 -1.819 0.107 1.00 0.00 C ATOM 0 H THR A 66 5.580 -0.712 -3.527 1.00 0.00 H new ATOM 0 HA THR A 66 6.134 -0.595 -0.605 1.00 0.00 H new ATOM 0 HB THR A 66 3.717 -1.632 -2.028 1.00 0.00 H new ATOM 0 HG1 THR A 66 2.983 0.251 -0.333 1.00 0.00 H new ATOM 0 HG21 THR A 66 2.805 -1.849 0.284 1.00 0.00 H new ATOM 0 HG22 THR A 66 4.265 -2.837 0.041 1.00 0.00 H new ATOM 0 HG23 THR A 66 4.369 -1.298 0.930 1.00 0.00 H new ATOM 977 N ALA A 67 7.143 -2.858 -0.923 1.00 0.00 N ATOM 978 CA ALA A 67 7.896 -4.085 -1.104 1.00 0.00 C ATOM 979 C ALA A 67 8.294 -4.627 0.261 1.00 0.00 C ATOM 980 O ALA A 67 8.552 -3.851 1.188 1.00 0.00 O ATOM 981 CB ALA A 67 9.165 -3.779 -1.903 1.00 0.00 C ATOM 0 H ALA A 67 7.348 -2.389 -0.041 1.00 0.00 H new ATOM 0 HA ALA A 67 7.288 -4.818 -1.635 1.00 0.00 H new ATOM 0 HB1 ALA A 67 9.737 -4.696 -2.043 1.00 0.00 H new ATOM 0 HB2 ALA A 67 8.893 -3.369 -2.875 1.00 0.00 H new ATOM 0 HB3 ALA A 67 9.771 -3.054 -1.360 1.00 0.00 H new ATOM 987 N GLY A 68 8.406 -5.946 0.380 1.00 0.00 N ATOM 988 CA GLY A 68 9.048 -6.568 1.523 1.00 0.00 C ATOM 989 C GLY A 68 8.651 -8.031 1.698 1.00 0.00 C ATOM 990 O GLY A 68 7.820 -8.555 0.948 1.00 0.00 O ATOM 0 H GLY A 68 8.055 -6.608 -0.312 1.00 0.00 H new ATOM 0 HA2 GLY A 68 10.130 -6.501 1.408 1.00 0.00 H new ATOM 0 HA3 GLY A 68 8.788 -6.015 2.426 1.00 0.00 H new ATOM 994 N PRO A 69 9.263 -8.710 2.680 1.00 0.00 N ATOM 995 CA PRO A 69 9.025 -10.116 2.949 1.00 0.00 C ATOM 996 C PRO A 69 7.674 -10.377 3.637 1.00 0.00 C ATOM 997 O PRO A 69 6.970 -9.447 4.034 1.00 0.00 O ATOM 998 CB PRO A 69 10.208 -10.563 3.815 1.00 0.00 C ATOM 999 CG PRO A 69 10.600 -9.287 4.555 1.00 0.00 C ATOM 1000 CD PRO A 69 10.350 -8.211 3.503 1.00 0.00 C ATOM 0 HA PRO A 69 8.960 -10.685 2.022 1.00 0.00 H new ATOM 0 HB2 PRO A 69 9.924 -11.358 4.505 1.00 0.00 H new ATOM 0 HB3 PRO A 69 11.029 -10.945 3.209 1.00 0.00 H new ATOM 0 HG2 PRO A 69 9.994 -9.132 5.447 1.00 0.00 H new ATOM 0 HG3 PRO A 69 11.641 -9.307 4.877 1.00 0.00 H new ATOM 0 HD2 PRO A 69 10.084 -7.262 3.969 1.00 0.00 H new ATOM 0 HD3 PRO A 69 11.244 -8.033 2.905 1.00 0.00 H new ATOM 1008 N ALA A 70 7.336 -11.656 3.834 1.00 0.00 N ATOM 1009 CA ALA A 70 6.139 -12.139 4.523 1.00 0.00 C ATOM 1010 C ALA A 70 6.511 -13.159 5.606 1.00 0.00 C ATOM 1011 O ALA A 70 7.339 -14.043 5.352 1.00 0.00 O ATOM 1012 CB ALA A 70 5.206 -12.784 3.498 1.00 0.00 C ATOM 0 H ALA A 70 7.922 -12.420 3.499 1.00 0.00 H new ATOM 0 HA ALA A 70 5.639 -11.299 5.006 1.00 0.00 H new ATOM 0 HB1 ALA A 70 4.310 -13.148 4.000 1.00 0.00 H new ATOM 0 HB2 ALA A 70 4.926 -12.046 2.746 1.00 0.00 H new ATOM 0 HB3 ALA A 70 5.716 -13.618 3.016 1.00 0.00 H new ATOM 1018 N TYR A 71 5.868 -13.079 6.776 1.00 0.00 N ATOM 1019 CA TYR A 71 6.241 -13.803 7.992 1.00 0.00 C ATOM 1020 C TYR A 71 5.065 -14.678 8.429 1.00 0.00 C ATOM 1021 O TYR A 71 3.940 -14.189 8.535 1.00 0.00 O ATOM 1022 CB TYR A 71 6.614 -12.777 9.077 1.00 0.00 C ATOM 1023 CG TYR A 71 7.776 -13.134 9.983 1.00 0.00 C ATOM 1024 CD1 TYR A 71 9.051 -13.365 9.432 1.00 0.00 C ATOM 1025 CD2 TYR A 71 7.614 -13.119 11.382 1.00 0.00 C ATOM 1026 CE1 TYR A 71 10.156 -13.590 10.270 1.00 0.00 C ATOM 1027 CE2 TYR A 71 8.720 -13.326 12.227 1.00 0.00 C ATOM 1028 CZ TYR A 71 9.994 -13.573 11.671 1.00 0.00 C ATOM 1029 OH TYR A 71 11.068 -13.791 12.478 1.00 0.00 O ATOM 0 H TYR A 71 5.047 -12.488 6.905 1.00 0.00 H new ATOM 0 HA TYR A 71 7.100 -14.451 7.816 1.00 0.00 H new ATOM 0 HB2 TYR A 71 6.844 -11.831 8.586 1.00 0.00 H new ATOM 0 HB3 TYR A 71 5.736 -12.607 9.701 1.00 0.00 H new ATOM 0 HD1 TYR A 71 9.180 -13.369 8.360 1.00 0.00 H new ATOM 0 HD2 TYR A 71 6.637 -12.948 11.808 1.00 0.00 H new ATOM 0 HE1 TYR A 71 11.130 -13.776 9.841 1.00 0.00 H new ATOM 0 HE2 TYR A 71 8.594 -13.296 13.299 1.00 0.00 H new ATOM 0 HH TYR A 71 10.787 -13.745 13.416 1.00 0.00 H new ATOM 1039 N ARG A 72 5.294 -15.970 8.667 1.00 0.00 N ATOM 1040 CA ARG A 72 4.240 -16.938 8.985 1.00 0.00 C ATOM 1041 C ARG A 72 4.229 -17.232 10.477 1.00 0.00 C ATOM 1042 O ARG A 72 5.253 -17.099 11.152 1.00 0.00 O ATOM 1043 CB ARG A 72 4.329 -18.214 8.129 1.00 0.00 C ATOM 1044 CG ARG A 72 5.693 -18.926 8.137 1.00 0.00 C ATOM 1045 CD ARG A 72 6.606 -18.491 6.982 1.00 0.00 C ATOM 1046 NE ARG A 72 6.083 -18.973 5.695 1.00 0.00 N ATOM 1047 CZ ARG A 72 5.995 -18.320 4.536 1.00 0.00 C ATOM 1048 NH1 ARG A 72 6.373 -17.050 4.400 1.00 0.00 N ATOM 1049 NH2 ARG A 72 5.521 -18.969 3.487 1.00 0.00 N ATOM 0 H ARG A 72 6.228 -16.380 8.644 1.00 0.00 H new ATOM 0 HA ARG A 72 3.282 -16.487 8.726 1.00 0.00 H new ATOM 0 HB2 ARG A 72 3.571 -18.916 8.476 1.00 0.00 H new ATOM 0 HB3 ARG A 72 4.079 -17.958 7.099 1.00 0.00 H new ATOM 0 HG2 ARG A 72 6.195 -18.726 9.084 1.00 0.00 H new ATOM 0 HG3 ARG A 72 5.534 -20.003 8.081 1.00 0.00 H new ATOM 0 HD2 ARG A 72 6.685 -17.404 6.964 1.00 0.00 H new ATOM 0 HD3 ARG A 72 7.612 -18.881 7.140 1.00 0.00 H new ATOM 0 HE ARG A 72 5.742 -19.934 5.688 1.00 0.00 H new ATOM 0 HH11 ARG A 72 6.746 -16.540 5.201 1.00 0.00 H new ATOM 0 HH12 ARG A 72 6.289 -16.587 3.495 1.00 0.00 H new ATOM 0 HH21 ARG A 72 5.234 -19.944 3.577 1.00 0.00 H new ATOM 0 HH22 ARG A 72 5.442 -18.495 2.587 1.00 0.00 H new ATOM 1063 N ILE A 73 3.059 -17.543 11.028 1.00 0.00 N ATOM 1064 CA ILE A 73 2.943 -18.178 12.338 1.00 0.00 C ATOM 1065 C ILE A 73 3.242 -19.682 12.141 1.00 0.00 C ATOM 1066 O ILE A 73 3.533 -20.107 11.016 1.00 0.00 O ATOM 1067 CB ILE A 73 1.567 -17.767 12.937 1.00 0.00 C ATOM 1068 CG1 ILE A 73 1.681 -17.190 14.364 1.00 0.00 C ATOM 1069 CG2 ILE A 73 0.474 -18.842 12.866 1.00 0.00 C ATOM 1070 CD1 ILE A 73 0.732 -16.002 14.566 1.00 0.00 C ATOM 0 H ILE A 73 2.162 -17.361 10.578 1.00 0.00 H new ATOM 0 HA ILE A 73 3.663 -17.856 13.091 1.00 0.00 H new ATOM 0 HB ILE A 73 1.235 -16.970 12.272 1.00 0.00 H new ATOM 0 HG12 ILE A 73 1.452 -17.968 15.092 1.00 0.00 H new ATOM 0 HG13 ILE A 73 2.707 -16.873 14.549 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -0.444 -18.457 13.309 1.00 0.00 H new ATOM 0 HG22 ILE A 73 0.291 -19.107 11.825 1.00 0.00 H new ATOM 0 HG23 ILE A 73 0.798 -19.727 13.414 1.00 0.00 H new ATOM 0 HD11 ILE A 73 0.838 -15.620 15.581 1.00 0.00 H new ATOM 0 HD12 ILE A 73 0.979 -15.214 13.854 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -0.296 -16.326 14.406 1.00 0.00 H new ATOM 1082 N ASN A 74 3.223 -20.505 13.197 1.00 0.00 N ATOM 1083 CA ASN A 74 3.569 -21.932 13.077 1.00 0.00 C ATOM 1084 C ASN A 74 2.607 -22.643 12.129 1.00 0.00 C ATOM 1085 O ASN A 74 3.048 -23.252 11.158 1.00 0.00 O ATOM 1086 CB ASN A 74 3.647 -22.653 14.435 1.00 0.00 C ATOM 1087 CG ASN A 74 5.004 -22.513 15.120 1.00 0.00 C ATOM 1088 OD1 ASN A 74 5.971 -22.054 14.519 1.00 0.00 O ATOM 1089 ND2 ASN A 74 5.123 -22.927 16.370 1.00 0.00 N ATOM 0 H ASN A 74 2.973 -20.212 14.141 1.00 0.00 H new ATOM 0 HA ASN A 74 4.573 -21.974 12.655 1.00 0.00 H new ATOM 0 HB2 ASN A 74 2.874 -22.257 15.093 1.00 0.00 H new ATOM 0 HB3 ASN A 74 3.430 -23.711 14.289 1.00 0.00 H new ATOM 0 HD21 ASN A 74 6.024 -22.867 16.844 1.00 0.00 H new ATOM 0 HD22 ASN A 74 4.313 -23.307 16.861 1.00 0.00 H new ATOM 1096 N ASP A 75 1.309 -22.507 12.370 1.00 0.00 N ATOM 1097 CA ASP A 75 0.251 -22.524 11.362 1.00 0.00 C ATOM 1098 C ASP A 75 -0.948 -21.844 12.018 1.00 0.00 C ATOM 1099 O ASP A 75 -1.077 -21.938 13.236 1.00 0.00 O ATOM 1100 CB ASP A 75 -0.132 -23.947 10.921 1.00 0.00 C ATOM 1101 CG ASP A 75 -1.264 -23.894 9.892 1.00 0.00 C ATOM 1102 OD1 ASP A 75 -0.987 -23.561 8.714 1.00 0.00 O ATOM 1103 OD2 ASP A 75 -2.439 -24.097 10.266 1.00 0.00 O ATOM 0 H ASP A 75 0.947 -22.376 13.314 1.00 0.00 H new ATOM 0 HA ASP A 75 0.588 -22.016 10.458 1.00 0.00 