USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1287 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 170 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 1.2: A 171 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 2.1: A 127 SER OG : rot -159:sc= 0.00379 USER MOD Set 2.2: A 147 MET CE :methyl -177:sc= -0.218 (180deg=-0.236) USER MOD Set 3.1: A 80 THR OG1 : rot 150:sc= -0.329 USER MOD Set 3.2: A 81 THR OG1 : rot 150:sc= 0.0192 USER MOD Set 3.3: A 109 HIS : no HE2:sc= -2.51 K(o=-2.8,f=-4.1!) USER MOD Set 4.1: A 66 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 72 LYS NZ :NH3+ 166:sc= -1.71! (180deg=-2.22!) USER MOD Single : A 1 THR N :NH3+ 177:sc= 0.427 (180deg=0.417) USER MOD Single : A 1 THR OG1 : rot 171:sc= 0.415 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 154:sc= 1.02 (180deg=0.581) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 176:sc= -0.566 USER MOD Single : A 25 LYS NZ :NH3+ -137:sc= 0 (180deg=-1.5!) USER MOD Single : A 36 GLN : amide:sc= -1.88! C(o=-1.9!,f=-3.3!) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.432 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 HIS : no HD1:sc= -0.137 K(o=-0.14,f=-0.98) USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.0408 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot -34:sc= 0.597 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 MET CE :methyl 161:sc= -0.0639 (180deg=-0.863) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 87 HIS : +bothHN:sc= 0.296 K(o=0.3,f=-2) USER MOD Single : A 98 HIS : no HD1:sc= -0.309 X(o=-0.31,f=-0.21) USER MOD Single : A 108 THR OG1 : rot 38:sc= -0.646 USER MOD Single : A 111 THR OG1 : rot 180:sc= -0.0123 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 121 THR OG1 : rot 80:sc= 0.299 USER MOD Single : A 123 MET CE :methyl -105:sc= -0.937 (180deg=-3.94!) USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot -119:sc= -1.2 USER MOD Single : A 131 SER OG : rot 180:sc= 0.011 USER MOD Single : A 134 GLN : amide:sc= 0.0895 K(o=0.089,f=-5.9!) USER MOD Single : A 135 MET CE :methyl 170:sc= 0 (180deg=-0.095) USER MOD Single : A 136 GLN : amide:sc= -0.149 X(o=-0.15,f=-0.13) USER MOD Single : A 137 LYS NZ :NH3+ -157:sc= -0.0729 (180deg=-0.134) USER MOD Single : A 138 MET CE :methyl 171:sc= -1.42 (180deg=-1.74) USER MOD Single : A 141 MET CE :methyl -171:sc= -0.463 (180deg=-0.744) USER MOD Single : A 143 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 153 GLN : amide:sc= -3.54! C(o=-3.5!,f=-3.5!) USER MOD Single : A 159 SER OG : rot -51:sc= 0.285 USER MOD Single : A 163 ASN : amide:sc=-0.00666 X(o=-0.0067,f=0) USER MOD Single : A 167 HIS : no HD1:sc= 0 X(o=0,f=-0.0055) USER MOD Single : A 168 HIS : no HE2:sc= 0.479 K(o=0.48,f=-1.7!) USER MOD Single : A 169 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 172 HIS : no HD1:sc= 0 X(o=0,f=-0.0017) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -12.620 2.418 -7.538 1.00 32.11 N ATOM 2 CA THR A 1 -12.414 2.275 -9.005 1.00 4.35 C ATOM 3 C THR A 1 -11.579 1.012 -9.341 1.00 12.20 C ATOM 4 O THR A 1 -12.153 -0.061 -9.536 1.00 30.03 O ATOM 5 CB THR A 1 -11.765 3.560 -9.623 1.00 43.14 C ATOM 6 OG1 THR A 1 -12.465 4.722 -9.152 1.00 35.52 O ATOM 7 CG2 THR A 1 -11.790 3.542 -11.164 1.00 15.55 C ATOM 0 H1 THR A 1 -13.138 3.299 -7.344 1.00 32.11 H new ATOM 0 H2 THR A 1 -13.169 1.609 -7.184 1.00 32.11 H new ATOM 0 H3 THR A 1 -11.697 2.447 -7.059 1.00 32.11 H new ATOM 0 HA THR A 1 -13.398 2.152 -9.458 1.00 4.35 H new ATOM 0 HB THR A 1 -10.722 3.586 -9.308 1.00 43.14 H new ATOM 0 HG1 THR A 1 -11.979 5.529 -9.422 1.00 35.52 H new ATOM 0 HG21 THR A 1 -11.329 4.453 -11.546 1.00 15.55 H new ATOM 0 HG22 THR A 1 -11.237 2.676 -11.527 1.00 15.55 H new ATOM 0 HG23 THR A 1 -12.822 3.484 -11.511 1.00 15.55 H new ATOM 17 N VAL A 2 -10.221 1.147 -9.345 1.00 72.14 N ATOM 18 CA VAL A 2 -9.271 0.107 -9.837 1.00 2.34 C ATOM 19 C VAL A 2 -9.545 -0.260 -11.328 1.00 51.43 C ATOM 20 O VAL A 2 -10.541 -0.916 -11.649 1.00 3.44 O ATOM 21 CB VAL A 2 -9.241 -1.188 -8.936 1.00 3.43 C ATOM 22 CG1 VAL A 2 -8.170 -2.200 -9.426 1.00 23.31 C ATOM 23 CG2 VAL A 2 -9.010 -0.820 -7.451 1.00 4.43 C ATOM 0 H VAL A 2 -9.753 1.987 -9.004 1.00 72.14 H new ATOM 0 HA VAL A 2 -8.280 0.555 -9.768 1.00 2.34 H new ATOM 0 HB VAL A 2 -10.214 -1.671 -9.023 1.00 3.43 H new ATOM 0 HG11 VAL A 2 -8.178 -3.079 -8.782 1.00 23.31 H new ATOM 0 HG12 VAL A 2 -8.393 -2.499 -10.450 1.00 23.31 H new ATOM 0 HG13 VAL A 2 -7.185 -1.734 -9.391 1.00 23.31 H new ATOM 0 HG21 VAL A 2 -8.993 -1.729 -6.849 1.00 4.43 H new ATOM 0 HG22 VAL A 2 -8.058 -0.300 -7.349 1.00 4.43 H new ATOM 0 HG23 VAL A 2 -9.816 -0.172 -7.107 1.00 4.43 H new ATOM 33 N VAL A 3 -8.653 0.185 -12.231 1.00 3.11 N ATOM 34 CA VAL A 3 -8.824 0.010 -13.702 1.00 23.30 C ATOM 35 C VAL A 3 -7.777 -0.943 -14.335 1.00 23.25 C ATOM 36 O VAL A 3 -7.981 -1.421 -15.456 1.00 20.21 O ATOM 37 CB VAL A 3 -8.815 1.407 -14.438 1.00 51.41 C ATOM 38 CG1 VAL A 3 -10.123 2.188 -14.152 1.00 40.33 C ATOM 39 CG2 VAL A 3 -7.575 2.248 -14.031 1.00 42.54 C ATOM 0 H VAL A 3 -7.796 0.674 -11.974 1.00 3.11 H new ATOM 0 HA VAL A 3 -9.796 -0.464 -13.839 1.00 23.30 H new ATOM 0 HB VAL A 3 -8.755 1.218 -15.510 1.00 51.41 H new ATOM 0 HG11 VAL A 3 -10.095 3.147 -14.669 1.00 40.33 H new ATOM 0 HG12 VAL A 3 -10.977 1.610 -14.506 1.00 40.33 H new ATOM 0 HG13 VAL A 3 -10.219 2.357 -13.079 1.00 40.33 H new ATOM 0 HG21 VAL A 3 -7.596 3.204 -14.554 1.00 42.54 H new ATOM 0 HG22 VAL A 3 -7.591 2.422 -12.955 1.00 42.54 H new ATOM 0 HG23 VAL A 3 -6.666 1.709 -14.298 1.00 42.54 H new ATOM 49 N SER A 4 -6.666 -1.219 -13.625 1.00 53.25 N ATOM 50 CA SER A 4 -5.616 -2.150 -14.111 1.00 22.42 C ATOM 51 C SER A 4 -4.890 -2.833 -12.937 1.00 52.30 C ATOM 52 O SER A 4 -4.724 -2.237 -11.869 1.00 60.12 O ATOM 53 CB SER A 4 -4.583 -1.403 -14.986 1.00 13.54 C ATOM 54 OG SER A 4 -3.566 -2.282 -15.464 1.00 44.03 O ATOM 0 H SER A 4 -6.468 -0.812 -12.711 1.00 53.25 H new ATOM 0 HA SER A 4 -6.111 -2.913 -14.711 1.00 22.42 H new ATOM 0 HB2 SER A 4 -5.090 -0.938 -15.832 1.00 13.54 H new ATOM 0 HB3 SER A 4 -4.128 -0.600 -14.407 1.00 13.54 H new ATOM 0 HG SER A 4 -2.931 -1.778 -16.015 1.00 44.03 H new ATOM 60 N VAL A 5 -4.484 -4.100 -13.150 1.00 53.03 N ATOM 61 CA VAL A 5 -3.659 -4.884 -12.198 1.00 31.22 C ATOM 62 C VAL A 5 -2.553 -5.651 -12.976 1.00 61.34 C ATOM 63 O VAL A 5 -2.836 -6.616 -13.697 1.00 23.14 