USER MOD reduce.3.24.130724 H: found=0, std=0, add=1000, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1000 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 80 THR OG1 : rot -134:sc= 0.276 USER MOD Set 1.2: A 86 SER OG : rot 172:sc= 0.293 USER MOD Set 2.1: A 42 SER OG : rot 160:sc=-0.000342 USER MOD Set 2.2: A 43 THR OG1 : rot -130:sc= -1.66 USER MOD Set 2.3: A 57 ASN : amide:sc=-0.00679 X(o=-1.7,f=-1.7) USER MOD Set 3.1: A 28 THR OG1 : rot 4:sc= 0.193 USER MOD Set 3.2: A 47 THR OG1 : rot 180:sc= -0.0391 USER MOD Single : A 0 MET CE :methyl -164:sc= -0.0659 (180deg=-0.374) USER MOD Single : A 0 MET N :NH3+ -174:sc= -0.338 (180deg=-0.446) USER MOD Single : A 1 ASN : amide:sc= -10! C(o=-10!,f=-4.5!) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl -145:sc= -0.341 (180deg=-1.78) USER MOD Single : A 17 THR OG1 : rot 36:sc= 0.855 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 166:sc= -0.0368 (180deg=-0.219) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0.00137 USER MOD Single : A 27 THR OG1 : rot 170:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 TYR OH : rot 30:sc= -0.0937 USER MOD Single : A 32 THR OG1 : rot 180:sc= -0.118 USER MOD Single : A 37 TYR OH : rot -141:sc= -0.193! USER MOD Single : A 40 SER OG : rot -49:sc= 1.01 USER MOD Single : A 41 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 44 GLN : amide:sc= -1.54 K(o=-1.5,f=0.043) USER MOD Single : A 45 THR OG1 : rot 60:sc= -2.05 USER MOD Single : A 49 ASN : amide:sc= -5.1 K(o=-5.1,f=-9.7!) USER MOD Single : A 50 SER OG : rot -60:sc= 0.152 USER MOD Single : A 56 TYR OH : rot 150:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot 61:sc= 0.573 USER MOD Single : A 63 LYS NZ :NH3+ -111:sc= -1.26! (180deg=-3.51!) USER MOD Single : A 67 HIS : no HD1:sc= -1.63 K(o=-1.6,f=-5.2!) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 75 GLN : amide:sc= -0.0945 K(o=-0.094,f=-0.7) USER MOD Single : A 79 LYS NZ :NH3+ 179:sc= -0.576 (180deg=-0.58) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 87 GLN : amide:sc= -8.12! K(o=-8.1!,f=-2.3) USER MOD Single : A 91 SER OG : rot -22:sc= 0.633 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 21:sc= 1.18 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 126:sc= 1.12 USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= -0.776 K(o=-0.78,f=0.21) USER MOD Single : A 121 GLN : amide:sc= -0.873 K(o=-0.87,f=0) USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 128 HIS : no HD1:sc= -0.0526 X(o=-0.053,f=0) USER MOD Single : A 129 HIS : no HD1:sc=-0.00407 X(o=-0.0041,f=-0.27) USER MOD Single : A 130 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 131 HIS : no HD1:sc= -0.437 X(o=-0.44,f=-0.06) USER MOD Single : A 132 HIS : no HD1:sc=-0.00102 X(o=-0.001,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 35.090 -1.805 -2.123 1.00 0.00 N ATOM 2 CA MET A 0 34.519 -2.145 -0.795 1.00 0.00 C ATOM 3 C MET A 0 33.086 -1.636 -0.674 1.00 0.00 C ATOM 4 O MET A 0 32.471 -1.729 0.387 1.00 0.00 O ATOM 5 CB MET A 0 35.380 -1.543 0.318 1.00 0.00 C ATOM 6 CG MET A 0 36.858 -1.885 0.198 1.00 0.00 C ATOM 7 SD MET A 0 37.162 -3.663 0.162 1.00 0.00 S ATOM 8 CE MET A 0 36.550 -4.145 1.774 1.00 0.00 C ATOM 0 H1 MET A 0 36.026 -2.247 -2.222 1.00 0.00 H new ATOM 0 H2 MET A 0 34.460 -2.156 -2.872 1.00 0.00 H new ATOM 0 H3 MET A 0 35.185 -0.773 -2.206 1.00 0.00 H new ATOM 0 HA MET A 0 34.510 -3.230 -0.695 1.00 0.00 H new ATOM 0 HB2 MET A 0 35.265 -0.459 0.309 1.00 0.00 H new ATOM 0 HB3 MET A 0 35.011 -1.895 1.282 1.00 0.00 H new ATOM 0 HG2 MET A 0 37.258 -1.434 -0.710 1.00 0.00 H new ATOM 0 HG3 MET A 0 37.397 -1.445 1.037 1.00 0.00 H new ATOM 0 HE1 MET A 0 36.918 -5.141 2.020 1.00 0.00 H new ATOM 0 HE2 MET A 0 36.899 -3.434 2.523 1.00 0.00 H new ATOM 0 HE3 MET A 0 35.460 -4.154 1.762 1.00 0.00 H new ATOM 20 N ASN A 1 32.562 -1.099 -1.773 1.00 0.00 N ATOM 21 CA ASN A 1 31.202 -0.575 -1.797 1.00 0.00 C ATOM 22 C ASN A 1 30.320 -1.381 -2.743 1.00 0.00 C ATOM 23 O ASN A 1 30.818 -2.080 -3.627 1.00 0.00 O ATOM 24 CB ASN A 1 31.206 0.895 -2.215 1.00 0.00 C ATOM 25 CG ASN A 1 31.544 1.818 -1.063 1.00 0.00 C ATOM 26 OD1 ASN A 1 32.705 2.164 -0.845 1.00 0.00 O ATOM 27 ND2 ASN A 1 30.522 2.215 -0.314 1.00 0.00 N ATOM 0 H ASN A 1 33.061 -1.016 -2.659 1.00 0.00 H new ATOM 0 HA ASN A 1 30.793 -0.659 -0.790 1.00 0.00 H new ATOM 0 HB2 ASN A 1 31.928 1.040 -3.018 1.00 0.00 H new ATOM 0 HB3 ASN A 1 30.227 1.160 -2.615 1.00 0.00 H new ATOM 0 HD21 ASN A 1 30.682 2.833 0.481 1.00 0.00 H new ATOM 0 HD22 ASN A 1 29.577 1.902 -0.534 1.00 0.00 H new ATOM 34 N CYS A 2 29.008 -1.279 -2.553 1.00 0.00 N ATOM 35 CA CYS A 2 28.059 -2.005 -3.389 1.00 0.00 C ATOM 36 C CYS A 2 27.663 -1.195 -4.618 1.00 0.00 C ATOM 37 O CYS A 2 26.903 -1.672 -5.462 1.00 0.00 O ATOM 38 CB CYS A 2 26.814 -2.373 -2.584 1.00 0.00 C ATOM 39 SG CYS A 2 27.093 -3.699 -1.370 1.00 0.00 S ATOM 0 H CYS A 2 28.579 -0.702 -1.829 1.00 0.00 H new ATOM 0 HA CYS A 2 28.550 -2.917 -3.729 1.00 0.00 H new ATOM 0 HB2 CYS A 2 26.454 -1.486 -2.063 1.00 0.00 H new ATOM 0 HB3 CYS A 2 26.026 -2.682 -3.271 1.00 0.00 H new ATOM 44 N GLY A 3 28.173 0.028 -4.723 1.00 0.00 N ATOM 45 CA GLY A 3 27.844 0.882 -5.847 1.00 0.00 C ATOM 46 C GLY A 3 26.676 1.796 -5.526 1.00 0.00 C ATOM 47 O GLY A 3 25.885 1.489 -4.636 1.00 0.00 O ATOM 0 H GLY A 3 28.812 0.444 -4.045 1.00 0.00 H new ATOM 0 HA2 GLY A 3 28.713 1.482 -6.117 1.00 0.00 H new ATOM 0 HA3 GLY A 3 27.599 0.267 -6.713 1.00 0.00 H new ATOM 51 N PRO A 4 26.542 2.935 -6.229 1.00 0.00 N ATOM 52 CA PRO A 4 25.446 3.882 -5.990 1.00 0.00 C ATOM 53 C PRO A 4 24.092 3.189 -5.878 1.00 0.00 C ATOM 54 O PRO A 4 23.721 2.390 -6.738 1.00 0.00 O ATOM 55 CB PRO A 4 25.497 4.783 -7.222 1.00 0.00 C ATOM 56 CG PRO A 4 26.932 4.777 -7.619 1.00 0.00 C ATOM 57 CD PRO A 4 27.440 3.393 -7.308 1.00 0.00 C ATOM 0 HA PRO A 4 25.559 4.418 -5.048 1.00 0.00 H new ATOM 0 HB2 PRO A 4 24.861 4.402 -8.021 1.00 0.00 H new ATOM 0 HB3 PRO A 4 25.151 5.791 -6.993 1.00 0.00 H new ATOM 0 HG2 PRO A 4 27.045 5.006 -8.679 1.00 0.00 H new ATOM 0 HG3 PRO A 4 27.493 5.532 -7.068 1.00 0.00 H new ATOM 0 HD2 PRO A 4 27.387 2.740 -8.179 1.00 0.00 H new ATOM 0 HD3 PRO A 4 28.481 3.410 -6.985 1.00 0.00 H new ATOM 65 N PRO A 5 23.335 3.491 -4.807 1.00 0.00 N ATOM 66 CA PRO A 5 22.020 2.891 -4.573 1.00 0.00 C ATOM 67 C PRO A 5 21.086 3.042 -5.770 1.00 0.00 C ATOM 68 O PRO A 5 20.714 4.157 -6.137 1.00 0.00 O ATOM 69 CB PRO A 5 21.473 3.672 -3.374 1.00 0.00 C ATOM 70 CG PRO A 5 22.682 4.184 -2.671 1.00 0.00 C ATOM 71 CD PRO A 5 23.704 4.442 -3.742 1.00 0.00 C ATOM 0 HA PRO A 5 22.095 1.817 -4.403 1.00 0.00 H new ATOM 0 HB2 PRO A 5 20.827 4.489 -3.695 1.00 0.00 H new ATOM 0 HB3 PRO A 5 20.878 3.032 -2.723 1.00 0.00 H new ATOM 0 HG2 PRO A 5 22.456 5.096 -2.119 1.00 0.00 H new ATOM 0 HG3 PRO A 5 23.050 3.457 -1.947 1.00 0.00 H new ATOM 0 HD2 PRO A 5 23.665 5.473 -4.094 1.00 0.00 H new ATOM 0 HD3 PRO A 5 24.717 4.266 -3.381 1.00 0.00 H new ATOM 79 N PRO A 6 20.702 1.916 -6.397 1.00 0.00 N ATOM 80 CA PRO A 6 19.796 1.920 -7.548 1.00 0.00 C ATOM 81 C PRO A 6 18.499 2.649 -7.236 1.00 0.00 C ATOM 82 O PRO A 6 18.278 3.155 -6.135 1.00 0.00 O ATOM 83 CB PRO A 6 19.511 0.431 -7.802 1.00 0.00 C ATOM 84 CG PRO A 6 20.012 -0.288 -6.594 1.00 0.00 C ATOM 85 CD PRO A 6 21.120 0.556 -6.040 1.00 0.00 C ATOM 0 HA PRO A 6 20.233 2.431 -8.406 1.00 0.00 H new ATOM 0 HB2 PRO A 6 18.445 0.256 -7.948 1.00 0.00 H new ATOM 0 HB3 PRO A 6 20.017 0.084 -8.703 1.00 0.00 H new ATOM 0 HG2 PRO A 6 19.217 -0.419 -5.860 1.00 0.00 H new ATOM 0 HG3 PRO A 6 20.372 -1.283 -6.854 1.00 0.00 H new ATOM 0 HD2 PRO A 6 21.221 0.434 -4.962 1.00 0.00 H new ATOM 0 HD3 PRO A 6 22.083 0.300 -6.481 1.00 0.00 H new ATOM 93 N THR A 7 17.649 2.674 -8.255 1.00 0.00 N ATOM 94 CA THR A 7 16.351 3.316 -8.159 1.00 0.00 C ATOM 95 C THR A 7 15.295 2.277 -7.813 1.00 0.00 C ATOM 96 O THR A 7 15.222 1.224 -8.447 1.00 0.00 O ATOM 97 CB THR A 7 15.962 4.025 -9.471 1.00 0.00 C ATOM 98 OG1 THR A 7 16.945 5.015 -9.802 1.00 0.00 O ATOM 99 CG2 THR A 7 14.596 4.685 -9.348 1.00 0.00 C ATOM 0 H THR A 7 17.841 2.252 -9.164 1.00 0.00 H new ATOM 0 HA THR A 7 16.410 4.071 -7.376 1.00 0.00 H new ATOM 0 HB THR A 7 15.916 3.276 -10.262 1.00 0.00 H new ATOM 0 HG1 THR A 7 16.692 5.460 -10.638 1.00 0.00 H new ATOM 0 HG21 THR A 7 14.344 5.178 -10.287 1.00 0.00 H new ATOM 0 HG22 THR A 7 13.845 3.928 -9.124 1.00 0.00 H new ATOM 0 HG23 THR A 7 14.619 5.422 -8.545 1.00 0.00 H new ATOM 107 N LEU A 8 14.479 2.568 -6.812 1.00 0.00 N ATOM 108 CA LEU A 8 13.428 1.653 -6.405 1.00 0.00 C ATOM 109 C LEU A 8 12.057 2.208 -6.753 1.00 0.00 C ATOM 110 O LEU A 8 11.605 3.184 -6.164 1.00 0.00 O ATOM 111 CB LEU A 8 13.512 1.387 -4.905 1.00 0.00 C ATOM 112 CG LEU A 8 14.836 0.793 -4.434 1.00 0.00 C ATOM 113 CD1 LEU A 8 15.887 1.879 -4.260 1.00 0.00 C ATOM 114 CD2 LEU A 8 14.637 0.029 -3.134 1.00 0.00 C ATOM 0 H LEU A 8 14.525 3.430 -6.268 1.00 0.00 H new ATOM 0 HA LEU A 8 13.569 0.717 -6.945 1.00 0.00 H new ATOM 0 HB2 LEU A 8 13.341 2.323 -4.374 1.00 0.00 H new ATOM 0 HB3 LEU A 8 12.706 0.709 -4.625 1.00 0.00 H new ATOM 0 HG LEU A 8 15.191 0.099 -5.196 1.00 0.00 H new ATOM 0 HD11 LEU A 8 16.822 1.430 -3.924 1.00 0.00 H new ATOM 0 HD12 LEU A 8 16.049 2.384 -5.212 1.00 0.00 H new ATOM 0 HD13 LEU A 8 15.544 2.602 -3.519 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.589 -0.390 -2.809 1.00 0.00 H new ATOM 0 HD22 LEU A 8 14.258 0.706 -2.368 1.00 0.00 H new ATOM 0 HD23 LEU A 8 13.921 -0.777 -3.292 1.00 0.00 H new ATOM 126 N SER A 9 11.404 1.591 -7.723 1.00 0.00 N ATOM 127 CA SER A 9 10.078 2.031 -8.118 1.00 0.00 C ATOM 128 C SER A 9 9.082 1.715 -7.008 1.00 0.00 C ATOM 129 O SER A 9 7.922 2.122 -7.061 1.00 0.00 O ATOM 130 CB SER A 9 9.650 1.358 -9.423 1.00 0.00 C ATOM 131 OG SER A 9 9.589 -0.050 -9.275 1.00 0.00 O ATOM 0 H SER A 9 11.765 0.793 -8.246 1.00 0.00 H new ATOM 0 HA SER A 9 10.101 3.108 -8.285 1.00 0.00 H new ATOM 0 HB2 SER A 9 8.675 1.737 -9.728 1.00 0.00 H new ATOM 0 HB3 SER A 9 10.354 1.613 -10.215 1.00 0.00 H new ATOM 0 HG SER A 9 9.311 -0.456 -10.123 1.00 0.00 H new ATOM 137 N PHE A 10 9.559 0.987 -5.998 1.00 0.00 N ATOM 138 CA PHE A 10 8.732 0.605 -4.860 1.00 0.00 C ATOM 139 C PHE A 10 9.256 1.239 -3.572 1.00 0.00 C ATOM 140 O PHE A 10 9.296 0.596 -2.522 1.00 0.00 O ATOM 141 CB PHE A 10 8.687 -0.921 -4.724 1.00 0.00 C ATOM 142 CG PHE A 10 10.028 -1.552 -4.469 1.00 0.00 C ATOM 143 CD1 PHE A 10 10.978 -1.622 -5.475 1.00 0.00 C ATOM 144 CD2 PHE A 10 10.335 -2.077 -3.224 1.00 0.00 C ATOM 145 CE1 PHE A 10 12.211 -2.202 -5.244 1.00 0.00 C ATOM 146 CE2 PHE A 10 11.566 -2.660 -2.987 1.00 0.00 C ATOM 147 CZ PHE A 10 12.505 -2.722 -3.998 1.00 0.00 C ATOM 0 H PHE A 10 10.520 0.650 -5.948 1.00 0.00 H new ATOM 0 HA PHE A 10 7.720 0.971 -5.033 1.00 0.00 H new ATOM 0 HB2 PHE A 10 8.013 -1.183 -3.909 1.00 0.00 H new ATOM 0 HB3 PHE A 10 8.265 -1.344 -5.635 1.00 0.00 H new ATOM 0 HD1 PHE A 10 10.752 -1.219 -6.451 1.00 0.00 H new ATOM 0 HD2 PHE A 10 9.605 -2.030 -2.430 1.00 0.00 H new ATOM 0 HE1 PHE A 10 12.944 -2.249 -6.036 1.00 0.00 H new ATOM 0 HE2 PHE A 10 11.793 -3.066 -2.013 1.00 0.00 H new ATOM 0 HZ PHE A 10 13.468 -3.176 -3.815 1.00 0.00 H new ATOM 157 N ALA A 11 9.612 2.522 -3.668 1.00 0.00 N ATOM 158 CA ALA A 11 10.148 3.304 -2.549 1.00 0.00 C ATOM 159 C ALA A 11 10.956 4.474 -3.095 1.00 0.00 C ATOM 160 O ALA A 11 11.553 4.399 -4.164 1.00 0.00 O ATOM 161 CB ALA A 11 11.007 2.456 -1.621 1.00 0.00 C ATOM 0 H ALA A 11 9.536 3.054 -4.535 1.00 0.00 H new ATOM 0 HA ALA A 11 9.309 3.674 -1.960 1.00 0.00 H new ATOM 0 HB1 ALA A 11 11.383 3.075 -0.807 1.00 0.00 H new ATOM 0 HB2 ALA A 11 10.407 1.643 -1.212 1.00 0.00 H new ATOM 0 HB3 ALA A 11 11.846 2.042 -2.180 1.00 0.00 H new ATOM 167 N ALA A 12 10.968 5.555 -2.327 1.00 0.00 N ATOM 168 CA ALA A 12 11.741 6.727 -2.711 1.00 0.00 C ATOM 169 C ALA A 12 12.656 7.177 -1.574 1.00 0.00 C ATOM 170 O ALA A 12 12.251 7.183 -0.413 1.00 0.00 O ATOM 171 CB ALA A 12 10.818 7.859 -3.133 1.00 0.00 C ATOM 0 H ALA A 12 10.459 5.645 -1.447 1.00 0.00 H new ATOM 0 HA ALA A 12 12.368 6.455 -3.560 1.00 0.00 H new ATOM 0 HB1 ALA A 12 11.413 8.727 -3.417 1.00 0.00 H new ATOM 0 HB2 ALA A 12 10.215 7.539 -3.983 1.00 0.00 H new ATOM 0 HB3 ALA A 12 10.163 8.124 -2.303 1.00 0.00 H new ATOM 177 N PRO A 13 13.904 7.570 -1.892 1.00 0.00 N ATOM 178 CA PRO A 13 14.875 8.016 -0.885 1.00 0.00 C ATOM 179 C PRO A 13 14.281 9.032 0.087 1.00 0.00 C ATOM 180 O PRO A 13 13.367 9.776 -0.267 1.00 0.00 O ATOM 181 CB PRO A 13 15.980 8.654 -1.725 1.00 0.00 C ATOM 182 CG PRO A 13 15.917 7.937 -3.029 1.00 0.00 C ATOM 183 CD PRO A 13 14.463 7.618 -3.257 1.00 0.00 C ATOM 0 HA PRO A 13 15.219 7.196 -0.255 1.00 0.00 H new ATOM 0 HB2 PRO A 13 15.815 9.724 -1.852 1.00 0.00 H new ATOM 0 HB3 PRO A 13 16.956 8.536 -1.254 1.00 0.00 H new ATOM 0 HG2 PRO A 13 16.312 8.556 -3.834 1.00 0.00 H new ATOM 0 HG3 PRO A 13 16.517 7.027 -3.004 1.00 0.00 H new ATOM 0 HD2 PRO A 13 13.975 8.380 -3.864 1.00 0.00 H new ATOM 0 HD3 PRO A 13 14.337 6.668 -3.776 1.00 0.00 H new ATOM 191 N MET A 14 14.803 9.063 1.311 1.00 0.00 N ATOM 192 CA MET A 14 14.307 9.995 2.318 1.00 0.00 C ATOM 193 C MET A 14 15.332 10.214 3.426 1.00 0.00 C ATOM 194 O MET A 14 15.313 11.237 4.111 1.00 0.00 O ATOM 195 CB MET A 14 12.994 9.473 2.911 1.00 0.00 C ATOM 196 CG MET A 14 12.007 10.568 3.293 1.00 0.00 C ATOM 197 SD MET A 14 12.558 11.558 4.696 1.00 0.00 S ATOM 198 CE MET A 14 12.802 10.290 5.937 1.00 0.00 C ATOM 0 H MET A 14 15.562 8.459 1.627 1.00 0.00 H new ATOM 0 HA MET A 14 14.129 10.954 1.832 1.00 0.00 H new ATOM 0 HB2 MET A 14 12.521 8.807 2.189 1.00 0.00 H new ATOM 0 HB3 MET A 14 13.219 8.876 3.795 1.00 0.00 H new ATOM 0 HG2 MET A 14 11.848 11.221 2.435 1.00 0.00 H new ATOM 0 HG3 MET A 14 11.045 10.115 3.531 1.00 0.00 H new ATOM 0 HE1 MET A 14 12.532 10.683 6.917 1.00 0.00 H new ATOM 0 HE2 MET A 14 12.175 9.429 5.706 1.00 0.00 H new ATOM 0 HE3 MET A 14 13.848 9.985 5.944 1.00 0.00 H new ATOM 208 N ASP A 15 16.232 9.255 3.591 1.00 0.00 N ATOM 209 CA ASP A 15 17.260 9.345 4.622 1.00 0.00 C ATOM 210 C ASP A 15 18.609 8.860 4.098 1.00 0.00 C ATOM 211 O ASP A 15 19.589 8.797 4.841 1.00 0.00 O ATOM 212 CB ASP A 15 16.849 8.529 5.850 1.00 0.00 C ATOM 213 CG ASP A 15 17.730 8.804 7.054 1.00 0.00 C ATOM 214 OD1 ASP A 15 17.425 9.752 7.806 1.00 0.00 O ATOM 215 OD2 ASP A 15 18.723 8.070 7.244 1.00 0.00 O ATOM 0 H ASP A 15 16.273 8.407 3.026 1.00 0.00 H new ATOM 0 HA ASP A 15 17.363 10.392 4.906 1.00 0.00 H new ATOM 0 HB2 ASP A 15 15.813 8.756 6.103 1.00 0.00 H new ATOM 0 HB3 ASP A 15 16.892 7.467 5.607 1.00 0.00 H new ATOM 220 N ILE A 16 18.655 8.521 2.813 1.00 0.00 N ATOM 221 CA ILE A 16 19.884 8.043 2.194 1.00 0.00 C ATOM 222 C ILE A 16 20.863 9.187 1.985 1.00 0.00 C ATOM 223 O ILE A 16 22.034 8.974 1.670 1.00 0.00 O ATOM 224 CB ILE A 16 19.603 7.342 0.839 1.00 0.00 C ATOM 225 CG1 ILE A 16 20.152 8.158 -0.338 1.00 0.00 C ATOM 226 CG2 ILE A 16 18.111 7.108 0.660 1.00 0.00 C ATOM 227 CD1 ILE A 16 20.003 7.468 -1.679 1.00 0.00 C ATOM 0 H ILE A 16 17.855 8.569 2.182 1.00 0.00 H new ATOM 0 HA ILE A 16 20.325 7.314 2.873 1.00 0.00 H new ATOM 0 HB ILE A 16 20.115 6.380 0.852 1.00 0.00 H new ATOM 0 HG12 ILE A 16 19.638 9.118 -0.374 1.00 0.00 H