H new ATOM 0 HB2 ASP A 75 0.736 -24.449 10.493 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -0.444 -24.532 11.786 1.00 0.00 H new ATOM 1108 N TRP A 76 -1.778 -21.159 11.231 1.00 0.00 N ATOM 1109 CA TRP A 76 -3.045 -20.483 11.533 1.00 0.00 C ATOM 1110 C TRP A 76 -3.151 -19.233 10.677 1.00 0.00 C ATOM 1111 O TRP A 76 -4.203 -18.996 10.086 1.00 0.00 O ATOM 1112 CB TRP A 76 -3.261 -20.077 13.006 1.00 0.00 C ATOM 1113 CG TRP A 76 -3.742 -21.108 13.982 1.00 0.00 C ATOM 1114 CD1 TRP A 76 -4.571 -22.143 13.721 1.00 0.00 C ATOM 1115 CD2 TRP A 76 -3.360 -21.246 15.384 1.00 0.00 C ATOM 1116 NE1 TRP A 76 -4.758 -22.878 14.872 1.00 0.00 N ATOM 1117 CE2 TRP A 76 -4.003 -22.398 15.918 1.00 0.00 C ATOM 1118 CE3 TRP A 76 -2.501 -20.532 16.247 1.00 0.00 C ATOM 1119 CZ2 TRP A 76 -3.797 -22.824 17.237 1.00 0.00 C ATOM 1120 CZ3 TRP A 76 -2.258 -20.973 17.561 1.00 0.00 C ATOM 1121 CH2 TRP A 76 -2.912 -22.111 18.060 1.00 0.00 C ATOM 0 H TRP A 76 -1.551 -21.050 10.243 1.00 0.00 H new ATOM 0 HA TRP A 76 -3.817 -21.221 11.314 1.00 0.00 H new ATOM 0 HB2 TRP A 76 -2.316 -19.685 13.381 1.00 0.00 H new ATOM 0 HB3 TRP A 76 -3.975 -19.254 13.019 1.00 0.00 H new ATOM 0 HD1 TRP A 76 -5.017 -22.360 12.762 1.00 0.00 H new ATOM 0 HE1 TRP A 76 -5.382 -23.682 14.940 1.00 0.00 H new ATOM 0 HE3 TRP A 76 -2.022 -19.631 15.893 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 -4.314 -23.693 17.616 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 -1.565 -20.433 18.189 1.00 0.00 H new ATOM 0 HH2 TRP A 76 -2.734 -22.437 19.074 1.00 0.00 H new ATOM 1132 N ALA A 77 -2.109 -18.404 10.666 1.00 0.00 N ATOM 1133 CA ALA A 77 -2.092 -17.143 9.956 1.00 0.00 C ATOM 1134 C ALA A 77 -0.675 -16.840 9.492 1.00 0.00 C ATOM 1135 O ALA A 77 0.299 -17.423 9.984 1.00 0.00 O ATOM 1136 CB ALA A 77 -2.584 -16.030 10.891 1.00 0.00 C ATOM 0 H ALA A 77 -1.240 -18.601 11.162 1.00 0.00 H new ATOM 0 HA ALA A 77 -2.747 -17.201 9.087 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -2.573 -15.078 10.361 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -3.600 -16.252 11.218 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -1.929 -15.969 11.760 1.00 0.00 H new ATOM 1142 N SER A 78 -0.569 -15.836 8.633 1.00 0.00 N ATOM 1143 CA SER A 78 0.673 -15.160 8.328 1.00 0.00 C ATOM 1144 C SER A 78 0.395 -13.651 8.373 1.00 0.00 C ATOM 1145 O SER A 78 -0.757 -13.209 8.252 1.00 0.00 O ATOM 1146 CB SER A 78 1.220 -15.666 6.982 1.00 0.00 C ATOM 1147 OG SER A 78 1.325 -17.079 6.945 1.00 0.00 O ATOM 0 H SER A 78 -1.367 -15.464 8.119 1.00 0.00 H new ATOM 0 HA SER A 78 1.457 -15.374 9.055 1.00 0.00 H new ATOM 0 HB2 SER A 78 0.566 -15.331 6.177 1.00 0.00 H new ATOM 0 HB3 SER A 78 2.200 -15.225 6.801 1.00 0.00 H new ATOM 0 HG SER A 78 1.675 -17.358 6.073 1.00 0.00 H new ATOM 1153 N ILE A 79 1.441 -12.858 8.591 1.00 0.00 N ATOM 1154 CA ILE A 79 1.421 -11.405 8.752 1.00 0.00 C ATOM 1155 C ILE A 79 2.436 -10.789 7.772 1.00 0.00 C ATOM 1156 O ILE A 79 3.240 -11.520 7.178 1.00 0.00 O ATOM 1157 CB ILE A 79 1.672 -11.041 10.241 1.00 0.00 C ATOM 1158 CG1 ILE A 79 3.141 -11.252 10.682 1.00 0.00 C ATOM 1159 CG2 ILE A 79 0.721 -11.837 11.163 1.00 0.00 C ATOM 1160 CD1 ILE A 79 3.418 -10.821 12.130 1.00 0.00 C ATOM 0 H ILE A 79 2.385 -13.236 8.665 1.00 0.00 H new ATOM 0 HA ILE A 79 0.446 -10.985 8.504 1.00 0.00 H new ATOM 0 HB ILE A 79 1.465 -9.975 10.334 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.397 -12.306 10.570 1.00 0.00 H new ATOM 0 HG13 ILE A 79 3.796 -10.692 10.014 1.00 0.00 H new ATOM 0 HG21 ILE A 79 0.912 -11.568 12.202 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -0.313 -11.600 10.911 1.00 0.00 H new ATOM 0 HG23 ILE A 79 0.892 -12.905 11.027 1.00 0.00 H new ATOM 0 HD11 ILE A 79 4.467 -10.998 12.368 1.00 0.00 H new ATOM 0 HD12 ILE A 79 3.194 -9.760 12.243 1.00 0.00 H new ATOM 0 HD13 ILE A 79 2.790 -11.398 12.808 1.00 0.00 H new ATOM 1172 N TYR A 80 2.414 -9.469 7.564 1.00 0.00 N ATOM 1173 CA TYR A 80 3.289 -8.828 6.592 1.00 0.00 C ATOM 1174 C TYR A 80 3.931 -7.601 7.238 1.00 0.00 C ATOM 1175 O TYR A 80 3.225 -6.707 7.703 1.00 0.00 O ATOM 1176 CB TYR A 80 2.462 -8.455 5.351 1.00 0.00 C ATOM 1177 CG TYR A 80 1.768 -9.597 4.627 1.00 0.00 C ATOM 1178 CD1 TYR A 80 2.530 -10.560 3.948 1.00 0.00 C ATOM 1179 CD2 TYR A 80 0.362 -9.664 4.574 1.00 0.00 C ATOM 1180 CE1 TYR A 80 1.895 -11.546 3.169 1.00 0.00 C ATOM 1181 CE2 TYR A 80 -0.277 -10.656 3.811 1.00 0.00 C ATOM 1182 CZ TYR A 80 0.488 -11.589 3.077 1.00 0.00 C ATOM 1183 OH TYR A 80 -0.105 -12.524 2.283 1.00 0.00 O ATOM 0 H TYR A 80 1.796 -8.827 8.060 1.00 0.00 H new ATOM 0 HA TYR A 80 4.087 -9.501 6.278 1.00 0.00 H new ATOM 0 HB2 TYR A 80 1.704 -7.732 5.652 1.00 0.00 H new ATOM 0 HB3 TYR A 80 3.120 -7.952 4.642 1.00 0.00 H new ATOM 0 HD1 TYR A 80 3.607 -10.545 4.023 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -0.230 -8.947 5.124 1.00 0.00 H new ATOM 0 HE1 TYR A 80 2.489 -12.275 2.638 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -1.356 -10.705 3.786 1.00 0.00 H new ATOM 0 HH TYR A 80 -0.565 -13.184 2.843 1.00 0.00 H new ATOM 1193 N GLY A 81 5.257 -7.543 7.241 1.00 0.00 N ATOM 1194 CA GLY A 81 6.058 -6.437 7.734 1.00 0.00 C ATOM 1195 C GLY A 81 6.875 -5.928 6.563 1.00 0.00 C ATOM 1196 O GLY A 81 7.987 -6.414 6.334 1.00 0.00 O ATOM 0 H GLY A 81 5.829 -8.307 6.881 1.00 0.00 H new ATOM 0 HA2 GLY A 81 5.422 -5.647 8.133 1.00 0.00 H new ATOM 0 HA3 GLY A 81 6.708 -6.763 8.546 1.00 0.00 H new ATOM 1200 N VAL A 82 6.294 -5.019 5.779 1.00 0.00 N ATOM 1201 CA VAL A 82 6.910 -4.501 4.549 1.00 0.00 C ATOM 1202 C VAL A 82 7.242 -3.010 4.719 1.00 0.00 C ATOM 1203 O VAL A 82 7.067 -2.465 5.813 1.00 0.00 O ATOM 1204 CB VAL A 82 6.051 -4.854 3.306 1.00 0.00 C ATOM 1205 CG1 VAL A 82 5.497 -6.287 3.358 1.00 0.00 C ATOM 1206 CG2 VAL A 82 4.934 -3.852 2.994 1.00 0.00 C ATOM 0 H VAL A 82 5.378 -4.617 5.977 1.00 0.00 H new ATOM 0 HA VAL A 82 7.865 -4.993 4.364 1.00 0.00 H new ATOM 0 HB VAL A 82 6.755 -4.787 2.476 1.00 0.00 H new ATOM 0 HG11 VAL A 82 4.904 -6.480 2.464 1.00 0.00 H new ATOM 0 HG12 VAL A 82 6.324 -6.995 3.405 1.00 0.00 H new ATOM 0 HG13 VAL A 82 4.870 -6.403 4.242 1.00 0.00 H new ATOM 0 HG21 VAL A 82 4.387 -4.180 2.110 1.00 0.00 H new ATOM 0 HG22 VAL A 82 4.251 -3.792 3.842 1.00 0.00 H new ATOM 0 HG23 VAL A 82 5.368 -2.870 2.808 1.00 0.00 H new ATOM 1216 N VAL A 83 7.747 -2.353 3.673 1.00 0.00 N ATOM 1217 CA VAL A 83 7.839 -0.898 3.606 1.00 0.00 C ATOM 1218 C VAL A 83 6.962 -0.399 2.470 1.00 0.00 C ATOM 1219 O VAL A 83 6.806 -1.103 1.471 1.00 0.00 O ATOM 1220 CB VAL A 83 9.292 -0.434 3.403 1.00 0.00 C ATOM 1221 CG1 VAL A 83 10.055 -0.588 4.709 1.00 0.00 C ATOM 1222 CG2 VAL A 83 10.058 -1.124 2.260 1.00 0.00 C ATOM 0 H VAL A 83 8.106 -2.823 2.842 1.00 0.00 H new ATOM 0 HA VAL A 83 7.494 -0.481 4.552 1.00 0.00 H new ATOM 0 HB VAL A 83 9.224 0.610 3.098 1.00 0.00 H new ATOM 0 HG11 VAL A 83 11.085 -0.260 4.569 1.00 0.00 H new ATOM 0 HG12 VAL A 83 9.582 0.020 5.480 1.00 0.00 H new ATOM 0 HG13 VAL A 83 10.045 -1.634 5.015 1.00 0.00 H new ATOM 0 HG21 VAL A 83 11.070 -0.722 2.206 1.00 0.00 H new ATOM 0 HG22 VAL A 83 10.103 -2.197 2.448 1.00 0.00 H new ATOM 0 HG23 VAL A 83 9.544 -0.942 1.316 1.00 0.00 H new ATOM 1232 N GLY A 84 6.449 0.823 2.607 1.00 0.00 N ATOM 1233 CA GLY A 84 5.808 1.583 1.547 1.00 0.00 C ATOM 1234 C GLY A 84 6.481 2.943 1.427 1.00 0.00 C ATOM 1235 O GLY A 84 7.102 3.421 2.382 1.00 0.00 O ATOM 0 H GLY A 84 6.472 1.325 3.494 1.00 0.00 H new ATOM 0 HA2 GLY A 84 5.880 1.044 0.602 1.00 0.00 H new ATOM 0 HA3 GLY A 84 4.747 1.707 1.763 1.00 0.00 H new ATOM 1239 N VAL A 85 6.356 3.598 0.278 1.00 