O ATOM 64 CB VAL A 5 -4.528 -5.911 -11.354 1.00 21.32 C ATOM 65 CG1 VAL A 5 -3.646 -6.744 -10.389 1.00 54.43 C ATOM 66 CG2 VAL A 5 -5.652 -5.190 -10.566 1.00 14.42 C ATOM 0 H VAL A 5 -4.720 -4.618 -13.997 1.00 53.03 H new ATOM 0 HA VAL A 5 -3.209 -4.181 -11.497 1.00 31.22 H new ATOM 0 HB VAL A 5 -4.993 -6.593 -12.066 1.00 21.32 H new ATOM 0 HG11 VAL A 5 -4.274 -7.436 -9.828 1.00 54.43 H new ATOM 0 HG12 VAL A 5 -2.910 -7.306 -10.963 1.00 54.43 H new ATOM 0 HG13 VAL A 5 -3.133 -6.076 -9.697 1.00 54.43 H new ATOM 0 HG21 VAL A 5 -6.227 -5.923 -10.000 1.00 14.42 H new ATOM 0 HG22 VAL A 5 -5.210 -4.467 -9.880 1.00 14.42 H new ATOM 0 HG23 VAL A 5 -6.311 -4.672 -11.263 1.00 14.42 H new ATOM 76 N ASP A 6 -1.305 -5.177 -12.862 1.00 2.31 N ATOM 77 CA ASP A 6 -0.118 -5.826 -13.462 1.00 13.21 C ATOM 78 C ASP A 6 0.553 -6.790 -12.457 1.00 61.25 C ATOM 79 O ASP A 6 0.710 -6.449 -11.284 1.00 44.13 O ATOM 80 CB ASP A 6 0.890 -4.741 -13.909 1.00 12.02 C ATOM 81 CG ASP A 6 0.275 -3.763 -14.918 1.00 22.15 C ATOM 82 OD1 ASP A 6 -0.399 -2.796 -14.485 1.00 13.03 O ATOM 83 OD2 ASP A 6 0.431 -3.966 -16.146 1.00 22.23 O ATOM 0 H ASP A 6 -1.083 -4.325 -12.347 1.00 2.31 H new ATOM 0 HA ASP A 6 -0.438 -6.408 -14.326 1.00 13.21 H new ATOM 0 HB2 ASP A 6 1.239 -4.189 -13.036 1.00 12.02 H new ATOM 0 HB3 ASP A 6 1.763 -5.219 -14.354 1.00 12.02 H new ATOM 88 N LYS A 7 0.919 -7.999 -12.909 1.00 74.41 N ATOM 89 CA LYS A 7 1.639 -8.987 -12.070 1.00 70.22 C ATOM 90 C LYS A 7 2.798 -9.650 -12.857 1.00 32.53 C ATOM 91 O LYS A 7 2.566 -10.457 -13.760 1.00 52.34 O ATOM 92 CB LYS A 7 0.644 -10.055 -11.542 1.00 61.35 C ATOM 93 CG LYS A 7 1.252 -11.074 -10.549 1.00 72.45 C ATOM 94 CD LYS A 7 0.216 -12.121 -10.096 1.00 25.14 C ATOM 95 CE LYS A 7 0.799 -13.160 -9.134 1.00 50.03 C ATOM 96 NZ LYS A 7 -0.206 -14.191 -8.788 1.00 2.52 N ATOM 0 H LYS A 7 0.729 -8.324 -13.857 1.00 74.41 H new ATOM 0 HA LYS A 7 2.078 -8.466 -11.219 1.00 70.22 H new ATOM 0 HB2 LYS A 7 -0.188 -9.547 -11.055 1.00 61.35 H new ATOM 0 HB3 LYS A 7 0.232 -10.599 -12.392 1.00 61.35 H new ATOM 0 HG2 LYS A 7 2.097 -11.578 -11.018 1.00 72.45 H new ATOM 0 HG3 LYS A 7 1.639 -10.546 -9.678 1.00 72.45 H new ATOM 0 HD2 LYS A 7 -0.618 -11.613 -9.612 1.00 25.14 H new ATOM 0 HD3 LYS A 7 -0.186 -12.630 -10.972 1.00 25.14 H new ATOM 0 HE2 LYS A 7 1.668 -13.634 -9.589 1.00 50.03 H new ATOM 0 HE3 LYS A 7 1.145 -12.666 -8.226 1.00 50.03 H new ATOM 0 HZ1 LYS A 7 0.278 -15.074 -8.527 1.00 2.52 H new ATOM 0 HZ2 LYS A 7 -0.780 -13.861 -7.986 1.00 2.52 H new ATOM 0 HZ3 LYS A 7 -0.823 -14.363 -9.607 1.00 2.52 H new ATOM 110 N ASP A 8 4.041 -9.280 -12.515 1.00 1.13 N ATOM 111 CA ASP A 8 5.268 -9.906 -13.052 1.00 32.24 C ATOM 112 C ASP A 8 5.962 -10.752 -11.964 1.00 44.32 C ATOM 113 O ASP A 8 6.685 -10.219 -11.120 1.00 63.10 O ATOM 114 CB ASP A 8 6.248 -8.832 -13.580 1.00 11.30 C ATOM 115 CG ASP A 8 5.667 -8.005 -14.728 1.00 74.22 C ATOM 116 OD1 ASP A 8 5.714 -8.471 -15.889 1.00 63.04 O ATOM 117 OD2 ASP A 8 5.158 -6.894 -14.477 1.00 63.45 O ATOM 0 H ASP A 8 4.229 -8.529 -11.850 1.00 1.13 H new ATOM 0 HA ASP A 8 4.980 -10.554 -13.879 1.00 32.24 H new ATOM 0 HB2 ASP A 8 6.523 -8.166 -12.762 1.00 11.30 H new ATOM 0 HB3 ASP A 8 7.164 -9.318 -13.917 1.00 11.30 H new ATOM 122 N VAL A 9 5.709 -12.068 -11.986 1.00 32.52 N ATOM 123 CA VAL A 9 6.410 -13.055 -11.128 1.00 4.32 C ATOM 124 C VAL A 9 7.899 -13.205 -11.564 1.00 55.42 C ATOM 125 O VAL A 9 8.774 -13.533 -10.754 1.00 10.54 O ATOM 126 CB VAL A 9 5.660 -14.443 -11.170 1.00 11.31 C ATOM 127 CG1 VAL A 9 6.381 -15.532 -10.335 1.00 63.51 C ATOM 128 CG2 VAL A 9 4.192 -14.275 -10.698 1.00 64.15 C ATOM 0 H VAL A 9 5.011 -12.488 -12.600 1.00 32.52 H new ATOM 0 HA VAL A 9 6.401 -12.694 -10.100 1.00 4.32 H new ATOM 0 HB VAL A 9 5.667 -14.783 -12.206 1.00 11.31 H new ATOM 0 HG11 VAL A 9 5.824 -16.467 -10.398 1.00 63.51 H new ATOM 0 HG12 VAL A 9 7.388 -15.683 -10.725 1.00 63.51 H new ATOM 0 HG13 VAL A 9 6.439 -15.213 -9.294 1.00 63.51 H new ATOM 0 HG21 VAL A 9 3.686 -15.240 -10.732 1.00 64.15 H new ATOM 0 HG22 VAL A 9 4.179 -13.894 -9.677 1.00 64.15 H new ATOM 0 HG23 VAL A 9 3.677 -13.572 -11.353 1.00 64.15 H new ATOM 138 N GLU A 10 8.161 -12.925 -12.854 1.00 42.54 N ATOM 139 CA GLU A 10 9.521 -12.907 -13.438 1.00 24.53 C ATOM 140 C GLU A 10 10.334 -11.708 -12.889 1.00 62.10 C ATOM 141 O GLU A 10 11.444 -11.872 -12.376 1.00 22.32 O ATOM 142 CB GLU A 10 9.416 -12.803 -14.984 1.00 60.23 C ATOM 143 CG GLU A 10 8.630 -13.945 -15.655 1.00 14.54 C ATOM 144 CD GLU A 10 8.339 -13.679 -17.144 1.00 12.14 C ATOM 145 OE1 GLU A 10 7.505 -12.792 -17.443 1.00 1.43 O ATOM 146 OE2 GLU A 10 8.944 -14.334 -18.021 1.00 62.54 O ATOM 0 H GLU A 10 7.430 -12.702 -13.529 1.00 42.54 H new ATOM 0 HA GLU A 10 10.034 -13.829 -13.164 1.00 24.53 H new ATOM 0 HB2 GLU A 10 8.942 -11.855 -15.239 1.00 60.23 H new ATOM 0 HB3 GLU A 10 10.422 -12.779 -15.402 1.00 60.23 H new ATOM 0 HG2 GLU A 10 9.195 -14.872 -15.561 1.00 14.54 H new ATOM 0 HG3 GLU A 10 7.688 -14.090 -15.126 1.00 14.54 H new ATOM 153 N ALA A 11 9.744 -10.499 -12.993 1.00 64.33 N ATOM 154 CA ALA A 11 10.388 -9.231 -12.558 1.00 11.22 C ATOM 155 C ALA A 11 10.118 -8.906 -11.062 1.00 4.32 C ATOM 156 O ALA A 11 10.536 -7.847 -10.575 1.00 22.03 O ATOM 157 CB ALA A 11 9.919 -8.075 -13.464 1.00 42.14 C ATOM 0 H ALA A 11 8.809 -10.369 -13.380 1.00 64.33 H new ATOM 0 HA ALA A 11 11.466 -9.357 -12.655 1.00 11.22 H new ATOM 0 HB1 ALA A 11 10.392 -7.147 -13.144 1.00 42.14 H new ATOM 0 HB2 ALA A 11 10.197 -8.286 -14.497 1.00 42.14 H new ATOM 0 HB3 ALA A 11 8.836 -7.974 -13.393 1.00 42.14 H new ATOM 163 N LEU A 12 9.417 -9.828 -10.357 1.00 52.34 N ATOM 164 CA LEU A 12 9.116 -9.741 -8.897 1.00 34.32 C ATOM 165 C LEU A 12 8.317 -8.474 -8.495 1.00 72.50 C ATOM 166 O LEU A 12 8.339 -8.067 -7.339 1.00 43.25 O ATOM 167 CB LEU A 12 10.427 -9.867 -8.062 1.00 14.45 C ATOM 168 CG LEU A 12 11.279 -11.138 -8.351 1.00 62.42 C ATOM 169 CD1 LEU A 12 12.551 -11.172 -7.480 1.00 15.52 C ATOM 170 CD2 LEU A 12 10.436 -12.412 -8.167 1.00 23.50 C ATOM 0 H LEU A 12 9.036 -10.669 -10.790 1.00 52.34 H new ATOM 0 HA LEU A 12 8.462 -10.583 -8.670 1.00 34.32 H new ATOM 0 HB2 LEU A 12 11.043 -8.987 -8.247 1.00 14.45 H new ATOM 0 HB3 LEU A 12 10.167 -9.857 -7.004 1.00 14.45 H new ATOM 0 HG LEU A 12 11.602 -11.098 -9.391 1.00 62.42 H new ATOM 0 HD11 LEU A 12 13.123 -12.072 -7.706 1.00 15.52 H new ATOM 0 HD12 LEU A 