new ATOM 0 HG13 ILE A 16 21.207 8.368 -0.162 1.00 0.00 H new ATOM 0 HG21 ILE A 16 17.932 6.615 -0.296 1.00 0.00 H new ATOM 0 HG22 ILE A 16 17.742 6.477 1.468 1.00 0.00 H new ATOM 0 HG23 ILE A 16 17.588 8.064 0.679 1.00 0.00 H new ATOM 0 HD11 ILE A 16 20.413 8.104 -2.463 1.00 0.00 H new ATOM 0 HD12 ILE A 16 20.541 6.520 -1.662 1.00 0.00 H new ATOM 0 HD13 ILE A 16 18.947 7.282 -1.877 1.00 0.00 H new ATOM 239 N THR A 17 20.363 10.394 2.192 1.00 0.00 N ATOM 240 CA THR A 17 21.149 11.608 2.015 1.00 0.00 C ATOM 241 C THR A 17 21.925 11.586 0.709 1.00 0.00 C ATOM 242 O THR A 17 22.993 10.981 0.613 1.00 0.00 O ATOM 243 CB THR A 17 22.137 11.843 3.163 1.00 0.00 C ATOM 244 OG1 THR A 17 22.950 10.681 3.367 1.00 0.00 O ATOM 245 CG2 THR A 17 21.406 12.195 4.449 1.00 0.00 C ATOM 0 H THR A 17 19.401 10.562 2.487 1.00 0.00 H new ATOM 0 HA THR A 17 20.426 12.423 2.002 1.00 0.00 H new ATOM 0 HB THR A 17 22.776 12.682 2.889 1.00 0.00 H new ATOM 0 HG1 THR A 17 23.149 10.265 2.502 1.00 0.00 H new ATOM 0 HG21 THR A 17 22.131 12.356 5.247 1.00 0.00 H new ATOM 0 HG22 THR A 17 20.823 13.104 4.299 1.00 0.00 H new ATOM 0 HG23 THR A 17 20.740 11.378 4.724 1.00 0.00 H new ATOM 253 N LEU A 18 21.379 12.254 -0.289 1.00 0.00 N ATOM 254 CA LEU A 18 22.002 12.326 -1.590 1.00 0.00 C ATOM 255 C LEU A 18 23.161 13.318 -1.588 1.00 0.00 C ATOM 256 O LEU A 18 23.105 14.359 -2.243 1.00 0.00 O ATOM 257 CB LEU A 18 20.962 12.732 -2.623 1.00 0.00 C ATOM 258 CG LEU A 18 20.114 11.582 -3.174 1.00 0.00 C ATOM 259 CD1 LEU A 18 21.000 10.545 -3.846 1.00 0.00 C ATOM 260 CD2 LEU A 18 19.296 10.943 -2.061 1.00 0.00 C ATOM 0 H LEU A 18 20.495 12.759 -0.218 1.00 0.00 H new ATOM 0 HA LEU A 18 22.404 11.345 -1.842 1.00 0.00 H new ATOM 0 HB2 LEU A 18 20.298 13.472 -2.176 1.00 0.00 H new ATOM 0 HB3 LEU A 18 21.469 13.220 -3.455 1.00 0.00 H new ATOM 0 HG LEU A 18 19.427 11.984 -3.918 1.00 0.00 H new ATOM 0 HD11 LEU A 18 20.382 9.734 -4.232 1.00 0.00 H new ATOM 0 HD12 LEU A 18 21.545 11.010 -4.668 1.00 0.00 H new ATOM 0 HD13 LEU A 18 21.709 10.147 -3.120 1.00 0.00 H new ATOM 0 HD21 LEU A 18 18.699 10.128 -2.470 1.00 0.00 H new ATOM 0 HD22 LEU A 18 19.966 10.553 -1.295 1.00 0.00 H new ATOM 0 HD23 LEU A 18 18.636 11.690 -1.620 1.00 0.00 H new ATOM 272 N THR A 19 24.206 12.988 -0.841 1.00 0.00 N ATOM 273 CA THR A 19 25.381 13.842 -0.746 1.00 0.00 C ATOM 274 C THR A 19 26.632 13.080 -1.167 1.00 0.00 C ATOM 275 O THR A 19 27.669 13.674 -1.460 1.00 0.00 O ATOM 276 CB THR A 19 25.566 14.375 0.687 1.00 0.00 C ATOM 277 OG1 THR A 19 25.982 13.313 1.555 1.00 0.00 O ATOM 278 CG2 THR A 19 24.268 14.977 1.206 1.00 0.00 C ATOM 0 H THR A 19 24.263 12.131 -0.290 1.00 0.00 H new ATOM 0 HA THR A 19 25.228 14.687 -1.418 1.00 0.00 H new ATOM 0 HB THR A 19 26.332 15.151 0.669 1.00 0.00 H new ATOM 0 HG1 THR A 19 26.099 13.660 2.464 1.00 0.00 H new ATOM 0 HG21 THR A 19 24.419 15.348 2.220 1.00 0.00 H new ATOM 0 HG22 THR A 19 23.965 15.801 0.559 1.00 0.00 H new ATOM 0 HG23 THR A 19 23.490 14.214 1.211 1.00 0.00 H new ATOM 286 N GLU A 20 26.517 11.756 -1.191 1.00 0.00 N ATOM 287 CA GLU A 20 27.624 10.892 -1.582 1.00 0.00 C ATOM 288 C GLU A 20 27.207 9.990 -2.738 1.00 0.00 C ATOM 289 O GLU A 20 26.143 10.177 -3.328 1.00 0.00 O ATOM 290 CB GLU A 20 28.080 10.044 -0.392 1.00 0.00 C ATOM 291 CG GLU A 20 28.610 10.864 0.774 1.00 0.00 C ATOM 292 CD GLU A 20 29.925 11.549 0.457 1.00 0.00 C ATOM 293 OE1 GLU A 20 29.904 12.570 -0.263 1.00 0.00 O ATOM 294 OE2 GLU A 20 30.975 11.065 0.927 1.00 0.00 O ATOM 0 H GLU A 20 25.663 11.256 -0.943 1.00 0.00 H new ATOM 0 HA GLU A 20 28.455 11.517 -1.907 1.00 0.00 H new ATOM 0 HB2 GLU A 20 27.243 9.437 -0.047 1.00 0.00 H new ATOM 0 HB3 GLU A 20 28.857 9.356 -0.724 1.00 0.00 H new ATOM 0 HG2 GLU A 20 27.871 11.616 1.050 1.00 0.00 H new ATOM 0 HG3 GLU A 20 28.743 10.214 1.639 1.00 0.00 H new ATOM 301 N THR A 21 28.047 9.012 -3.059 1.00 0.00 N ATOM 302 CA THR A 21 27.752 8.087 -4.147 1.00 0.00 C ATOM 303 C THR A 21 28.082 6.653 -3.749 1.00 0.00 C ATOM 304 O THR A 21 27.719 5.705 -4.447 1.00 0.00 O ATOM 305 CB THR A 21 28.540 8.446 -5.418 1.00 0.00 C ATOM 306 OG1 THR A 21 28.770 9.859 -5.471 1.00 0.00 O ATOM 307 CG2 THR A 21 27.782 8.009 -6.663 1.00 0.00 C ATOM 0 H THR A 21 28.933 8.840 -2.584 1.00 0.00 H new ATOM 0 HA THR A 21 26.685 8.171 -4.354 1.00 0.00 H new ATOM 0 HB THR A 21 29.495 7.922 -5.386 1.00 0.00 H new ATOM 0 HG1 THR A 21 29.274 10.078 -6.283 1.00 0.00 H new ATOM 0 HG21 THR A 21 28.357 8.273 -7.550 1.00 0.00 H new ATOM 0 HG22 THR A 21 27.630 6.930 -6.636 1.00 0.00 H new ATOM 0 HG23 THR A 21 26.815 8.511 -6.695 1.00 0.00 H new ATOM 315 N ARG A 22 28.773 6.503 -2.625 1.00 0.00 N ATOM 316 CA ARG A 22 29.155 5.188 -2.123 1.00 0.00 C ATOM 317 C ARG A 22 28.600 4.977 -0.721 1.00 0.00 C ATOM 318 O ARG A 22 28.421 5.934 0.032 1.00 0.00 O ATOM 319 CB ARG A 22 30.670 5.044 -2.102 1.00 0.00 C ATOM 320 CG ARG A 22 31.315 5.142 -3.474 1.00 0.00 C ATOM 321 CD ARG A 22 32.818 4.939 -3.395 1.00 0.00 C ATOM 322 NE ARG A 22 33.445 5.861 -2.451 1.00 0.00 N ATOM 323 CZ ARG A 22 34.754 5.904 -2.219 1.00 0.00 C ATOM 324 NH1 ARG A 22 35.572 5.085 -2.864 1.00 0.00 N ATOM 325 NH2 ARG A 22 35.244 6.770 -1.342 1.00 0.00 N ATOM 0 H ARG A 22 29.082 7.280 -2.041 1.00 0.00 H new ATOM 0 HA ARG A 22 28.738 4.433 -2.790 1.00 0.00 H new ATOM 0 HB2 ARG A 22 31.090 5.816 -1.458 1.00 0.00 H new ATOM 0 HB3 ARG A 22 30.928 4.083 -1.657 1.00 0.00 H new ATOM 0 HG2 ARG A 22 30.880 4.394 -4.137 1.00 0.00 H new ATOM 0 HG3 ARG A 22 31.100 6.118 -3.910 1.00 0.00 H new ATOM 0 HD2 ARG A 22 33.030 3.913 -3.095 1.00 0.00 H new ATOM 0 HD3 ARG A 22 33.255 5.079 -4.384 1.00 0.00 H new ATOM 0 HE ARG A 22 32.845 6.509 -1.941 1.00 0.00 H new ATOM 0 HH11 ARG A 22 35.198 4.419 -3.540 1.00 0.00 H new ATOM 0 HH12 ARG A 22 36.575 5.120 -2.684 1.00 0.00 H new ATOM 0 HH21 ARG A 22 34.617 7.403 -0.845 1.00 0.00 H new ATOM 0 HH22 ARG A 22 36.248 6.803 -1.164 1.00 0.00 H new ATOM 339 N PHE A 23 28.334 3.721 -0.369 1.00 0.00 N ATOM 340 CA PHE A 23 27.784 3.376 0.937 1.00 0.00 C ATOM 341 C PHE A 23 28.342 2.031 1.393 1.00 0.00 C ATOM 342 O PHE A 23 27.818 0.978 1.027 1.00 0.00 O ATOM 343 CB PHE A 23 26.251 3.318 0.870 1.00 0.00 C ATOM 344 CG PHE A 23 25.613 4.611 0.437 1.00 0.00 C ATOM 345 CD1 PHE A 23 25.707 5.035 -0.878 1.00 0.00 C ATOM 346 CD2 PHE A 23 24.930 5.407 1.344 1.00 0.00 C ATOM 347 CE1 PHE A 23 25.137 6.224 -1.283 1.00 0.00 C ATOM 348 CE2 PHE A 23 24.355 6.600 0.944 1.00 0.00 C ATOM 349 CZ PHE A 23 24.460 7.009 -0.371 1.00 0.00 C ATOM 0 H PHE A 23 28.493 2.919 -0.978 1.00 0.00 H new ATOM 0 HA PHE A 23 28.071 4.143 1.656 1.00 0.00 H new ATOM 0 HB2 PHE A 23 25.956 2.529 0.178 1.00 0.00 H new ATOM 0 HB3 PHE A 23 25.864 3.043 1.851 1.00 0.00 H new ATOM 0 HD1 PHE A 23 26.234 4.426 -1.597 1.00 0.00 H new ATOM 0 HD2 PHE A 23 24.846 5.092 2.374 1.00 0.00 H new ATOM 0 HE1 PHE A 23 25.220 6.541 -2.312 1.00 0.00 H new ATOM 0 HE2 PHE A 23 23.825 7.211 1.659 1.00 0.00 H new ATOM 0 HZ PHE A 23 24.014 7.941 -0.685 1.00 0.00 H new ATOM 359 N LYS A 24 29.432 2.080 2.164 1.00 0.00 N ATOM 360 CA LYS A 24 30.083 0.877 2.686 1.00 0.00 C ATOM 361 C LYS A 24 29.076 -0.166 3.127 1.00 0.00 C ATOM 362 O LYS A 24 27.897 0.127 3.316 1.00 0.00 O ATOM 363 CB LYS A 24 30.967 1.226 3.881 1.00 0.00 C ATOM 364 CG LYS A 24 30.357 2.262 4.812 1.00 0.00 C ATOM 365 CD LYS A 24 31.297 2.601 5.958 1.00 0.00 C ATOM 366 CE LYS A 24 30.679 3.616 6.906 1.00 0.00 C ATOM 367 NZ LYS A 24 29.446 3.091 7.556 1.00 0.00 N ATOM 0 H LYS A 24 29.885 2.950 2.442 1.00 0.00 H new ATOM 0 HA LYS A 24 30.683 0.467 1.874 1.00 0.00 H new ATOM 0 HB2 LYS A 24 31.172 0.318 4.447 1.00 0.00 H new ATOM 0 HB3 LYS A 24 31.925 1.597 3.517 1.00 0.00 H new ATOM 0 HG2 LYS A 24 30.125 3.167 4.250 1.00 0.00 H new ATOM 0 HG3 LYS A 24 29.415 1.885 5.211 1.00 0.00 H new ATOM 0 HD2 LYS A 24 31.545 1.693 6.507 1.00 0.00 H new ATOM 0 HD3 LYS A 24 32.231 2.997 5.559 1.00 0.00 H new ATOM 0 HE2 LYS A 24 31.406 3.887 7.672 1.00 0.00 H new ATOM 0 HE3 LYS A 24 30.440 4.527 6.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 29.189 3.702 8.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 28.668 3.080 6.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 29.619 2.124 7.898 1.00 0.00 H new ATOM 381 N THR A 25 29.554 -1.386 3.314 1.00 0.00 N ATOM 382 CA THR A 25 28.701 -2.456 3.774 1.00 0.00 C ATOM 383 C THR A 25 28.141 -2.078 5.137 1.00 0.00 C ATOM 384 O THR A 25 28.608 -1.121 5.755 1.00 0.00 O ATOM 385 CB THR A 25 29.466 -3.786 3.884 1.00 0.00 C ATOM 386 OG1 THR A 25 30.716 -3.579 4.551 1.00 0.00 O ATOM 387 CG2 THR A 25 29.709 -4.402 2.509 1.00 0.00 C ATOM 0 H THR A 25 30.525 -1.654 3.153 1.00 0.00 H new ATOM 0 HA THR A 25 27.898 -2.595 3.050 1.00 0.00 H new ATOM 0 HB THR A 25 28.855 -4.478 4.463 1.00 0.00 H new ATOM 0 HG1 THR A 25 31.196 -4.431 4.618 1.00 0.00 H new ATOM 0 HG21 THR A 25 30.252 -5.341 2.622 1.00 0.00 H new ATOM 0 HG22 THR A 25 28.753 -4.592 2.021 1.00 0.00 H new ATOM 0 HG23 THR A 25 30.296 -3.714 1.901 1.00 0.00 H new ATOM 395 N GLY A 26 27.153 -2.815 5.615 1.00 0.00 N ATOM 396 CA GLY A 26 26.568 -2.505 6.903 1.00 0.00 C ATOM 397 C GLY A 26 25.727 -1.241 6.865 1.00 0.00 C ATOM 398 O GLY A 26 24.860 -1.047 7.719 1.00 0.00 O ATOM 0 H GLY A 26 26.746 -3.619 5.138 1.00 0.00 H new ATOM 0 HA2 GLY A 26 25.949 -3.341 7.229 1.00 0.00 H new ATOM 0 HA3 GLY A 26 27.361 -2.389 7.641 1.00 0.00 H new ATOM 402 N THR A 27 25.976 -0.374 5.879 1.00 0.00 N ATOM 403 CA THR A 27 25.234 0.873 5.734 1.00 0.00 C ATOM 404 C THR A 27 23.750 0.578 5.559 1.00 0.00 C ATOM 405 O THR A 27 23.384 -0.506 5.110 1.00 0.00 O ATOM 406 CB THR A 27 25.742 1.678 4.523 1.00 0.00 C ATOM 407 OG1 THR A 27 25.440 3.068 4.696 1.00 0.00 O ATOM 408 CG2 THR A 27 25.116 1.183 3.225 1.00 0.00 C ATOM 0 H THR A 27 26.692 -0.518 5.167 1.00 0.00 H new ATOM 0 HA THR A 27 25.387 1.465 6.636 1.00 0.00 H new ATOM 0 HB THR A 27 26.821 1.539 4.461 1.00 0.00 H new ATOM 0 HG1 THR A 27 25.903 3.591 4.009 1.00 0.00 H new ATOM 0 HG21 THR A 27 25.496 1.772 2.390 1.00 0.00 H new ATOM 0 HG22 THR A 27 25.371 0.134 3.075 1.00 0.00 H new ATOM 0 HG23 THR A 27 24.033 1.288 3.280 1.00 0.00 H new ATOM 416 N THR A 28 22.892 1.530 5.904 1.00 0.00 N ATOM 417 CA THR A 28 21.459 1.310 5.769 1.00 0.00 C ATOM 418 C THR A 28 20.693 2.592 5.464 1.00 0.00 C ATOM 419 O THR A 28 20.785 3.580 6.194 1.00 0.00 O ATOM 420 CB THR A 28 20.873 0.658 7.037 1.00 0.00 C ATOM 421 OG1 THR A 28 21.308 -0.703 7.133 1.00 0.00 O ATOM 422 CG2 THR A 28 19.352 0.711 7.029 1.00 0.00 C ATOM 0 H THR A 28 23.156 2.444 6.272 1.00 0.00 H new ATOM 0 HA THR A 28 21.339 0.635 4.921 1.00 0.00 H new ATOM 0 HB THR A 28 21.231 1.218 7.901 1.00 0.00 H new ATOM 0 HG1 THR A 28 21.937 -0.897 6.407 1.00 0.00 H new ATOM 0 HG21 THR A 28 18.967 0.244 7.935 1.00 0.00 H new ATOM 0 HG22 THR A 28 19.024 1.750 6.989 1.00 0.00 H new ATOM 0 HG23 THR A 28 18.974 0.177 6.157 1.00 0.00 H new ATOM 430 N LEU A 29 19.936 2.556 4.373 1.00 0.00 N ATOM 431 CA LEU A 29 19.152 3.702 3.939 1.00 0.00 C ATOM 432 C LEU A 29 17.780 3.700 4.618 1.00 0.00 C ATOM 433 O LEU A 29 17.653 3.262 5.762 1.00 0.00 O ATOM 434 CB LEU A 29 19.000 3.683 2.413 1.00 0.00 C ATOM 435 CG LEU A 29 20.306 3.480 1.636 1.00 0.00 C ATOM 436 CD1 LEU A 29 20.686 2.009 1.604 1.00 0.00 C ATOM 437 CD2 LEU A 29 20.181 4.021 0.220 1.00 0.00 C ATOM 0 H LEU A 29 19.850 1.738 3.770 1.00 0.00 H new ATOM 0 HA LEU A 29 19.672 4.615 4.227 1.00 0.00 H new ATOM 0 HB2 LEU A 29 18.306 2.888 2.142 1.00 0.00 H new ATOM 0 HB3 LEU A 29 18.548 4.623 2.096 1.00 0.00 H new ATOM 0 HG LEU A 29 21.093 4.033 2.149 1.00 0.00 H new ATOM 0 HD11 LEU A 29 21.615 1.885 1.048 1.00 0.00 H new ATOM 0 HD12 LEU A 29 20.821 1.646 2.623 1.00 0.00 H new ATOM 0 HD13 LEU A 29 19.894 1.439 1.118 1.00 0.00 H new ATOM 0 HD21 LEU A 29 21.119 3.866 -0.313 1.00 0.00 H new ATOM 0 HD22 LEU A 29 19.378 3.498 -0.300 1.00 0.00 H new ATOM 0 HD23 LEU A 29 19.956 5.087 0.256 1.00 0.00 H new ATOM 449 N LYS A 30 16.756 4.189 3.920 1.00 0.00 N ATOM 450 CA LYS A 30 15.405 4.228 4.477 1.00 0.00 C ATOM 451 C LYS A 30 14.349 4.001 3.396 1.00 0.00 C ATOM 452 O LYS A 30 13.771 2.918 3.301 1.00 0.00 O ATOM 453 CB LYS A 30 15.156 5.561 5.185 1.00 0.00 C ATOM 454 CG LYS A 30 13.817 5.627 5.901 1.00 0.00 C ATOM 455 CD LYS A 30 13.759 6.794 6.876 1.00 0.00 C ATOM 456 CE LYS A 30 14.698 6.584 8.054 1.00 0.00 C ATOM 457 NZ LYS A 30 14.592 7.684 9.052 1.00 0.00 N ATOM 0 H LYS A 30 16.835 4.561 2.974 1.00 0.00 H new ATOM 0 HA LYS A 30 15.323 3.420 5.204 1.00 0.00 H new ATOM 0 HB2 LYS A 30 15.954 5.734 5.907 1.00 0.00 H new ATOM 0 HB3 LYS A 30 15.208 6.367 4.453 1.00 0.00 H new ATOM 0 HG2 LYS A 30 13.016 5.725 5.168 1.00 0.00 H new ATOM 0 HG3 LYS A 30 13.645 4.694 6.438 1.00 0.00 H new ATOM 0 HD2 LYS A 30 14.024 7.716 6.358 1.00 0.00 H new ATOM 0 HD3 LYS A 30 12.739 6.915 7.240 1.00 0.00 H new ATOM 0 HE2 LYS A 30 14.469 5.633 8.536 1.00 0.00 H new ATOM 0 HE3 LYS A 30 15.724 6.519 7.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 15.248 7.503 9.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 14.835 8.588 8.