0.00 N ATOM 1240 CA VAL A 85 6.751 4.981 0.108 1.00 0.00 C ATOM 1241 C VAL A 85 5.785 5.633 -0.878 1.00 0.00 C ATOM 1242 O VAL A 85 5.638 5.175 -2.011 1.00 0.00 O ATOM 1243 CB VAL A 85 8.248 5.105 -0.249 1.00 0.00 C ATOM 1244 CG1 VAL A 85 8.639 4.460 -1.577 1.00 0.00 C ATOM 1245 CG2 VAL A 85 8.713 6.558 -0.256 1.00 0.00 C ATOM 0 H VAL A 85 5.973 3.174 -0.567 1.00 0.00 H new ATOM 0 HA VAL A 85 6.672 5.533 1.045 1.00 0.00 H new ATOM 0 HB VAL A 85 8.752 4.551 0.543 1.00 0.00 H new ATOM 0 HG11 VAL A 85 9.707 4.595 -1.747 1.00 0.00 H new ATOM 0 HG12 VAL A 85 8.408 3.395 -1.546 1.00 0.00 H new ATOM 0 HG13 VAL A 85 8.081 4.929 -2.387 1.00 0.00 H new ATOM 0 HG21 VAL A 85 9.772 6.600 -0.512 1.00 0.00 H new ATOM 0 HG22 VAL A 85 8.139 7.120 -0.993 1.00 0.00 H new ATOM 0 HG23 VAL A 85 8.561 6.993 0.732 1.00 0.00 H new ATOM 1255 N GLY A 86 5.111 6.694 -0.442 1.00 0.00 N ATOM 1256 CA GLY A 86 4.136 7.431 -1.232 1.00 0.00 C ATOM 1257 C GLY A 86 4.808 8.671 -1.801 1.00 0.00 C ATOM 1258 O GLY A 86 5.089 9.609 -1.048 1.00 0.00 O ATOM 0 H GLY A 86 5.233 7.073 0.497 1.00 0.00 H new ATOM 0 HA2 GLY A 86 3.752 6.806 -2.038 1.00 0.00 H new ATOM 0 HA3 GLY A 86 3.284 7.713 -0.614 1.00 0.00 H new ATOM 1262 N TYR A 87 5.099 8.673 -3.104 1.00 0.00 N ATOM 1263 CA TYR A 87 5.655 9.826 -3.798 1.00 0.00 C ATOM 1264 C TYR A 87 4.558 10.396 -4.701 1.00 0.00 C ATOM 1265 O TYR A 87 4.079 9.736 -5.622 1.00 0.00 O ATOM 1266 CB TYR A 87 6.935 9.438 -4.558 1.00 0.00 C ATOM 1267 CG TYR A 87 7.832 10.628 -4.868 1.00 0.00 C ATOM 1268 CD1 TYR A 87 7.425 11.612 -5.789 1.00 0.00 C ATOM 1269 CD2 TYR A 87 9.068 10.771 -4.206 1.00 0.00 C ATOM 1270 CE1 TYR A 87 8.229 12.740 -6.024 1.00 0.00 C ATOM 1271 CE2 TYR A 87 9.880 11.897 -4.432 1.00 0.00 C ATOM 1272 CZ TYR A 87 9.457 12.893 -5.339 1.00 0.00 C ATOM 1273 OH TYR A 87 10.211 14.009 -5.555 1.00 0.00 O ATOM 0 H TYR A 87 4.952 7.864 -3.708 1.00 0.00 H new ATOM 0 HA TYR A 87 5.963 10.602 -3.097 1.00 0.00 H new ATOM 0 HB2 TYR A 87 7.495 8.713 -3.967 1.00 0.00 H new ATOM 0 HB3 TYR A 87 6.661 8.945 -5.491 1.00 0.00 H new ATOM 0 HD1 TYR A 87 6.490 11.499 -6.318 1.00 0.00 H new ATOM 0 HD2 TYR A 87 9.396 10.007 -3.517 1.00 0.00 H new ATOM 0 HE1 TYR A 87 7.909 13.492 -6.730 1.00 0.00 H new ATOM 0 HE2 TYR A 87 10.822 11.999 -3.914 1.00 0.00 H new ATOM 0 HH TYR A 87 9.622 14.773 -5.728 1.00 0.00 H new ATOM 1283 N GLY A 88 4.149 11.636 -4.443 1.00 0.00 N ATOM 1284 CA GLY A 88 3.052 12.302 -5.124 1.00 0.00 C ATOM 1285 C GLY A 88 3.496 13.669 -5.615 1.00 0.00 C ATOM 1286 O GLY A 88 4.620 14.100 -5.362 1.00 0.00 O ATOM 0 H GLY A 88 4.589 12.219 -3.731 1.00 0.00 H new ATOM 0 HA2 GLY A 88 2.715 11.697 -5.965 1.00 0.00 H new ATOM 0 HA3 GLY A 88 2.204 12.408 -4.447 1.00 0.00 H new ATOM 1290 N LYS A 89 2.629 14.346 -6.365 1.00 0.00 N ATOM 1291 CA LYS A 89 2.811 15.740 -6.749 1.00 0.00 C ATOM 1292 C LYS A 89 1.422 16.292 -7.001 1.00 0.00 C ATOM 1293 O LYS A 89 0.863 16.025 -8.066 1.00 0.00 O ATOM 1294 CB LYS A 89 3.725 15.851 -7.986 1.00 0.00 C ATOM 1295 CG LYS A 89 3.865 17.295 -8.495 1.00 0.00 C ATOM 1296 CD LYS A 89 4.914 17.423 -9.613 1.00 0.00 C ATOM 1297 CE LYS A 89 6.357 17.332 -9.095 1.00 0.00 C ATOM 1298 NZ LYS A 89 6.744 18.532 -8.325 1.00 0.00 N ATOM 0 H LYS A 89 1.769 13.934 -6.727 1.00 0.00 H new ATOM 0 HA LYS A 89 3.308 16.316 -5.968 1.00 0.00 H new ATOM 0 HB2 LYS A 89 4.712 15.460 -7.739 1.00 0.00 H new ATOM 0 HB3 LYS A 89 3.325 15.226 -8.785 1.00 0.00 H new ATOM 0 HG2 LYS A 89 2.900 17.642 -8.864 1.00 0.00 H new ATOM 0 HG3 LYS A 89 4.141 17.945 -7.665 1.00 0.00 H new ATOM 0 HD2 LYS A 89 4.748 16.638 -10.351 1.00 0.00 H new ATOM 0 HD3 LYS A 89 4.777 18.375 -10.125 1.00 0.00 H new ATOM 0 HE2 LYS A 89 6.462 16.448 -8.466 1.00 0.00 H new ATOM 0 HE3 LYS A 89 7.038 17.206 -9.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 7.761 18.493 -8.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 6.541 19.384 -8.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 6.203 18.564 -7.437 1.00 0.00 H new ATOM 1524 N SER A 103 7.737 18.248 -4.467 1.00 0.00 N ATOM 1525 CA SER A 103 7.268 16.990 -3.899 1.00 0.00 C ATOM 1526 C SER A 103 8.236 16.510 -2.806 1.00 0.00 C ATOM 1527 O SER A 103 9.430 16.827 -2.849 1.00 0.00 O ATOM 1528 CB SER A 103 7.116 15.974 -5.041 1.00 0.00 C ATOM 1529 OG SER A 103 8.188 16.055 -5.973 1.00 0.00 O ATOM 0 HA SER A 103 6.298 17.116 -3.419 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.071 14.967 -4.627 1.00 0.00 H new ATOM 0 HB3 SER A 103 6.172 16.148 -5.558 1.00 0.00 H new ATOM 0 HG SER A 103 8.638 16.921 -5.880 1.00 0.00 H new ATOM 1535 N ASP A 104 7.744 15.699 -1.870 1.00 0.00 N ATOM 1536 CA ASP A 104 8.554 14.906 -0.944 1.00 0.00 C ATOM 1537 C ASP A 104 7.861 13.554 -0.786 1.00 0.00 C ATOM 1538 O ASP A 104 6.673 13.436 -1.095 1.00 0.00 O ATOM 1539 CB ASP A 104 8.733 15.617 0.414 1.00 0.00 C ATOM 1540 CG ASP A 104 9.630 14.822 1.372 1.00 0.00 C ATOM 1541 OD1 ASP A 104 10.562 14.141 0.882 1.00 0.00 O ATOM 1542 OD2 ASP A 104 9.450 14.888 2.614 1.00 0.00 O ATOM 0 H ASP A 104 6.742 15.571 -1.731 1.00 0.00 H new ATOM 0 HA ASP A 104 9.561 14.773 -1.340 1.00 0.00 H new ATOM 0 HB2 ASP A 104 9.164 16.605 0.251 1.00 0.00 H new ATOM 0 HB3 ASP A 104 7.757 15.768 0.874 1.00 0.00 H new ATOM 1547 N TYR A 105 8.571 12.519 -0.351 1.00 0.00 N ATOM 1548 CA TYR A 105 7.989 11.204 -0.120 1.00 0.00 C ATOM 1549 C TYR A 105 7.388 11.130 1.284 1.00 0.00 C ATOM 1550 O TYR A 105 7.727 11.933 2.157 1.00 0.00 O ATOM 1551 CB TYR A 105 9.063 10.126 -0.295 1.00 0.00 C ATOM 1552 CG TYR A 105 10.239 10.213 0.661 1.00 0.00 C ATOM 1553 CD1 TYR A 105 11.351 10.999 0.315 1.00 0.00 C ATOM 1554 CD2 TYR A 105 10.225 9.521 1.890 1.00 0.00 C ATOM 1555 CE1 TYR A 105 12.426 11.132 1.206 1.00 0.00 C ATOM 1556 CE2 TYR A 105 11.306 9.641 2.783 1.00 0.00 C ATOM 1557 CZ TYR A 105 12.402 10.464 2.448 1.00 0.00 C ATOM 1558 OH TYR A 105 13.455 10.612 3.292 1.00 0.00 O ATOM 0 H TYR A 105 9.569 12.570 -0.148 1.00 0.00 H new ATOM 0 HA TYR A 105 7.193 11.035 -0.846 1.00 0.00 H new ATOM 0 HB2 TYR A 105 8.594 9.149 -0.179 1.00 0.00 H new ATOM 0 HB3 TYR A 105 9.442 10.178 -1.316 1.00 0.00 H new ATOM 0 HD1 TYR A 105 11.378 11.502 -0.640 1.00 0.00 H new ATOM 0 HD2 TYR A 105 9.382 8.897 2.147 1.00 0.00 H new ATOM 0 HE1 TYR A 105 13.273 11.747 0.941 1.00 0.00 H new ATOM 0 HE2 TYR A 105 11.297 9.105 3.721 1.00 0.00 H new ATOM 0 HH TYR A 105 13.295 10.093 4.108 1.00 0.00 H new ATOM 1568 N GLY A 106 6.573 10.104 1.532 1.00 0.00 N ATOM 1569 CA GLY A 106 6.191 9.665 2.867 1.00 0.00 C ATOM 1570 C GLY A 106 6.559 8.200 3.024 1.00 0.00 C ATOM 1571 O GLY A 106 6.470 7.465 2.047 1.00 0.00 O ATOM 0 H GLY A 106 6.152 9.545 0.790 1.00 0.00 H new ATOM 0 HA2 GLY A 106 6.700 10.265 3.622 1.00 0.00 H new ATOM 0 HA3 GLY A 106 5.120 9.804 3.018 1.00 0.00 H new ATOM 1575 N PHE A 107 7.026 7.782 4.202 1.00 0.00 N ATOM 1576 CA PHE A 107 7.787 6.546 4.399 1.00 0.00 C ATOM 1577 C PHE A 107 7.005 5.622 5.339 1.00 0.00 C ATOM 1578 O PHE A 107 7.087 5.764 6.562 1.00 0.00 O ATOM 1579 CB PHE A 107 9.183 6.942 4.929 1.00 0.00 C ATOM 1580 CG PHE A 107 10.281 5.899 4.796 1.00 0.00 C ATOM 1581 CD1 PHE A 107 10.758 5.543 3.519 1.00 0.00 C ATOM 1582 CD2 PHE A 107 10.874 5.328 5.941 1.00 0.00 C ATOM 1583 CE1 PHE A 107 11.792 4.597 3.390 1.00 0.00 C ATOM 1584 CE2 PHE A 107 11.917 4.390 5.810 1.00 0.00 C ATOM 1585 CZ PHE A 107 12.365 4.011 4.533 1.00 0.00 C ATOM 0 H PHE A 107 6.882 8.305 5.066 1.00 0.00 H new ATOM 0 HA PHE A 107 7.929 5.987 3.474 1.00 0.00 H new ATOM 0 HB2 PHE A 107 9.503 7.843 4.406 1.00 0.00 H new ATOM 0 HB3 PHE A 107 9.086 7.203 5.983 1.00 0.00 H new ATOM 0 