12 13.160 -10.293 -7.690 1.00 15.52 H new ATOM 0 HD13 LEU A 12 12.271 -11.176 -6.427 1.00 15.52 H new ATOM 0 HD21 LEU A 12 11.051 -13.288 -8.374 1.00 23.50 H new ATOM 0 HD22 LEU A 12 10.069 -12.460 -7.142 1.00 23.50 H new ATOM 0 HD23 LEU A 12 9.591 -12.391 -8.855 1.00 23.50 H new ATOM 182 N SER A 13 7.575 -7.896 -9.445 1.00 33.35 N ATOM 183 CA SER A 13 6.792 -6.661 -9.221 1.00 64.20 C ATOM 184 C SER A 13 5.292 -6.921 -9.428 1.00 53.14 C ATOM 185 O SER A 13 4.894 -7.497 -10.429 1.00 42.45 O ATOM 186 CB SER A 13 7.271 -5.545 -10.176 1.00 74.41 C ATOM 187 OG SER A 13 7.210 -5.948 -11.544 1.00 60.11 O ATOM 0 H SER A 13 7.496 -8.265 -10.393 1.00 33.35 H new ATOM 0 HA SER A 13 6.948 -6.340 -8.191 1.00 64.20 H new ATOM 0 HB2 SER A 13 6.656 -4.656 -10.032 1.00 74.41 H new ATOM 0 HB3 SER A 13 8.295 -5.268 -9.925 1.00 74.41 H new ATOM 0 HG SER A 13 7.519 -5.214 -12.115 1.00 60.11 H new ATOM 193 N PHE A 14 4.476 -6.491 -8.464 1.00 63.11 N ATOM 194 CA PHE A 14 3.009 -6.549 -8.543 1.00 11.53 C ATOM 195 C PHE A 14 2.449 -5.108 -8.457 1.00 34.25 C ATOM 196 O PHE A 14 2.449 -4.495 -7.391 1.00 24.11 O ATOM 197 CB PHE A 14 2.462 -7.451 -7.399 1.00 24.00 C ATOM 198 CG PHE A 14 0.944 -7.430 -7.261 1.00 30.34 C ATOM 199 CD1 PHE A 14 0.130 -8.036 -8.215 1.00 51.34 C ATOM 200 CD2 PHE A 14 0.332 -6.783 -6.185 1.00 40.54 C ATOM 201 CE1 PHE A 14 -1.244 -7.992 -8.100 1.00 3.12 C ATOM 202 CE2 PHE A 14 -1.038 -6.745 -6.073 1.00 4.25 C ATOM 203 CZ PHE A 14 -1.828 -7.347 -7.027 1.00 11.24 C ATOM 0 H PHE A 14 4.817 -6.086 -7.592 1.00 63.11 H new ATOM 0 HA PHE A 14 2.690 -6.986 -9.489 1.00 11.53 H new ATOM 0 HB2 PHE A 14 2.786 -8.477 -7.574 1.00 24.00 H new ATOM 0 HB3 PHE A 14 2.906 -7.133 -6.456 1.00 24.00 H new ATOM 0 HD1 PHE A 14 0.580 -8.546 -9.054 1.00 51.34 H new ATOM 0 HD2 PHE A 14 0.942 -6.307 -5.432 1.00 40.54 H new ATOM 0 HE1 PHE A 14 -1.864 -8.462 -8.849 1.00 3.12 H new ATOM 0 HE2 PHE A 14 -1.496 -6.242 -5.234 1.00 4.25 H new ATOM 0 HZ PHE A 14 -2.904 -7.315 -6.936 1.00 11.24 H new ATOM 213 N SER A 15 1.971 -4.575 -9.593 1.00 43.24 N ATOM 214 CA SER A 15 1.471 -3.180 -9.684 1.00 53.42 C ATOM 215 C SER A 15 -0.064 -3.116 -9.855 1.00 2.33 C ATOM 216 O SER A 15 -0.674 -4.022 -10.410 1.00 60.10 O ATOM 217 CB SER A 15 2.162 -2.440 -10.847 1.00 42.13 C ATOM 218 OG SER A 15 1.755 -1.079 -10.903 1.00 5.13 O ATOM 0 H SER A 15 1.917 -5.089 -10.472 1.00 43.24 H new ATOM 0 HA SER A 15 1.715 -2.689 -8.742 1.00 53.42 H new ATOM 0 HB2 SER A 15 3.244 -2.494 -10.725 1.00 42.13 H new ATOM 0 HB3 SER A 15 1.923 -2.933 -11.789 1.00 42.13 H new ATOM 0 HG SER A 15 2.256 -0.616 -11.607 1.00 5.13 H new ATOM 224 N ILE A 16 -0.682 -2.030 -9.344 1.00 44.32 N ATOM 225 CA ILE A 16 -2.134 -1.753 -9.504 1.00 64.11 C ATOM 226 C ILE A 16 -2.337 -0.265 -9.873 1.00 5.00 C ATOM 227 O ILE A 16 -1.826 0.626 -9.185 1.00 42.42 O ATOM 228 CB ILE A 16 -2.945 -2.085 -8.186 1.00 33.53 C ATOM 229 CG1 ILE A 16 -2.755 -3.582 -7.772 1.00 24.34 C ATOM 230 CG2 ILE A 16 -4.456 -1.747 -8.352 1.00 14.12 C ATOM 231 CD1 ILE A 16 -3.274 -3.930 -6.393 1.00 62.14 C ATOM 0 H ILE A 16 -0.191 -1.316 -8.807 1.00 44.32 H new ATOM 0 HA ILE A 16 -2.512 -2.395 -10.300 1.00 64.11 H new ATOM 0 HB ILE A 16 -2.547 -1.458 -7.388 1.00 33.53 H new ATOM 0 HG12 ILE A 16 -3.258 -4.214 -8.504 1.00 24.34 H new ATOM 0 HG13 ILE A 16 -1.693 -3.825 -7.817 1.00 24.34 H new ATOM 0 HG21 ILE A 16 -4.986 -1.986 -7.430 1.00 14.12 H new ATOM 0 HG22 ILE A 16 -4.569 -0.685 -8.571 1.00 14.12 H new ATOM 0 HG23 ILE A 16 -4.872 -2.333 -9.172 1.00 14.12 H new ATOM 0 HD11 ILE A 16 -3.099 -4.987 -6.194 1.00 62.14 H new ATOM 0 HD12 ILE A 16 -2.754 -3.329 -5.646 1.00 62.14 H new ATOM 0 HD13 ILE A 16 -4.343 -3.724 -6.344 1.00 62.14 H new ATOM 243 N VAL A 17 -3.082 -0.013 -10.961 1.00 11.13 N ATOM 244 CA VAL A 17 -3.447 1.343 -11.411 1.00 34.40 C ATOM 245 C VAL A 17 -4.945 1.601 -11.104 1.00 22.25 C ATOM 246 O VAL A 17 -5.807 0.773 -11.430 1.00 74.33 O ATOM 247 CB VAL A 17 -3.192 1.517 -12.955 1.00 15.35 C ATOM 248 CG1 VAL A 17 -3.509 2.957 -13.431 1.00 4.00 C ATOM 249 CG2 VAL A 17 -1.747 1.107 -13.340 1.00 42.42 C ATOM 0 H VAL A 17 -3.452 -0.751 -11.560 1.00 11.13 H new ATOM 0 HA VAL A 17 -2.825 2.061 -10.877 1.00 34.40 H new ATOM 0 HB VAL A 17 -3.878 0.845 -13.471 1.00 15.35 H new ATOM 0 HG11 VAL A 17 -3.320 3.036 -14.502 1.00 4.00 H new ATOM 0 HG12 VAL A 17 -4.556 3.185 -13.229 1.00 4.00 H new ATOM 0 HG13 VAL A 17 -2.874 3.665 -12.897 1.00 4.00 H new ATOM 0 HG21 VAL A 17 -1.605 1.239 -14.413 1.00 42.42 H new ATOM 0 HG22 VAL A 17 -1.035 1.732 -12.800 1.00 42.42 H new ATOM 0 HG23 VAL A 17 -1.584 0.062 -13.079 1.00 42.42 H new ATOM 259 N ALA A 18 -5.241 2.753 -10.478 1.00 4.21 N ATOM 260 CA ALA A 18 -6.618 3.155 -10.121 1.00 33.02 C ATOM 261 C ALA A 18 -6.801 4.686 -10.241 1.00 11.32 C ATOM 262 O ALA A 18 -6.034 5.452 -9.665 1.00 73.31 O ATOM 263 CB ALA A 18 -6.931 2.686 -8.695 1.00 42.50 C ATOM 0 H ALA A 18 -4.533 3.434 -10.204 1.00 4.21 H new ATOM 0 HA ALA A 18 -7.312 2.685 -10.817 1.00 33.02 H new ATOM 0 HB1 ALA A 18 -7.946 2.981 -8.429 1.00 42.50 H new ATOM 0 HB2 ALA A 18 -6.843 1.601 -8.641 1.00 42.50 H new ATOM 0 HB3 ALA A 18 -6.227 3.142 -7.999 1.00 42.50 H new ATOM 269 N GLU A 19 -7.846 5.117 -10.969 1.00 2.11 N ATOM 270 CA GLU A 19 -8.144 6.557 -11.201 1.00 44.45 C ATOM 271 C GLU A 19 -9.350 7.001 -10.342 1.00 72.31 C ATOM 272 O GLU A 19 -10.415 6.398 -10.418 1.00 54.34 O ATOM 273 CB GLU A 19 -8.441 6.779 -12.711 1.00 30.13 C ATOM 274 CG GLU A 19 -7.315 6.297 -13.648 1.00 45.35 C ATOM 275 CD GLU A 19 -7.616 6.526 -15.139 1.00 33.11 C ATOM 276 OE1 GLU A 19 -7.375 7.648 -15.634 1.00 21.10 O ATOM 277 OE2 GLU A 19 -8.080 5.588 -15.822 1.00 24.31 O ATOM 0 H GLU A 19 -8.511 4.486 -11.416 1.00 2.11 H new ATOM 0 HA GLU A 19 -7.282 7.158 -10.911 1.00 44.45 H new ATOM 0 HB2 GLU A 19 -9.363 6.259 -12.970 1.00 30.13 H new ATOM 0 HB3 GLU A 19 -8.615 7.841 -12.885 1.00 30.13 H new ATOM 0 HG2 GLU A 19 -6.391 6.814 -13.389 1.00 45.35 H new ATOM 0 HG3 GLU A 19 -7.143 5.234 -13.479 1.00 45.35 H new ATOM 284 N PHE A 20 -9.181 8.071 -9.545 1.00 51.45 N ATOM 285 CA PHE A 20 -10.231 8.557 -8.610 1.00 21.12 C ATOM 286 C PHE A 20 -10.572 10.037 -8.872 1.00 22.23 C ATOM 287 O PHE A 20 -9.716 10.828 -9.295 1.00 54.32 O ATOM 288 CB PHE A 20 -9.778 8.367 -7.134 1.00 64.42 C ATOM 289 CG PHE A 20 -9.504 6.911 -6.753 1.00 15.22 C ATOM 290 CD1 PHE A 20 -10.558 6.028 -6.512 