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 13.619 7.730 9.416 1.00 0.00 H new ATOM 471 N TYR A 31 14.099 5.034 2.592 1.00 0.00 N ATOM 472 CA TYR A 31 13.119 4.961 1.505 1.00 0.00 C ATOM 473 C TYR A 31 11.684 4.911 2.029 1.00 0.00 C ATOM 474 O TYR A 31 11.380 4.204 2.990 1.00 0.00 O ATOM 475 CB TYR A 31 13.385 3.745 0.616 1.00 0.00 C ATOM 476 CG TYR A 31 14.665 3.843 -0.179 1.00 0.00 C ATOM 477 CD1 TYR A 31 14.698 4.506 -1.399 1.00 0.00 C ATOM 478 CD2 TYR A 31 15.839 3.271 0.289 1.00 0.00 C ATOM 479 CE1 TYR A 31 15.866 4.597 -2.130 1.00 0.00 C ATOM 480 CE2 TYR A 31 17.011 3.359 -0.435 1.00 0.00 C ATOM 481 CZ TYR A 31 17.020 4.021 -1.643 1.00 0.00 C ATOM 482 OH TYR A 31 18.186 4.107 -2.367 1.00 0.00 O ATOM 0 H TYR A 31 14.565 5.938 2.673 1.00 0.00 H new ATOM 0 HA TYR A 31 13.232 5.871 0.916 1.00 0.00 H new ATOM 0 HB2 TYR A 31 13.422 2.852 1.239 1.00 0.00 H new ATOM 0 HB3 TYR A 31 12.549 3.619 -0.072 1.00 0.00 H new ATOM 0 HD1 TYR A 31 13.795 4.958 -1.782 1.00 0.00 H new ATOM 0 HD2 TYR A 31 15.836 2.749 1.234 1.00 0.00 H new ATOM 0 HE1 TYR A 31 15.875 5.116 -3.077 1.00 0.00 H new ATOM 0 HE2 TYR A 31 17.917 2.911 -0.056 1.00 0.00 H new ATOM 0 HH TYR A 31 18.185 4.935 -2.891 1.00 0.00 H new ATOM 492 N THR A 32 10.811 5.675 1.377 1.00 0.00 N ATOM 493 CA THR A 32 9.400 5.730 1.745 1.00 0.00 C ATOM 494 C THR A 32 8.591 4.715 0.943 1.00 0.00 C ATOM 495 O THR A 32 9.157 3.824 0.310 1.00 0.00 O ATOM 496 CB THR A 32 8.815 7.135 1.498 1.00 0.00 C ATOM 497 OG1 THR A 32 8.304 7.225 0.162 1.00 0.00 O ATOM 498 CG2 THR A 32 9.875 8.205 1.704 1.00 0.00 C ATOM 0 H THR A 32 11.059 6.268 0.585 1.00 0.00 H new ATOM 0 HA THR A 32 9.335 5.494 2.807 1.00 0.00 H new ATOM 0 HB THR A 32 8.007 7.297 2.212 1.00 0.00 H new ATOM 0 HG1 THR A 32 7.933 8.120 0.013 1.00 0.00 H new ATOM 0 HG21 THR A 32 9.440 9.188 1.524 1.00 0.00 H new ATOM 0 HG22 THR A 32 10.248 8.155 2.727 1.00 0.00 H new ATOM 0 HG23 THR A 32 10.698 8.040 1.009 1.00 0.00 H new ATOM 506 N CYS A 33 7.268 4.854 0.971 1.00 0.00 N ATOM 507 CA CYS A 33 6.390 3.949 0.236 1.00 0.00 C ATOM 508 C CYS A 33 5.095 4.653 -0.178 1.00 0.00 C ATOM 509 O CYS A 33 4.232 4.965 0.643 1.00 0.00 O ATOM 510 CB CYS A 33 6.075 2.706 1.076 1.00 0.00 C ATOM 511 SG CYS A 33 7.530 1.672 1.454 1.00 0.00 S ATOM 0 H CYS A 33 6.782 5.583 1.493 1.00 0.00 H new ATOM 0 HA CYS A 33 6.911 3.637 -0.669 1.00 0.00 H new ATOM 0 HB2 CYS A 33 5.614 3.021 2.012 1.00 0.00 H new ATOM 0 HB3 CYS A 33 5.340 2.100 0.546 1.00 0.00 H new ATOM 516 N LEU A 34 5.016 4.898 -1.485 1.00 0.00 N ATOM 517 CA LEU A 34 3.885 5.590 -2.099 1.00 0.00 C ATOM 518 C LEU A 34 2.555 5.132 -1.496 1.00 0.00 C ATOM 519 O LEU A 34 2.414 3.978 -1.096 1.00 0.00 O ATOM 520 CB LEU A 34 3.896 5.377 -3.615 1.00 0.00 C ATOM 521 CG LEU A 34 5.272 5.527 -4.274 1.00 0.00 C ATOM 522 CD1 LEU A 34 5.171 5.309 -5.775 1.00 0.00 C ATOM 523 CD2 LEU A 34 5.873 6.893 -3.971 1.00 0.00 C ATOM 0 H LEU A 34 5.738 4.621 -2.150 1.00 0.00 H new ATOM 0 HA LEU A 34 3.988 6.655 -1.893 1.00 0.00 H new ATOM 0 HB2 LEU A 34 3.512 4.380 -3.831 1.00 0.00 H new ATOM 0 HB3 LEU A 34 3.210 6.089 -4.073 1.00 0.00 H new ATOM 0 HG LEU A 34 5.933 4.766 -3.858 1.00 0.00 H new ATOM 0 HD11 LEU A 34 6.157 5.419 -6.226 1.00 0.00 H new ATOM 0 HD12 LEU A 34 4.792 4.306 -5.972 1.00 0.00 H new ATOM 0 HD13 LEU A 34 4.491 6.045 -6.205 1.00 0.00 H new ATOM 0 HD21 LEU A 34 6.849 6.975 -4.449 1.00 0.00 H new ATOM 0 HD22 LEU A 34 5.215 7.673 -4.353 1.00 0.00 H new ATOM 0 HD23 LEU A 34 5.986 7.010 -2.893 1.00 0.00 H new ATOM 535 N PRO A 35 1.564 6.044 -1.421 1.00 0.00 N ATOM 536 CA PRO A 35 0.242 5.756 -0.849 1.00 0.00 C ATOM 537 C PRO A 35 -0.364 4.455 -1.365 1.00 0.00 C ATOM 538 O PRO A 35 -0.725 4.346 -2.536 1.00 0.00 O ATOM 539 CB PRO A 35 -0.620 6.954 -1.282 1.00 0.00 C ATOM 540 CG PRO A 35 0.217 7.730 -2.249 1.00 0.00 C ATOM 541 CD PRO A 35 1.644 7.428 -1.898 1.00 0.00 C ATOM 0 HA PRO A 35 0.304 5.625 0.231 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -1.547 6.620 -1.748 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -0.896 7.567 -0.424 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -0.002 7.438 -3.276 1.00 0.00 H new ATOM 0 HG3 PRO A 35 0.014 8.798 -2.171 1.00 0.00 H new ATOM 0 HD2 PRO A 35 2.304 7.523 -2.761 1.00 0.00 H new ATOM 0 HD3 PRO A 35 2.025 8.101 -1.130 1.00 0.00 H new ATOM 549 N GLY A 36 -0.470 3.473 -0.476 1.00 0.00 N ATOM 550 CA GLY A 36 -1.033 2.185 -0.839 1.00 0.00 C ATOM 551 C GLY A 36 -0.020 1.072 -0.687 1.00 0.00 C ATOM 552 O GLY A 36 -0.375 -0.080 -0.436 1.00 0.00 O ATOM 0 H GLY A 36 -0.173 3.547 0.497 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -1.900 1.977 -0.212 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -1.385 2.219 -1.870 1.00 0.00 H new ATOM 556 N TYR A 37 1.245 1.436 -0.851 1.00 0.00 N ATOM 557 CA TYR A 37 2.332 0.475 -0.723 1.00 0.00 C ATOM 558 C TYR A 37 2.267 -0.200 0.632 1.00 0.00 C ATOM 559 O TYR A 37 2.871 0.276 1.593 1.00 0.00 O ATOM 560 CB TYR A 37 3.690 1.172 -0.862 1.00 0.00 C ATOM 561 CG TYR A 37 4.302 1.076 -2.236 1.00 0.00 C ATOM 562 CD1 TYR A 37 4.810 -0.127 -2.708 1.00 0.00 C ATOM 563 CD2 TYR A 37 4.370 2.188 -3.060 1.00 0.00 C ATOM 564 CE1 TYR A 37 5.367 -0.218 -3.969 1.00 0.00 C ATOM 565 CE2 TYR A 37 4.926 2.107 -4.322 1.00 0.00 C ATOM 566 CZ TYR A 37 5.421 0.902 -4.772 1.00 0.00 C ATOM 567 OH TYR A 37 5.969 0.815 -6.030 1.00 0.00 O ATOM 0 H TYR A 37 1.543 2.386 -1.072 1.00 0.00 H new ATOM 0 HA TYR A 37 2.225 -0.266 -1.515 1.00 0.00 H new ATOM 0 HB2 TYR A 37 3.573 2.224 -0.603 1.00 0.00 H new ATOM 0 HB3 TYR A 37 4.382 0.741 -0.139 1.00 0.00 H new ATOM 0 HD1 TYR A 37 4.769 -1.005 -2.080 1.00 0.00 H new ATOM 0 HD2 TYR A 37 3.982 3.133 -2.710 1.00 0.00 H new ATOM 0 HE1 TYR A 37 5.758 -1.160 -4.324 1.00 0.00 H new ATOM 0 HE2 TYR A 37 4.973 2.983 -4.952 1.00 0.00 H new ATOM 0 HH TYR A 37 6.490 1.624 -6.217 1.00 0.00 H new ATOM 577 N VAL A 38 1.532 -1.304 0.729 1.00 0.00 N ATOM 578 CA VAL A 38 1.380 -2.060 1.955 1.00 0.00 C ATOM 579 C VAL A 38 2.544 -3.013 2.152 1.00 0.00 C ATOM 580 O VAL A 38 2.864 -3.802 1.268 1.00 0.00 O ATOM 581 CB VAL A 38 0.057 -2.854 1.898 1.00 0.00 C ATOM 582 CG1 VAL A 38 0.182 -4.213 2.561 1.00 0.00 C ATOM 583 CG2 VAL A 38 -1.070 -2.048 2.510 1.00 0.00 C ATOM 0 H VAL A 38 1.019 -1.700 -0.059 1.00 0.00 H new ATOM 0 HA VAL A 38 1.363 -1.367 2.796 1.00 0.00 H new ATOM 0 HB VAL A 38 -0.176 -3.034 0.849 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -0.771 -4.738 2.498 1.00 0.00 H new ATOM 0 HG12 VAL A 38 0.951 -4.796 2.054 1.00 0.00 H new ATOM 0 HG13 VAL A 38 0.456 -4.083 3.608 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -1.995 -2.622 2.462 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -0.835 -1.825 3.551 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -1.192 -1.116 1.958 1.00 0.00 H new ATOM 593 N ARG A 39 3.167 -2.939 3.317 1.00 0.00 N ATOM 594 CA ARG A 39 4.318 -3.776 3.607 1.00 0.00 C ATOM 595 C ARG A 39 3.959 -4.974 4.474 1.00 0.00 C ATOM 596 O ARG A 39 2.934 -4.986 5.157 1.00 0.00 O ATOM 597 CB ARG A 39 5.401 -2.941 4.288 1.00 0.00 C ATOM 598 CG ARG A 39 5.067 -2.545 5.717 1.00 0.00 C ATOM 599 CD ARG A 39 6.218 -1.798 6.371 1.00 0.00 C ATOM 600 NE ARG A 39 5.924 -1.439 7.755 1.00 0.00 N ATOM 601 CZ ARG A 39 6.667 -0.605 8.475 1.00 0.00 C ATOM 602 NH1 ARG A 39 7.744 -0.042 7.944 1.00 0.00 N ATOM 603 NH2 ARG A 39 6.334 -0.331 9.730 1.00 0.00 N ATOM 0 H ARG A 39 2.896 -2.311 4.074 1.00 0.00 H new ATOM 0 HA ARG A 39 4.689 -4.166 2.659 1.00 0.00 H new ATOM 0 HB2 ARG A 39 6.335 -3.504 4.286 1.00 0.00 H new ATOM 0 HB3 ARG A 39 5.572 -2.038 3.702 1.00 0.00 H new ATOM 0 HG2 ARG A 39 4.175 -1.919 5.723 1.00 0.00 H new ATOM 0 HG3 ARG A 39 4.834 -3.437 6.298 1.00 0.00 H new ATOM 0 HD2 ARG A 39 7.115 -2.416 6.340 1.00 0.00 H new ATOM 0 HD3 ARG A 39 6.434 -0.895 5.801 1.00 0.00 H new ATOM 0 HE ARG A 39 5.101 -1.852 8.195 1.00 0.00 H new ATOM 0 HH11 ARG A 39 8.005 -0.249 6.980 1.00 0.00 H new ATOM 0 HH12 ARG A 39 8.312 0.598 8.500 1.00 0.00 H new ATOM 0 HH21 ARG A 39 5.507 -0.761 10.144 1.00 0.00 H new ATOM 0 HH22 ARG A 39 6.906 0.309 10.281 1.00 0.00 H new ATOM 617 N SER A 40 4.824 -5.979 4.431 1.00 0.00 N ATOM 618 CA SER A 40 4.637 -7.199 5.200 1.00 0.00 C ATOM 619 C SER A 40 5.818 -7.412 6.146 1.00 0.00 C ATOM 620 O SER A 40 6.281 -8.536 6.339 1.00 0.00 O ATOM 621 CB SER A 40 4.489 -8.393 4.252 1.00 0.00 C ATOM 622 OG SER A 40 4.336 -9.605 4.970 1.00 0.00 O ATOM 0 H SER A 40 5.672 -5.970 3.864 1.00 0.00 H new ATOM 0 HA SER A 40 3.729 -7.109 5.796 1.00 0.00 H new ATOM 0 HB2 SER A 40 3.626 -8.241 3.604 1.00 0.00 H new ATOM 0 HB3 SER A 40 5.365 -8.458 3.607 1.00 0.00 H new ATOM 0 HG SER A 40 5.034 -9.670 5.654 1.00 0.00 H new ATOM 628 N HIS A 41 6.296 -6.314 6.734 1.00 0.00 N ATOM 629 CA HIS A 41 7.425 -6.358 7.660 1.00 0.00 C ATOM 630 C HIS A 41 8.692 -6.824 6.946 1.00 0.00 C ATOM 631 O HIS A 41 8.947 -6.427 5.809 1.00 0.00 O ATOM 632 CB HIS A 41 7.115 -7.280 8.840 1.00 0.00 C ATOM 633 CG HIS A 41 5.848 -6.935 9.556 1.00 0.00 C ATOM 634 ND1 HIS A 41 5.744 -5.874 10.432 1.00 0.00 N ATOM 635 CD2 HIS A 41 4.624 -7.515 9.524 1.00 0.00 C ATOM 636 CE1 HIS A 41 4.512 -5.819 10.908 1.00 0.00 C ATOM 637 NE2 HIS A 41 3.814 -6.801 10.372 1.00 0.00 N ATOM 0 H HIS A 41 5.915 -5.380 6.583 1.00 0.00 H new ATOM 0 HA HIS A 41 7.593 -5.350 8.039 1.00 0.00 H new ATOM 0 HB2 HIS A 41 7.050 -8.307 8.480 1.00 0.00 H new ATOM 0 HB3 HIS A 41 7.944 -7.242 9.547 1.00 0.00 H new ATOM 0 HD2 HIS A 41 4.339 -8.378 8.940 1.00 0.00 H new ATOM 0 HE1 HIS A 41 4.140 -5.093 11.616 1.00 0.00 H new ATOM 0 HE2 HIS A 41 2.831 -6.998 10.558 1.00 0.00 H new ATOM 646 N SER A 42 9.480 -7.661 7.627 1.00 0.00 N ATOM 647 CA SER A 42 10.723 -8.194 7.071 1.00 0.00 C ATOM 648 C SER A 42 11.829 -7.147 7.085 1.00 0.00 C ATOM 649 O SER A 42 12.858 -7.322 7.739 1.00 0.00 O ATOM 650 CB SER A 42 10.507 -8.710 5.646 1.00 0.00 C ATOM 651 OG SER A 42 11.649 -9.407 5.177 1.00 0.00 O ATOM 0 H SER A 42 9.275 -7.985 8.572 1.00 0.00 H new ATOM 0 HA SER A 42 11.032 -9.027 7.702 1.00 0.00 H new ATOM 0 HB2 SER A 42 9.639 -9.370 5.622 1.00 0.00 H new ATOM 0 HB3 SER A 42 10.290 -7.873 4.982 1.00 0.00 H new ATOM 0 HG SER A 42 11.394 -9.988 4.430 1.00 0.00 H new ATOM 657 N THR A 43 11.608 -6.060 6.363 1.00 0.00 N ATOM 658 CA THR A 43 12.587 -4.979 6.279 1.00 0.00 C ATOM 659 C THR A 43 11.926 -3.669 5.845 1.00 0.00 C ATOM 660 O THR A 43 10.706 -3.605 5.694 1.00 0.00 O ATOM 661 CB THR A 43 13.718 -5.329 5.289 1.00 0.00 C ATOM 662 OG1 THR A 43 13.957 -6.741 5.296 1.00 0.00 O ATOM 663 CG2 THR A 43 15.005 -4.600 5.649 1.00 0.00 C ATOM 0 H THR A 43 10.757 -5.899 5.824 1.00 0.00 H new ATOM 0 HA THR A 43 13.011 -4.852 7.275 1.00 0.00 H new ATOM 0 HB THR A 43 13.403 -5.013 4.294 1.00 0.00 H new ATOM 0 HG1 THR A 43 14.916 -6.910 5.405 1.00 0.00 H new ATOM 0 HG21 THR A 43 15.785 -4.865 4.935 1.00 0.00 H new ATOM 0 HG22 THR A 43 14.835 -3.524 5.618 1.00 0.00 H new ATOM 0 HG23 THR A 43 15.318 -4.889 6.652 1.00 0.00 H new ATOM 671 N GLN A 44 12.736 -2.628 5.652 1.00 0.00 N ATOM 672 CA GLN A 44 12.228 -1.323 5.234 1.00 0.00 C ATOM 673 C GLN A 44 13.367 -0.423 4.750 1.00 0.00 C ATOM 674 O GLN A 44 13.320 0.796 4.914 1.00 0.00 O ATOM 675 CB GLN A 44 11.482 -0.649 6.388 1.00 0.00 C ATOM 676 CG GLN A 44 12.351 -0.390 7.608 1.00 0.00 C ATOM 677 CD GLN A 44 11.583 0.240 8.756 1.00 0.00 C ATOM 678 OE1 GLN A 44 11.907 0.027 9.924 1.00 0.00 O ATOM 679 NE2 GLN A 44 10.558 1.020 8.428 1.00 0.00 N ATOM 0 H GLN A 44 13.747 -2.664 5.779 1.00 0.00 H new ATOM 0 HA GLN A 44 11.536 -1.478 4.406 1.00 0.00 H new ATOM 0 HB2 GLN A 44 11.070 0.298 6.039 1.00 0.00 H new ATOM 0 HB3 GLN A 44 10.639 -1.276 6.680 1.00 0.00 H new ATOM 0 HG2 GLN A 44 12.788 -1.331 7.943 1.00 0.00 H new ATOM 0 HG3 GLN A 44 13.177 0.264 7.328 1.00 0.00 H new ATOM 0 HE21 GLN A 44 10.324 1.169 7.446 1.00 0.00 H new ATOM 0 HE22 GLN A 44 10.005 1.469 9.158 1.00 0.00 H new ATOM 688 N THR A 45 14.378 -1.038 4.139 1.00 0.00 N ATOM 689 CA THR A 45 15.540 -0.315 3.629 1.00 0.00 C ATOM 690 C THR A 45 16.543 -1.293 3.028 1.00 0.00 C ATOM 691 O THR A 45 16.390 -2.507 3.171 1.00 0.00 O ATOM 692 CB THR A 45 16.237 0.508 4.733 1.00 0.00 C ATOM 693 OG1 THR A 45 17.535 0.920 4.294 1.00 0.00 O ATOM 694 CG2 THR A 45 16.362 -0.297 6.017 1.00 0.00 C ATOM 0 H THR A 45 14.415 -2.046 3.984 1.00 0.00 H new ATOM 0 HA THR A 45 15.182 0.374 2.864 1.00 0.00 H new ATOM 0 HB THR A 45 15.626 1.388 4.935 1.00 0.00 H new ATOM 0 HG1 THR A 45 17.448 1.470 3.488 1.00 0.00 H new ATOM 0 HG21 THR A 45 16.857 0.306 6.778 1.00 0.00 H new ATOM 0 HG22 THR A 45 15.369 -0.580 6.367 1.00 0.00 H new ATOM 0 HG23 THR A 45 16.950 -1.195 5.828 1.00 0.00 H new ATOM 702 N LEU A 46 17.569 -0.774 2.359 1.00 0.00 N ATOM 703 CA LEU A 46 18.582 -1.622 1.742 1.00 0.00 C ATOM 704 C LEU A 46 19.874 -1.614 2.556 1.00 0.00 C ATOM 705 O LEU A 46 20.059 -0.780 3.442 1.00 0.00 O ATOM 706 CB LEU A 46 18.859 -1.133 0.319 1.00 0.00 C ATOM 707 CG LEU A 46 17.635 -0.578 -0.416 1.00 0.00 C ATOM 708 CD1 LEU A 46 18.057 0.380 -1.518 1.00 0.00 C ATOM 709 CD2 LEU A 46 16.793 -1.704 -0.987 1.00 0.00 C ATOM 0 H LEU A 46 17.720 0.227 2.231 1.00 0.00 H new ATOM 0 HA LEU A 46 18.207 -2.645 1.713 1.00 0.00 H new ATOM 0 HB2 LEU A 46 19.625 -0.358 0.358 1.00 0.00 H new ATOM 0 HB3 LEU A 46 19.271 -1.959 -0.261 1.00 0.00 H new ATOM 0 HG LEU A 46 17.030 -0.028 0.305 1.00 0.00 H new ATOM 0 HD11 LEU A 46 17.172 0.762 -2.027 1.00 0.00 H new ATOM 0 HD12 LEU A 46 18.613 1.211 -1.084 1.00 0.00 H new ATOM 0 HD13 LEU A 46 18.689 -0.145 -2.234 1.00 0.00 H new ATOM 0 HD21 LEU A 46 15.929 -1.286 -1.504 1.00 0.00 H new ATOM 0 HD22 LEU A 46 17.391 -2.285 -1.689 1.00 0.00 H new ATOM 0 HD23 LEU A 46 16.453 -2.351 -0.178 1.00 0.00 H new ATOM 721 N THR A 47 20.763 -2.551 2.242 1.00 0.00 N ATOM 722 CA THR A 47 22.045 -2.663 2.932 1.00 0.00 C ATOM 723 C THR A 47 23.112 -3.185 1.981 1.00 0.00 C ATOM 724 O THR A 47 22.807 -3.947 1.063 1.00 0.00 O ATOM 725 CB THR A 47 21.955 -3.623 4.135 1.00 0.00 C ATOM 726 OG1 THR A 47 20.709 -3.441 4.816 1.00 0.00 O ATOM 727 CG2 THR A 47 23.103 -3.390 5.105 1.00 0.00 C ATOM 0 H THR A 47 20.619 -3.247 1.511 1.00 0.00 H new ATOM 0 HA THR A 47 22.308 -1.667 3.287 1.00 0.00 H new ATOM 0 HB THR A 47 22.020 -4.644 3.758 1.00 0.00 H new ATOM 0 HG1 THR A 47 20.660 -4.056 5.578 1.00 0.00 H new ATOM 0 HG21 THR A 47 23.016 -4.080 5.944 1.00 0.00 H new ATOM 0 HG22 THR A 47 24.051 -3.558 4.594 1.00 0.00 H new ATOM 0 HG23 THR A 47 23.066 -2.365 5.473 1.00 0.00 H new ATOM 735 N CYS A 48 24.362 -2.779 2.189 1.00 0.00 N ATOM 736 CA CYS A 48 25.437 -3.249 1.332 1.00 0.00 C ATOM 737 C CYS A 48 25.976 -4.556 1.892 1.00 0.00 C ATOM 738 O CYS A 48 26.488 -4.610 3.010 1.00 0.00 O ATOM 739 CB CYS A 48 26.544 -2.203 1.207 1.00 0.00 C ATOM 740 SG CYS A 48 27.958 -2.742 0.198 1.00 0.00 S ATOM 0 H CYS A 48 24.648 -2.138 2.929 1.00 0.00 H new ATOM 0 HA CYS A 48 25.049 -3.419 0.328 1.00 0.00 H new ATOM 0 HB2 CYS A 48 26.125 -1.295 0.772 1.00 0.00 H new ATOM 0 HB3 CYS A 48 26.900 -1.944 2.204 1.00 0.00 H new ATOM 745 N ASN A 49 25.854 -5.605 1.091 1.00 0.00 N ATOM 746 CA ASN A 49 26.366 -6.912 1.467 1.00 0.00 C ATOM 747 C ASN A 49 27.752 -7.107 0.856 1.00 0.00 C ATOM 748 O ASN A 49 28.248 -6.228 0.150 1.00 0.00 O ATOM 749 CB ASN A 49 25.414 -8.015 0.990 1.00 0.00 C ATOM 750 CG ASN A 49 25.501 -8.254 -0.505 1.00 0.00 C ATOM 751 OD1 ASN A 49 25.968 -7.401 -1.257 1.00 0.00 O ATOM 752 ND2 ASN A 49 25.038 -9.417 -0.944 1.00 0.00 N ATOM 0 H ASN A 49 25.404 -5.575 0.176 1.00 0.00 H new ATOM 0 HA ASN A 49 26.440 -6.971 2.553 1.00 0.00 H new ATOM 0 HB2 ASN A 49 25.644 -8.941 1.516 1.00 0.00 H new ATOM 0 HB3 ASN A 49 24.391 -7.745 1.252 1.00 0.00 H new ATOM 0 HD21 ASN A 49 25.061 -9.632 -1.941 1.00 0.00 H new ATOM 0 HD22 ASN A 49 24.659 -10.097 -0.285 1.00 0.00 H new ATOM 759 N SER A 50 28.375 -8.246 1.123 1.00 0.00 N ATOM 760 CA SER A 50 29.695 -8.530 0.565 1.00 0.00 C ATOM 761 C SER A 50 29.520 -9.196 -0.796 1.00 0.00 C ATOM 762 O SER A 50 29.903 -10.346 -1.014 1.00 0.00 O ATOM 763 CB SER A 50 30.497 -9.424 1.511 1.00 0.00 C ATOM 764 OG SER A 50 31.772 -9.725 0.972 1.00 0.00 O ATOM 0 H SER A 50 27.995 -8.984 1.716 1.00 0.00 H new ATOM 0 HA SER A 50 30.250 -7.600 0.443 1.00 0.00 H new ATOM 0 HB2 SER A 50 30.614 -8.927 2.474 1.00 0.00 H new ATOM 0 HB3 SER A 50 29.949 -10.348 1.694 1.00 0.00 H new ATOM 0 HG SER A 50 31.664 -10.199 0.121 1.00 0.00 H new ATOM 770 N ASP A 51 28.922 -8.429 -1.697 1.00 0.00 N ATOM 771 CA ASP A 51 28.630 -8.859 -3.060 1.00 0.00 C ATOM 772 C ASP A 51 28.608 -7.656 -3.993 1.00 0.00 C ATOM 773 O ASP A 51 28.320 -7.783 -5.184 1.00 0.00 O ATOM 774 CB ASP A 51 27.268 -9.544 -3.106 1.00 0.00 C ATOM 775 CG ASP A 51 27.100 -10.412 -4.338 1.00 0.00 C ATOM 776 OD1 ASP A 51 26.766 -9.864 -5.410 1.00 0.00 O ATOM 777 OD2 ASP A 51 27.306 -11.640 -4.231 1.00 0.00 O ATOM 0 H ASP A 51 28.621 -7.475 -1.500 1.00 0.00 H new ATOM 0 HA ASP A 51 29.405 -9.556 -3.379 1.00 0.00 H new ATOM 0 HB2 ASP A 51 27.142 -10.156 -2.213 1.00 0.00 H new ATOM 0 HB3 ASP A 51 26.483 -8.788 -3.087 1.00 0.00 H new ATOM 782 N GLY A 52 28.920 -6.490 -3.438 1.00 0.00 N ATOM 783 CA GLY A 52 28.898 -5.274 -4.225 1.00 0.00 C ATOM 784 C GLY A 52 27.537 -5.028 -4.840 1.00 0.00 C ATOM 785 O GLY A 52 27.381 -4.271 -5.798 1.00 0.00 O ATOM 0 H GLY A 52 29.187 -6.367 -2.461 1.00 0.00 H new ATOM 0 HA2 GLY A 52 29.170 -4.428 -3.594 1.00 0.00 H new ATOM 0 HA3 