HD1 PHE A 107 10.329 5.997 2.638 1.00 0.00 H new ATOM 0 HD2 PHE A 107 10.527 5.611 6.924 1.00 0.00 H new ATOM 0 HE1 PHE A 107 12.147 4.320 2.409 1.00 0.00 H new ATOM 0 HE2 PHE A 107 12.372 3.962 6.691 1.00 0.00 H new ATOM 0 HZ PHE A 107 13.146 3.273 4.430 1.00 0.00 H new ATOM 1595 N SER A 108 6.192 4.720 4.784 1.00 0.00 N ATOM 1596 CA SER A 108 5.298 3.878 5.562 1.00 0.00 C ATOM 1597 C SER A 108 6.022 2.614 6.009 1.00 0.00 C ATOM 1598 O SER A 108 6.857 2.052 5.295 1.00 0.00 O ATOM 1599 CB SER A 108 4.034 3.536 4.764 1.00 0.00 C ATOM 1600 OG SER A 108 3.127 2.807 5.577 1.00 0.00 O ATOM 0 H SER A 108 6.140 4.557 3.778 1.00 0.00 H new ATOM 0 HA SER A 108 4.988 4.429 6.450 1.00 0.00 H new ATOM 0 HB2 SER A 108 3.561 4.451 4.408 1.00 0.00 H new ATOM 0 HB3 SER A 108 4.298 2.950 3.884 1.00 0.00 H new ATOM 0 HG SER A 108 3.196 1.852 5.369 1.00 0.00 H new ATOM 1606 N TYR A 109 5.622 2.148 7.183 1.00 0.00 N ATOM 1607 CA TYR A 109 6.007 0.918 7.840 1.00 0.00 C ATOM 1608 C TYR A 109 4.706 0.238 8.288 1.00 0.00 C ATOM 1609 O TYR A 109 3.751 0.911 8.706 1.00 0.00 O ATOM 1610 CB TYR A 109 6.884 1.266 9.053 1.00 0.00 C ATOM 1611 CG TYR A 109 8.337 0.840 8.980 1.00 0.00 C ATOM 1612 CD1 TYR A 109 9.225 1.467 8.085 1.00 0.00 C ATOM 1613 CD2 TYR A 109 8.818 -0.150 9.857 1.00 0.00 C ATOM 1614 CE1 TYR A 109 10.584 1.102 8.069 1.00 0.00 C ATOM 1615 CE2 TYR A 109 10.168 -0.519 9.853 1.00 0.00 C ATOM 1616 CZ TYR A 109 11.056 0.112 8.960 1.00 0.00 C ATOM 1617 OH TYR A 109 12.356 -0.266 8.966 1.00 0.00 O ATOM 0 H TYR A 109 4.957 2.675 7.749 1.00 0.00 H new ATOM 0 HA TYR A 109 6.574 0.256 7.185 1.00 0.00 H new ATOM 0 HB2 TYR A 109 6.852 2.346 9.199 1.00 0.00 H new ATOM 0 HB3 TYR A 109 6.439 0.811 9.938 1.00 0.00 H new ATOM 0 HD1 TYR A 109 8.863 2.229 7.410 1.00 0.00 H new ATOM 0 HD2 TYR A 109 8.136 -0.631 10.542 1.00 0.00 H new ATOM 0 HE1 TYR A 109 11.264 1.577 7.378 1.00 0.00 H new ATOM 0 HE2 TYR A 109 10.526 -1.281 10.529 1.00 0.00 H new ATOM 0 HH TYR A 109 12.493 -0.957 9.647 1.00 0.00 H new ATOM 1627 N GLY A 110 4.679 -1.092 8.227 1.00 0.00 N ATOM 1628 CA GLY A 110 3.461 -1.887 8.316 1.00 0.00 C ATOM 1629 C GLY A 110 3.177 -2.465 6.939 1.00 0.00 C ATOM 1630 O GLY A 110 4.055 -2.390 6.076 1.00 0.00 O ATOM 0 H GLY A 110 5.521 -1.656 8.112 1.00 0.00 H new ATOM 0 HA2 GLY A 110 3.580 -2.686 9.048 1.00 0.00 H new ATOM 0 HA3 GLY A 110 2.627 -1.270 8.650 1.00 0.00 H new ATOM 1634 N ALA A 111 2.004 -3.064 6.732 1.00 0.00 N ATOM 1635 CA ALA A 111 1.614 -3.599 5.435 1.00 0.00 C ATOM 1636 C ALA A 111 0.126 -3.915 5.451 1.00 0.00 C ATOM 1637 O ALA A 111 -0.663 -3.333 4.706 1.00 0.00 O ATOM 1638 CB ALA A 111 2.396 -4.885 5.123 1.00 0.00 C ATOM 0 H ALA A 111 1.301 -3.190 7.460 1.00 0.00 H new ATOM 0 HA ALA A 111 1.835 -2.856 4.669 1.00 0.00 H new ATOM 0 HB1 ALA A 111 2.091 -5.270 4.150 1.00 0.00 H new ATOM 0 HB2 ALA A 111 3.464 -4.667 5.108 1.00 0.00 H new ATOM 0 HB3 ALA A 111 2.189 -5.632 5.889 1.00 0.00 H new ATOM 1644 N GLY A 112 -0.252 -4.887 6.277 1.00 0.00 N ATOM 1645 CA GLY A 112 -1.553 -5.502 6.243 1.00 0.00 C ATOM 1646 C GLY A 112 -1.440 -6.890 6.832 1.00 0.00 C ATOM 1647 O GLY A 112 -0.339 -7.339 7.179 1.00 0.00 O ATOM 0 H GLY A 112 0.359 -5.269 6.999 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -2.269 -4.907 6.810 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -1.922 -5.554 5.218 1.00 0.00 H new ATOM 1651 N LEU A 113 -2.579 -7.555 6.983 1.00 0.00 N ATOM 1652 CA LEU A 113 -2.689 -8.882 7.557 1.00 0.00 C ATOM 1653 C LEU A 113 -3.804 -9.599 6.825 1.00 0.00 C ATOM 1654 O LEU A 113 -4.847 -9.011 6.524 1.00 0.00 O ATOM 1655 CB LEU A 113 -2.973 -8.821 9.072 1.00 0.00 C ATOM 1656 CG LEU A 113 -1.752 -8.322 9.866 1.00 0.00 C ATOM 1657 CD1 LEU A 113 -1.851 -6.825 10.183 1.00 0.00 C ATOM 1658 CD2 LEU A 113 -1.518 -9.054 11.180 1.00 0.00 C ATOM 0 H LEU A 113 -3.479 -7.169 6.698 1.00 0.00 H new ATOM 0 HA LEU A 113 -1.747 -9.419 7.442 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -3.820 -8.160 9.256 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -3.258 -9.811 9.428 1.00 0.00 H new ATOM 0 HG LEU A 113 -0.911 -8.527 9.204 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.970 -6.513 10.744 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -1.908 -6.259 9.253 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -2.745 -6.637 10.778 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -0.639 -8.641 11.675 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -2.389 -8.932 11.824 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -1.358 -10.114 10.983 1.00 0.00 H new ATOM 1670 N GLN A 114 -3.621 -10.898 6.619 1.00 0.00 N ATOM 1671 CA GLN A 114 -4.519 -11.705 5.812 1.00 0.00 C ATOM 1672 C GLN A 114 -5.367 -12.536 6.759 1.00 0.00 C ATOM 1673 O GLN A 114 -4.918 -12.899 7.847 1.00 0.00 O ATOM 1674 CB GLN A 114 -3.729 -12.615 4.852 1.00 0.00 C ATOM 1675 CG GLN A 114 -2.559 -13.373 5.505 1.00 0.00 C ATOM 1676 CD GLN A 114 -2.289 -14.700 4.812 1.00 0.00 C ATOM 1677 OE1 GLN A 114 -1.700 -14.746 3.734 1.00 0.00 O ATOM 1678 NE2 GLN A 114 -2.730 -15.799 5.398 1.00 0.00 N ATOM 0 H GLN A 114 -2.839 -11.422 7.012 1.00 0.00 H new ATOM 0 HA GLN A 114 -5.151 -11.063 5.198 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -4.414 -13.340 4.413 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -3.340 -12.008 4.034 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -1.661 -12.756 5.470 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -2.783 -13.551 6.557 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -3.216 -15.740 6.293 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -2.584 -16.707 4.956 1.00 0.00 H new ATOM 1687 N PHE A 115 -6.594 -12.836 6.339 1.00 0.00 N ATOM 1688 CA PHE A 115 -7.452 -13.781 7.028 1.00 0.00 C ATOM 1689 C PHE A 115 -7.308 -15.143 6.359 1.00 0.00 C ATOM 1690 O PHE A 115 -6.667 -15.234 5.304 1.00 0.00 O ATOM 1691 CB PHE A 115 -8.891 -13.236 7.067 1.00 0.00 C ATOM 1692 CG PHE A 115 -9.480 -13.245 8.463 1.00 0.00 C ATOM 1693 CD1 PHE A 115 -8.733 -12.733 9.544 1.00 0.00 C ATOM 1694 CD2 PHE A 115 -10.754 -13.796 8.693 1.00 0.00 C ATOM 1695 CE1 PHE A 115 -9.209 -12.865 10.856 1.00 0.00 C ATOM 1696 CE2 PHE A 115 -11.242 -13.903 10.007 1.00 0.00 C ATOM 1697 CZ PHE A 115 -10.451 -13.472 11.087 1.00 0.00 C ATOM 0 H PHE A 115 -7.018 -12.425 5.507 1.00 0.00 H new ATOM 0 HA PHE A 115 -7.160 -13.912 8.070 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -8.900 -12.217 6.679 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -9.520 -13.834 6.407 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -7.791 -12.238 9.361 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -11.355 -14.136 7.863 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -8.621 -12.500 11.685 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -12.224 -14.316 10.187 1.00 0.00 H new ATOM 0 HZ PHE A 115 -10.802 -13.609 12.099 1.00 0.00 H new ATOM 1707 N ASN A 116 -7.877 -16.198 6.951 1.00 0.00 N ATOM 1708 CA ASN A 116 -7.672 -17.553 6.434 1.00 0.00 C ATOM 1709 C ASN A 116 -8.150 -17.634 4.994 1.00 0.00 C ATOM 1710 O ASN A 116 -9.172 -17.019 4.662 1.00 0.00 O ATOM 1711 CB ASN A 116 -8.410 -18.622 7.247 1.00 0.00 C ATOM 1712 CG ASN A 116 -7.566 -19.033 8.430 1.00 0.00 C ATOM 1713 OD1 ASN A 116 -6.675 -19.859 8.290 1.00 0.00 O ATOM 1714 ND2 ASN A 116 -7.800 -18.442 9.583 1.00 0.00 N ATOM 0 H ASN A 116 -8.474 -16.142 7.776 1.00 0.00 H new ATOM 0 HA ASN A 116 -6.603 -17.752 6.507 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -9.370 -18.235 7.589 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -8.621 -19.488 6.620 