1.00 71.41 C ATOM 291 CD2 PHE A 20 -8.198 6.426 -6.640 1.00 51.31 C ATOM 292 CE1 PHE A 20 -10.316 4.710 -6.173 1.00 13.44 C ATOM 293 CE2 PHE A 20 -7.959 5.107 -6.300 1.00 0.01 C ATOM 294 CZ PHE A 20 -9.019 4.251 -6.069 1.00 11.11 C ATOM 0 H PHE A 20 -8.324 8.624 -9.525 1.00 51.45 H new ATOM 0 HA PHE A 20 -11.129 7.965 -8.784 1.00 21.12 H new ATOM 0 HB2 PHE A 20 -8.875 8.953 -6.963 1.00 64.42 H new ATOM 0 HB3 PHE A 20 -10.548 8.767 -6.474 1.00 64.42 H new ATOM 0 HD1 PHE A 20 -11.576 6.379 -6.591 1.00 71.41 H new ATOM 0 HD2 PHE A 20 -7.365 7.090 -6.820 1.00 51.31 H new ATOM 0 HE1 PHE A 20 -11.142 4.039 -5.989 1.00 13.44 H new ATOM 0 HE2 PHE A 20 -6.945 4.746 -6.215 1.00 0.01 H new ATOM 0 HZ PHE A 20 -8.832 3.220 -5.806 1.00 11.11 H new ATOM 304 N ASP A 21 -11.839 10.397 -8.606 1.00 34.51 N ATOM 305 CA ASP A 21 -12.338 11.776 -8.748 1.00 52.10 C ATOM 306 C ASP A 21 -11.927 12.629 -7.512 1.00 24.31 C ATOM 307 O ASP A 21 -12.685 12.806 -6.551 1.00 1.01 O ATOM 308 CB ASP A 21 -13.879 11.759 -8.998 1.00 70.31 C ATOM 309 CG ASP A 21 -14.673 10.886 -7.999 1.00 51.21 C ATOM 310 OD1 ASP A 21 -14.623 9.640 -8.118 1.00 42.11 O ATOM 311 OD2 ASP A 21 -15.344 11.435 -7.098 1.00 73.42 O ATOM 0 H ASP A 21 -12.548 9.738 -8.285 1.00 34.51 H new ATOM 0 HA ASP A 21 -11.881 12.251 -9.616 1.00 52.10 H new ATOM 0 HB2 ASP A 21 -14.255 12.781 -8.949 1.00 70.31 H new ATOM 0 HB3 ASP A 21 -14.068 11.398 -10.009 1.00 70.31 H new ATOM 316 N ALA A 22 -10.682 13.136 -7.577 1.00 32.30 N ATOM 317 CA ALA A 22 -10.032 13.932 -6.506 1.00 71.12 C ATOM 318 C ALA A 22 -8.680 14.476 -7.019 1.00 15.42 C ATOM 319 O ALA A 22 -8.124 13.933 -7.972 1.00 32.33 O ATOM 320 CB ALA A 22 -9.811 13.068 -5.243 1.00 4.20 C ATOM 0 H ALA A 22 -10.082 13.004 -8.391 1.00 32.30 H new ATOM 0 HA ALA A 22 -10.683 14.765 -6.241 1.00 71.12 H new ATOM 0 HB1 ALA A 22 -9.333 13.670 -4.470 1.00 4.20 H new ATOM 0 HB2 ALA A 22 -10.772 12.704 -4.878 1.00 4.20 H new ATOM 0 HB3 ALA A 22 -9.172 12.220 -5.489 1.00 4.20 H new ATOM 326 N ASP A 23 -8.129 15.520 -6.369 1.00 74.11 N ATOM 327 CA ASP A 23 -6.838 16.128 -6.796 1.00 1.11 C ATOM 328 C ASP A 23 -5.641 15.407 -6.144 1.00 20.05 C ATOM 329 O ASP A 23 -5.803 14.634 -5.197 1.00 62.44 O ATOM 330 CB ASP A 23 -6.784 17.639 -6.472 1.00 24.12 C ATOM 331 CG ASP A 23 -6.969 17.937 -4.979 1.00 23.30 C ATOM 332 OD1 ASP A 23 -8.125 18.068 -4.530 1.00 61.55 O ATOM 333 OD2 ASP A 23 -5.962 18.025 -4.243 1.00 53.31 O ATOM 0 H ASP A 23 -8.549 15.962 -5.551 1.00 74.11 H new ATOM 0 HA ASP A 23 -6.773 16.009 -7.877 1.00 1.11 H new ATOM 0 HB2 ASP A 23 -5.826 18.042 -6.802 1.00 24.12 H new ATOM 0 HB3 ASP A 23 -7.559 18.155 -7.039 1.00 24.12 H new ATOM 338 N VAL A 24 -4.443 15.716 -6.660 1.00 60.43 N ATOM 339 CA VAL A 24 -3.171 15.053 -6.279 1.00 72.31 C ATOM 340 C VAL A 24 -2.853 15.181 -4.767 1.00 24.03 C ATOM 341 O VAL A 24 -2.367 14.236 -4.155 1.00 52.22 O ATOM 342 CB VAL A 24 -1.986 15.623 -7.148 1.00 30.34 C ATOM 343 CG1 VAL A 24 -0.634 14.929 -6.849 1.00 24.55 C ATOM 344 CG2 VAL A 24 -2.310 15.518 -8.648 1.00 55.22 C ATOM 0 H VAL A 24 -4.320 16.443 -7.365 1.00 60.43 H new ATOM 0 HA VAL A 24 -3.290 13.988 -6.479 1.00 72.31 H new ATOM 0 HB VAL A 24 -1.879 16.672 -6.872 1.00 30.34 H new ATOM 0 HG11 VAL A 24 0.144 15.363 -7.477 1.00 24.55 H new ATOM 0 HG12 VAL A 24 -0.376 15.072 -5.800 1.00 24.55 H new ATOM 0 HG13 VAL A 24 -0.718 13.863 -7.060 1.00 24.55 H new ATOM 0 HG21 VAL A 24 -1.478 15.917 -9.229 1.00 55.22 H new ATOM 0 HG22 VAL A 24 -2.469 14.473 -8.914 1.00 55.22 H new ATOM 0 HG23 VAL A 24 -3.212 16.089 -8.866 1.00 55.22 H new ATOM 354 N LYS A 25 -3.176 16.348 -4.173 1.00 42.11 N ATOM 355 CA LYS A 25 -2.958 16.606 -2.722 1.00 33.42 C ATOM 356 C LYS A 25 -3.934 15.765 -1.863 1.00 1.12 C ATOM 357 O LYS A 25 -3.566 15.242 -0.808 1.00 12.54 O ATOM 358 CB LYS A 25 -3.161 18.112 -2.400 1.00 31.01 C ATOM 359 CG LYS A 25 -2.269 19.077 -3.210 1.00 1.34 C ATOM 360 CD LYS A 25 -0.769 18.964 -2.856 1.00 1.25 C ATOM 361 CE LYS A 25 0.081 19.956 -3.661 1.00 33.44 C ATOM 362 NZ LYS A 25 1.511 19.923 -3.275 1.00 71.04 N ATOM 0 H LYS A 25 -3.591 17.134 -4.673 1.00 42.11 H new ATOM 0 HA LYS A 25 -1.934 16.320 -2.483 1.00 33.42 H new ATOM 0 HB2 LYS A 25 -4.205 18.369 -2.579 1.00 31.01 H new ATOM 0 HB3 LYS A 25 -2.971 18.270 -1.338 1.00 31.01 H new ATOM 0 HG2 LYS A 25 -2.401 18.876 -4.273 1.00 1.34 H new ATOM 0 HG3 LYS A 25 -2.601 20.101 -3.035 1.00 1.34 H new ATOM 0 HD2 LYS A 25 -0.632 19.148 -1.791 1.00 1.25 H new ATOM 0 HD3 LYS A 25 -0.425 17.948 -3.051 1.00 1.25 H new ATOM 0 HE2 LYS A 25 -0.010 19.729 -4.723 1.00 33.44 H new ATOM 0 HE3 LYS A 25 -0.308 20.964 -3.516 1.00 33.44 H new ATOM 0 HZ1 LYS A 25 1.875 20.895 -3.209 1.00 71.04 H new ATOM 0 HZ2 LYS A 25 1.611 19.452 -2.353 1.00 71.04 H new ATOM 0 HZ3 LYS A 25 2.052 19.399 -3.992 1.00 71.04 H new ATOM 376 N ARG A 26 -5.182 15.653 -2.354 1.00 32.24 N ATOM 377 CA ARG A 26 -6.267 14.887 -1.693 1.00 35.22 C ATOM 378 C ARG A 26 -5.946 13.365 -1.654 1.00 23.02 C ATOM 379 O ARG A 26 -6.173 12.695 -0.638 1.00 53.22 O ATOM 380 CB ARG A 26 -7.609 15.161 -2.440 1.00 3.51 C ATOM 381 CG ARG A 26 -8.845 14.391 -1.916 1.00 71.30 C ATOM 382 CD ARG A 26 -9.236 14.758 -0.472 1.00 74.31 C ATOM 383 NE ARG A 26 -10.363 13.933 0.013 1.00 11.43 N ATOM 384 CZ ARG A 26 -10.308 13.064 1.004 1.00 72.24 C ATOM 385 NH1 ARG A 26 -9.205 12.845 1.651 1.00 1.33 N ATOM 386 NH2 ARG A 26 -11.368 12.413 1.333 1.00 72.12 N ATOM 0 H ARG A 26 -5.473 16.093 -3.227 1.00 32.24 H new ATOM 0 HA ARG A 26 -6.356 15.216 -0.658 1.00 35.22 H new ATOM 0 HB2 ARG A 26 -7.821 16.229 -2.386 1.00 3.51 H new ATOM 0 HB3 ARG A 26 -7.472 14.916 -3.493 1.00 3.51 H new ATOM 0 HG2 ARG A 26 -9.691 14.589 -2.574 1.00 71.30 H new ATOM 0 HG3 ARG A 26 -8.644 13.321 -1.968 1.00 71.30 H new ATOM 0 HD2 ARG A 26 -8.376 14.622 0.184 1.00 74.31 H new ATOM 0 HD3 ARG A 26 -9.509 15.812 -0.425 1.00 74.31 H new ATOM 0 HE ARG A 26 -11.260 14.045 -0.459 1.00 11.43 H new ATOM 0 HH11 ARG A 26 -8.356 13.350 1.397 1.00 1.33 H new ATOM 0 HH12 ARG A 26 -9.187 12.168 2.414 1.00 1.33 H new ATOM 0 HH21 ARG A 26 -12.241 12.571 0.829 1.00 72.12 H new ATOM 0 HH22 ARG A 26 -11.336 11.739 2.098 1.00 72.12 H new ATOM 400 N VAL A 27 -5.409 12.840 -2.773 1.00 41.31 N ATOM 401 CA VAL A 27 -5.020 11.411 -2.900 1.00 55.11 C ATOM 402 C VAL A 27 -3.679 11.128 -2.160 1.00 2.15 C ATOM 403 O VAL A 27 -3.454 10.033 -1.660 1.00 44.11 O