GLY A 52 29.647 -5.338 -5.014 1.00 0.00 H new ATOM 789 N GLU A 53 26.557 -5.704 -4.252 1.00 0.00 N ATOM 790 CA GLU A 53 25.168 -5.565 -4.663 1.00 0.00 C ATOM 791 C GLU A 53 24.297 -5.257 -3.456 1.00 0.00 C ATOM 792 O GLU A 53 24.636 -5.614 -2.329 1.00 0.00 O ATOM 793 CB GLU A 53 24.665 -6.839 -5.344 1.00 0.00 C ATOM 794 CG GLU A 53 24.197 -7.908 -4.368 1.00 0.00 C ATOM 795 CD GLU A 53 23.665 -9.145 -5.066 1.00 0.00 C ATOM 796 OE1 GLU A 53 22.674 -9.023 -5.817 1.00 0.00 O ATOM 797 OE2 GLU A 53 24.238 -10.237 -4.862 1.00 0.00 O ATOM 0 H GLU A 53 26.702 -6.358 -3.483 1.00 0.00 H new ATOM 0 HA GLU A 53 25.108 -4.744 -5.377 1.00 0.00 H new ATOM 0 HB2 GLU A 53 23.842 -6.583 -6.012 1.00 0.00 H new ATOM 0 HB3 GLU A 53 25.463 -7.249 -5.964 1.00 0.00 H new ATOM 0 HG2 GLU A 53 25.026 -8.190 -3.719 1.00 0.00 H new ATOM 0 HG3 GLU A 53 23.418 -7.494 -3.728 1.00 0.00 H new ATOM 804 N TRP A 54 23.183 -4.589 -3.690 1.00 0.00 N ATOM 805 CA TRP A 54 22.271 -4.256 -2.624 1.00 0.00 C ATOM 806 C TRP A 54 21.305 -5.399 -2.394 1.00 0.00 C ATOM 807 O TRP A 54 20.439 -5.695 -3.218 1.00 0.00 O ATOM 808 CB TRP A 54 21.529 -2.974 -2.972 1.00 0.00 C ATOM 809 CG TRP A 54 22.452 -1.812 -3.157 1.00 0.00 C ATOM 810 CD1 TRP A 54 23.042 -1.402 -4.316 1.00 0.00 C ATOM 811 CD2 TRP A 54 22.905 -0.924 -2.138 1.00 0.00 C ATOM 812 NE1 TRP A 54 23.827 -0.299 -4.079 1.00 0.00 N ATOM 813 CE2 TRP A 54 23.760 0.012 -2.746 1.00 0.00 C ATOM 814 CE3 TRP A 54 22.662 -0.832 -0.772 1.00 0.00 C ATOM 815 CZ2 TRP A 54 24.375 1.033 -2.024 1.00 0.00 C ATOM 816 CZ3 TRP A 54 23.272 0.179 -0.053 1.00 0.00 C ATOM 817 CH2 TRP A 54 24.119 1.100 -0.681 1.00 0.00 C ATOM 0 H TRP A 54 22.892 -4.268 -4.613 1.00 0.00 H new ATOM 0 HA TRP A 54 22.828 -4.094 -1.701 1.00 0.00 H new ATOM 0 HB2 TRP A 54 20.954 -3.127 -3.886 1.00 0.00 H new ATOM 0 HB3 TRP A 54 20.815 -2.745 -2.181 1.00 0.00 H new ATOM 0 HD1 TRP A 54 22.912 -1.874 -5.278 1.00 0.00 H new ATOM 0 HE1 TRP A 54 24.370 0.205 -4.780 1.00 0.00 H new ATOM 0 HE3 TRP A 54 22.008 -1.538 -0.281 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 25.029 1.745 -2.506 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 23.092 0.260 1.009 1.00 0.00 H new ATOM 0 HH2 TRP A 54 24.580 1.880 -0.093 1.00 0.00 H new ATOM 828 N VAL A 55 21.483 -6.036 -1.245 1.00 0.00 N ATOM 829 CA VAL A 55 20.678 -7.173 -0.848 1.00 0.00 C ATOM 830 C VAL A 55 19.568 -6.679 0.067 1.00 0.00 C ATOM 831 O VAL A 55 19.789 -5.745 0.839 1.00 0.00 O ATOM 832 CB VAL A 55 21.543 -8.222 -0.122 1.00 0.00 C ATOM 833 CG1 VAL A 55 20.745 -8.970 0.929 1.00 0.00 C ATOM 834 CG2 VAL A 55 22.145 -9.193 -1.119 1.00 0.00 C ATOM 0 H VAL A 55 22.194 -5.774 -0.562 1.00 0.00 H new ATOM 0 HA VAL A 55 20.250 -7.648 -1.731 1.00 0.00 H new ATOM 0 HB VAL A 55 22.349 -7.693 0.387 1.00 0.00 H new ATOM 0 HG11 VAL A 55 21.386 -9.701 1.421 1.00 0.00 H new ATOM 0 HG12 VAL A 55 20.366 -8.265 1.668 1.00 0.00 H new ATOM 0 HG13 VAL A 55 19.908 -9.482 0.454 1.00 0.00 H new ATOM 0 HG21 VAL A 55 22.753 -9.927 -0.590 1.00 0.00 H new ATOM 0 HG22 VAL A 55 21.346 -9.703 -1.658 1.00 0.00 H new ATOM 0 HG23 VAL A 55 22.769 -8.647 -1.827 1.00 0.00 H new ATOM 844 N TYR A 56 18.391 -7.296 0.010 1.00 0.00 N ATOM 845 CA TYR A 56 17.306 -6.859 0.890 1.00 0.00 C ATOM 846 C TYR A 56 15.993 -7.593 0.634 1.00 0.00 C ATOM 847 O TYR A 56 15.886 -8.398 -0.290 1.00 0.00 O ATOM 848 CB TYR A 56 17.075 -5.357 0.706 1.00 0.00 C ATOM 849 CG TYR A 56 16.693 -4.990 -0.712 1.00 0.00 C ATOM 850 CD1 TYR A 56 17.666 -4.796 -1.686 1.00 0.00 C ATOM 851 CD2 TYR A 56 15.361 -4.844 -1.078 1.00 0.00 C ATOM 852 CE1 TYR A 56 17.322 -4.465 -2.983 1.00 0.00 C ATOM 853 CE2 TYR A 56 15.010 -4.515 -2.374 1.00 0.00 C ATOM 854 CZ TYR A 56 15.993 -4.327 -3.321 1.00 0.00 C ATOM 855 OH TYR A 56 15.647 -3.999 -4.612 1.00 0.00 O ATOM 0 H TYR A 56 18.166 -8.073 -0.612 1.00 0.00 H new ATOM 0 HA TYR A 56 17.616 -7.090 1.909 1.00 0.00 H new ATOM 0 HB2 TYR A 56 16.288 -5.029 1.385 1.00 0.00 H new ATOM 0 HB3 TYR A 56 17.981 -4.818 0.984 1.00 0.00 H new ATOM 0 HD1 TYR A 56 18.708 -4.906 -1.425 1.00 0.00 H new ATOM 0 HD2 TYR A 56 14.587 -4.990 -0.339 1.00 0.00 H new ATOM 0 HE1 TYR A 56 18.090 -4.315 -3.727 1.00 0.00 H new ATOM 0 HE2 TYR A 56 13.970 -4.406 -2.643 1.00 0.00 H new ATOM 0 HH TYR A 56 14.772 -4.387 -4.825 1.00 0.00 H new ATOM 865 N ASN A 57 14.998 -7.305 1.468 1.00 0.00 N ATOM 866 CA ASN A 57 13.686 -7.925 1.340 1.00 0.00 C ATOM 867 C ASN A 57 12.666 -6.920 0.819 1.00 0.00 C ATOM 868 O ASN A 57 12.892 -5.710 0.864 1.00 0.00 O ATOM 869 CB ASN A 57 13.233 -8.483 2.691 1.00 0.00 C ATOM 870 CG ASN A 57 14.112 -9.622 3.168 1.00 0.00 C ATOM 871 OD1 ASN A 57 13.802 -10.793 2.952 1.00 0.00 O ATOM 872 ND2 ASN A 57 15.221 -9.282 3.815 1.00 0.00 N ATOM 0 H ASN A 57 15.077 -6.644 2.241 1.00 0.00 H new ATOM 0 HA ASN A 57 13.760 -8.744 0.625 1.00 0.00 H new ATOM 0 HB2 ASN A 57 13.243 -7.684 3.433 1.00 0.00 H new ATOM 0 HB3 ASN A 57 12.203 -8.831 2.611 1.00 0.00 H new ATOM 0 HD21 ASN A 57 15.855 -10.005 4.155 1.00 0.00 H new ATOM 0 HD22 ASN A 57 15.439 -8.298 3.972 1.00 0.00 H new ATOM 879 N THR A 58 11.542 -7.426 0.324 1.00 0.00 N ATOM 880 CA THR A 58 10.491 -6.569 -0.208 1.00 0.00 C ATOM 881 C THR A 58 9.594 -6.063 0.910 1.00 0.00 C ATOM 882 O THR A 58 8.739 -6.794 1.413 1.00 0.00 O ATOM 883 CB THR A 58 9.631 -7.308 -1.249 1.00 0.00 C ATOM 884 OG1 THR A 58 10.467 -7.859 -2.274 1.00 0.00 O ATOM 885 CG2 THR A 58 8.610 -6.368 -1.874 1.00 0.00 C ATOM 0 H THR A 58 11.336 -8.424 0.280 1.00 0.00 H new ATOM 0 HA THR A 58 10.981 -5.726 -0.695 1.00 0.00 H new ATOM 0 HB THR A 58 9.099 -8.113 -0.742 1.00 0.00 H new ATOM 0 HG1 THR A 58 9.912 -8.329 -2.931 1.00 0.00 H new ATOM 0 HG21 THR A 58 8.014 -6.913 -2.606 1.00 0.00 H new ATOM 0 HG22 THR A 58 7.956 -5.972 -1.097 1.00 0.00 H new ATOM 0 HG23 THR A 58 9.127 -5.545 -2.367 1.00 0.00 H new ATOM 893 N PHE A 59 9.795 -4.811 1.301 1.00 0.00 N ATOM 894 CA PHE A 59 9.003 -4.216 2.367 1.00 0.00 C ATOM 895 C PHE A 59 7.579 -3.924 1.894 1.00 0.00 C ATOM 896 O PHE A 59 6.731 -4.817 1.887 1.00 0.00 O ATOM 897 CB PHE A 59 9.672 -2.942 2.897 1.00 0.00 C ATOM 898 CG PHE A 59 10.644 -2.312 1.939 1.00 0.00 C ATOM 899 CD1 PHE A 59 10.203 -1.479 0.924 1.00 0.00 C ATOM 900 CD2 PHE A 59 12.004 -2.553 2.058 1.00 0.00 C ATOM 901 CE1 PHE A 59 11.098 -0.898 0.046 1.00 0.00 C ATOM 902 CE2 PHE A 59 12.904 -1.975 1.182 1.00 0.00 C ATOM 903 CZ PHE A 59 12.450 -1.145 0.175 1.00 0.00 C ATOM 0 H PHE A 59 10.497 -4.191 0.897 1.00 0.00 H new ATOM 0 HA PHE A 59 8.946 -4.935 3.184 1.00 0.00 H new ATOM 0 HB2 PHE A 59 8.899 -2.214 3.143 1.00 0.00 H new ATOM 0 HB3 PHE A 59 10.194 -3.178 3.824 1.00 0.00 H new ATOM 0 HD1 PHE A 59 9.147 -1.281 0.818 1.00 0.00 H new ATOM 0 HD2 PHE A 59 12.365 -3.200 2.844 1.00 0.00 H new ATOM 0 HE1 PHE A 59 10.740 -0.251 -0.741 1.00 0.00 H new ATOM 0 HE2 PHE A 59 13.961 -2.172 1.285 1.00 0.00 H new ATOM 0 HZ PHE A 59 13.151 -0.691 -0.509 1.00 0.00 H new ATOM 913 N CYS A 60 7.314 -2.681 1.495 1.00 0.00 N ATOM 914 CA CYS A 60 5.986 -2.310 1.020 1.00 0.00 C ATOM 915 C CYS A 60 5.686 -2.985 -0.314 1.00 0.00 C ATOM 916 O CYS A 60 6.161 -2.552 -1.364 1.00 0.00 O ATOM 917 CB CYS A 60 5.849 -0.789 0.895 1.00 0.00 C ATOM 918 SG CYS A 60 7.316 0.063 0.235 1.00 0.00 S ATOM 0 H CYS A 60 7.995 -1.922 1.492 1.00 0.00 H new ATOM 0 HA CYS A 60 5.258 -2.654 1.755 1.00 0.00 H new ATOM 0 HB2 CYS A 60 4.998 -0.568 0.251 1.00 0.00 H new ATOM 0 HB3 CYS A 60 5.620 -0.378 1.878 1.00 0.00 H new ATOM 923 N ILE A 61 4.894 -4.054 -0.259 1.00 0.00 N ATOM 924 CA ILE A 61 4.536 -4.805 -1.454 1.00 0.00 C ATOM 925 C ILE A 61 3.366 -4.172 -2.209 1.00 0.00 C ATOM 926 O ILE A 61 3.078 -4.563 -3.340 1.00 0.00 O ATOM 927 CB ILE A 61 4.201 -6.275 -1.118 1.00 0.00 C ATOM 928 CG1 ILE A 61 3.033 -6.354 -0.132 1.00 0.00 C ATOM 929 CG2 ILE A 61 5.426 -6.979 -0.548 1.00 0.00 C ATOM 930 CD1 ILE A 61 2.680 -7.769 0.275 1.00 0.00 C ATOM 0 H ILE A 61 4.489 -4.418 0.603 1.00 0.00 H new ATOM 0 HA ILE A 61 5.412 -4.779 -2.102 1.00 0.00 H new ATOM 0 HB ILE A 61 3.905 -6.778 -2.038 1.00 0.00 H new ATOM 0 HG12 ILE A 61 3.282 -5.779 0.760 1.00 0.00 H new ATOM 0 HG13 ILE A 61 2.157 -5.884 -0.580 1.00 0.00 H new ATOM 0 HG21 ILE A 61 5.176 -8.014 -0.316 1.00 0.00 H new ATOM 0 HG22 ILE A 61 6.232 -6.957 -1.281 1.00 0.00 H new ATOM 0 HG23 ILE A 61 5.748 -6.471 0.361 1.00 0.00 H new ATOM 0 HD11 ILE A 61 1.844 -7.749 0.974 1.00 0.00 H new ATOM 0 HD12 ILE A 61 2.400 -8.343 -0.609 1.00 0.00 H new ATOM 0 HD13 ILE A 61 3.541 -8.236 0.752 1.00 0.00 H new ATOM 942 N TYR A 62 2.691 -3.199 -1.586 1.00 0.00 N ATOM 943 CA TYR A 62 1.566 -2.516 -2.235 1.00 0.00 C ATOM 944 C TYR A 62 0.405 -3.458 -2.523 1.00 0.00 C ATOM 945 O TYR A 62 0.563 -4.451 -3.232 1.00 0.00 O ATOM 946 CB TYR A 62 2.022 -1.896 -3.561 1.00 0.00 C ATOM 947 CG TYR A 62 1.336 -0.585 -3.889 1.00 0.00 C ATOM 948 CD1 TYR A 62 -0.010 -0.382 -3.612 1.00 0.00 C ATOM 949 CD2 TYR A 62 2.048 0.460 -4.459 1.00 0.00 C ATOM 950 CE1 TYR A 62 -0.623 0.824 -3.899 1.00 0.00 C ATOM 951 CE2 TYR A 62 1.447 1.669 -4.745 1.00 0.00 C ATOM 952 CZ TYR A 62 0.111 1.847 -4.464 1.00 0.00 C ATOM 953 OH TYR A 62 -0.493 3.049 -4.748 1.00 0.00 O ATOM 0 H TYR A 62 2.901 -2.870 -0.644 1.00 0.00 H new ATOM 0 HA TYR A 62 1.225 -1.747 -1.543 1.00 0.00 H new ATOM 0 HB2 TYR A 62 3.099 -1.733 -3.524 1.00 0.00 H new ATOM 0 HB3 TYR A 62 1.835 -2.605 -4.367 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -0.587 -1.178 -3.166 1.00 0.00 H new ATOM 0 HD2 TYR A 62 3.096 0.325 -4.684 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -1.672 0.965 -3.682 1.00 0.00 H new ATOM 0 HE2 TYR A 62 2.021 2.470 -5.186 1.00 0.00 H new ATOM 0 HH TYR A 62 -0.840 3.444 -3.921 1.00 0.00 H new ATOM 963 N LYS A 63 -0.769 -3.143 -1.976 1.00 0.00 N ATOM 964 CA LYS A 63 -1.963 -3.932 -2.233 1.00 0.00 C ATOM 965 C LYS A 63 -3.217 -3.123 -1.922 1.00 0.00 C ATOM 966 O LYS A 63 -3.437 -2.707 -0.784 1.00 0.00 O ATOM 967 CB LYS A 63 -1.943 -5.222 -1.409 1.00 0.00 C ATOM 968 CG LYS A 63 -1.986 -4.991 0.091 1.00 0.00 C ATOM 969 CD LYS A 63 -1.846 -6.294 0.862 1.00 0.00 C ATOM 970 CE LYS A 63 -0.471 -6.904 0.684 1.00 0.00 C ATOM 971 NZ LYS A 63 -0.371 -8.242 1.330 1.00 0.00 N ATOM 0 H LYS A 63 -0.914 -2.348 -1.354 1.00 0.00 H new ATOM 0 HA LYS A 63 -1.976 -4.197 -3.290 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -2.794 -5.839 -1.697 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -1.043 -5.785 -1.655 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -1.185 -4.310 0.378 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -2.926 -4.508 0.359 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -2.029 -6.112 1.921 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -2.604 -7.000 0.524 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -0.249 -6.996 -0.379 1.00 0.00 H new ATOM 0 HE3 LYS A 63 0.280 -6.238 1.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 0.263 -8.184 2.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -1.315 -8.549 1.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 0.009 -8.929 0.648 1.00 0.00 H new ATOM 985 N ARG A 64 -4.034 -2.890 -2.942 1.00 0.00 N ATOM 986 CA ARG A 64 -5.265 -2.127 -2.783 1.00 0.00 C ATOM 987 C ARG A 64 -6.452 -2.870 -3.389 1.00 0.00 C ATOM 988 O ARG A 64 -6.283 -3.730 -4.253 1.00 0.00 O ATOM 989 CB ARG A 64 -5.112 -0.753 -3.435 1.00 0.00 C ATOM 990 CG ARG A 64 -4.450 -0.804 -4.801 1.00 0.00 C ATOM 991 CD ARG A 64 -3.642 0.454 -5.071 1.00 0.00 C ATOM 992 NE ARG A 64 -4.494 1.617 -5.305 1.00 0.00 N ATOM 993 CZ ARG A 64 -4.057 2.759 -5.825 1.00 0.00 C ATOM 994 NH1 ARG A 64 -2.781 2.894 -6.162 1.00 0.00 N ATOM 995 NH2 ARG A 64 -4.896 3.769 -6.012 1.00 0.00 N ATOM 0 H ARG A 64 -3.865 -3.220 -3.892 1.00 0.00 H new ATOM 0 HA ARG A 64 -5.456 -1.999 -1.717 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -6.096 -0.294 -3.533 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -4.525 -0.111 -2.779 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -3.799 -1.676 -4.859 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -5.211 -0.922 -5.572 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -2.986 0.651 -4.223 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -3.002 0.294 -5.939 1.00 0.00 H new ATOM 0 HE ARG A 64 -5.481 1.549 -5.055 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -2.132 2.120 -6.022 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -2.449 3.772 -6.561 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -5.878 3.670 -5.756 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -4.559 4.645 -6.411 1.00 0.00 H new ATOM 1009 N CYS A 65 -7.653 -2.518 -2.945 1.00 0.00 N ATOM 1010 CA CYS A 65 -8.864 -3.159 -3.431 1.00 0.00 C ATOM 1011 C CYS A 65 -9.488 -2.314 -4.520 1.00 0.00 C ATOM 1012 O CYS A 65 -9.602 -1.096 -4.371 1.00 0.00 O ATOM 1013 CB CYS A 65 -9.867 -3.342 -2.291 1.00 0.00 C ATOM 1014 SG CYS A 65 -9.134 -3.965 -0.746 1.00 0.00 S ATOM 0 H CYS A 65 -7.812 -1.791 -2.248 1.00 0.00 H new ATOM 0 HA CYS A 65 -8.602 -4.138 -3.832 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -10.351 -2.386 -2.091 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -10.646 -4.032 -2.615 1.00 0.00 H new ATOM 1019 N ARG A 66 -9.884 -2.943 -5.617 1.00 0.00 N ATOM 1020 CA ARG A 66 -10.493 -2.197 -6.701 1.00 0.00 C ATOM 1021 C ARG A 66 -11.636 -1.357 -6.154 1.00 0.00 C ATOM 1022 O ARG A 66 -12.444 -1.830 -5.359 1.00 0.00 O ATOM 1023 CB ARG A 66 -10.982 -3.123 -7.818 1.00 0.00 C ATOM 1024 CG ARG A 66 -11.716 -2.397 -8.936 1.00 0.00 C ATOM 1025 CD ARG A 66 -10.891 -1.248 -9.495 1.00 0.00 C ATOM 1026 NE ARG A 66 -11.525 -0.628 -10.655 1.00 0.00 N ATOM 1027 CZ ARG A 66 -10.875 0.137 -11.527 1.00 0.00 C ATOM 1028 NH1 ARG A 66 -9.576 0.364 -11.376 1.00 0.00 N ATOM 1029 NH2 ARG A 66 -11.520 0.674 -12.553 1.00 0.00 N ATOM 0 H ARG A 66 -9.796 -3.947 -5.776 1.00 0.00 H new ATOM 0 HA ARG A 66 -9.740 -1.541 -7.138 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -10.127 -3.652 -8.240 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -11.643 -3.876 -7.390 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -11.949 -3.100 -9.735 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -12.665 -2.015 -8.560 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -10.744 -0.497 -8.719 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -9.903 -1.615 -9.775 1.00 0.00 H new ATOM 0 HE ARG A 66 -12.521 -0.791 -10.805 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -9.074 -0.049 -10.590 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -9.080 0.951 -12.046 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -12.518 0.501 -12.675 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -11.019 1.260 -13.220 1.00 0.00 H new ATOM 1043 N HIS A 67 -11.692 -0.114 -6.591 1.00 0.00 N ATOM 1044 CA HIS A 67 -12.720 0.808 -6.127 1.00 0.00 C ATOM 1045 C HIS A 67 -14.116 0.198 -6.266 1.00 0.00 C ATOM 1046 O HIS A 67 -14.551 -0.107 -7.377 1.00 0.00 O ATOM 1047 CB HIS A 67 -12.644 2.114 -6.917 1.00 0.00 C ATOM 1048 CG HIS A 67 -13.480 3.211 -6.339 1.00 0.00 C ATOM 1049 ND1 HIS A 67 -14.729 3.544 -6.821 1.00 0.00 N ATOM 1050 CD2 HIS A 67 -13.236 4.058 -5.313 1.00 0.00 C ATOM 1051 CE1 HIS A 67 -15.218 4.548 -6.114 1.00 0.00 C ATOM 1052 NE2 HIS A 67 -14.332 4.877 -5.192 1.00 0.00 N ATOM 0 H HIS A 67 -11.040 0.284 -7.267 1.00 0.00 H new ATOM 0 HA HIS A 67 -12.541 1.010 -5.071 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -11.606 2.443 -6.960 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -12.962 1.928 -7.943 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -12.345 4.085 -4.703 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -16.178 5.019 -6.265 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -14.443 5.619 -4.501 1.00 0.00 H new ATOM 1061 N PRO A 68 -14.832 0.003 -5.136 1.00 0.00 N ATOM 1062 CA PRO A 68 -16.188 -0.551 -5.144 1.00 0.00 C ATOM 1063 C PRO A 68 -17.019 0.011 -6.286 1.00 0.00 C ATOM 1064 O PRO A 68 -17.844 -0.689 -6.871 1.00 0.00 O ATOM 1065 CB PRO A 68 -16.746 -0.088 -3.802 1.00 0.00 C ATOM 1066 CG PRO A 68 -15.560 -0.063 -2.902 1.00 0.00 C ATOM 1067 CD PRO A 68 -14.378 0.311 -3.764 1.00 0.00 C ATOM 0 HA PRO A 68 -16.202 -1.632 -5.282 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -17.207 0.897 -3.881 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -17.512 -0.770 -3.433 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -15.698 0.660 -2.098 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -15.407 -1.035 -2.434 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -14.120 1.364 -3.655 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -13.491 -0.263 -3.498 1.00 0.00 H new ATOM 1075 N GLY A 69 -16.788 1.276 -6.604 1.00 0.00 N ATOM 1076 CA GLY A 69 -17.529 1.920 -7.666 1.00 0.00 C ATOM 1077 C GLY A 69 -18.550 2.906 -7.139 1.00 0.00 C ATOM 1078 O GLY A 69 -18.572 3.241 -5.954 1.00 0.00 O ATOM 0 H GLY A 69 -16.098 1.869 -6.143 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.835 2.438 -8.328 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -18.034 1.162 -8.265 1.00 0.00 H new ATOM 1082 N GLU A 70 -19.394 3.356 -8.054 1.00 0.00 N ATOM 1083 CA GLU A 70 -20.435 4.313 -7.719 1.00 0.00 C ATOM 1084 C GLU A 70 -21.607 3.602 -7.041 1.00 0.00 C ATOM 1085 O GLU A 70 -22.054 2.545 -7.486 1.00 0.00 O ATOM 1086 CB GLU A 70 -20.902 5.064 -8.969 1.00 0.00 C ATOM 1087 CG GLU A 70 -21.613 6.378 -8.677 1.00 0.00 C ATOM 1088 CD GLU A 70 -22.941 6.190 -7.973 1.00 0.00 C ATOM 1089 OE1 GLU A 70 -23.862 5.608 -8.586 1.00 0.00 O ATOM 1090 OE2 GLU A 70 -23.062 6.628 -6.809 1.00 0.00 O ATOM 0 H GLU A 70 -19.378 3.074 -9.034 1.00 0.00 H new ATOM 0 HA GLU A 70 -20.025 5.044 -7.022 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -20.038 5.264 -9.603 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -21.572 4.419 -9.537 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -20.968 7.005 -8.062 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -21.777 6.912 -9.613 1.00 0.00 H new ATOM 1097 N LEU A 71 -22.092 4.204 -5.956 1.00 0.00 N ATOM 1098 CA LEU A 71 -23.222 3.664 -5.205 1.00 0.00 C ATOM 1099 C LEU A 71 -24.502 4.308 -5.714 1.00 0.00 C ATOM 1100 O LEU A 71 -24.854 5.410 -5.290 1.00 0.00 O ATOM 1101 CB LEU A 71 -23.052 3.952 -3.704 1.00 0.00 C ATOM 1102 CG LEU A 71 -23.664 2.925 -2.737 1.00 0.00 C ATOM 1103 CD1 LEU A 71 -23.503 3.398 -1.300 1.00 0.00 C ATOM 1104 CD2 LEU A 71 -25.133 2.671 -3.047 1.00 0.00 C ATOM 0 H LEU A 71 -21.716 5.073 -5.576 1.00 0.00 H new ATOM 0 HA LEU A 71 -23.269 2.584 -5.345 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -21.986 4.030 -3.490 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -23.492 4.926 -3.491 1.00 0.00 H new ATOM 0 HG LEU A 71 -23.130 1.984 -2.867 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -23.940 2.663 -0.624 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -22.444 3.516 -1.072 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -24.010 4.355 -1.173 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -25.532 1.940 -2.344 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -25.690 3.603 -2.957 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -25.229 2.287 -4.063 1.00 0.00 H new ATOM 1116 N ARG A 72 -25.202 3.636 -6.621 1.00 0.00 N ATOM 1117 CA ARG A 72 -26.456 4.174 -7.133 1.00 0.00 C ATOM 1118 C ARG A 72 -27.443 4.322 -5.986 1.00 0.00 C ATOM 1119 O ARG A 72 -27.817 3.349 -5.329 1.00 0.00 O ATOM 1120 CB ARG A 72 -27.029 3.307 -8.254 1.00 0.00 C ATOM 1121 CG ARG A 72 -28.456 3.666 -8.634 1.00 0.00 C ATOM 1122 CD ARG A 72 -28.939 2.851 -9.822 1.00 0.00 C ATOM 1123 NE ARG A 72 -28.279 3.244 -11.065 1.00 0.00 N ATOM 1124 CZ ARG A 72 -28.240 2.480 -12.152 1.00 0.00 C ATOM 1125 NH1 ARG A 72 -28.809 1.282 -12.146 1.00 0.00 N ATOM 1126 NH2 ARG A 72 -27.630 2.914 -13.247 1.00 0.00 N ATOM 0 H ARG A 72 -24.929 2.734 -7.011 1.00 0.00 H new ATOM 0 HA ARG A 72 -26.265 5.155 -7.568 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -26.393 3.400 -9.135 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -26.996 2.262 -7.946 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -29.114 3.495 -7.782 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -28.514 4.728 -8.873 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -28.755 1.793 -9.634 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -30.017 2.973 -9.930 1.00 0.00 H new ATOM 0 HE ARG A 72 -27.823 4.156 -11.101 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -29.278 0.945 -11.306 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -28.777 0.698 -12.982 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -27.191 3.834 -13.255 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -27.600 2.327 -14.081 1.00 0.00 H new ATOM 1140 N ASN A 73 -27.844 5.572 -5.764 1.00 0.00 N ATOM 1141 CA ASN A 73 -28.724 5.918 -4.664 1.00 0.00 C ATOM 1142 C ASN A 73 -27.964 5.644 -3.382 1.00 0.00 C ATOM 1143 O ASN A 73 -28.490 5.029 -2.458 1.00 0.00 O ATOM 1144 CB ASN A 73 -30.027 5.114 -4.715 1.00 0.00 C ATOM 1145 CG ASN A 73 -30.773 5.299 -6.022 1.00 0.00 C ATOM 1146 OD1 ASN A 73 -30.699 6.355 -6.649 1.00 0.00 O ATOM 1147 ND2 ASN A 73 -31.498 4.267 -6.439 1.00 0.00 N ATOM 0 H ASN A 73 -27.567 6.366 -6.342 1.00 0.00 H new ATOM 0 HA ASN A 73 -29.011 6.968 -4.724 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -29.803 4.056 -4.575 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -30.669 5.416 -3.888 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -32.022 4.331 -7.312 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -31.530 3.410 -5.887 1.00 0.00 H new ATOM 1154 N GLY A 74 -26.729 6.137 -3.315 1.00 0.00 N ATOM 1155 CA GLY A 74 -25.917 5.897 -2.145 1.00 0.00 C ATOM 1156 C GLY A 74 -24.600 6.650 -2.167 1.00 0.00 C ATOM 1157 O GLY A 74 -24.292 7.356 -3.127 1.00 0.00 O ATOM 0 H GLY A 74 -26.284 6.693 -4.045 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -26.478 6.185 -1.256 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -25.716 4.829 -2.063 1.00 0.00 H new ATOM 1161 N GLN A 75 -23.824 6.493 -1.097 1.00 0.00 N ATOM 1162 CA GLN A 75 -22.534 7.166 -0.983 1.00 0.00 C ATOM 1163 C GLN A 75 -21.441 6.197 -0.535 1.00 0.00 C ATOM 1164 O GLN A 75 -21.642 5.393 0.374 1.00 0.00 O ATOM 1165 CB GLN A 75 -22.628 8.331 0.004 1.00 0.00 C ATOM 1166 CG GLN A 75 -23.577 9.431 -0.444 1.00 0.00 C ATOM 1167 CD GLN A 75 -23.133 10.096 -1.732 1.00 0.00 C ATOM 1168 OE1 GLN A 75 -21.940 10.173 -2.025 1.00 0.00 O ATOM 1169 NE2 GLN A 75 -24.094 10.584 -2.509 1.00 0.00 N ATOM 0 H GLN A 75 -24.066 5.907 -0.298 1.00 0.00 H new ATOM 0 HA GLN A 75 -22.270 7.549 -1.969 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -22.956 7.951 0.972 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -21.635 8.756 0.148 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -24.574 9.012 -0.581 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -23.652 10.183 0.342 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -25.071 10.498 -2.227 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -23.855 11.044 -3.387 1.00 0.00 H new ATOM 1178 N VAL A 76 -20.284 6.285 -1.185 1.00 0.00 N ATOM 1179 CA VAL A 76 -19.156 5.424 -0.849 1.00 0.00 C ATOM 1180 C VAL A 76 -18.080 6.217 -0.115 1.00 0.00 C ATOM 1181 O VAL A 76 -17.374 7.023 -0.724 1.00 0.00 O ATOM 1182 CB VAL A 76 -18.532 4.775 -2.098 1.00 0.00 C ATOM 1183 CG1 VAL A 76 -17.513 3.720 -1.688 1.00 0.00 C ATOM 1184 CG2 VAL A 76 -19.613 4.166 -2.978 1.00 0.00 C ATOM 0 H VAL A 76 -20.104 6.942 -1.945 1.00 0.00 H new ATOM 0 HA VAL A 76 -19.543 4.633 -0.206 1.00 0.00 H new ATOM 0 HB VAL A 76 -18.019 5.545 -2.674 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -17.078 3.268 -2.580 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -16.725 4.186 -1.096 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -18.005 2.950 -1.094 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -19.154 3.712 -3.856 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -20.153 3.404 -2.416 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -20.307 4.945 -3.293 1.00 0.00 H new ATOM 1194 N GLU A 77 -17.956 5.995 1.186 1.00 0.00 N ATOM 1195 CA GLU A 77 -16.950 6.695 1.975 1.00 0.00 C ATOM 1196 C GLU A 77 -15.547 6.226 1.595 1.00 0.00 C ATOM 1197 O GLU A 77 -14.984 5.338 2.236 1.00 0.00 O ATOM 1198 CB GLU A 77 -17.190 6.475 3.471 1.00 0.00 C ATOM 1199 CG GLU A 77 -16.160 7.156 4.359 1.00 0.00 C ATOM 1200 CD GLU A 77 -16.395 6.896 5.834 1.00 0.00 C ATOM 1201 OE1 GLU A 77 -15.969 5.829 6.323 1.00 0.00 O ATOM 1202 OE2 GLU A 77 -17.003 7.760 6.499 1.00 0.00 O ATOM 0 H GLU A 77 -18.534 5.342 1.715 1.00 0.00 H new ATOM 0 HA GLU A 77 -17.032 7.761 1.761 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -18.182 6.845 3.730 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -17.185 5.405 3.678 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -15.164 6.806 4.087 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -16.182 8.230 4.176 1.00 0.00 H new ATOM 1209 N ILE A 78 -14.993 6.819 0.541 1.00 0.00 N ATOM 1210 CA ILE A 78 -13.656 6.462 0.080 1.00 0.00 C ATOM 1211 C ILE A 78 -12.648 7.541 0.437 1.00 0.00 C ATOM 1212 O ILE A 78 -12.725 8.670 -0.046 1.00 0.00 O ATOM 1213 CB ILE A 78 -13.620 6.216 -1.441 1.00 0.00 C ATOM 1214 CG1 ILE A 78 -14.396 4.946 -1.783 1.00 0.00 C ATOM 1215 CG2 ILE A 78 -12.183 6.117 -1.937 1.00 0.00 C ATOM 1216 CD1 ILE A 78 -13.830 3.692 -1.149 1.00 0.00 C ATOM 0 H ILE A 78 -15.449 7.547 -0.009 1.00 0.00 H new ATOM 0 HA ILE A 78 -13.388 5.535 0.588 1.00 0.00 H new ATOM 0 HB ILE A 78 -14.092 7.061 -1.942 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -15.431 5.067 -1.464 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -14.409 4.820 -2.866 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -12.181 5.943 -3.013 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -11.658 7.047 -1.718 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -11.681 5.290 -1.435 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -14.435 2.833 -1.439 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -12.804 3.544 -1.487 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -13.843 3.795 -0.064 1.00 0.00 H new ATOM 1228 N LYS A 79 -11.705 7.177 1.291 1.00 0.00 N ATOM 1229 CA LYS A 79 -10.675 8.096 1.734 1.00 0.00 C ATOM 1230 C LYS A 79 -9.320 7.412 1.775 1.00 0.00 C ATOM 1231 O LYS A 79 -8.315 7.958 1.320 1.00 0.00 O ATOM 1232 CB LYS A 79 -11.019 8.619 3.132 1.00 0.00 C ATOM 1233 CG LYS A 79 -11.107 7.533 4.203 1.00 0.00 C ATOM 1234 CD LYS A 79 -12.172 6.496 3.901 1.00 0.00 C ATOM 1235 CE LYS A 79 -12.804 5.978 5.181 1.00 0.00 C ATOM 1236 NZ LYS A 79 -11.843 5.188 5.998 1.00 0.00 N ATOM 0 H LYS A 79 -11.634 6.242 1.693 1.00 0.00 H new ATOM 0 HA LYS A 79 -10.627 8.924 1.027 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -10.265 9.348 3.431 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -11.972 9.146 3.086 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -10.140 7.039 4.293 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -11.320 7.996 5.167 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -12.940 6.933 3.263 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -11.731 5.667 3.347 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -13.174 6.818 5.768 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -13.666 5.358 4.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -12.310 4.868 6.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -11.522 4.362 5.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -11.024 5.782 6.242 1.00 0.00 H new ATOM 1250 N THR A 80 -9.309 6.211 2.327 1.00 0.00 N ATOM 1251 CA THR A 80 -8.090 5.439 2.475 1.00 0.00 C ATOM 1252 C THR A 80 -7.531 4.932 1.149 1.00 0.00 C ATOM 1253 O THR A 80 -6.550 4.189 1.145 1.00 0.00 O ATOM 1254 CB THR A 80 -8.328 4.249 3.415 1.00 0.00 C ATOM 1255 OG1 THR A 80 -9.252 3.328 2.822 1.00 0.00 O ATOM 1256 CG2 THR A 80 -8.876 4.736 4.749 1.00 0.00 C ATOM 0 H THR A 80 -10.143 5.745 2.684 1.00 0.00 H new ATOM 0 HA THR A 80 -7.349 6.117 2.898 1.00 0.00 H new ATOM 0 HB THR A 80 -7.377 3.743 3.583 1.00 0.00 H new ATOM 0 HG1 THR A 80 -9.922 3.063 3.487 1.00 0.00 H new ATOM 0 HG21 THR A 80 -9.041 3.883 5.408 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.160 5.417 5.209 1.00 0.00 H new ATOM 0 HG23 THR A 80 -9.820 5.257 4.586 1.00 0.00 H new ATOM 1264 N ASP A 81 -8.141 5.319 0.022 1.00 0.00 N ATOM 1265 CA ASP A 81 -7.632 4.876 -1.279 1.00 0.00 C ATOM 1266 C ASP A 81 -7.625 3.356 -1.379 1.00 0.00 C ATOM 1267 O ASP A 81 -7.053 2.785 -2.309 1.00 0.00 O ATOM 1268 CB ASP A 81 -6.201 5.370 -1.445 1.00 0.00 C ATOM 1269 CG ASP A 81 -6.105 6.882 -1.464 1.00 0.00 C ATOM 1270 OD1 ASP A 81 -5.983 7.484 -0.377 1.00 0.00 O ATOM 1271 OD2 ASP A 81 -6.150 7.466 -2.568 1.00 0.00 O ATOM 0 H ASP A 81 -8.964 5.920 -0.017 1.00 0.00 H new ATOM 0 HA ASP A 81 -8.282 5.280 -2.055 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -5.590 4.981 -0.631 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -5.788 4.972 -2.372 1.00 0.00 H new ATOM 1276 N LEU A 82 -8.262 2.716 -0.412 1.00 0.00 N ATOM 1277 CA LEU A 82 -8.325 1.262 -0.354 1.00 0.00 C ATOM 1278 C LEU A 82 -6.919 0.698 -0.176 1.00 0.00 C ATOM 1279 O LEU A 82 -6.496 -0.184 -0.920 1.00 0.00 O ATOM 1280 CB LEU A 82 -8.961 0.694 -1.627 1.00 0.00 C ATOM 1281 CG LEU A 82 -10.444 1.023 -1.841 1.00 0.00 C ATOM 1282 CD1 LEU A 82 -11.225 0.883 -0.541 1.00 0.00 C ATOM 1283 CD2 LEU A 82 -10.601 2.423 -2.414 1.00 0.00 C ATOM 0 H LEU A 82 -8.748 3.185 0.352 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.944 0.972 0.495 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -8.400 1.063 -2.486 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -8.848 -0.390 -1.614 1.00 0.00 H new ATOM 0 HG LEU A 82 -10.851 0.309 -2.557 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -12.274 1.122 -0.719 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -11.143 -0.141 -0.176 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -10.818 1.568 0.203 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -11.659 2.640 -2.560 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -10.173 3.149 -1.723 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -10.083 2.485 -3.371 1.00 0.00 H new ATOM 1295 N SER A 83 -6.208 1.203 0.821 1.00 0.00 N ATOM 1296 CA SER A 83 -4.843 0.760 1.079 1.00 0.00 C ATOM 1297 C SER A 83 -4.807 -0.540 1.879 1.00 0.00 C ATOM 1298 O SER A 83 -3.885 -0.758 2.664 1.00 0.00 O ATOM 1299 CB SER A 83 -4.065 