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -7.229 -18.668 10.397 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -8.552 -17.758 9.662 1.00 0.00 H new ATOM 1721 N PRO A 117 -7.460 -18.372 4.119 1.00 0.00 N ATOM 1722 CA PRO A 117 -7.962 -18.604 2.785 1.00 0.00 C ATOM 1723 C PRO A 117 -9.222 -19.477 2.816 1.00 0.00 C ATOM 1724 O PRO A 117 -9.439 -20.306 3.710 1.00 0.00 O ATOM 1725 CB PRO A 117 -6.810 -19.235 2.008 1.00 0.00 C ATOM 1726 CG PRO A 117 -5.908 -19.842 3.071 1.00 0.00 C ATOM 1727 CD PRO A 117 -6.159 -18.989 4.312 1.00 0.00 C ATOM 0 HA PRO A 117 -8.277 -17.682 2.297 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -7.170 -19.995 1.315 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -6.278 -18.490 1.416 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -6.154 -20.888 3.251 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -4.861 -19.808 2.770 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -6.147 -19.600 5.214 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -5.382 -18.233 4.429 1.00 0.00 H new ATOM 1735 N MET A 118 -10.019 -19.250 1.781 1.00 0.00 N ATOM 1736 CA MET A 118 -11.101 -20.039 1.223 1.00 0.00 C ATOM 1737 C MET A 118 -10.570 -20.575 -0.118 1.00 0.00 C ATOM 1738 O MET A 118 -9.368 -20.529 -0.373 1.00 0.00 O ATOM 1739 CB MET A 118 -12.375 -19.191 1.093 1.00 0.00 C ATOM 1740 CG MET A 118 -13.270 -19.140 2.331 1.00 0.00 C ATOM 1741 SD MET A 118 -12.762 -17.946 3.592 1.00 0.00 S ATOM 1742 CE MET A 118 -14.382 -17.625 4.344 1.00 0.00 C ATOM 0 H MET A 118 -9.902 -18.391 1.244 1.00 0.00 H new ATOM 0 HA MET A 118 -11.393 -20.873 1.861 1.00 0.00 H new ATOM 0 HB2 MET A 118 -12.086 -18.172 0.835 1.00 0.00 H new ATOM 0 HB3 MET A 118 -12.962 -19.577 0.259 1.00 0.00 H new ATOM 0 HG2 MET A 118 -14.287 -18.904 2.017 1.00 0.00 H new ATOM 0 HG3 MET A 118 -13.298 -20.132 2.782 1.00 0.00 H new ATOM 0 HE1 MET A 118 -14.271 -16.903 5.153 1.00 0.00 H new ATOM 0 HE2 MET A 118 -15.060 -17.224 3.590 1.00 0.00 H new ATOM 0 HE3 MET A 118 -14.789 -18.555 4.741 1.00 0.00 H new ATOM 1752 N GLU A 119 -11.408 -21.242 -0.903 1.00 0.00 N ATOM 1753 CA GLU A 119 -11.090 -21.840 -2.200 1.00 0.00 C ATOM 1754 C GLU A 119 -11.812 -21.057 -3.312 1.00 0.00 C ATOM 1755 O GLU A 119 -11.499 -21.197 -4.493 1.00 0.00 O ATOM 1756 CB GLU A 119 -11.508 -23.320 -2.174 1.00 0.00 C ATOM 1757 CG GLU A 119 -10.742 -24.141 -1.118 1.00 0.00 C ATOM 1758 CD GLU A 119 -11.679 -25.020 -0.285 1.00 0.00 C ATOM 1759 OE1 GLU A 119 -12.333 -24.510 0.652 1.00 0.00 O ATOM 1760 OE2 GLU A 119 -11.725 -26.247 -0.534 1.00 0.00 O ATOM 0 H GLU A 119 -12.382 -21.390 -0.639 1.00 0.00 H new ATOM 0 HA GLU A 119 -10.020 -21.790 -2.402 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -12.577 -23.387 -1.973 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -11.340 -23.757 -3.158 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -10.001 -24.769 -1.614 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -10.197 -23.465 -0.459 1.00 0.00 H new ATOM 1767 N ASN A 120 -12.756 -20.175 -2.954 1.00 0.00 N ATOM 1768 CA ASN A 120 -13.448 -19.269 -3.864 1.00 0.00 C ATOM 1769 C ASN A 120 -13.690 -17.895 -3.219 1.00 0.00 C ATOM 1770 O ASN A 120 -14.500 -17.094 -3.686 1.00 0.00 O ATOM 1771 CB ASN A 120 -14.752 -19.916 -4.363 1.00 0.00 C ATOM 1772 CG ASN A 120 -15.432 -19.047 -5.407 1.00 0.00 C ATOM 1773 OD1 ASN A 120 -14.651 -18.559 -6.357 1.00 0.00 O flip ATOM 1774 ND2 ASN A 120 -16.628 -18.784 -5.332 1.00 0.00 N flip ATOM 0 H ASN A 120 -13.065 -20.074 -1.987 1.00 0.00 H new ATOM 0 HA ASN A 120 -12.810 -19.091 -4.729 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -14.535 -20.896 -4.787 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -15.427 -20.075 -3.522 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -17.192 -19.183 -4.582 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -17.058 -18.166 -6.020 1.00 0.00 H new ATOM 1781 N VAL A 121 -12.969 -17.602 -2.143 1.00 0.00 N ATOM 1782 CA VAL A 121 -12.936 -16.309 -1.490 1.00 0.00 C ATOM 1783 C VAL A 121 -11.479 -16.102 -1.027 1.00 0.00 C ATOM 1784 O VAL A 121 -10.759 -17.088 -0.818 1.00 0.00 O ATOM 1785 CB VAL A 121 -14.003 -16.295 -0.366 1.00 0.00 C ATOM 1786 CG1 VAL A 121 -13.798 -15.132 0.592 1.00 0.00 C ATOM 1787 CG2 VAL A 121 -15.432 -16.211 -0.920 1.00 0.00 C ATOM 0 H VAL A 121 -12.369 -18.290 -1.687 1.00 0.00 H new ATOM 0 HA VAL A 121 -13.197 -15.469 -2.134 1.00 0.00 H new ATOM 0 HB VAL A 121 -13.878 -17.239 0.165 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -14.566 -15.158 1.365 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -12.814 -15.211 1.055 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -13.866 -14.192 0.044 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -16.143 -16.204 -0.094 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -15.543 -15.296 -1.502 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -15.626 -17.073 -1.558 1.00 0.00 H new ATOM 1797 N ALA A 122 -11.034 -14.855 -0.840 1.00 0.00 N ATOM 1798 CA ALA A 122 -9.905 -14.531 0.019 1.00 0.00 C ATOM 1799 C ALA A 122 -10.122 -13.146 0.633 1.00 0.00 C ATOM 1800 O ALA A 122 -10.860 -12.339 0.063 1.00 0.00 O ATOM 1801 CB ALA A 122 -8.611 -14.575 -0.787 1.00 0.00 C ATOM 0 H ALA A 122 -11.455 -14.040 -1.287 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.827 -15.263 0.823 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -7.770 -14.332 -0.138 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -8.473 -15.574 -1.200 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -8.664 -13.851 -1.600 1.00 0.00 H new ATOM 1807 N LEU A 123 -9.477 -12.880 1.774 1.00 0.00 N ATOM 1808 CA LEU A 123 -9.578 -11.668 2.576 1.00 0.00 C ATOM 1809 C LEU A 123 -8.170 -11.263 3.019 1.00 0.00 C ATOM 1810 O LEU A 123 -7.501 -12.018 3.732 1.00 0.00 O ATOM 1811 CB LEU A 123 -10.440 -11.890 3.842 1.00 0.00 C ATOM 1812 CG LEU A 123 -11.970 -11.731 3.749 1.00 0.00 C ATOM 1813 CD1 LEU A 123 -12.382 -10.399 3.117 1.00 0.00 C ATOM 1814 CD2 LEU A 123 -12.671 -12.890 3.039 1.00 0.00 C ATOM 0 H LEU A 123 -8.830 -13.553 2.184 1.00 0.00 H new ATOM 0 HA LEU A 123 -10.049 -10.894 1.970 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -10.237 -12.898 4.204 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -10.084 -11.199 4.606 1.00 0.00 H new ATOM 0 HG LEU A 123 -12.307 -11.743 4.786 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -13.469 -10.337 3.075 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -11.995 -9.576 3.718 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -11.976 -10.334 2.108 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -13.745 -12.705 3.014 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -12.293 -12.975 2.020 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -12.475 -13.818 3.577 1.00 0.00 H new ATOM 1826 N ASP A 124 -7.763 -10.047 2.670 1.00 0.00 N ATOM 1827 CA ASP A 124 -6.642 -9.286 3.219 1.00 0.00 C ATOM 1828 C ASP A 124 -7.188 -7.937 3.701 1.00 0.00 C ATOM 1829 O ASP A 124 -8.296 -7.542 3.323 1.00 0.00 O ATOM 1830 CB ASP A 124 -5.535 -9.127 2.166 1.00 0.00 C ATOM 1831 CG ASP A 124 -4.187 -8.689 2.748 1.00 0.00 C ATOM 1832 OD1 ASP A 124 -3.999 -7.506 3.108 1.00 0.00 O ATOM 1833 OD2 ASP A 124 -3.266 -9.540 2.759 1.00 0.00 O ATOM 0 H ASP A 124 -8.246 -9.525 1.938 1.00 0.00 H new ATOM 0 HA ASP A 124 -6.188 -9.808 4.061 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -5.404 -10.075 1.644 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -5.855 -8.396 1.424 1.00 0.00 H new ATOM 1838 N PHE A 125 -6.454 -7.258 4.575 1.00 0.00 N ATOM 1839 CA PHE A 125 -6.764 -5.953 