ATOM 404 CB VAL A 27 -4.915 10.971 -4.412 1.00 53.31 C ATOM 405 CG1 VAL A 27 -4.686 9.440 -4.552 1.00 23.24 C ATOM 406 CG2 VAL A 27 -6.167 11.414 -5.216 1.00 22.42 C ATOM 0 H VAL A 27 -5.231 13.388 -3.615 1.00 41.31 H new ATOM 0 HA VAL A 27 -5.806 10.820 -2.431 1.00 55.11 H new ATOM 0 HB VAL A 27 -4.045 11.476 -4.832 1.00 53.31 H new ATOM 0 HG11 VAL A 27 -4.619 9.177 -5.608 1.00 23.24 H new ATOM 0 HG12 VAL A 27 -3.759 9.163 -4.050 1.00 23.24 H new ATOM 0 HG13 VAL A 27 -5.519 8.904 -4.097 1.00 23.24 H new ATOM 0 HG21 VAL A 27 -6.064 11.096 -6.254 1.00 22.42 H new ATOM 0 HG22 VAL A 27 -7.057 10.958 -4.783 1.00 22.42 H new ATOM 0 HG23 VAL A 27 -6.260 12.499 -5.176 1.00 22.42 H new ATOM 416 N TRP A 28 -2.785 12.130 -2.120 1.00 62.53 N ATOM 417 CA TRP A 28 -1.510 12.054 -1.353 1.00 4.14 C ATOM 418 C TRP A 28 -1.774 12.004 0.173 1.00 11.00 C ATOM 419 O TRP A 28 -1.023 11.376 0.925 1.00 63.10 O ATOM 420 CB TRP A 28 -0.614 13.268 -1.723 1.00 4.52 C ATOM 421 CG TRP A 28 0.768 13.273 -1.094 1.00 44.44 C ATOM 422 CD1 TRP A 28 1.198 14.034 -0.038 1.00 63.53 C ATOM 423 CD2 TRP A 28 1.899 12.486 -1.503 1.00 20.12 C ATOM 424 NE1 TRP A 28 2.515 13.767 0.227 1.00 71.22 N ATOM 425 CE2 TRP A 28 2.968 12.825 -0.659 1.00 64.31 C ATOM 426 CE3 TRP A 28 2.110 11.528 -2.503 1.00 42.34 C ATOM 427 CZ2 TRP A 28 4.226 12.241 -0.783 1.00 62.52 C ATOM 428 CZ3 TRP A 28 3.358 10.956 -2.624 1.00 41.35 C ATOM 429 CH2 TRP A 28 4.404 11.317 -1.768 1.00 14.52 C ATOM 0 H TRP A 28 -2.915 13.014 -2.612 1.00 62.53 H new ATOM 0 HA TRP A 28 -0.992 11.133 -1.620 1.00 4.14 H new ATOM 0 HB2 TRP A 28 -0.501 13.298 -2.807 1.00 4.52 H new ATOM 0 HB3 TRP A 28 -1.131 14.182 -1.431 1.00 4.52 H new ATOM 0 HD1 TRP A 28 0.588 14.740 0.505 1.00 63.53 H new ATOM 0 HE1 TRP A 28 3.070 14.200 0.965 1.00 71.22 H new ATOM 0 HE3 TRP A 28 1.308 11.242 -3.168 1.00 42.34 H new ATOM 0 HZ2 TRP A 28 5.034 12.512 -0.120 1.00 62.52 H new ATOM 0 HZ3 TRP A 28 3.531 10.217 -3.392 1.00 41.35 H new ATOM 0 HH2 TRP A 28 5.372 10.854 -1.891 1.00 14.52 H new ATOM 440 N ALA A 29 -2.863 12.664 0.607 1.00 54.02 N ATOM 441 CA ALA A 29 -3.260 12.750 2.033 1.00 30.12 C ATOM 442 C ALA A 29 -3.613 11.375 2.666 1.00 13.54 C ATOM 443 O ALA A 29 -3.453 11.195 3.870 1.00 35.03 O ATOM 444 CB ALA A 29 -4.435 13.720 2.173 1.00 62.52 C ATOM 0 H ALA A 29 -3.498 13.157 -0.021 1.00 54.02 H new ATOM 0 HA ALA A 29 -2.394 13.117 2.584 1.00 30.12 H new ATOM 0 HB1 ALA A 29 -4.730 13.786 3.220 1.00 62.52 H new ATOM 0 HB2 ALA A 29 -4.137 14.706 1.817 1.00 62.52 H new ATOM 0 HB3 ALA A 29 -5.277 13.360 1.581 1.00 62.52 H new ATOM 450 N ILE A 30 -4.080 10.403 1.851 1.00 54.54 N ATOM 451 CA ILE A 30 -4.415 9.031 2.348 1.00 1.11 C ATOM 452 C ILE A 30 -3.136 8.184 2.602 1.00 43.42 C ATOM 453 O ILE A 30 -3.220 7.048 3.061 1.00 43.22 O ATOM 454 CB ILE A 30 -5.381 8.264 1.362 1.00 50.35 C ATOM 455 CG1 ILE A 30 -4.620 7.766 0.093 1.00 3.51 C ATOM 456 CG2 ILE A 30 -6.586 9.158 0.985 1.00 25.32 C ATOM 457 CD1 ILE A 30 -5.466 7.089 -0.965 1.00 13.04 C ATOM 0 H ILE A 30 -4.236 10.532 0.851 1.00 54.54 H new ATOM 0 HA ILE A 30 -4.935 9.167 3.296 1.00 1.11 H new ATOM 0 HB ILE A 30 -5.761 7.380 1.875 1.00 50.35 H new ATOM 0 HG12 ILE A 30 -4.117 8.619 -0.363 1.00 3.51 H new ATOM 0 HG13 ILE A 30 -3.843 7.070 0.409 1.00 3.51 H new ATOM 0 HG21 ILE A 30 -7.243 8.616 0.305 1.00 25.32 H new ATOM 0 HG22 ILE A 30 -7.137 9.425 1.887 1.00 25.32 H new ATOM 0 HG23 ILE A 30 -6.228 10.065 0.497 1.00 25.32 H new ATOM 0 HD11 ILE A 30 -4.832 6.786 -1.798 1.00 13.04 H new ATOM 0 HD12 ILE A 30 -5.949 6.210 -0.537 1.00 13.04 H new ATOM 0 HD13 ILE A 30 -6.227 7.783 -1.322 1.00 13.04 H new ATOM 469 N TRP A 31 -1.966 8.742 2.246 1.00 75.14 N ATOM 470 CA TRP A 31 -0.640 8.132 2.494 1.00 25.31 C ATOM 471 C TRP A 31 0.133 8.904 3.574 1.00 3.44 C ATOM 472 O TRP A 31 0.791 8.307 4.429 1.00 40.03 O ATOM 473 CB TRP A 31 0.177 8.130 1.176 1.00 62.34 C ATOM 474 CG TRP A 31 -0.431 7.254 0.114 1.00 72.42 C ATOM 475 CD1 TRP A 31 -1.176 7.637 -0.972 1.00 4.11 C ATOM 476 CD2 TRP A 31 -0.358 5.830 0.070 1.00 11.25 C ATOM 477 NE1 TRP A 31 -1.570 6.528 -1.676 1.00 30.33 N ATOM 478 CE2 TRP A 31 -1.071 5.409 -1.056 1.00 1.31 C ATOM 479 CE3 TRP A 31 0.253 4.871 0.883 1.00 20.13 C ATOM 480 CZ2 TRP A 31 -1.194 4.070 -1.390 1.00 20.35 C ATOM 481 CZ3 TRP A 31 0.132 3.542 0.551 1.00 3.12 C ATOM 482 CH2 TRP A 31 -0.582 3.147 -0.578 1.00 71.22 C ATOM 0 H TRP A 31 -1.910 9.643 1.771 1.00 75.14 H new ATOM 0 HA TRP A 31 -0.790 7.111 2.845 1.00 25.31 H new ATOM 0 HB2 TRP A 31 0.253 9.150 0.799 1.00 62.34 H new ATOM 0 HB3 TRP A 31 1.192 7.790 1.383 1.00 62.34 H new ATOM 0 HD1 TRP A 31 -1.416 8.657 -1.233 1.00 4.11 H new ATOM 0 HE1 TRP A 31 -2.140 6.533 -2.522 1.00 30.33 H new ATOM 0 HE3 TRP A 31 0.811 5.169 1.758 1.00 20.13 H new ATOM 0 HZ2 TRP A 31 -1.753 3.762 -2.261 1.00 20.35 H new ATOM 0 HZ3 TRP A 31 0.597 2.793 1.175 1.00 3.12 H new ATOM 0 HH2 TRP A 31 -0.656 2.097 -0.819 1.00 71.22 H new ATOM 493 N GLU A 32 0.047 10.238 3.498 1.00 2.12 N ATOM 494 CA GLU A 32 0.803 11.164 4.361 1.00 44.51 C ATOM 495 C GLU A 32 0.181 11.289 5.772 1.00 54.00 C ATOM 496 O GLU A 32 0.895 11.441 6.775 1.00 0.04 O ATOM 497 CB GLU A 32 0.879 12.539 3.651 1.00 43.14 C ATOM 498 CG GLU A 32 1.657 13.624 4.417 1.00 75.10 C ATOM 499 CD GLU A 32 1.960 14.851 3.550 1.00 44.33 C ATOM 500 OE1 GLU A 32 1.063 15.706 3.374 1.00 0.13 O ATOM 501 OE2 GLU A 32 3.091 14.951 3.016 1.00 11.03 O ATOM 0 H GLU A 32 -0.557 10.714 2.828 1.00 2.12 H new ATOM 0 HA GLU A 32 1.807 10.769 4.514 1.00 44.51 H new ATOM 0 HB2 GLU A 32 1.343 12.402 2.674 1.00 43.14 H new ATOM 0 HB3 GLU A 32 -0.135 12.897 3.475 1.00 43.14 H new ATOM 0 HG2 GLU A 32 1.080 13.933 5.289 1.00 75.10 H new ATOM 0 HG3 GLU A 32 2.593 13.204 4.786 1.00 75.10 H new ATOM 508 N ASP A 33 -1.151 11.226 5.832 1.00 24.01 N ATOM 509 CA ASP A 33 -1.913 11.308 7.089 1.00 73.45 C ATOM 510 C ASP A 33 -2.297 9.882 7.589 1.00 63.15 C ATOM 511 O ASP A 33 -3.037 9.170 6.892 1.00 40.11 O ATOM 512 CB ASP A 33 -3.163 12.183 6.848 1.00 41.44 C ATOM 513 CG ASP A 33 -3.966 12.457 8.121 1.00 70.22 C ATOM 514 OD1 ASP A 33 -3.630 13.415 8.844 1.00 24.15 O ATOM 515 OD2 ASP A 33 -4.929 11.720 8.406 1.00 74.01 O ATOM 0 H ASP A 33 -1.739 11.116 5.006 1.00 24.01 H new ATOM 0 HA ASP A 33 -1.304 11.765 7.869 1.00 73.45 H new ATOM 0 HB2 ASP A 33 -2.854 13.132 6.410 1.00 41.44 H new ATOM 0 HB3 ASP A 33 -3.807 11.691 