1.850 1.818 1.00 0.00 C ATOM 1300 OG SER A 83 -4.648 2.128 3.080 1.00 0.00 O ATOM 0 H SER A 83 -6.551 1.917 1.463 1.00 0.00 H new ATOM 0 HA SER A 83 -4.374 0.568 0.114 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.031 1.534 1.954 1.00 0.00 H new ATOM 0 HB3 SER A 83 -4.045 2.758 1.216 1.00 0.00 H new ATOM 0 HG SER A 83 -4.131 2.827 3.532 1.00 0.00 H new ATOM 1306 N PHE A 84 -5.795 -1.410 1.660 1.00 0.00 N ATOM 1307 CA PHE A 84 -5.867 -2.694 2.359 1.00 0.00 C ATOM 1308 C PHE A 84 -5.934 -2.504 3.873 1.00 0.00 C ATOM 1309 O PHE A 84 -5.164 -1.736 4.446 1.00 0.00 O ATOM 1310 CB PHE A 84 -4.659 -3.561 1.994 1.00 0.00 C ATOM 1311 CG PHE A 84 -4.507 -4.786 2.851 1.00 0.00 C ATOM 1312 CD1 PHE A 84 -5.391 -5.846 2.733 1.00 0.00 C ATOM 1313 CD2 PHE A 84 -3.478 -4.876 3.775 1.00 0.00 C ATOM 1314 CE1 PHE A 84 -5.253 -6.972 3.521 1.00 0.00 C ATOM 1315 CE2 PHE A 84 -3.335 -6.001 4.566 1.00 0.00 C ATOM 1316 CZ PHE A 84 -4.223 -7.050 4.438 1.00 0.00 C ATOM 0 H PHE A 84 -6.558 -1.248 1.003 1.00 0.00 H new ATOM 0 HA PHE A 84 -6.782 -3.195 2.042 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -4.746 -3.867 0.952 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -3.754 -2.959 2.075 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -6.197 -5.791 2.017 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -2.780 -4.058 3.878 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -5.950 -7.791 3.420 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -2.530 -6.059 5.283 1.00 0.00 H new ATOM 0 HZ PHE A 84 -4.113 -7.930 5.054 1.00 0.00 H new ATOM 1326 N GLY A 85 -6.854 -3.209 4.524 1.00 0.00 N ATOM 1327 CA GLY A 85 -6.986 -3.105 5.963 1.00 0.00 C ATOM 1328 C GLY A 85 -7.783 -1.887 6.382 1.00 0.00 C ATOM 1329 O GLY A 85 -7.449 -1.232 7.370 1.00 0.00 O ATOM 0 H GLY A 85 -7.510 -3.851 4.079 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -7.471 -4.003 6.347 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -5.995 -3.060 6.414 1.00 0.00 H new ATOM 1333 N SER A 86 -8.841 -1.580 5.634 1.00 0.00 N ATOM 1334 CA SER A 86 -9.675 -0.426 5.950 1.00 0.00 C ATOM 1335 C SER A 86 -11.156 -0.720 5.766 1.00 0.00 C ATOM 1336 O SER A 86 -11.548 -1.660 5.074 1.00 0.00 O ATOM 1337 CB SER A 86 -9.289 0.780 5.094 1.00 0.00 C ATOM 1338 OG SER A 86 -9.259 0.443 3.718 1.00 0.00 O ATOM 0 H SER A 86 -9.138 -2.109 4.814 1.00 0.00 H new ATOM 0 HA SER A 86 -9.500 -0.197 7.001 1.00 0.00 H new ATOM 0 HB2 SER A 86 -10.002 1.588 5.258 1.00 0.00 H new ATOM 0 HB3 SER A 86 -8.311 1.150 5.402 1.00 0.00 H new ATOM 0 HG SER A 86 -9.140 1.256 3.184 1.00 0.00 H new ATOM 1344 N GLN A 87 -11.961 0.113 6.405 1.00 0.00 N ATOM 1345 CA GLN A 87 -13.407 -0.004 6.340 1.00 0.00 C ATOM 1346 C GLN A 87 -13.989 1.217 5.634 1.00 0.00 C ATOM 1347 O GLN A 87 -13.605 2.351 5.924 1.00 0.00 O ATOM 1348 CB GLN A 87 -13.987 -0.155 7.754 1.00 0.00 C ATOM 1349 CG GLN A 87 -15.437 0.286 7.896 1.00 0.00 C ATOM 1350 CD GLN A 87 -15.560 1.757 8.241 1.00 0.00 C ATOM 1351 OE1 GLN A 87 -15.518 2.139 9.411 1.00 0.00 O ATOM 1352 NE2 GLN A 87 -15.728 2.591 7.223 1.00 0.00 N ATOM 0 H GLN A 87 -11.631 0.887 6.982 1.00 0.00 H new ATOM 0 HA GLN A 87 -13.676 -0.893 5.769 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -13.908 -1.200 8.055 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -13.376 0.424 8.447 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -15.967 0.088 6.965 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -15.921 -0.308 8.671 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -15.757 2.232 6.269 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -15.828 3.591 7.395 1.00 0.00 H new ATOM 1361 N ILE A 88 -14.897 0.982 4.693 1.00 0.00 N ATOM 1362 CA ILE A 88 -15.525 2.070 3.949 1.00 0.00 C ATOM 1363 C ILE A 88 -17.044 2.009 4.067 1.00 0.00 C ATOM 1364 O ILE A 88 -17.710 1.273 3.341 1.00 0.00 O ATOM 1365 CB ILE A 88 -15.119 2.054 2.464 1.00 0.00 C ATOM 1366 CG1 ILE A 88 -15.301 0.657 1.868 1.00 0.00 C ATOM 1367 CG2 ILE A 88 -13.676 2.516 2.310 1.00 0.00 C ATOM 1368 CD1 ILE A 88 -15.094 0.606 0.371 1.00 0.00 C ATOM 0 H ILE A 88 -15.215 0.050 4.427 1.00 0.00 H new ATOM 0 HA ILE A 88 -15.171 3.001 4.391 1.00 0.00 H new ATOM 0 HB ILE A 88 -15.767 2.742 1.920 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -14.601 -0.027 2.347 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -16.304 0.300 2.100 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -13.400 2.501 1.256 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -13.575 3.530 2.697 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -13.019 1.848 2.867 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -15.239 -0.415 0.018 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -15.812 1.264 -0.118 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -14.082 0.932 0.132 1.00 0.00 H new ATOM 1380 N GLU A 89 -17.583 2.788 4.999 1.00 0.00 N ATOM 1381 CA GLU A 89 -19.017 2.830 5.227 1.00 0.00 C ATOM 1382 C GLU A 89 -19.752 3.387 4.016 1.00 0.00 C ATOM 1383 O GLU A 89 -19.164 4.071 3.180 1.00 0.00 O ATOM 1384 CB GLU A 89 -19.322 3.678 6.459 1.00 0.00 C ATOM 1385 CG GLU A 89 -19.252 2.902 7.762 1.00 0.00 C ATOM 1386 CD GLU A 89 -19.492 3.777 8.976 1.00 0.00 C ATOM 1387 OE1 GLU A 89 -20.666 4.116 9.240 1.00 0.00 O ATOM 1388 OE2 GLU A 89 -18.509 4.126 9.662 1.00 0.00 O ATOM 0 H GLU A 89 -17.042 3.400 5.610 1.00 0.00 H new ATOM 0 HA GLU A 89 -19.365 1.810 5.393 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -18.617 4.509 6.502 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -20.318 4.110 6.356 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -19.992 2.102 7.744 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -18.273 2.430 7.847 1.00 0.00 H new ATOM 1395 N PHE A 90 -21.042 3.086 3.929 1.00 0.00 N ATOM 1396 CA PHE A 90 -21.862 3.559 2.823 1.00 0.00 C ATOM 1397 C PHE A 90 -22.981 4.460 3.329 1.00 0.00 C ATOM 1398 O PHE A 90 -23.091 4.713 4.529 1.00 0.00 O ATOM 1399 CB PHE A 90 -22.442 2.376 2.046 1.00 0.00 C ATOM 1400 CG PHE A 90 -21.397 1.425 1.533 1.00 0.00 C ATOM 1401 CD1 PHE A 90 -20.947 0.382 2.326 1.00 0.00 C ATOM 1402 CD2 PHE A 90 -20.863 1.576 0.262 1.00 0.00 C ATOM 1403 CE1 PHE A 90 -19.985 -0.493 1.860 1.00 0.00 C ATOM 1404 CE2 PHE A 90 -19.901 0.703 -0.207 1.00 0.00 C ATOM 1405 CZ PHE A 90 -19.462 -0.332 0.593 1.00 0.00 C ATOM 0 H PHE A 90 -21.542 2.516 4.612 1.00 0.00 H new ATOM 0 HA PHE A 90 -21.230 4.141 2.152 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -23.132 1.832 2.690 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -23.022 2.754 1.204 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -21.352 0.252 3.319 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -21.203 2.385 -0.368 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -19.642 -1.303 2.487 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -19.493 0.830 -1.199 1.00 0.00 H new ATOM 0 HZ PHE A 90 -18.710 -1.016 0.228 1.00 0.00 H new ATOM 1415 N SER A 91 -23.811 4.938 2.409 1.00 0.00 N ATOM 1416 CA SER A 91 -24.913 5.819 2.784 1.00 0.00 C ATOM 1417 C SER A 91 -26.006 5.829 1.730 1.00 0.00 C ATOM 1418 O SER A 91 -25.831 6.376 0.644 1.00 0.00 O ATOM 1419 CB SER A 91 -24.416 7.245 3.008 1.00 0.00 C ATOM 1420 OG SER A 91 -23.378 7.285 3.971 1.00 0.00 O ATOM 0 H SER A 91 -23.745 4.735 1.412 1.00 0.00 H new ATOM 0 HA SER A 91 -25.329 5.430 3.713 1.00 0.00 H new ATOM 0 HB2 SER A 91 -24.057 7.659 2.066 1.00 0.00 H new ATOM 0 HB3 SER A 91 -25.244 7.873 3.337 1.00 0.00 H new ATOM 0 HG SER A 91 -23.424 6.485 4.535 1.00 0.00 H new ATOM 1426 N CYS A 92 -27.140 5.239 2.070 1.00 0.00 N ATOM 1427 CA CYS A 92 -28.254 5.202 1.135 1.00 0.00 C ATOM 1428 C CYS A 92 -29.043 6.504 1.219 1.00 0.00 C ATOM 1429 O CYS A 92 -29.424 6.945 2.304 1.00 0.00 O ATOM 1430 CB CYS A 92 -29.154 3.996 1.385 1.00 0.00 C ATOM 1431 SG CYS A 92 -30.089 3.483 -0.079 1.00 0.00 S ATOM 0 H CYS A 92 -27.313 4.787 2.968 1.00 0.00 H new ATOM 0 HA CYS A 92 -27.854 5.098 0.126 1.00 0.00 H new ATOM 0 HB2 CYS A 92 -28.543 3.161 1.728 1.00 0.00 H new ATOM 0 HB3 CYS A 92 -29.852 4.232 2.188 1.00 0.00 H new ATOM 1436 N SER A 93 -29.263 7.117 0.060 1.00 0.00 N ATOM 1437 CA SER A 93 -29.978 8.391 -0.029 1.00 0.00 C ATOM 1438 C SER A 93 -31.287 8.421 0.757 1.00 0.00 C ATOM 1439 O SER A 93 -31.685 7.454 1.406 1.00 0.00 O ATOM 1440 CB SER A 93 -30.273 8.734 -1.489 1.00 0.00 C ATOM 1441 OG SER A 93 -29.094 9.120 -2.173 1.00 0.00 O ATOM 0 H SER A 93 -28.954 6.750 -0.840 1.00 0.00 H new ATOM 0 HA SER A 93 -29.315 9.131 0.419 1.00 0.00 H new ATOM 0 HB2 SER A 93 -30.718 7.872 -1.985 1.00 0.00 H new ATOM 0 HB3 SER A 93 -31.004 9.541 -1.535 1.00 0.00 H new ATOM 0 HG SER A 93 -29.311 9.332 -3.105 1.00 0.00 H new ATOM 1447 N GLU A 94 -31.945 9.571 0.658 1.00 0.00 N ATOM 1448 CA GLU A 94 -33.212 9.848 1.324 1.00 0.00 C ATOM 1449 C GLU A 94 -34.239 8.724 1.194 1.00 0.00 C ATOM 1450 O GLU A 94 -34.461 7.968 2.141 1.00 0.00 O ATOM 1451 CB GLU A 94 -33.798 11.145 0.765 1.00 0.00 C ATOM 1452 CG GLU A 94 -35.148 11.509 1.354 1.00 0.00 C ATOM 1453 CD GLU A 94 -35.698 12.809 0.800 1.00 0.00 C ATOM 1454 OE1 GLU A 94 -35.280 13.883 1.281 1.00 0.00 O ATOM 1455 OE2 GLU A 94 -36.545 12.752 -0.116 1.00 0.00 O ATOM 0 H GLU A 94 -31.604 10.354 0.100 1.00 0.00 H new ATOM 0 HA GLU A 94 -32.994 9.939 2.388 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -33.098 11.960 0.952 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -33.897 11.052 -0.317 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -35.856 10.705 1.153 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -35.057 11.590 2.437 1.00 0.00 H new ATOM 1462 N GLY A 95 -34.869 8.626 0.032 1.00 0.00 N ATOM 1463 CA GLY A 95 -35.924 7.646 -0.186 1.00 0.00 C ATOM 1464 C GLY A 95 -35.500 6.190 -0.118 1.00 0.00 C ATOM 1465 O GLY A 95 -36.199 5.336 -0.649 1.00 0.00 O ATOM 0 H GLY A 95 -34.667 9.215 -0.776 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -36.706 7.812 0.555 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -36.368 7.830 -1.164 1.00 0.00 H new ATOM 1469 N PHE A 96 -34.397 5.884 0.550 1.00 0.00 N ATOM 1470 CA PHE A 96 -33.950 4.490 0.671 1.00 0.00 C ATOM 1471 C PHE A 96 -33.068 4.306 1.899 1.00 0.00 C ATOM 1472 O PHE A 96 -32.802 5.254 2.638 1.00 0.00 O ATOM 1473 CB PHE A 96 -33.164 4.034 -0.570 1.00 0.00 C ATOM 1474 CG PHE A 96 -33.429 4.821 -1.819 1.00 0.00 C ATOM 1475 CD1 PHE A 96 -34.499 4.507 -2.639 1.00 0.00 C ATOM 1476 CD2 PHE A 96 -32.605 5.877 -2.167 1.00 0.00 C ATOM 1477 CE1 PHE A 96 -34.747 5.232 -3.785 1.00 0.00 C ATOM 1478 CE2 PHE A 96 -32.846 6.608 -3.316 1.00 0.00 C ATOM 1479 CZ PHE A 96 -33.920 6.286 -4.126 1.00 0.00 C ATOM 0 H PHE A 96 -33.797 6.567 1.013 1.00 0.00 H new ATOM 0 HA PHE A 96 -34.849 3.881 0.766 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -32.099 4.087 -0.345 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -33.397 2.987 -0.763 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -35.148 3.684 -2.378 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -31.767 6.132 -1.536 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -35.586 4.977 -4.415 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -32.196 7.429 -3.581 1.00 0.00 H new ATOM 0 HZ PHE A 96 -34.112 6.857 -5.023 1.00 0.00 H new ATOM 1489 N PHE A 97 -32.615 3.071 2.107 1.00 0.00 N ATOM 1490 CA PHE A 97 -31.750 2.749 3.235 1.00 0.00 C ATOM 1491 C PHE A 97 -30.692 1.733 2.822 1.00 0.00 C ATOM 1492 O PHE A 97 -30.732 1.167 1.729 1.00 0.00 O ATOM 1493 CB PHE A 97 -32.572 2.237 4.424 1.00 0.00 C ATOM 1494 CG PHE A 97 -33.168 0.869 4.236 1.00 0.00 C ATOM 1495 CD1 PHE A 97 -34.180 0.657 3.313 1.00 0.00 C ATOM 1496 CD2 PHE A 97 -32.725 -0.201 4.997 1.00 0.00 C ATOM 1497 CE1 PHE A 97 -34.739 -0.597 3.154 1.00 0.00 C ATOM 1498 CE2 PHE A 97 -33.279 -1.457 4.841 1.00 0.00 C ATOM 1499 CZ PHE A 97 -34.289 -1.655 3.919 1.00 0.00 C ATOM 0 H PHE A 97 -32.835 2.277 1.506 1.00 0.00 H new ATOM 0 HA PHE A 97 -31.241 3.660 3.550 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -31.935 2.222 5.308 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -33.377 2.945 4.623 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -34.536 1.481 2.712 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -31.937 -0.051 5.721 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -35.527 -0.749 2.432 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -32.923 -2.283 5.439 1.00 0.00 H new ATOM 0 HZ PHE A 97 -34.726 -2.635 3.797 1.00 0.00 H new ATOM 1509 N LEU A 98 -29.749 1.519 3.730 1.00 0.00 N ATOM 1510 CA LEU A 98 -28.642 0.602 3.495 1.00 0.00 C ATOM 1511 C LEU A 98 -29.023 -0.826 3.868 1.00 0.00 C ATOM 1512 O LEU A 98 -29.674 -1.063 4.886 1.00 0.00 O ATOM 1513 CB LEU A 98 -27.425 1.056 4.312 1.00 0.00 C ATOM 1514 CG LEU A 98 -26.065 0.505 3.865 1.00 0.00 C ATOM 1515 CD1 LEU A 98 -25.976 -0.993 4.112 1.00 0.00 C ATOM 1516 CD2 LEU A 98 -25.808 0.824 2.401 1.00 0.00 C ATOM 0 H LEU A 98 -29.729 1.972 4.643 1.00 0.00 H new ATOM 0 HA LEU A 98 -28.397 0.615 2.433 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -27.380 2.145 4.283 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -27.585 0.771 5.352 1.00 0.00 H new ATOM 0 HG LEU A 98 -25.293 0.992 4.461 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -25.002 -1.358 3.786 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -26.102 -1.194 5.176 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -26.760 -1.501 3.551 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -24.838 0.424 2.106 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -26.588 0.373 1.788 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -25.813 1.905 2.258 1.00 0.00 H new ATOM 1528 N ILE A 99 -28.610 -1.775 3.032 1.00 0.00 N ATOM 1529 CA ILE A 99 -28.873 -3.196 3.245 1.00 0.00 C ATOM 1530 C ILE A 99 -27.864 -4.023 2.471 1.00 0.00 C ATOM 1531 O ILE A 99 -27.799 -3.983 1.245 1.00 0.00 O ATOM 1532 CB ILE A 99 -30.271 -3.607 2.750 1.00 0.00 C ATOM 1533 CG1 ILE A 99 -31.101 -2.375 2.419 1.00 0.00 C ATOM 1534 CG2 ILE A 99 -30.967 -4.469 3.788 1.00 0.00 C ATOM 1535 CD1 ILE A 99 -32.282 -2.653 1.516 1.00 0.00 C ATOM 0 H ILE A 99 -28.080 -1.579 2.183 1.00 0.00 H new ATOM 0 HA ILE A 99 -28.804 -3.372 4.318 1.00 0.00 H new ATOM 0 HB ILE A 99 -30.161 -4.195 1.839 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -31.463 -1.933 3.347 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -30.459 -1.634 1.942 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -31.955 -4.752 3.423 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -30.377 -5.367 3.970 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -31.070 -3.908 4.717 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -32.822 -1.725 1.327 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -31.928 -3.066 0.571 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -32.948 -3.369 1.998 1.00 0.00 H new ATOM 1547 N GLY A 100 -27.085 -4.779 3.228 1.00 0.00 N ATOM 1548 CA GLY A 100 -26.049 -5.614 2.656 1.00 0.00 C ATOM 1549 C GLY A 100 -24.872 -5.743 3.596 1.00 0.00 C ATOM 1550 O GLY A 100 -24.533 -6.835 4.052 1.00 0.00 O ATOM 0 H GLY A 100 -27.154 -4.829 4.244 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -26.454 -6.602 2.437 