5.140 1.00 0.00 C ATOM 1840 C PHE A 125 -5.424 -5.242 5.192 1.00 0.00 C ATOM 1841 O PHE A 125 -4.525 -5.732 5.881 1.00 0.00 O ATOM 1842 CB PHE A 125 -7.318 -6.078 6.569 1.00 0.00 C ATOM 1843 CG PHE A 125 -8.709 -6.664 6.722 1.00 0.00 C ATOM 1844 CD1 PHE A 125 -8.942 -8.036 6.499 1.00 0.00 C ATOM 1845 CD2 PHE A 125 -9.766 -5.842 7.158 1.00 0.00 C ATOM 1846 CE1 PHE A 125 -10.227 -8.575 6.675 1.00 0.00 C ATOM 1847 CE2 PHE A 125 -11.048 -6.385 7.351 1.00 0.00 C ATOM 1848 CZ PHE A 125 -11.280 -7.747 7.098 1.00 0.00 C ATOM 0 H PHE A 125 -5.572 -7.628 4.929 1.00 0.00 H new ATOM 0 HA PHE A 125 -7.518 -5.431 4.550 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -6.627 -6.691 7.147 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -7.317 -5.086 7.020 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -8.128 -8.676 6.191 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -9.591 -4.793 7.344 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -10.405 -9.623 6.486 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -11.855 -5.755 7.694 1.00 0.00 H new ATOM 0 HZ PHE A 125 -12.270 -8.158 7.229 1.00 0.00 H new ATOM 1858 N SER A 126 -5.261 -4.145 4.459 1.00 0.00 N ATOM 1859 CA SER A 126 -3.959 -3.536 4.253 1.00 0.00 C ATOM 1860 C SER A 126 -4.025 -2.045 4.574 1.00 0.00 C ATOM 1861 O SER A 126 -5.036 -1.395 4.307 1.00 0.00 O ATOM 1862 CB SER A 126 -3.477 -3.814 2.822 1.00 0.00 C ATOM 1863 OG SER A 126 -4.027 -4.985 2.218 1.00 0.00 O ATOM 0 H SER A 126 -6.027 -3.658 3.994 1.00 0.00 H new ATOM 0 HA SER A 126 -3.227 -3.976 4.931 1.00 0.00 H new ATOM 0 HB2 SER A 126 -3.720 -2.953 2.199 1.00 0.00 H new ATOM 0 HB3 SER A 126 -2.391 -3.904 2.831 1.00 0.00 H new ATOM 0 HG SER A 126 -3.784 -5.772 2.749 1.00 0.00 H new ATOM 1869 N TYR A 127 -2.949 -1.501 5.144 1.00 0.00 N ATOM 1870 CA TYR A 127 -2.854 -0.099 5.517 1.00 0.00 C ATOM 1871 C TYR A 127 -1.477 0.417 5.120 1.00 0.00 C ATOM 1872 O TYR A 127 -0.523 -0.356 5.018 1.00 0.00 O ATOM 1873 CB TYR A 127 -3.064 0.066 7.032 1.00 0.00 C ATOM 1874 CG TYR A 127 -4.508 0.014 7.502 1.00 0.00 C ATOM 1875 CD1 TYR A 127 -5.129 -1.213 7.804 1.00 0.00 C ATOM 1876 CD2 TYR A 127 -5.229 1.211 7.668 1.00 0.00 C ATOM 1877 CE1 TYR A 127 -6.461 -1.239 8.258 1.00 0.00 C ATOM 1878 CE2 TYR A 127 -6.553 1.197 8.135 1.00 0.00 C ATOM 1879 CZ TYR A 127 -7.182 -0.034 8.419 1.00 0.00 C ATOM 1880 OH TYR A 127 -8.481 -0.063 8.827 1.00 0.00 O ATOM 0 H TYR A 127 -2.108 -2.036 5.361 1.00 0.00 H new ATOM 0 HA TYR A 127 -3.627 0.472 5.002 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -2.505 -0.716 7.546 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -2.634 1.020 7.339 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -4.582 -2.137 7.687 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -4.757 2.154 7.433 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -6.934 -2.183 8.484 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -7.088 2.125 8.276 1.00 0.00 H new ATOM 0 HH TYR A 127 -8.826 0.852 8.887 1.00 0.00 H new ATOM 1890 N GLU A 128 -1.357 1.723 4.932 1.00 0.00 N ATOM 1891 CA GLU A 128 -0.103 2.444 5.067 1.00 0.00 C ATOM 1892 C GLU A 128 -0.408 3.628 5.980 1.00 0.00 C ATOM 1893 O GLU A 128 -1.555 4.088 6.062 1.00 0.00 O ATOM 1894 CB GLU A 128 0.504 2.827 3.698 1.00 0.00 C ATOM 1895 CG GLU A 128 1.127 1.586 3.048 1.00 0.00 C ATOM 1896 CD GLU A 128 2.002 1.810 1.809 1.00 0.00 C ATOM 1897 OE1 GLU A 128 2.346 2.952 1.433 1.00 0.00 O ATOM 1898 OE2 GLU A 128 2.368 0.783 1.180 1.00 0.00 O ATOM 0 H GLU A 128 -2.143 2.321 4.677 1.00 0.00 H new ATOM 0 HA GLU A 128 0.679 1.828 5.511 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -0.268 3.241 3.049 1.00 0.00 H new ATOM 0 HB3 GLU A 128 1.261 3.601 3.828 1.00 0.00 H new ATOM 0 HG2 GLU A 128 1.730 1.077 3.800 1.00 0.00 H new ATOM 0 HG3 GLU A 128 0.320 0.907 2.774 1.00 0.00 H new ATOM 1905 N GLN A 129 0.576 4.038 6.775 1.00 0.00 N ATOM 1906 CA GLN A 129 0.448 5.190 7.648 1.00 0.00 C ATOM 1907 C GLN A 129 1.696 6.029 7.458 1.00 0.00 C ATOM 1908 O GLN A 129 2.797 5.566 7.779 1.00 0.00 O ATOM 1909 CB GLN A 129 0.167 4.731 9.083 1.00 0.00 C ATOM 1910 CG GLN A 129 -0.368 5.871 9.957 1.00 0.00 C ATOM 1911 CD GLN A 129 -1.179 5.331 11.129 1.00 0.00 C ATOM 1912 OE1 GLN A 129 -0.702 4.512 11.915 1.00 0.00 O ATOM 1913 NE2 GLN A 129 -2.432 5.732 11.263 1.00 0.00 N ATOM 0 H GLN A 129 1.484 3.577 6.829 1.00 0.00 H new ATOM 0 HA GLN A 129 -0.405 5.823 7.403 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -0.557 3.916 9.068 1.00 0.00 H new ATOM 0 HB3 GLN A 129 1.083 4.336 9.523 1.00 0.00 H new ATOM 0 HG2 GLN A 129 0.464 6.468 10.331 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -0.990 6.533 9.355 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -2.823 6.411 10.610 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -3.007 5.363 12.020 1.00 0.00 H new ATOM 1922 N SER A 130 1.531 7.207 6.877 1.00 0.00 N ATOM 1923 CA SER A 130 2.559 7.961 6.195 1.00 0.00 C ATOM 1924 C SER A 130 2.388 9.434 6.554 1.00 0.00 C ATOM 1925 O SER A 130 1.345 9.861 7.064 1.00 0.00 O ATOM 1926 CB SER A 130 2.367 7.681 4.705 1.00 0.00 C ATOM 1927 OG SER A 130 3.408 8.146 3.879 1.00 0.00 O ATOM 0 H SER A 130 0.629 7.683 6.871 1.00 0.00 H new ATOM 0 HA SER A 130 3.573 7.682 6.481 1.00 0.00 H new ATOM 0 HB2 SER A 130 2.261 6.606 4.562 1.00 0.00 H new ATOM 0 HB3 SER A 130 1.432 8.139 4.381 1.00 0.00 H new ATOM 0 HG SER A 130 3.208 7.925 2.945 1.00 0.00 H new ATOM 1933 N ARG A 131 3.442 10.221 6.367 1.00 0.00 N ATOM 1934 CA ARG A 131 3.407 11.670 6.500 1.00 0.00 C ATOM 1935 C ARG A 131 4.267 12.237 5.396 1.00 0.00 C ATOM 1936 O ARG A 131 5.297 11.635 5.087 1.00 0.00 O ATOM 1937 CB ARG A 131 3.976 12.113 7.853 1.00 0.00 C ATOM 1938 CG ARG A 131 3.045 11.777 9.019 1.00 0.00 C ATOM 1939 CD ARG A 131 3.685 12.091 10.374 1.00 0.00 C ATOM 1940 NE ARG A 131 3.910 10.867 11.152 1.00 0.00 N ATOM 1941 CZ ARG A 131 4.881 9.963 10.983 1.00 0.00 C ATOM 1942 NH1 ARG A 131 5.868 10.112 10.104 1.00 0.00 N ATOM 1943 NH2 ARG A 131 4.867 8.874 11.723 1.00 0.00 N ATOM 0 H ARG A 131 4.362 9.861 6.114 1.00 0.00 H new ATOM 0 HA ARG A 131 2.378 12.023 6.436 1.00 0.00 H new ATOM 0 HB2 ARG A 131 4.941 11.632 8.013 1.00 0.00 H new ATOM 0 HB3 ARG A 131 4.155 13.188 7.834 1.00 0.00 H new ATOM 0 HG2 ARG A 131 2.118 12.341 8.917 1.00 0.00 H new ATOM 0 HG3 ARG A 131 2.781 10.720 8.979 1.00 0.00 H new ATOM 0 HD2 ARG A 131 4.633 12.607 10.220 1.00 0.00 H new ATOM 0 HD3 ARG A 131 3.041 12.768 10.935 1.00 0.00 H new ATOM 0 HE ARG A 131 3.250 10.685 11.908 1.00 0.00 H new ATOM 0 HH11 ARG A 131 5.908 10.947 9.519 1.00 0.00 H new ATOM 0 HH12 ARG A 131 6.584 9.392 10.015 1.00 0.00 H new ATOM 0 HH21 ARG A 131 4.125 8.733 12.409 1.00 0.00 H new ATOM 0 HH22 ARG A 131 5.598 8.172 11.610 1.00 0.00 H new ATOM 1957 N ILE A 132 3.896 13.394 4.859 1.00 0.00 N ATOM 1958 CA ILE A 132 4.717 14.139 3.917 1.00 0.00 C ATOM 1959 C ILE A 132 4.746 15.559 4.453 1.00 0.00 C ATOM 1960 O ILE A 132 3.718 16.227 4.472 1.00 0.00 O ATOM 1961 CB ILE A 132 4.183 14.034 2.466 1.00 0.00 C ATOM 1962 CG1 ILE A 132 4.159 12.571 1.971 1.00 0.00 C ATOM 1963 CG2 ILE A 132 5.112 14.815 1.525 1.00 0.00 C ATOM 1964 CD1 ILE A 132 2.817 11.858 2.142 1.00 0.00 C ATOM 0 H ILE A 132 3.006 13.845 5.069 1.00 0.00 H new ATOM 0 HA ILE A 132 5.727 13.735 3.844 1.00 0.00 H new ATOM 0 HB ILE A 132 3.170 14.436 2.463 1.00 0.00 H new ATOM 0 HG12 ILE A 132 4.431 12.555 0.916 1.00 0.00 H new ATOM 0 HG13 ILE A 132 4.924 12.009 2.506 1.00 0.00 H new ATOM 0 HG21 ILE A 132 4.739 14.743 0.503 1.00 0.00 H new ATOM 0 HG22 ILE A 132 5.141 15.862 1.828 1.00 0.00 H