6.119 1.00 41.44 H new ATOM 520 N PRO A 34 -1.783 9.439 8.794 1.00 33.24 N ATOM 521 CA PRO A 34 -2.069 8.087 9.364 1.00 41.22 C ATOM 522 C PRO A 34 -3.579 7.791 9.546 1.00 70.12 C ATOM 523 O PRO A 34 -4.010 6.656 9.336 1.00 0.41 O ATOM 524 CB PRO A 34 -1.335 8.094 10.739 1.00 1.14 C ATOM 525 CG PRO A 34 -1.064 9.543 11.024 1.00 13.11 C ATOM 526 CD PRO A 34 -0.854 10.193 9.677 1.00 15.43 C ATOM 0 HA PRO A 34 -1.728 7.303 8.688 1.00 41.22 H new ATOM 0 HB2 PRO A 34 -1.952 7.647 11.518 1.00 1.14 H new ATOM 0 HB3 PRO A 34 -0.409 7.520 10.696 1.00 1.14 H new ATOM 0 HG2 PRO A 34 -1.900 10.001 11.553 1.00 13.11 H new ATOM 0 HG3 PRO A 34 -0.184 9.660 11.656 1.00 13.11 H new ATOM 0 HD2 PRO A 34 -1.093 11.256 9.700 1.00 15.43 H new ATOM 0 HD3 PRO A 34 0.180 10.106 9.343 1.00 15.43 H new ATOM 534 N ARG A 35 -4.367 8.824 9.929 1.00 42.30 N ATOM 535 CA ARG A 35 -5.823 8.683 10.183 1.00 24.45 C ATOM 536 C ARG A 35 -6.582 8.283 8.890 1.00 62.43 C ATOM 537 O ARG A 35 -7.548 7.507 8.928 1.00 42.34 O ATOM 538 CB ARG A 35 -6.419 10.014 10.750 1.00 12.54 C ATOM 539 CG ARG A 35 -7.723 9.836 11.593 1.00 62.32 C ATOM 540 CD ARG A 35 -7.468 9.872 13.128 1.00 64.14 C ATOM 541 NE ARG A 35 -6.237 9.158 13.524 1.00 45.42 N ATOM 542 CZ ARG A 35 -6.124 7.867 13.731 1.00 52.43 C ATOM 543 NH1 ARG A 35 -7.145 7.076 13.663 1.00 71.01 N ATOM 544 NH2 ARG A 35 -4.967 7.372 13.996 1.00 52.34 N ATOM 0 H ARG A 35 -4.016 9.771 10.070 1.00 42.30 H new ATOM 0 HA ARG A 35 -5.950 7.892 10.922 1.00 24.45 H new ATOM 0 HB2 ARG A 35 -5.665 10.499 11.370 1.00 12.54 H new ATOM 0 HB3 ARG A 35 -6.629 10.686 9.918 1.00 12.54 H new ATOM 0 HG2 ARG A 35 -8.429 10.624 11.330 1.00 62.32 H new ATOM 0 HG3 ARG A 35 -8.191 8.887 11.331 1.00 62.32 H new ATOM 0 HD2 ARG A 35 -7.401 10.909 13.456 1.00 64.14 H new ATOM 0 HD3 ARG A 35 -8.320 9.429 13.643 1.00 64.14 H new ATOM 0 HE ARG A 35 -5.396 9.721 13.648 1.00 45.42 H new ATOM 0 HH11 ARG A 35 -8.068 7.452 13.444 1.00 71.01 H new ATOM 0 HH12 ARG A 35 -7.028 6.076 13.829 1.00 71.01 H new ATOM 0 HH21 ARG A 35 -4.150 7.981 14.043 1.00 52.34 H new ATOM 0 HH22 ARG A 35 -4.866 6.370 14.159 1.00 52.34 H new ATOM 558 N GLN A 36 -6.134 8.851 7.756 1.00 71.23 N ATOM 559 CA GLN A 36 -6.687 8.550 6.423 1.00 24.02 C ATOM 560 C GLN A 36 -6.089 7.260 5.818 1.00 21.41 C ATOM 561 O GLN A 36 -6.736 6.636 4.992 1.00 32.10 O ATOM 562 CB GLN A 36 -6.469 9.748 5.462 1.00 35.22 C ATOM 563 CG GLN A 36 -7.240 11.022 5.862 1.00 54.12 C ATOM 564 CD GLN A 36 -7.040 12.173 4.878 1.00 74.03 C ATOM 565 OE1 GLN A 36 -7.776 12.307 3.911 1.00 21.41 O ATOM 566 NE2 GLN A 36 -6.060 13.017 5.119 1.00 5.12 N ATOM 0 H GLN A 36 -5.376 9.534 7.738 1.00 71.23 H new ATOM 0 HA GLN A 36 -7.757 8.382 6.550 1.00 24.02 H new ATOM 0 HB2 GLN A 36 -5.404 9.978 5.421 1.00 35.22 H new ATOM 0 HB3 GLN A 36 -6.771 9.454 4.457 1.00 35.22 H new ATOM 0 HG2 GLN A 36 -8.303 10.790 5.931 1.00 54.12 H new ATOM 0 HG3 GLN A 36 -6.918 11.339 6.854 1.00 54.12 H new ATOM 0 HE21 GLN A 36 -5.460 12.883 5.933 1.00 5.12 H new ATOM 0 HE22 GLN A 36 -5.900 13.806 4.492 1.00 5.12 H new ATOM 575 N LEU A 37 -4.863 6.867 6.232 1.00 1.53 N ATOM 576 CA LEU A 37 -4.190 5.645 5.705 1.00 51.01 C ATOM 577 C LEU A 37 -4.794 4.354 6.303 1.00 44.02 C ATOM 578 O LEU A 37 -5.204 3.456 5.559 1.00 61.12 O ATOM 579 CB LEU A 37 -2.658 5.709 5.975 1.00 62.04 C ATOM 580 CG LEU A 37 -1.818 4.432 5.607 1.00 61.24 C ATOM 581 CD1 LEU A 37 -1.965 4.020 4.123 1.00 42.32 C ATOM 582 CD2 LEU A 37 -0.336 4.634 5.967 1.00 25.31 C ATOM 0 H LEU A 37 -4.316 7.373 6.928 1.00 1.53 H new ATOM 0 HA LEU A 37 -4.357 5.615 4.628 1.00 51.01 H new ATOM 0 HB2 LEU A 37 -2.251 6.555 5.421 1.00 62.04 H new ATOM 0 HB3 LEU A 37 -2.508 5.920 7.034 1.00 62.04 H new ATOM 0 HG LEU A 37 -2.222 3.613 6.201 1.00 61.24 H new ATOM 0 HD11 LEU A 37 -1.362 3.133 3.930 1.00 42.32 H new ATOM 0 HD12 LEU A 37 -3.011 3.802 3.908 1.00 42.32 H new ATOM 0 HD13 LEU A 37 -1.626 4.835 3.484 1.00 42.32 H new ATOM 0 HD21 LEU A 37 0.228 3.739 5.704 1.00 25.31 H new ATOM 0 HD22 LEU A 37 0.060 5.487 5.415 1.00 25.31 H new ATOM 0 HD23 LEU A 37 -0.244 4.820 7.037 1.00 25.31 H new ATOM 594 N GLU A 38 -4.888 4.290 7.646 1.00 72.52 N ATOM 595 CA GLU A 38 -5.432 3.107 8.372 1.00 14.31 C ATOM 596 C GLU A 38 -6.929 2.877 8.059 1.00 34.52 C ATOM 597 O GLU A 38 -7.452 1.766 8.215 1.00 11.24 O ATOM 598 CB GLU A 38 -5.218 3.276 9.897 1.00 62.14 C ATOM 599 CG GLU A 38 -5.985 4.444 10.551 1.00 70.44 C ATOM 600 CD GLU A 38 -5.656 4.613 12.043 1.00 33.13 C ATOM 601 OE1 GLU A 38 -4.535 5.062 12.365 1.00 31.33 O ATOM 602 OE2 GLU A 38 -6.499 4.279 12.905 1.00 23.43 O ATOM 0 H GLU A 38 -4.593 5.048 8.262 1.00 72.52 H new ATOM 0 HA GLU A 38 -4.889 2.227 8.028 1.00 14.31 H new ATOM 0 HB2 GLU A 38 -5.511 2.350 10.392 1.00 62.14 H new ATOM 0 HB3 GLU A 38 -4.153 3.414 10.083 1.00 62.14 H new ATOM 0 HG2 GLU A 38 -5.747 5.368 10.025 1.00 70.44 H new ATOM 0 HG3 GLU A 38 -7.056 4.278 10.437 1.00 70.44 H new ATOM 609 N ARG A 39 -7.579 3.956 7.598 1.00 33.21 N ATOM 610 CA ARG A 39 -8.998 4.008 7.219 1.00 44.34 C ATOM 611 C ARG A 39 -9.362 3.014 6.084 1.00 74.10 C ATOM 612 O ARG A 39 -10.498 2.526 6.012 1.00 70.21 O ATOM 613 CB ARG A 39 -9.293 5.472 6.810 1.00 55.11 C ATOM 614 CG ARG A 39 -10.731 5.771 6.340 1.00 64.41 C ATOM 615 CD ARG A 39 -11.063 7.275 6.389 1.00 62.12 C ATOM 616 NE ARG A 39 -10.853 7.830 7.748 1.00 12.01 N ATOM 617 CZ ARG A 39 -11.679 8.618 8.392 1.00 41.34 C ATOM 618 NH1 ARG A 39 -12.787 9.024 7.859 1.00 63.24 N ATOM 619 NH2 ARG A 39 -11.386 8.998 9.588 1.00 44.31 N ATOM 0 H ARG A 39 -7.110 4.853 7.474 1.00 33.21 H new ATOM 0 HA ARG A 39 -9.616 3.700 8.062 1.00 44.34 H new ATOM 0 HB2 ARG A 39 -9.069 6.117 7.660 1.00 55.11 H new ATOM 0 HB3 ARG A 39 -8.606 5.749 6.010 1.00 55.11 H new ATOM 0 HG2 ARG A 39 -10.861 5.406 5.321 1.00 64.41 H new ATOM 0 HG3 ARG A 39 -11.436 5.225 6.967 1.00 64.41 H new ATOM 0 HD2 ARG A 39 -10.438 7.811 5.675 1.00 62.12 H new ATOM 0 HD3 ARG A 39 -12.098 7.431 6.086 1.00 62.12 H new ATOM 0 HE ARG A 39 -9.988 7.576 8.225 1.00 12.01 H new ATOM 0 HH11 ARG A 39 -13.036 8.731 6.914 1.00 63.24 H new ATOM 0 HH12 ARG A 39 -13.411 9.637 8.384 1.00 63.24 H new ATOM 0 HH21 ARG A 39 -10.519 8.686 10.024 1.00 44.31 H new ATOM 0 HH22 ARG A 39 -12.022 9.611 10.098 1.00 44.31 H new ATOM 633 N TRP A 40 -8.388 2.708 5.214 1.00 2.54 N ATOM 634 CA TRP A 40 -8.593 1.792 4.067 1.00 70.31 C ATOM 635 C TRP