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -25.717 -5.189 1.709 1.00 0.00 H new ATOM 1554 N SER A 101 -24.263 -4.601 3.876 1.00 0.00 N ATOM 1555 CA SER A 101 -23.117 -4.502 4.760 1.00 0.00 C ATOM 1556 C SER A 101 -22.634 -3.061 4.763 1.00 0.00 C ATOM 1557 O SER A 101 -21.907 -2.642 3.861 1.00 0.00 O ATOM 1558 CB SER A 101 -22.002 -5.437 4.297 1.00 0.00 C ATOM 1559 OG SER A 101 -21.456 -5.015 3.060 1.00 0.00 O ATOM 0 H SER A 101 -24.557 -3.705 3.488 1.00 0.00 H new ATOM 0 HA SER A 101 -23.403 -4.799 5.769 1.00 0.00 H new ATOM 0 HB2 SER A 101 -21.216 -5.470 5.051 1.00 0.00 H new ATOM 0 HB3 SER A 101 -22.392 -6.450 4.198 1.00 0.00 H new ATOM 0 HG SER A 101 -21.657 -4.066 2.920 1.00 0.00 H new ATOM 1565 N THR A 102 -23.043 -2.294 5.770 1.00 0.00 N ATOM 1566 CA THR A 102 -22.669 -0.892 5.844 1.00 0.00 C ATOM 1567 C THR A 102 -21.165 -0.739 5.929 1.00 0.00 C ATOM 1568 O THR A 102 -20.634 0.364 5.809 1.00 0.00 O ATOM 1569 CB THR A 102 -23.310 -0.190 7.058 1.00 0.00 C ATOM 1570 OG1 THR A 102 -22.640 -0.586 8.261 1.00 0.00 O ATOM 1571 CG2 THR A 102 -24.788 -0.528 7.168 1.00 0.00 C ATOM 0 H THR A 102 -23.629 -2.620 6.539 1.00 0.00 H new ATOM 0 HA THR A 102 -23.037 -0.422 4.932 1.00 0.00 H new ATOM 0 HB THR A 102 -23.210 0.886 6.917 1.00 0.00 H new ATOM 0 HG1 THR A 102 -23.051 -0.135 9.028 1.00 0.00 H new ATOM 0 HG21 THR A 102 -25.214 -0.019 8.033 1.00 0.00 H new ATOM 0 HG22 THR A 102 -25.304 -0.202 6.265 1.00 0.00 H new ATOM 0 HG23 THR A 102 -24.907 -1.605 7.285 1.00 0.00 H new ATOM 1579 N THR A 103 -20.483 -1.849 6.138 1.00 0.00 N ATOM 1580 CA THR A 103 -19.042 -1.836 6.226 1.00 0.00 C ATOM 1581 C THR A 103 -18.441 -2.657 5.102 1.00 0.00 C ATOM 1582 O THR A 103 -19.086 -3.557 4.562 1.00 0.00 O ATOM 1583 CB THR A 103 -18.562 -2.372 7.575 1.00 0.00 C ATOM 1584 OG1 THR A 103 -18.960 -3.739 7.737 1.00 0.00 O ATOM 1585 CG2 THR A 103 -19.119 -1.532 8.713 1.00 0.00 C ATOM 0 H THR A 103 -20.907 -2.770 6.250 1.00 0.00 H new ATOM 0 HA THR A 103 -18.712 -0.801 6.134 1.00 0.00 H new ATOM 0 HB THR A 103 -17.474 -2.314 7.598 1.00 0.00 H new ATOM 0 HG1 THR A 103 -18.645 -4.071 8.604 1.00 0.00 H new ATOM 0 HG21 THR A 103 -18.766 -1.929 9.665 1.00 0.00 H new ATOM 0 HG22 THR A 103 -18.782 -0.501 8.603 1.00 0.00 H new ATOM 0 HG23 THR A 103 -20.208 -1.563 8.688 1.00 0.00 H new ATOM 1593 N SER A 104 -17.205 -2.345 4.751 1.00 0.00 N ATOM 1594 CA SER A 104 -16.485 -3.077 3.727 1.00 0.00 C ATOM 1595 C SER A 104 -15.022 -3.150 4.132 1.00 0.00 C ATOM 1596 O SER A 104 -14.331 -2.133 4.176 1.00 0.00 O ATOM 1597 CB SER A 104 -16.639 -2.403 2.361 1.00 0.00 C ATOM 1598 OG SER A 104 -17.938 -2.608 1.839 1.00 0.00 O ATOM 0 H SER A 104 -16.675 -1.579 5.167 1.00 0.00 H new ATOM 0 HA SER A 104 -16.895 -4.083 3.637 1.00 0.00 H new ATOM 0 HB2 SER A 104 -16.445 -1.334 2.455 1.00 0.00 H new ATOM 0 HB3 SER A 104 -15.898 -2.802 1.669 1.00 0.00 H new ATOM 0 HG SER A 104 -18.338 -1.744 1.609 1.00 0.00 H new ATOM 1604 N ARG A 105 -14.552 -4.353 4.428 1.00 0.00 N ATOM 1605 CA ARG A 105 -13.178 -4.558 4.865 1.00 0.00 C ATOM 1606 C ARG A 105 -12.283 -4.994 3.716 1.00 0.00 C ATOM 1607 O ARG A 105 -12.627 -5.895 2.951 1.00 0.00 O ATOM 1608 CB ARG A 105 -13.138 -5.603 5.982 1.00 0.00 C ATOM 1609 CG ARG A 105 -14.042 -5.265 7.157 1.00 0.00 C ATOM 1610 CD ARG A 105 -13.967 -6.324 8.245 1.00 0.00 C ATOM 1611 NE ARG A 105 -14.476 -7.615 7.791 1.00 0.00 N ATOM 1612 CZ ARG A 105 -14.764 -8.624 8.609 1.00 0.00 C ATOM 1613 NH1 ARG A 105 -14.597 -8.489 9.919 1.00 0.00 N ATOM 1614 NH2 ARG A 105 -15.223 -9.767 8.119 1.00 0.00 N ATOM 0 H ARG A 105 -15.106 -5.208 4.373 1.00 0.00 H new ATOM 0 HA ARG A 105 -12.801 -3.606 5.239 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -13.430 -6.571 5.575 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -12.113 -5.704 6.339 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -13.756 -4.298 7.570 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -15.071 -5.172 6.810 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -12.933 -6.437 8.570 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -14.539 -5.994 9.112 1.00 0.00 H new ATOM 0 HE ARG A 105 -14.619 -7.751 6.790 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -14.247 -7.610 10.301 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -14.819 -9.264 10.544 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -15.356 -9.874 7.113 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -15.443 -10.539 8.748 1.00 0.00 H new ATOM 1628 N CYS A 106 -11.127 -4.351 3.612 1.00 0.00 N ATOM 1629 CA CYS A 106 -10.173 -4.663 2.563 1.00 0.00 C ATOM 1630 C CYS A 106 -9.294 -5.820 3.002 1.00 0.00 C ATOM 1631 O CYS A 106 -8.515 -5.700 3.947 1.00 0.00 O ATOM 1632 CB CYS A 106 -9.319 -3.438 2.232 1.00 0.00 C ATOM 1633 SG CYS A 106 -9.757 -2.637 0.657 1.00 0.00 S ATOM 0 H CYS A 106 -10.829 -3.608 4.245 1.00 0.00 H new ATOM 0 HA CYS A 106 -10.717 -4.950 1.663 1.00 0.00 H new ATOM 0 HB2 CYS A 106 -9.417 -2.711 3.038 1.00 0.00 H new ATOM 0 HB3 CYS A 106 -8.271 -3.736 2.198 1.00 0.00 H new ATOM 1638 N GLU A 107 -9.424 -6.943 2.312 1.00 0.00 N ATOM 1639 CA GLU A 107 -8.676 -8.134 2.655 1.00 0.00 C ATOM 1640 C GLU A 107 -7.802 -8.571 1.489 1.00 0.00 C ATOM 1641 O GLU A 107 -7.916 -8.042 0.387 1.00 0.00 O ATOM 1642 CB GLU A 107 -9.649 -9.242 3.057 1.00 0.00 C ATOM 1643 CG GLU A 107 -8.978 -10.459 3.674 1.00 0.00 C ATOM 1644 CD GLU A 107 -9.971 -11.532 4.077 1.00 0.00 C ATOM 1645 OE1 GLU A 107 -10.692 -11.329 5.075 1.00 0.00 O ATOM 1646 OE2 GLU A 107 -10.025 -12.576 3.392 1.00 0.00 O ATOM 0 H GLU A 107 -10.044 -7.050 1.509 1.00 0.00 H new ATOM 0 HA GLU A 107 -8.018 -7.919 3.497 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -10.370 -8.838 3.767 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -10.210 -9.556 2.177 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -8.267 -10.877 2.962 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -8.408 -10.150 4.550 1.00 0.00 H new ATOM 1653 N VAL A 108 -6.946 -9.549 1.734 1.00 0.00 N ATOM 1654 CA VAL A 108 -6.052 -10.022 0.692 1.00 0.00 C ATOM 1655 C VAL A 108 -5.838 -11.532 0.721 1.00 0.00 C ATOM 1656 O VAL A 108 -5.612 -12.138 1.768 1.00 0.00 O ATOM 1657 CB VAL A 108 -4.693 -9.290 0.755 1.00 0.00 C ATOM 1658 CG1 VAL A 108 -3.600 -10.092 0.066 1.00 0.00 C ATOM 1659 CG2 VAL A 108 -4.812 -7.912 0.128 1.00 0.00 C ATOM 0 H VAL A 108 -6.852 -10.025 2.631 1.00 0.00 H new ATOM 0 HA VAL A 108 -6.544 -9.791 -0.253 1.00 0.00 H new ATOM 0 HB VAL A 108 -4.416 -9.182 1.804 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -2.657 -9.549 0.128 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -3.495 -11.060 0.556 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -3.864 -10.242 -0.981 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -3.848 -7.405 0.178 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -5.116 -8.011 -0.914 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -5.557 -7.329 0.669 1.00 0.00 H new ATOM 1669 N GLN A 109 -5.918 -12.111 -0.469 1.00 0.00 N ATOM 1670 CA GLN A 109 -5.727 -13.545 -0.642 1.00 0.00 C ATOM 1671 C GLN A 109 -4.995 -13.825 -1.942 1.00 0.00 C ATOM 1672 O GLN A 109 -5.046 -14.930 -2.482 1.00 0.00 O ATOM 1673 CB GLN A 109 -7.079 -14.263 -0.619 1.00 0.00 C ATOM 1674 CG GLN A 109 -8.090 -13.685 -1.596 1.00 0.00 C ATOM 1675 CD GLN A 109 -9.474 -14.286 -1.436 1.00 0.00 C ATOM 1676 OE1 GLN A 109 -9.784 -15.322 -2.023 1.00 0.00 O ATOM 1677 NE2 GLN A 109 -10.321 -13.628 -0.647 1.00 0.00 N ATOM 0 H GLN A 109 -6.115 -11.607 -1.333 1.00 0.00 H new ATOM 0 HA GLN A 109 -5.121 -13.922 0.182 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -6.925 -15.317 -0.849 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -7.491 -14.213 0.389 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -8.149 -12.606 -1.454 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -7.741 -13.854 -2.615 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -10.022 -12.772 -0.179 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -11.269 -13.980 -0.510 1.00 0.00 H new ATOM 1686 N ASP A 110 -4.295 -12.805 -2.413 1.00 0.00 N ATOM 1687 CA ASP A 110 -3.529 -12.877 -3.648 1.00 0.00 C ATOM 1688 C ASP A 110 -2.554 -11.707 -3.724 1.00 0.00 C ATOM 1689 O ASP A 110 -2.364 -10.985 -2.746 1.00 0.00 O ATOM 1690 CB ASP A 110 -4.458 -12.852 -4.868 1.00 0.00 C ATOM 1691 CG ASP A 110 -5.213 -14.152 -5.061 1.00 0.00 C ATOM 1692 OD1 ASP A 110 -4.602 -15.126 -5.549 1.00 0.00 O ATOM 1693 OD2 ASP A 110 -6.414 -14.196 -4.723 1.00 0.00 O ATOM 0 H ASP A 110 -4.242 -11.899 -1.947 1.00 0.00 H new ATOM 0 HA ASP A 110 -2.974 -13.815 -3.652 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -5.172 -12.036 -4.758 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -3.870 -12.643 -5.762 1.00 0.00 H new ATOM 1698 N ARG A 111 -1.940 -11.526 -4.885 1.00 0.00 N ATOM 1699 CA ARG A 111 -0.998 -10.437 -5.083 1.00 0.00 C ATOM 1700 C ARG A 111 -1.701 -9.213 -5.655 1.00 0.00 C ATOM 1701 O ARG A 111 -1.056 -8.286 -6.146 1.00 0.00 O ATOM 1702 CB ARG A 111 0.144 -10.876 -6.003 1.00 0.00 C ATOM 1703 CG ARG A 111 -0.307 -11.728 -7.178 1.00 0.00 C ATOM 1704 CD ARG A 111 -1.030 -10.905 -8.231 1.00 0.00 C ATOM 1705 NE ARG A 111 -1.555 -11.738 -9.310 1.00 0.00 N ATOM 1706 CZ ARG A 111 -2.121 -11.253 -10.411 1.00 0.00 C ATOM 1707 NH1 ARG A 111 -2.229 -9.942 -10.585 1.00 0.00 N ATOM 1708 NH2 ARG A 111 -2.578 -12.079 -11.342 1.00 0.00 N ATOM 0 H ARG A 111 -2.078 -12.120 -5.703 1.00 0.00 H new ATOM 0 HA ARG A 111 -0.578 -10.169 -4.113 1.00 0.00 H new ATOM 0 HB2 ARG A 111 0.653 -9.990 -6.383 1.00 0.00 H new ATOM 0 HB3 ARG A 111 0.874 -11.437 -5.419 1.00 0.00 H new ATOM 0 HG2 ARG A 111 0.559 -12.213 -7.628 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -0.966 -12.520 -6.821 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -1.849 -10.358 -7.764 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -0.346 -10.164 -8.645 1.00 0.00 H new ATOM 0 HE ARG A 111 -1.483 -12.751 -9.213 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -1.877 -9.302 -9.873 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -2.664 -9.574 -11.431 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -2.496 -13.088 -11.214 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -3.012 -11.706 -12.186 1.00 0.00 H new ATOM 1722 N GLY A 112 -3.028 -9.215 -5.582 1.00 0.00 N ATOM 1723 CA GLY A 112 -3.798 -8.101 -6.098 1.00 0.00 C ATOM 1724 C GLY A 112 -5.006 -7.778 -5.247 1.00 0.00 C ATOM 1725 O GLY A 112 -5.924 -7.093 -5.698 1.00 0.00 O ATOM 0 H GLY A 112 -3.583 -9.968 -5.175 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -3.158 -7.221 -6.161 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -4.125 -8.330 -7.112 1.00 0.00 H new ATOM 1729 N VAL A 113 -5.005 -8.275 -4.013 1.00 0.00 N ATOM 1730 CA VAL A 113 -6.103 -8.026 -3.083 1.00 0.00 C ATOM 1731 C VAL A 113 -7.403 -8.658 -3.561 1.00 0.00 C ATOM 1732 O VAL A 113 -7.651 -8.789 -4.759 1.00 0.00 O ATOM 1733 CB VAL A 113 -6.321 -6.523 -2.869 1.00 0.00 C ATOM 1734 CG1 VAL A 113 -7.177 -6.270 -1.645 1.00 0.00 C ATOM 1735 CG2 VAL A 113 -4.983 -5.814 -2.748 1.00 0.00 C ATOM 0 H VAL A 113 -4.255 -8.853 -3.633 1.00 0.00 H new ATOM 0 HA VAL A 113 -5.818 -8.486 -2.137 1.00 0.00 H new ATOM 0 HB VAL A 113 -6.850 -6.123 -3.734 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -7.317 -5.197 -1.515 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -8.147 -6.750 -1.774 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -6.683 -6.681 -0.764 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -5.149 -4.747 -2.596 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -4.432 -6.220 -1.900 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -4.407 -5.965 -3.661 1.00 0.00 H new ATOM 1745 N GLY A 114 -8.225 -9.050 -2.597 1.00 0.00 N ATOM 1746 CA GLY A 114 -9.473 -9.692 -2.959 1.00 0.00 C ATOM 1747 C GLY A 114 -10.688 -9.200 -2.198 1.00 0.00 C ATOM 1748 O GLY A 114 -11.119 -9.868 -1.258 1.00 0.00 O ATOM 0 H GLY A 114 -8.058 -8.939 -1.597 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -9.645 -9.543 -4.025 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -9.372 -10.765 -2.799 1.00 0.00 H new ATOM 1752 N TRP A 115 -11.238 -8.042 -2.568 1.00 0.00 N ATOM 1753 CA TRP A 115 -12.423 -7.466 -1.921 1.00 0.00 C ATOM 1754 C TRP A 115 -13.320 -8.524 -1.290 1.00 0.00 C ATOM 1755 O TRP A 115 -13.614 -9.553 -1.900 1.00 0.00 O ATOM 1756 CB TRP A 115 -13.244 -6.659 -2.932 1.00 0.00 C ATOM 1757 CG TRP A 115 -13.221 -5.172 -2.710 1.00 0.00 C ATOM 1758 CD1 TRP A 115 -13.172 -4.210 -3.677 1.00 0.00 C ATOM 1759 CD2 TRP A 115 -13.255 -4.474 -1.454 1.00 0.00 C ATOM 1760 NE1 TRP A 115 -13.174 -2.961 -3.104 1.00 0.00 N ATOM 1761 CE2 TRP A 115 -13.222 -3.095 -1.744 1.00 0.00 C ATOM 1762 CE3 TRP A 115 -13.309 -4.874 -0.114 1.00 0.00 C ATOM 1763 CZ2 TRP A 115 -13.242 -2.121 -0.750 1.00 0.00 C ATOM 1764 CZ3 TRP A 115 -13.327 -3.902 0.871 1.00 0.00 C ATOM 1765 CH2 TRP A 115 -13.295 -2.541 0.548 1.00 0.00 C ATOM 0 H TRP A 115 -10.872 -7.472 -3.331 1.00 0.00 H new ATOM 0 HA TRP A 115 -12.056 -6.817 -1.126 1.00 0.00 H new ATOM 0 HB2 TRP A 115 -12.871 -6.870 -3.934 1.00 0.00 H new ATOM 0 HB3 TRP A 115 -14.278 -7.003 -2.898 1.00 0.00 H new ATOM 0 HD1 TRP A 115 -13.137 -4.403 -4.739 1.00 0.00 H new ATOM 0 HE1 TRP A 115 -13.144 -2.077 -3.611 1.00 0.00 H new ATOM 0 HE3 TRP A 115 -13.336 -5.922 0.147 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 -13.216 -1.070 -0.997 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 -13.366 -4.200 1.908 1.00 0.00 H new ATOM 0 HH2 TRP A 115 -13.313 -1.808 1.341 1.00 0.00 H new ATOM 1776 N SER A 116 -13.758 -8.255 -0.064 1.00 0.00 N ATOM 1777 CA SER A 116 -14.633 -9.168 0.654 1.00 0.00 C ATOM 1778 C SER A 116 -16.084 -8.964 0.220 1.00 0.00 C ATOM 1779 O SER A 116 -16.875 -9.908 0.192 1.00 0.00 O ATOM 1780 CB SER A 116 -14.505 -8.951 2.164 1.00 0.00 C ATOM 1781 OG SER A 116 -15.347 -9.837 2.881 1.00 0.00 O ATOM 0 H SER A 116 -13.519 -7.408 0.452 1.00 0.00 H new ATOM 0 HA SER A 116 -14.334 -10.189 0.418 1.00 0.00 H new ATOM 0 HB2 SER A 116 -13.470 -9.102 2.469 1.00 0.00 H new ATOM 0 HB3 SER A 116 -14.763 -7.921 2.409 1.00 0.00 H new ATOM 0 HG SER A 116 -15.245 -9.679 3.843 1.00 0.00 H new ATOM 1787 N HIS A 117 -16.421 -7.717 -0.121 1.00 0.00 N ATOM 1788 CA HIS A 117 -17.773 -7.369 -0.559 1.00 0.00 C ATOM 1789 C HIS A 117 -17.840 -5.902 -0.990 1.00 0.00 C ATOM 1790 O HIS A 117 -17.330 -5.023 -0.293 1.00 0.00 O ATOM 1791 CB HIS A 117 -18.780 -7.628 0.564 1.00 0.00 C ATOM 1792 CG HIS A 117 -20.203 -7.671 0.099 1.00 0.00 C ATOM 1793 ND1 HIS A 117 -20.880 -8.849 -0.139 1.00 0.00 N ATOM 1794 CD2 HIS A 117 -21.079 -6.675 -0.170 1.00 0.00 C ATOM 1795 CE1 HIS A 117 -22.110 -8.574 -0.535 1.00 0.00 C ATOM 1796 NE2 HIS A 117 -22.256 -7.263 -0.561 1.00 0.00 N ATOM 0 H HIS A 117 -15.772 -6.930 -0.102 1.00 0.00 H new ATOM 0 HA HIS A 117 -18.026 -7.996 -1.414 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -18.536 -8.574 1.047 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -18.677 -6.849 1.319 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -20.888 -5.615 -0.092 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -22.867 -9.299 -0.794 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -23.106 -6.767 -0.828 1.00 0.00 H new ATOM 1805 N PRO A 118 -18.471 -5.616 -2.146 1.00 0.00 N ATOM 1806 CA PRO A 118 -18.605 -4.267 -2.674 1.00 0.00 C ATOM 1807 C PRO A 118 -19.933 -3.614 -2.297 1.00 0.00 C ATOM 1808 O PRO A 118 -20.496 -3.893 -1.238 1.00 0.00 O ATOM 1809 CB PRO A 118 -18.529 -4.500 -4.185 1.00 0.00 C ATOM 1810 CG PRO A 118 -18.923 -5.936 -4.406 1.00 0.00 C ATOM 1811 CD PRO A 118 -19.101 -6.577 -3.049 1.00 0.00 C ATOM 0 HA PRO A 118 -17.848 -3.589 -2.281 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -19.199 -3.825 -4.718 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -17.523 -4.310 -4.559 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -19.847 -5.995 -4.981 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -18.157 -6.459 -4.979 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -20.154 -6.727 -2.808 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -18.620 -7.554 -2.998 1.00 0.00 H new ATOM 1819 N LEU A 119 -20.416 -2.733 -3.173 1.00 0.00 N ATOM 1820 CA LEU A 119 -21.668 -2.021 -2.962 1.00 0.00 C ATOM 1821 C LEU A 119 -22.754 -2.919 -2.371 1.00 0.00 C ATOM 1822 O LEU A 119 -22.879 -4.088 -2.738 1.00 0.00 O ATOM 1823 CB LEU A 119 -22.162 -1.434 -4.285 1.00 0.00 C ATOM 1824 CG LEU A 119 -21.089 -0.828 -5.194 1.00 0.00 C ATOM 1825 CD1 LEU A 119 -20.069 -0.046 -4.380 1.00 0.00 C ATOM 1826 CD2 LEU A 119 -20.413 -1.904 -6.029 1.00 0.00 C ATOM 0 H LEU A 119 -19.948 -2.496 -4.047 1.00 0.00 H new ATOM 0 HA LEU A 119 -21.468 -1.224 -2.245 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -22.677 -2.219 -4.838 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -22.900 -0.663 -4.064 1.00 0.00 H new ATOM 0 HG LEU A 119 -21.577 -0.133 -5.877 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -19.317 0.375 -5.047 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -20.571 0.760 -3.845 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -19.587 -0.712 -3.664 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -19.655 -1.448 -6.666 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -19.942 -2.634 -5.370 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -21.157 -2.403 -6.650 1.00 0.00 H new ATOM 1838 N PRO A 120 -23.555 -2.368 -1.441 1.00 0.00 N ATOM 1839 CA PRO A 120 -24.648 -3.086 -0.785 1.00 0.00 C ATOM 1840 C PRO A 120 -25.923 -3.094 -1.630 1.00 0.00 C ATOM 1841 O PRO A 120 -25.871 -3.308 -2.841 1.00 0.00 O ATOM 1842 CB PRO A 120 -24.867 -2.291 0.517 1.00 0.00 C ATOM 1843 CG PRO A 120 -23.864 -1.176 0.501 1.00 0.00 C ATOM 1844 CD PRO A 120 -23.451 -1.001 -0.929 1.00 0.00 C ATOM 0 HA PRO A 120 -24.408 -4.137 -0.621 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -25.883 -1.900 0.568 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -24.727 -2.928 1.390 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -24.298 -0.257 0.895 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -23.005 -1.417 1.127 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -24.107 -0.314 -1.463 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -22.438 -0.608 -1.017 1.00 0.00 H new ATOM 1852 N GLN A 121 -27.067 -2.859 -0.985 1.00 0.00 N ATOM 1853 CA GLN A 121 -28.351 -2.847 -1.682 1.00 0.00 C ATOM 1854 C GLN A 121 -29.202 -1.659 -1.241 1.00 0.00 C ATOM 1855 O GLN A 121 -29.601 -1.574 -0.080 1.00 0.00 O ATOM 1856 CB GLN A 121 -29.113 -4.143 -1.405 1.00 0.00 C ATOM 1857 CG GLN A 121 -30.204 -4.441 -2.420 1.00 0.00 C ATOM 1858 CD GLN A 121 -31.009 -5.677 -2.069 1.00 0.00 C ATOM 1859 OE1 GLN A 121 -32.196 -5.767 -2.384 1.00 0.00 O ATOM 1860 NE2 GLN A 121 -30.367 -6.639 -1.416 1.00 0.00 N ATOM 0 H GLN A 121 -27.129 -2.675 0.016 1.00 0.00 H new ATOM 0 HA GLN A 121 -28.151 -2.759 -2.750 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -28.407 -4.973 -1.390 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -29.559 -4.086 -0.412 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -30.874 -3.584 -2.489 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -29.753 -4.573 -3.403 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -29.383 -6.523 -1.175 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -30.858 -7.494 -1.156 1.00 0.00 H new ATOM 1869 N CYS A 122 -29.479 -0.744 -2.166 1.00 0.00 N ATOM 1870 CA CYS A 122 -30.291 0.420 -1.851 1.00 0.00 C ATOM 1871 C CYS A 122 -31.722 0.255 -2.357 1.00 0.00 C ATOM 1872 O CYS A 122 -31.966 0.218 -3.563 1.00 0.00 O ATOM 1873 CB CYS A 122 -29.664 1.669 -2.456 1.00 0.00 C ATOM 1874 SG CYS A 122 -28.686 2.624 -1.266 1.00 0.00 S ATOM 0 H CYS A 122 -29.154 -0.788 -3.132 1.00 0.00 H new ATOM 0 HA CYS A 122 -30.329 0.522 -0.766 1.00 0.00 H new ATOM 0 HB2 CYS A 122 -29.026 1.380 -3.291 1.00 0.00 H new ATOM 0 HB3 CYS A 122 -30.452 2.304 -2.861 1.00 0.00 H new ATOM 1879 N GLU A 123 -32.664 0.155 -1.421 1.00 0.00 N ATOM 1880 CA GLU A 123 -34.075 0.004 -1.758 1.00 0.00 C ATOM 1881 C GLU A 123 -34.915 1.013 -0.986 1.00 0.00 C ATOM 1882 O GLU A 123 -34.656 1.311 0.180 1.00 0.00 O ATOM 1883 CB GLU A 123 -34.550 -1.418 -1.452 1.00 0.00 C ATOM 1884 CG GLU A 123 -36.029 -1.638 -1.730 1.00 0.00 C ATOM 1885 CD GLU A 123 -36.455 -3.078 -1.527 1.00 0.00 C ATOM 1886 OE1 GLU A 123 -36.350 -3.870 -2.487 1.00 0.00 O ATOM 1887 OE2 GLU A 123 -36.894 -3.416 -0.407 1.00 0.00 O ATOM 0 H GLU A 123 -32.473 0.176 -0.419 1.00 0.00 H new ATOM 0 HA GLU A 123 -34.195 0.190 -2.825 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -33.968 -2.122 -2.047 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -34.348 -1.642 -0.405 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -36.617 -0.994 -1.076 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -36.250 -1.339 -2.755 1.00 0.00 H new ATOM 1894 N ILE A 124 -35.928 1.529 -1.676 1.00 0.00 N ATOM 1895 CA ILE A 124 -36.822 2.534 -1.117 1.00 0.00 C ATOM 1896 C ILE A 124 -37.516 2.034 0.148 1.00 0.00 C ATOM 1897 O ILE A 124 -37.776 0.839 0.298 1.00 0.00 O ATOM 1898 CB ILE A 124 -37.882 2.955 -2.157 1.00 0.00 C ATOM 1899 CG1 ILE A 124 -38.639 4.196 -1.683 1.00 0.00 C ATOM 1900 CG2 ILE A 124 -38.845 1.808 -2.429 1.00 0.00 C ATOM 1901 CD1 ILE A 124 -39.586 4.764 -2.717 1.00 0.00 C ATOM 0 H ILE A 124 -36.151 1.262 -2.635 1.00 0.00 H new ATOM 0 HA ILE A 124 -36.211 3.397 -0.852 1.00 0.00 H new ATOM 0 HB ILE A 124 -37.372 3.203 -3.088 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -39.204 3.945 -0.785 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -37.919 4.964 -1.402 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -39.586 2.122 -3.164 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -38.291 0.952 -2.814 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -39.348 1.528 -1.504 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -40.087 5.642 -2.309 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -39.025 5.048 -3.607 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -40.330 4.012 -2.981 1.00 0.00 H new ATOM 1913 N LEU A 125 -37.812 2.962 1.055 1.00 0.00 N ATOM 1914 CA LEU A 125 -38.475 2.627 2.312 1.00 0.00 C ATOM 1915 C LEU A 125 -39.934 2.252 2.073 1.00 0.00 C ATOM 1916 O LEU A 125 -40.337 1.110 2.298 1.00 0.00 O ATOM 1917 CB LEU A 125 -38.396 3.808 3.285 1.00 0.00 C ATOM 1918 CG LEU A 125 -36.989 4.363 3.526 1.00 0.00 C ATOM 1919 CD1 LEU A 125 -37.048 5.584 4.432 1.00 0.00 C ATOM 1920 CD2 LEU A 125 -36.086 3.296 4.130 1.00 0.00 C ATOM 0 H LEU A 125 -37.602 3.954 0.942 1.00 0.00 H new ATOM 0 HA LEU A 125 -37.962 1.769 2.747 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -39.026 4.613 2.906 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -38.816 3.498 4.242 1.00 0.00 H new ATOM 0 HG LEU A 125 -36.570 4.663 2.566 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -36.040 5.966 4.593 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -37.658 6.356 3.963 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -37.488 5.306 5.390 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -35.091 3.711 4.293 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -36.501 2.964 5.082 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -36.018 2.448 3.448 1.00 0.00 H new ATOM 1932 N GLU A 126 -40.723 3.221 1.616 1.00 0.00 N ATOM 1933 CA GLU A 126 -42.138 2.994 1.346 1.00 0.00 C ATOM 1934 C GLU A 126 -42.324 2.227 0.040 1.00 0.00 C ATOM 1935 O GLU A 126 -41.456 2.248 -0.831 1.00 0.00 O ATOM 1936 CB GLU A 126 -42.889 4.328 1.288 1.00 0.00 C ATOM 1937 CG GLU A 126 -44.394 4.176 1.145 1.00 0.00 C ATOM 1938 CD GLU A 126 -45.131 5.493 1.287 1.00 0.00 C ATOM 1939 OE1 GLU A 126 -45.368 5.919 2.437 1.00 0.00 O ATOM 1940 OE2 GLU A 126 -45.471 6.099 0.250 1.00 0.00 O ATOM 0 H GLU A 126 -40.405 4.171 1.425 1.00 0.00 H new ATOM 0 HA GLU A 126 -42.548 2.394 2.158 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -42.674 4.895 2.194 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -42.510 4.912 0.449 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -44.620 3.741 0.172 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -44.758 3.478 1.899 1.00 0.00 H new ATOM 1947 N HIS A 127 -43.462 1.551 -0.087 1.00 0.00 N ATOM 1948 CA HIS A 127 -43.760 0.772 -1.285 1.00 0.00 C ATOM 1949 C HIS A 127 -44.213 1.675 -2.429 1.00 0.00 C ATOM 1950 O HIS A 127 -44.560 1.195 -3.508 1.00 0.00 O ATOM 1951 CB HIS A 127 -44.841 -0.267 -0.983 1.00 0.00 C ATOM 1952 CG HIS A 127 -44.519 -1.143 0.188 1.00 0.00 C ATOM 1953 ND1 HIS A 127 -44.844 -0.812 1.487 1.00 0.00 N ATOM 1954 CD2 HIS A 127 -43.901 -2.347 0.253 1.00 0.00 C ATOM 1955 CE1 HIS A 127 -44.440 -1.772 2.299 1.00 0.00 C ATOM 1956 NE2 HIS A 127 -43.865 -2.715 1.575 1.00 0.00 N ATOM 0 H HIS A 127 -44.193 1.527 0.624 1.00 0.00 H new ATOM 0 HA HIS A 127 -42.847 0.262 -1.592 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -45.784 0.246 -0.794 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -44.989 -0.892 -1.864 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -43.510 -2.912 -0.580 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -44.559 -1.784 3.372 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -43.460 -3.577 1.939 1.00 0.00 H new ATOM 1965 N HIS A 128 -44.207 2.982 -2.186 1.00 0.00 N ATOM 1966 CA HIS A 128 -44.616 3.950 -3.199 1.00 0.00 C ATOM 1967 C HIS A 128 -43.659 3.931 -4.385 1.00 0.00 C ATOM 1968 O HIS A 128 -42.534 4.422 -4.294 1.00 0.00 O ATOM 1969 CB HIS A 128 -44.677 5.356 -2.597 1.00 0.00 C ATOM 1970 CG HIS A 128 -45.107 6.411 -3.569 1.00 0.00 C ATOM 1971 ND1 HIS A 128 -46.419 6.813 -3.714 1.00 0.00 N ATOM 1972 CD2 HIS A 128 -44.389 7.153 -4.447 1.00 0.00 C ATOM 1973 CE1 HIS A 128 -46.489 7.756 -4.638 1.00 0.00 C ATOM 1974 NE2 HIS A 128 -45.272 7.980 -5.096 1.00 0.00 N ATOM 0 H HIS A 128 -43.924 3.395 -1.298 1.00 0.00 H new ATOM 0 HA HIS A 128 -45.609 3.672 -3.553 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -45.366 5.350 -1.753 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -43.694 5.616 -2.204 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -43.322 7.103 -4.606 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -47.389 8.257 -4.963 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -45.027 8.659 -5.817 1.00 0.00 H new ATOM 1983 N HIS A 129 -44.112 3.357 -5.495 1.00 0.00 N ATOM 1984 CA HIS A 129 -43.294 3.274 -6.700 1.00 0.00 C ATOM 1985 C HIS A 129 -44.125 3.577 -7.943 1.00 0.00 C ATOM 1986 O HIS A 129 -43.674 4.281 -8.847 1.00 0.00 O ATOM 1987 CB HIS A 129 -42.663 1.885 -6.816 1.00 0.00 C ATOM 1988 CG HIS A 129 -41.735 1.744 -7.982 1.00 0.00 C ATOM 1989 ND1 HIS A 129 -42.163 1.399 -9.247 1.00 0.00 N ATOM 1990 CD2 HIS A 129 -40.394 1.905 -8.071 1.00 0.00 C ATOM 1991 CE1 HIS A 129 -41.124 1.352 -10.062 1.00 0.00 C ATOM 1992 NE2 HIS A 129 -40.040 1.656 -9.374 1.00 0.00 N ATOM 0 H HIS A 129 -45.040 2.943 -5.585 1.00 0.00 H new ATOM 0 HA HIS A 129 -42.502 4.019 -6.626 1.00 0.00 H new ATOM 0 HB2 HIS A 129 -42.117 1.666 -5.899 1.00 0.00 H new ATOM 0 HB3 HIS A 129 -43.455 1.141 -6.901 1.00 0.00 H new ATOM 0 HD2 HIS A 129 -39.727 2.178 -7.267 1.00 0.00 H new ATOM 0 HE1 HIS A 129 -41.157 1.106 -11.113 1.00 0.00 H new ATOM 0 HE2 HIS A 129 -39.093 1.699 -9.749 1.00 0.00 H new ATOM 2001 N HIS A 130 -45.342 3.043 -7.981 1.00 0.00 N ATOM 2002 CA HIS A 130 -46.237 3.255 -9.115 1.00 0.00 C ATOM 2003 C HIS A 130 -47.235 4.371 -8.823 1.00 0.00 C ATOM 2004 O HIS A 130 -47.111 5.086 -7.828 1.00 0.00 O ATOM 2005 CB HIS A 130 -46.983 1.964 -9.452 1.00 0.00 C ATOM 2006 CG HIS A 130 -46.093 0.870 -9.957 1.00 0.00 C ATOM 2007 ND1 HIS A 130 -45.624 -0.150 -9.155 1.00 0.00 N ATOM 2008 CD2 HIS A 130 -45.589 0.639 -11.192 1.00 0.00 C ATOM 2009 CE1 HIS A 130 -44.869 -0.961 -9.876 1.00 0.00 C ATOM 2010 NE2 HIS A 130 -44.833 -0.506 -11.114 1.00 0.00 N ATOM 0 H HIS A 130 -45.732 2.460 -7.240 1.00 0.00 H new ATOM 0 HA HIS A 130 -45.631 3.551 -9.971 1.00 0.00 H new ATOM 0 HB2 HIS A 130 -47.506 1.614 -8.562 1.00 0.00 H new ATOM 0 HB3 HIS A 130 -47.742 2.179 -10.204 1.00 0.00 H new ATOM 0 HD2 HIS A 130 -45.751 1.242 -12.073 1.00 0.00 H new ATOM 0 HE1 HIS A 130 -44.367 -1.846 -9.513 1.00 0.00 H new ATOM 0 HE2 HIS A 130 -44.326 -0.935 -11.888 1.00 0.00 H new ATOM 2019 N HIS A 131 -48.226 4.512 -9.700 1.00 0.00 N ATOM 2020 CA HIS A 131 -49.249 5.539 -9.545 1.00 0.00 C ATOM 2021 C HIS A 131 -50.519 4.960 -8.930 1.00 0.00 C ATOM 2022 O HIS A 131 -50.608 3.756 -8.686 1.00 0.00 O ATOM 2023 CB HIS A 131 -49.569 6.171 -10.901 1.00 0.00 C ATOM 2024 CG HIS A 131 -49.989 5.177 -11.937 1.00 0.00 C ATOM 2025 ND1 HIS A 131 -51.309 4.879 -12.203 1.00 0.00 N ATOM 2026 CD2 HIS A 131 -49.256 4.406 -12.774 1.00 0.00 C ATOM 2027 CE1 HIS A 131 -51.368 3.967 -13.158 1.00 0.00 C ATOM 2028 NE2 HIS A 131 -50.137 3.664 -13.523 1.00 0.00 N ATOM 0 H HIS A 131 -48.341 3.926 -10.527 1.00 0.00 H new ATOM 0 HA HIS A 131 -48.861 6.304 -8.873 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -50.363 6.907 -10.772 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -48.691 6.708 -11.259 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -48.178 4.379 -12.841 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -52.271 3.542 -13.570 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -49.881 2.989 -14.244 1.00 0.00 H new ATOM 2037 N HIS A 132 -51.498 5.824 -8.683 1.00 0.00 N ATOM 2038 CA HIS A 132 -52.765 5.400 -8.097 1.00 0.00 C ATOM 2039 C HIS A 132 -53.902 5.540 -9.105 1.00 0.00 C ATOM 2040 O HIS A 132 -54.489 6.640 -9.188 1.00 0.00 O ATOM 2041 CB HIS A 132 -53.070 6.225 -6.844 1.00 0.00 C ATOM 2042 CG HIS A 132 -54.312 5.791 -6.125 1.00 0.00 C ATOM 2043 ND1 HIS A 132 -54.308 4.855 -5.114 1.00 0.00 N ATOM 2044 CD2 HIS A 132 -55.603 6.175 -6.276 1.00 0.00 C ATOM 2045 CE1 HIS A 132 -55.542 4.681 -4.673 1.00 0.00 C ATOM 2046 NE2 HIS A 132 -56.345 5.469 -5.361 1.00 0.00 N ATOM 2047 OXT HIS A 132 -54.198 4.548 -9.804 1.00 0.00 O ATOM 0 H HIS A 132 -51.438 6.823 -8.880 1.00 0.00 H new ATOM 0 HA HIS A 132 -52.678 4.350 -7.819 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -52.223 6.159 -6.161 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -53.171 7.273 -7.125 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -55.978 6.900 -6.983 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -55.842 4.008 -3.883 1.00 0.00 H new ATOM 0 HE2 HIS A 132 -57.354 5.542 -5.234 1.00 0.00 H new TER 2056 HIS A 132