new ATOM 0 HG23 ILE A 132 6.117 14.395 1.575 1.00 0.00 H new ATOM 0 HD11 ILE A 132 2.897 10.838 1.767 1.00 0.00 H new ATOM 0 HD12 ILE A 132 2.548 11.836 3.198 1.00 0.00 H new ATOM 0 HD13 ILE A 132 2.048 12.391 1.583 1.00 0.00 H new ATOM 1976 N ARG A 133 5.896 16.013 4.952 1.00 0.00 N ATOM 1977 CA ARG A 133 6.049 17.300 5.633 1.00 0.00 C ATOM 1978 C ARG A 133 4.994 17.497 6.735 1.00 0.00 C ATOM 1979 O ARG A 133 4.415 18.577 6.856 1.00 0.00 O ATOM 1980 CB ARG A 133 6.038 18.418 4.575 1.00 0.00 C ATOM 1981 CG ARG A 133 6.785 19.651 5.082 1.00 0.00 C ATOM 1982 CD ARG A 133 6.502 20.873 4.214 1.00 0.00 C ATOM 1983 NE ARG A 133 7.580 21.851 4.367 1.00 0.00 N ATOM 1984 CZ ARG A 133 7.563 23.129 3.988 1.00 0.00 C ATOM 1985 NH1 ARG A 133 6.480 23.673 3.451 1.00 0.00 N ATOM 1986 NH2 ARG A 133 8.653 23.864 4.163 1.00 0.00 N ATOM 0 H ARG A 133 6.767 15.485 4.893 1.00 0.00 H new ATOM 0 HA ARG A 133 7.005 17.330 6.156 1.00 0.00 H new ATOM 0 HB2 ARG A 133 6.501 18.059 3.655 1.00 0.00 H new ATOM 0 HB3 ARG A 133 5.010 18.685 4.332 1.00 0.00 H new ATOM 0 HG2 ARG A 133 6.491 19.858 6.111 1.00 0.00 H new ATOM 0 HG3 ARG A 133 7.856 19.450 5.091 1.00 0.00 H new ATOM 0 HD2 ARG A 133 6.414 20.576 3.169 1.00 0.00 H new ATOM 0 HD3 ARG A 133 5.550 21.320 4.499 1.00 0.00 H new ATOM 0 HE ARG A 133 8.436 21.519 4.811 1.00 0.00 H new ATOM 0 HH11 ARG A 133 5.638 23.112 3.321 1.00 0.00 H new ATOM 0 HH12 ARG A 133 6.488 24.653 3.168 1.00 0.00 H new ATOM 0 HH21 ARG A 133 9.486 23.450 4.581 1.00 0.00 H new ATOM 0 HH22 ARG A 133 8.659 24.844 3.879 1.00 0.00 H new ATOM 2000 N SER A 134 4.691 16.450 7.509 1.00 0.00 N ATOM 2001 CA SER A 134 3.599 16.441 8.487 1.00 0.00 C ATOM 2002 C SER A 134 2.266 16.977 7.930 1.00 0.00 C ATOM 2003 O SER A 134 1.458 17.566 8.649 1.00 0.00 O ATOM 2004 CB SER A 134 4.066 17.098 9.794 1.00 0.00 C ATOM 2005 OG SER A 134 4.835 16.148 10.519 1.00 0.00 O ATOM 0 H SER A 134 5.206 15.571 7.473 1.00 0.00 H new ATOM 0 HA SER A 134 3.355 15.405 8.722 1.00 0.00 H new ATOM 0 HB2 SER A 134 4.661 17.986 9.581 1.00 0.00 H new ATOM 0 HB3 SER A 134 3.209 17.423 10.384 1.00 0.00 H new ATOM 0 HG SER A 134 5.145 16.549 11.358 1.00 0.00 H new ATOM 2011 N VAL A 135 1.987 16.675 6.663 1.00 0.00 N ATOM 2012 CA VAL A 135 0.642 16.379 6.204 1.00 0.00 C ATOM 2013 C VAL A 135 0.480 14.918 6.599 1.00 0.00 C ATOM 2014 O VAL A 135 1.235 14.065 6.116 1.00 0.00 O ATOM 2015 CB VAL A 135 0.533 16.563 4.673 1.00 0.00 C ATOM 2016 CG1 VAL A 135 -0.842 16.178 4.126 1.00 0.00 C ATOM 2017 CG2 VAL A 135 0.817 18.018 4.296 1.00 0.00 C ATOM 0 H VAL A 135 2.693 16.630 5.928 1.00 0.00 H new ATOM 0 HA VAL A 135 -0.123 17.029 6.627 1.00 0.00 H new ATOM 0 HB VAL A 135 1.272 15.896 4.229 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -0.859 16.328 3.046 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -1.042 15.130 4.350 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -1.606 16.801 4.591 1.00 0.00 H new ATOM 0 HG21 VAL A 135 0.737 18.136 3.215 1.00 0.00 H new ATOM 0 HG22 VAL A 135 0.093 18.669 4.786 1.00 0.00 H new ATOM 0 HG23 VAL A 135 1.823 18.287 4.617 1.00 0.00 H new ATOM 2027 N ASP A 136 -0.407 14.639 7.552 1.00 0.00 N ATOM 2028 CA ASP A 136 -0.801 13.278 7.876 1.00 0.00 C ATOM 2029 C ASP A 136 -1.461 12.656 6.649 1.00 0.00 C ATOM 2030 O ASP A 136 -2.194 13.328 5.925 1.00 0.00 O ATOM 2031 CB ASP A 136 -1.670 13.216 9.147 1.00 0.00 C ATOM 2032 CG ASP A 136 -3.181 13.451 8.980 1.00 0.00 C ATOM 2033 OD1 ASP A 136 -3.636 14.379 8.283 1.00 0.00 O ATOM 2034 OD2 ASP A 136 -3.955 12.732 9.656 1.00 0.00 O ATOM 0 H ASP A 136 -0.869 15.351 8.117 1.00 0.00 H new ATOM 0 HA ASP A 136 0.080 12.685 8.122 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -1.529 12.237 9.604 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -1.290 13.955 9.852 1.00 0.00 H new ATOM 2039 N VAL A 137 -1.117 11.402 6.366 1.00 0.00 N ATOM 2040 CA VAL A 137 -1.595 10.624 5.235 1.00 0.00 C ATOM 2041 C VAL A 137 -1.847 9.215 5.769 1.00 0.00 C ATOM 2042 O VAL A 137 -0.927 8.414 5.928 1.00 0.00 O ATOM 2043 CB VAL A 137 -0.568 10.689 4.077 1.00 0.00 C ATOM 2044 CG1 VAL A 137 -0.864 9.694 2.945 1.00 0.00 C ATOM 2045 CG2 VAL A 137 -0.534 12.097 3.462 1.00 0.00 C ATOM 0 H VAL A 137 -0.465 10.879 6.950 1.00 0.00 H new ATOM 0 HA VAL A 137 -2.521 11.010 4.809 1.00 0.00 H new ATOM 0 HB VAL A 137 0.391 10.429 4.525 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -0.107 9.792 2.167 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -0.849 8.678 3.340 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -1.847 9.904 2.523 1.00 0.00 H new ATOM 0 HG21 VAL A 137 0.193 12.122 2.651 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -1.521 12.348 3.073 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -0.250 12.821 4.226 1.00 0.00 H new ATOM 2055 N GLY A 138 -3.101 8.922 6.102 1.00 0.00 N ATOM 2056 CA GLY A 138 -3.549 7.557 6.298 1.00 0.00 C ATOM 2057 C GLY A 138 -3.812 6.930 4.934 1.00 0.00 C ATOM 2058 O GLY A 138 -4.105 7.616 3.950 1.00 0.00 O ATOM 0 H GLY A 138 -3.828 9.624 6.242 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -2.794 6.985 6.838 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -4.455 7.540 6.903 1.00 0.00 H new ATOM 2062 N THR A 139 -3.680 5.612 4.829 1.00 0.00 N ATOM 2063 CA THR A 139 -4.163 4.839 3.699 1.00 0.00 C ATOM 2064 C THR A 139 -4.738 3.526 4.234 1.00 0.00 C ATOM 2065 O THR A 139 -4.088 2.848 5.022 1.00 0.00 O ATOM 2066 CB THR A 139 -3.026 4.658 2.685 1.00 0.00 C ATOM 2067 OG1 THR A 139 -2.496 5.936 2.366 1.00 0.00 O ATOM 2068 CG2 THR A 139 -3.487 4.006 1.379 1.00 0.00 C ATOM 0 H THR A 139 -3.225 5.043 5.543 1.00 0.00 H new ATOM 0 HA THR A 139 -4.964 5.348 3.163 1.00 0.00 H new ATOM 0 HB THR A 139 -2.286 4.003 3.146 1.00 0.00 H new ATOM 0 HG1 THR A 139 -1.767 5.836 1.719 1.00 0.00 H new ATOM 0 HG21 THR A 139 -2.638 3.905 0.703 1.00 0.00 H new ATOM 0 HG22 THR A 139 -3.901 3.020 1.591 1.00 0.00 H new ATOM 0 HG23 THR A 139 -4.251 4.628 0.912 1.00 0.00 H new ATOM 2076 N TRP A 140 -5.949 3.177 3.800 1.00 0.00 N ATOM 2077 CA TRP A 140 -6.611 1.897 4.036 1.00 0.00 C ATOM 2078 C TRP A 140 -6.897 1.310 2.652 1.00 0.00 C ATOM 2079 O TRP A 140 -7.194 2.071 1.724 1.00 0.00 O ATOM 2080 CB TRP A 140 -7.892 2.133 4.860 1.00 0.00 C ATOM 2081 CG TRP A 140 -9.026 1.178 4.626 1.00 0.00 C ATOM 2082 CD1 TRP A 140 -10.243 1.526 4.159 1.00 0.00 C ATOM 2083 CD2 TRP A 140 -9.078 -0.274 4.784 1.00 0.00 C ATOM 2084 NE1 TRP A 140 -11.005 0.404 3.939 1.00 0.00 N ATOM 2085 CE2 TRP A 140 -10.332 -0.744 4.290 1.00 0.00 C ATOM 2086 CE3 TRP A 140 -8.183 -1.249 5.265 1.00 0.00 C ATOM 2087 CZ2 TRP A 140 -10.661 -2.108 4.235 1.00 0.00 C ATOM 2088 CZ3 TRP A 140 -8.513 -2.615 5.245 1.00 0.00 C ATOM 2089 CH2 TRP A 140 -9.739 -3.053 4.714 1.00 0.00 C ATOM 0 H TRP A 140 -6.523 3.813 3.246 1.00 0.00 H new ATOM 0 HA TRP A 140 -6.001 1.199 4.610 1.00 0.00 H new ATOM 0 HB2 TRP A 140 -7.629 2.097 5.917 1.00 0.00 H new ATOM 0 HB3 TRP A 140 -8.248 3.142 4.654 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -10.571 2.540 3.983 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -11.953 0.420 3.562 1.00 0.00 H new ATOM 0 HE3 TRP A 140 -7.225 -0.941 5.657 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -11.610 -2.426 3.830 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 -7.816 -3.338 5.643 1.00 0.00 H new ATOM 0 HH2 TRP A 140 -9.970 -4.107 4.675 1.00 0.00 H new ATOM 2100 N ILE A 141 -6.780 -0.012 2.498 1.00 0.00 N ATOM 2101 CA ILE A 141 -6.961 -0.721 1.240 1.00 0.00 C ATOM 2102 C ILE A 141 -7.609 -2.075 1.552 1.00 0.00 C ATOM 2103 O ILE A 141 -7.124 -2.814 2.414 1.00 0.00 