A 40 -7.523 0.681 3.996 1.00 11.54 C ATOM 636 O TRP A 40 -7.647 -0.220 3.170 1.00 51.31 O ATOM 637 CB TRP A 40 -8.605 2.601 2.747 1.00 54.41 C ATOM 638 CG TRP A 40 -7.332 3.379 2.490 1.00 15.24 C ATOM 639 CD1 TRP A 40 -7.036 4.649 2.893 1.00 14.33 C ATOM 640 CD2 TRP A 40 -6.184 2.923 1.768 1.00 22.13 C ATOM 641 NE1 TRP A 40 -5.779 4.997 2.475 1.00 13.54 N ATOM 642 CE2 TRP A 40 -5.243 3.957 1.775 1.00 55.34 C ATOM 643 CE3 TRP A 40 -5.872 1.732 1.121 1.00 44.14 C ATOM 644 CZ2 TRP A 40 -4.012 3.837 1.147 1.00 73.43 C ATOM 645 CZ3 TRP A 40 -4.658 1.607 0.500 1.00 50.14 C ATOM 646 CH2 TRP A 40 -3.744 2.654 0.518 1.00 4.23 C ATOM 0 H TRP A 40 -7.441 3.082 5.279 1.00 2.54 H new ATOM 0 HA TRP A 40 -9.555 1.300 4.213 1.00 70.31 H new ATOM 0 HB2 TRP A 40 -8.775 1.917 1.915 1.00 54.41 H new ATOM 0 HB3 TRP A 40 -9.445 3.295 2.766 1.00 54.41 H new ATOM 0 HD1 TRP A 40 -7.698 5.287 3.460 1.00 14.33 H new ATOM 0 HE1 TRP A 40 -5.319 5.889 2.658 1.00 13.54 H new ATOM 0 HE3 TRP A 40 -6.579 0.915 1.109 1.00 44.14 H new ATOM 0 HZ2 TRP A 40 -3.295 4.645 1.155 1.00 73.43 H new ATOM 0 HZ3 TRP A 40 -4.409 0.687 -0.008 1.00 50.14 H new ATOM 0 HH2 TRP A 40 -2.794 2.529 0.020 1.00 4.23 H new ATOM 657 N TRP A 41 -6.464 0.775 4.833 1.00 72.12 N ATOM 658 CA TRP A 41 -5.294 -0.135 4.750 1.00 65.43 C ATOM 659 C TRP A 41 -5.684 -1.595 5.123 1.00 53.52 C ATOM 660 O TRP A 41 -5.716 -1.972 6.299 1.00 21.23 O ATOM 661 CB TRP A 41 -4.129 0.399 5.634 1.00 14.45 C ATOM 662 CG TRP A 41 -2.786 -0.234 5.336 1.00 71.33 C ATOM 663 CD1 TRP A 41 -2.005 -0.977 6.177 1.00 32.41 C ATOM 664 CD2 TRP A 41 -2.076 -0.175 4.088 1.00 33.33 C ATOM 665 NE1 TRP A 41 -0.854 -1.359 5.534 1.00 52.24 N ATOM 666 CE2 TRP A 41 -0.883 -0.885 4.253 1.00 4.14 C ATOM 667 CE3 TRP A 41 -2.335 0.413 2.849 1.00 64.23 C ATOM 668 CZ2 TRP A 41 0.047 -1.019 3.229 1.00 4.32 C ATOM 669 CZ3 TRP A 41 -1.416 0.273 1.834 1.00 60.44 C ATOM 670 CH2 TRP A 41 -0.233 -0.435 2.027 1.00 22.24 C ATOM 0 H TRP A 41 -6.394 1.472 5.575 1.00 72.12 H new ATOM 0 HA TRP A 41 -4.947 -0.157 3.717 1.00 65.43 H new ATOM 0 HB2 TRP A 41 -4.049 1.477 5.497 1.00 14.45 H new ATOM 0 HB3 TRP A 41 -4.375 0.228 6.682 1.00 14.45 H new ATOM 0 HD1 TRP A 41 -2.257 -1.227 7.197 1.00 32.41 H new ATOM 0 HE1 TRP A 41 -0.099 -1.908 5.946 1.00 52.24 H new ATOM 0 HE3 TRP A 41 -3.246 0.971 2.689 1.00 64.23 H new ATOM 0 HZ2 TRP A 41 0.964 -1.569 3.380 1.00 4.32 H new ATOM 0 HZ3 TRP A 41 -1.616 0.720 0.871 1.00 60.44 H new ATOM 0 HH2 TRP A 41 0.473 -0.524 1.215 1.00 22.24 H new ATOM 681 N GLY A 42 -6.022 -2.380 4.085 1.00 2.22 N ATOM 682 CA GLY A 42 -6.568 -3.739 4.239 1.00 1.04 C ATOM 683 C GLY A 42 -7.944 -3.897 3.574 1.00 62.32 C ATOM 684 O GLY A 42 -8.485 -2.925 3.042 1.00 21.53 O ATOM 0 H GLY A 42 -5.924 -2.088 3.113 1.00 2.22 H new ATOM 0 HA2 GLY A 42 -5.873 -4.458 3.805 1.00 1.04 H new ATOM 0 HA3 GLY A 42 -6.651 -3.976 5.300 1.00 1.04 H new ATOM 688 N PRO A 43 -8.549 -5.122 3.579 1.00 31.43 N ATOM 689 CA PRO A 43 -9.893 -5.350 2.983 1.00 32.10 C ATOM 690 C PRO A 43 -11.043 -4.723 3.842 1.00 21.41 C ATOM 691 O PRO A 43 -10.828 -4.394 5.014 1.00 10.20 O ATOM 692 CB PRO A 43 -9.978 -6.901 2.925 1.00 10.33 C ATOM 693 CG PRO A 43 -9.126 -7.366 4.065 1.00 21.13 C ATOM 694 CD PRO A 43 -7.983 -6.368 4.160 1.00 11.33 C ATOM 0 HA PRO A 43 -10.015 -4.876 2.009 1.00 32.10 H new ATOM 0 HB2 PRO A 43 -11.006 -7.246 3.031 1.00 10.33 H new ATOM 0 HB3 PRO A 43 -9.610 -7.283 1.973 1.00 10.33 H new ATOM 0 HG2 PRO A 43 -9.697 -7.397 4.993 1.00 21.13 H new ATOM 0 HG3 PRO A 43 -8.751 -8.374 3.888 1.00 21.13 H new ATOM 0 HD2 PRO A 43 -7.666 -6.220 5.192 1.00 11.33 H new ATOM 0 HD3 PRO A 43 -7.109 -6.707 3.604 1.00 11.33 H new ATOM 702 N PRO A 44 -12.277 -4.525 3.253 1.00 12.53 N ATOM 703 CA PRO A 44 -13.479 -3.985 3.985 1.00 64.33 C ATOM 704 C PRO A 44 -13.821 -4.655 5.352 1.00 61.52 C ATOM 705 O PRO A 44 -14.526 -4.061 6.176 1.00 5.20 O ATOM 706 CB PRO A 44 -14.623 -4.203 2.960 1.00 14.12 C ATOM 707 CG PRO A 44 -13.947 -4.083 1.628 1.00 34.54 C ATOM 708 CD PRO A 44 -12.587 -4.732 1.806 1.00 15.41 C ATOM 0 HA PRO A 44 -13.302 -2.952 4.286 1.00 64.33 H new ATOM 0 HB2 PRO A 44 -15.089 -5.181 3.084 1.00 14.12 H new ATOM 0 HB3 PRO A 44 -15.410 -3.458 3.076 1.00 14.12 H new ATOM 0 HG2 PRO A 44 -14.522 -4.584 0.849 1.00 34.54 H new ATOM 0 HG3 PRO A 44 -13.848 -3.039 1.330 1.00 34.54 H new ATOM 0 HD2 PRO A 44 -12.613 -5.791 1.551 1.00 15.41 H new ATOM 0 HD3 PRO A 44 -11.836 -4.268 1.166 1.00 15.41 H new ATOM 716 N THR A 45 -13.334 -5.888 5.575 1.00 12.10 N ATOM 717 CA THR A 45 -13.568 -6.652 6.833 1.00 75.51 C ATOM 718 C THR A 45 -12.444 -6.438 7.890 1.00 32.41 C ATOM 719 O THR A 45 -12.664 -6.673 9.082 1.00 2.24 O ATOM 720 CB THR A 45 -13.719 -8.181 6.522 1.00 22.24 C ATOM 721 OG1 THR A 45 -12.583 -8.630 5.771 1.00 24.24 O ATOM 722 CG2 THR A 45 -15.005 -8.489 5.727 1.00 13.11 C ATOM 0 H THR A 45 -12.766 -6.391 4.894 1.00 12.10 H new ATOM 0 HA THR A 45 -14.493 -6.267 7.263 1.00 75.51 H new ATOM 0 HB THR A 45 -13.781 -8.706 7.475 1.00 22.24 H new ATOM 0 HG1 THR A 45 -12.676 -9.586 5.578 1.00 24.24 H new ATOM 0 HG21 THR A 45 -15.066 -9.560 5.535 1.00 13.11 H new ATOM 0 HG22 THR A 45 -15.874 -8.173 6.304 1.00 13.11 H new ATOM 0 HG23 THR A 45 -14.984 -7.951 4.779 1.00 13.11 H new ATOM 730 N TRP A 46 -11.240 -6.002 7.448 1.00 63.42 N ATOM 731 CA TRP A 46 -10.063 -5.766 8.341 1.00 34.30 C ATOM 732 C TRP A 46 -9.621 -4.268 8.326 1.00 2.33 C ATOM 733 O TRP A 46 -8.891 -3.847 7.416 1.00 64.22 O ATOM 734 CB TRP A 46 -8.861 -6.659 7.911 1.00 24.12 C ATOM 735 CG TRP A 46 -9.053 -8.145 8.132 1.00 73.12 C ATOM 736 CD1 TRP A 46 -9.950 -8.969 7.510 1.00 51.11 C ATOM 737 CD2 TRP A 46 -8.297 -8.979 9.016 1.00 25.12 C ATOM 738 NE1 TRP A 46 -9.830 -10.244 7.991 1.00 22.42 N ATOM 739 CE2 TRP A 46 -8.815 -10.280 8.906 1.00 34.22 C ATOM 740 CE3 TRP A 46 -7.240 -8.745 9.899 1.00 30.40 C ATOM 741 CZ2 TRP A 46 -8.316 -11.348 9.645 1.00 30.14 C ATOM 742 CZ3 TRP A 46 -6.737 -9.805 10.629 1.00 42.14 C ATOM 743 CH2 TRP A 46 -7.277 -11.093 10.499 1.00 35.55 C ATOM 0 H TRP A 46 -11.050 -5.802 6.466 1.00 63.42 H new ATOM 0 HA TRP A 46 -10.370 -6.028 9.353 1.00 34.30 H new ATOM 0 HB2 TRP A 46 -8.661 -6.488 6.853 1.00 24.12 H new ATOM 0 HB3 TRP A 46 -7.975 -6.337 8.459 1.00 24.12 H new ATOM 0 HD1 TRP A 46 -10.651 -8.658 6.750 1.00 51.11 H new ATOM 0 HE1 TRP A 46 -10.405 -11.039 7.712 1.00 22.42 H new ATOM 0 HE3 TRP