O ATOM 2104 CB ILE A 141 -5.612 -0.906 0.491 1.00 0.00 C ATOM 2105 CG1 ILE A 141 -4.675 0.329 0.535 1.00 0.00 C ATOM 2106 CG2 ILE A 141 -5.926 -1.288 -0.965 1.00 0.00 C ATOM 2107 CD1 ILE A 141 -3.293 0.112 -0.094 1.00 0.00 C ATOM 0 H ILE A 141 -6.549 -0.633 3.274 1.00 0.00 H new ATOM 0 HA ILE A 141 -7.604 -0.140 0.579 1.00 0.00 H new ATOM 0 HB ILE A 141 -5.060 -1.692 1.006 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -5.165 1.157 0.024 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -4.542 0.630 1.574 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -4.994 -1.424 -1.514 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -6.497 -2.217 -0.983 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -6.510 -0.494 -1.432 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -2.710 1.029 -0.016 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -2.777 -0.692 0.431 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -3.409 -0.156 -1.144 1.00 0.00 H new ATOM 2119 N ALA A 142 -8.660 -2.437 0.809 1.00 0.00 N ATOM 2120 CA ALA A 142 -9.306 -3.734 0.941 1.00 0.00 C ATOM 2121 C ALA A 142 -8.612 -4.733 0.015 1.00 0.00 C ATOM 2122 O ALA A 142 -7.845 -4.349 -0.873 1.00 0.00 O ATOM 2123 CB ALA A 142 -10.789 -3.592 0.578 1.00 0.00 C ATOM 0 H ALA A 142 -9.082 -1.835 0.102 1.00 0.00 H new ATOM 0 HA ALA A 142 -9.230 -4.097 1.966 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -11.281 -4.560 0.674 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -11.261 -2.876 1.251 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -10.880 -3.239 -0.449 1.00 0.00 H new ATOM 2129 N GLY A 143 -8.878 -6.018 0.217 1.00 0.00 N ATOM 2130 CA GLY A 143 -8.206 -7.117 -0.445 1.00 0.00 C ATOM 2131 C GLY A 143 -9.147 -8.304 -0.466 1.00 0.00 C ATOM 2132 O GLY A 143 -9.114 -9.129 0.439 1.00 0.00 O ATOM 0 H GLY A 143 -9.595 -6.329 0.872 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -7.927 -6.835 -1.460 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -7.285 -7.371 0.080 1.00 0.00 H new ATOM 2136 N VAL A 144 -9.992 -8.392 -1.481 1.00 0.00 N ATOM 2137 CA VAL A 144 -10.994 -9.421 -1.660 1.00 0.00 C ATOM 2138 C VAL A 144 -10.615 -10.176 -2.937 1.00 0.00 C ATOM 2139 O VAL A 144 -9.810 -9.701 -3.748 1.00 0.00 O ATOM 2140 CB VAL A 144 -12.385 -8.744 -1.701 1.00 0.00 C ATOM 2141 CG1 VAL A 144 -13.538 -9.748 -1.795 1.00 0.00 C ATOM 2142 CG2 VAL A 144 -12.627 -7.908 -0.435 1.00 0.00 C ATOM 0 H VAL A 144 -9.994 -7.710 -2.240 1.00 0.00 H new ATOM 0 HA VAL A 144 -11.039 -10.145 -0.846 1.00 0.00 H new ATOM 0 HB VAL A 144 -12.372 -8.122 -2.596 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -14.486 -9.211 -1.820 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -13.432 -10.340 -2.704 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -13.517 -10.408 -0.928 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -13.611 -7.443 -0.489 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -12.578 -8.553 0.442 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -11.864 -7.134 -0.359 1.00 0.00 H new ATOM 2152 N GLY A 145 -11.163 -11.371 -3.124 1.00 0.00 N ATOM 2153 CA GLY A 145 -11.025 -12.116 -4.355 1.00 0.00 C ATOM 2154 C GLY A 145 -11.142 -13.589 -4.052 1.00 0.00 C ATOM 2155 O GLY A 145 -12.190 -14.014 -3.573 1.00 0.00 O ATOM 0 H GLY A 145 -11.719 -11.848 -2.415 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -11.795 -11.815 -5.066 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -10.062 -11.902 -4.819 1.00 0.00 H new ATOM 2159 N TYR A 146 -10.100 -14.358 -4.345 1.00 0.00 N ATOM 2160 CA TYR A 146 -10.155 -15.801 -4.559 1.00 0.00 C ATOM 2161 C TYR A 146 -8.830 -16.426 -4.156 1.00 0.00 C ATOM 2162 O TYR A 146 -7.882 -15.742 -3.758 1.00 0.00 O ATOM 2163 CB TYR A 146 -10.482 -16.153 -6.027 1.00 0.00 C ATOM 2164 CG TYR A 146 -11.574 -15.289 -6.598 1.00 0.00 C ATOM 2165 CD1 TYR A 146 -12.889 -15.540 -6.196 1.00 0.00 C ATOM 2166 CD2 TYR A 146 -11.262 -14.122 -7.317 1.00 0.00 C ATOM 2167 CE1 TYR A 146 -13.883 -14.586 -6.424 1.00 0.00 C ATOM 2168 CE2 TYR A 146 -12.261 -13.168 -7.567 1.00 0.00 C ATOM 2169 CZ TYR A 146 -13.570 -13.377 -7.079 1.00 0.00 C ATOM 2170 OH TYR A 146 -14.515 -12.412 -7.228 1.00 0.00 O ATOM 0 H TYR A 146 -9.158 -13.980 -4.444 1.00 0.00 H new ATOM 0 HA TYR A 146 -10.957 -16.202 -3.940 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -9.582 -16.043 -6.633 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -10.782 -17.199 -6.088 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -13.136 -16.472 -5.709 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -10.256 -13.960 -7.676 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -14.895 -14.775 -6.098 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -12.029 -12.277 -8.131 1.00 0.00 H new ATOM 0 HH TYR A 146 -14.128 -11.646 -7.701 1.00 0.00 H new ATOM 2180 N ARG A 147 -8.777 -17.749 -4.233 1.00 0.00 N ATOM 2181 CA ARG A 147 -7.575 -18.502 -3.882 1.00 0.00 C ATOM 2182 C ARG A 147 -7.487 -19.731 -4.763 1.00 0.00 C ATOM 2183 O ARG A 147 -8.527 -20.351 -4.984 1.00 0.00 O ATOM 2184 CB ARG A 147 -7.722 -18.878 -2.410 1.00 0.00 C ATOM 2185 CG ARG A 147 -6.480 -19.446 -1.723 1.00 0.00 C ATOM 2186 CD ARG A 147 -6.185 -20.921 -2.028 1.00 0.00 C ATOM 2187 NE ARG A 147 -5.504 -21.570 -0.895 1.00 0.00 N ATOM 2188 CZ ARG A 147 -6.066 -22.348 0.034 1.00 0.00 C ATOM 2189 NH1 ARG A 147 -7.373 -22.582 0.012 1.00 0.00 N ATOM 2190 NH2 ARG A 147 -5.333 -22.870 1.011 1.00 0.00 N ATOM 0 H ARG A 147 -9.559 -18.329 -4.538 1.00 0.00 H new ATOM 0 HA ARG A 147 -6.662 -17.927 -4.033 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -8.040 -17.991 -1.862 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -8.525 -19.611 -2.324 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -5.616 -18.850 -2.018 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -6.595 -19.330 -0.645 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -7.116 -21.444 -2.245 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -5.563 -20.994 -2.920 1.00 0.00 H new ATOM 0 HE ARG A 147 -4.500 -21.409 -0.811 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -7.953 -22.167 -0.717 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -7.797 -23.177 0.724 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -4.332 -22.678 1.056 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -5.771 -23.463 1.716 1.00 0.00 H new ATOM 2204 N PHE A 148 -6.311 -20.083 -5.275 1.00 0.00 N ATOM 2205 CA PHE A 148 -6.070 -21.376 -5.902 1.00 0.00 C ATOM 2206 C PHE A 148 -4.632 -21.780 -5.643 1.00 0.00 C ATOM 2207 O PHE A 148 -4.267 -22.916 -6.007 1.00 0.00 O ATOM 2208 CB PHE A 148 -6.450 -21.399 -7.392 1.00 0.00 C ATOM 2209 CG PHE A 148 -5.747 -20.429 -8.324 1.00 0.00 C ATOM 2210 CD1 PHE A 148 -6.032 -19.049 -8.276 1.00 0.00 C ATOM 2211 CD2 PHE A 148 -4.869 -20.922 -9.310 1.00 0.00 C ATOM 2212 CE1 PHE A 148 -5.419 -18.169 -9.185 1.00 0.00 C ATOM 2213 CE2 PHE A 148 -4.262 -20.042 -10.223 1.00 0.00 C ATOM 2214 CZ PHE A 148 -4.532 -18.665 -10.154 1.00 0.00 C ATOM 0 H PHE A 148 -5.493 -19.473 -5.266 1.00 0.00 H new ATOM 0 HA PHE A 148 -6.728 -22.119 -5.451 1.00 0.00 H new ATOM 0 HB2 PHE A 148 -6.273 -22.408 -7.766 1.00 0.00 H new ATOM 0 HB3 PHE A 148 -7.522 -21.215 -7.466 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -6.723 -18.667 -7.539 1.00 0.00 H new ATOM 0 HD2 PHE A 148 -4.662 -21.980 -9.364 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -5.630 -17.111 -9.138 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -3.589 -20.424 -10.976 1.00 0.00 H new ATOM 0 HZ PHE A 148 -4.057 -17.987 -10.847 1.00 0.00 H new