A 46 -6.824 -7.754 10.009 1.00 30.40 H new ATOM 0 HZ2 TRP A 46 -8.732 -12.340 9.549 1.00 30.14 H new ATOM 0 HZ3 TRP A 46 -5.915 -9.639 11.310 1.00 42.14 H new ATOM 0 HH2 TRP A 46 -6.864 -11.901 11.085 1.00 35.55 H new ATOM 754 N PRO A 47 -10.089 -3.434 9.307 1.00 2.42 N ATOM 755 CA PRO A 47 -9.559 -2.056 9.507 1.00 53.33 C ATOM 756 C PRO A 47 -8.176 -2.042 10.233 1.00 42.15 C ATOM 757 O PRO A 47 -7.980 -2.721 11.254 1.00 2.11 O ATOM 758 CB PRO A 47 -10.667 -1.388 10.365 1.00 22.11 C ATOM 759 CG PRO A 47 -11.260 -2.519 11.161 1.00 52.32 C ATOM 760 CD PRO A 47 -11.207 -3.735 10.250 1.00 22.22 C ATOM 0 HA PRO A 47 -9.363 -1.539 8.567 1.00 53.33 H new ATOM 0 HB2 PRO A 47 -10.254 -0.618 11.016 1.00 22.11 H new ATOM 0 HB3 PRO A 47 -11.418 -0.907 9.739 1.00 22.11 H new ATOM 0 HG2 PRO A 47 -10.695 -2.691 12.077 1.00 52.32 H new ATOM 0 HG3 PRO A 47 -12.285 -2.295 11.456 1.00 52.32 H new ATOM 0 HD2 PRO A 47 -11.018 -4.648 10.814 1.00 22.22 H new ATOM 0 HD3 PRO A 47 -12.149 -3.877 9.720 1.00 22.22 H new ATOM 768 N ALA A 48 -7.216 -1.266 9.691 1.00 21.34 N ATOM 769 CA ALA A 48 -5.870 -1.102 10.297 1.00 3.13 C ATOM 770 C ALA A 48 -5.849 0.038 11.342 1.00 74.20 C ATOM 771 O ALA A 48 -6.817 0.798 11.473 1.00 60.24 O ATOM 772 CB ALA A 48 -4.823 -0.850 9.202 1.00 73.12 C ATOM 0 H ALA A 48 -7.345 -0.737 8.828 1.00 21.34 H new ATOM 0 HA ALA A 48 -5.623 -2.027 10.818 1.00 3.13 H new ATOM 0 HB1 ALA A 48 -3.840 -0.731 9.659 1.00 73.12 H new ATOM 0 HB2 ALA A 48 -4.804 -1.696 8.515 1.00 73.12 H new ATOM 0 HB3 ALA A 48 -5.080 0.057 8.654 1.00 73.12 H new ATOM 778 N THR A 49 -4.728 0.150 12.080 1.00 21.24 N ATOM 779 CA THR A 49 -4.518 1.213 13.091 1.00 62.41 C ATOM 780 C THR A 49 -3.013 1.537 13.214 1.00 64.31 C ATOM 781 O THR A 49 -2.245 0.707 13.709 1.00 64.42 O ATOM 782 CB THR A 49 -5.081 0.805 14.500 1.00 42.32 C ATOM 783 OG1 THR A 49 -6.456 0.386 14.393 1.00 21.05 O ATOM 784 CG2 THR A 49 -4.994 1.960 15.515 1.00 13.14 C ATOM 0 H THR A 49 -3.940 -0.492 11.995 1.00 21.24 H new ATOM 0 HA THR A 49 -5.063 2.094 12.753 1.00 62.41 H new ATOM 0 HB THR A 49 -4.463 -0.019 14.857 1.00 42.32 H new ATOM 0 HG1 THR A 49 -6.791 0.134 15.279 1.00 21.05 H new ATOM 0 HG21 THR A 49 -5.394 1.632 16.474 1.00 13.14 H new ATOM 0 HG22 THR A 49 -3.953 2.258 15.639 1.00 13.14 H new ATOM 0 HG23 THR A 49 -5.573 2.809 15.151 1.00 13.14 H new ATOM 792 N PHE A 50 -2.603 2.740 12.757 1.00 0.33 N ATOM 793 CA PHE A 50 -1.186 3.188 12.771 1.00 4.14 C ATOM 794 C PHE A 50 -0.847 3.935 14.084 1.00 71.42 C ATOM 795 O PHE A 50 -1.262 5.083 14.290 1.00 42.05 O ATOM 796 CB PHE A 50 -0.874 4.073 11.519 1.00 33.43 C ATOM 797 CG PHE A 50 -0.618 3.261 10.241 1.00 73.45 C ATOM 798 CD1 PHE A 50 -1.664 2.642 9.556 1.00 41.34 C ATOM 799 CD2 PHE A 50 0.679 3.098 9.738 1.00 21.04 C ATOM 800 CE1 PHE A 50 -1.428 1.888 8.419 1.00 74.22 C ATOM 801 CE2 PHE A 50 0.913 2.347 8.599 1.00 22.53 C ATOM 802 CZ PHE A 50 -0.140 1.742 7.939 1.00 63.01 C ATOM 0 H PHE A 50 -3.243 3.432 12.367 1.00 0.33 H new ATOM 0 HA PHE A 50 -0.552 2.303 12.725 1.00 4.14 H new ATOM 0 HB2 PHE A 50 -1.709 4.752 11.347 1.00 33.43 H new ATOM 0 HB3 PHE A 50 -0.000 4.690 11.729 1.00 33.43 H new ATOM 0 HD1 PHE A 50 -2.675 2.753 9.919 1.00 41.34 H new ATOM 0 HD2 PHE A 50 1.509 3.565 10.247 1.00 21.04 H new ATOM 0 HE1 PHE A 50 -2.252 1.413 7.906 1.00 74.22 H new ATOM 0 HE2 PHE A 50 1.920 2.234 8.225 1.00 22.53 H new ATOM 0 HZ PHE A 50 0.043 1.156 7.050 1.00 63.01 H new ATOM 812 N GLU A 51 -0.103 3.249 14.974 1.00 75.31 N ATOM 813 CA GLU A 51 0.431 3.830 16.227 1.00 30.33 C ATOM 814 C GLU A 51 1.496 4.882 15.937 1.00 31.23 C ATOM 815 O GLU A 51 1.535 5.954 16.554 1.00 11.42 O ATOM 816 CB GLU A 51 1.028 2.708 17.122 1.00 23.44 C ATOM 817 CG GLU A 51 0.029 1.597 17.501 1.00 32.11 C ATOM 818 CD GLU A 51 -1.252 2.139 18.157 1.00 14.40 C ATOM 819 OE1 GLU A 51 -1.221 2.487 19.359 1.00 33.31 O ATOM 820 OE2 GLU A 51 -2.289 2.236 17.473 1.00 74.24 O ATOM 0 H GLU A 51 0.147 2.269 14.845 1.00 75.31 H new ATOM 0 HA GLU A 51 -0.392 4.314 16.752 1.00 30.33 H new ATOM 0 HB2 GLU A 51 1.874 2.258 16.603 1.00 23.44 H new ATOM 0 HB3 GLU A 51 1.417 3.157 18.036 1.00 23.44 H new ATOM 0 HG2 GLU A 51 -0.238 1.035 16.606 1.00 32.11 H new ATOM 0 HG3 GLU A 51 0.513 0.898 18.184 1.00 32.11 H new ATOM 827 N THR A 52 2.350 4.557 14.976 1.00 73.53 N ATOM 828 CA THR A 52 3.445 5.419 14.548 1.00 42.35 C ATOM 829 C THR A 52 3.374 5.594 13.026 1.00 5.12 C ATOM 830 O THR A 52 3.017 4.647 12.316 1.00 62.11 O ATOM 831 CB THR A 52 4.820 4.802 14.962 1.00 24.20 C ATOM 832 OG1 THR A 52 4.803 4.461 16.361 1.00 31.23 O ATOM 833 CG2 THR A 52 5.971 5.773 14.701 1.00 44.23 C ATOM 0 H THR A 52 2.302 3.676 14.465 1.00 73.53 H new ATOM 0 HA THR A 52 3.353 6.391 15.032 1.00 42.35 H new ATOM 0 HB THR A 52 4.976 3.908 14.358 1.00 24.20 H new ATOM 0 HG1 THR A 52 5.667 4.073 16.614 1.00 31.23 H new ATOM 0 HG21 THR A 52 6.912 5.311 15.001 1.00 44.23 H new ATOM 0 HG22 THR A 52 6.008 6.016 13.639 1.00 44.23 H new ATOM 0 HG23 THR A 52 5.815 6.685 15.277 1.00 44.23 H new ATOM 841 N HIS A 53 3.662 6.810 12.538 1.00 61.22 N ATOM 842 CA HIS A 53 3.737 7.096 11.095 1.00 2.52 C ATOM 843 C HIS A 53 4.679 8.300 10.831 1.00 23.20 C ATOM 844 O HIS A 53 4.241 9.455 10.790 1.00 11.41 O ATOM 845 CB HIS A 53 2.305 7.330 10.534 1.00 4.15 C ATOM 846 CG HIS A 53 2.225 7.451 9.038 1.00 31.41 C ATOM 847 ND1 HIS A 53 2.415 8.655 8.415 1.00 12.01 N ATOM 848 CD2 HIS A 53 1.946 6.509 8.099 1.00 1.12 C ATOM 849 CE1 HIS A 53 2.245 8.431 7.136 1.00 54.23 C ATOM 850 NE2 HIS A 53 1.958 7.149 6.889 1.00 25.04 N ATOM 0 H HIS A 53 3.849 7.620 13.129 1.00 61.22 H new ATOM 0 HA HIS A 53 4.163 6.240 10.571 1.00 2.52 H new ATOM 0 HB2 HIS A 53 1.666 6.506 10.852 1.00 4.15 H new ATOM 0 HB3 HIS A 53 1.899 8.238 10.980 1.00 4.15 H new ATOM 0 HD2 HIS A 53 1.753 5.461 8.273 1.00 1.12 H new ATOM 0 HE1 HIS A 53 2.327 9.191 6.373 1.00 54.23 H new ATOM 0 HE2 HIS A 53 1.782 6.729 5.976 1.00 25.04 H new ATOM 858 N GLU A 54 5.992 8.010 10.714 1.00 71.51 N ATOM 859 CA GLU A 54 7.020 9.022 10.378 1.00 32.33 C ATOM 860 C GLU A 54 7.116 9.176 8.857 1.00 23.43 C ATOM 861 O GLU A 54 7.879 8.444 8.213 1.00 1.24 O ATOM 862 CB GLU A 54 8.412 8.601 10.929 1.00 13.11 C ATOM 863 CG GLU A 54 8.450 8.311 12.428 1.00 74.02 C ATOM 864 CD GLU A 54 9.817 7.785 12.894 1.00 71.32 C ATOM 865 OE1 GLU A 54 10.064 6.561 12.785 1.00 0.34 O ATOM 866 OE2 GLU A 54 10.651 8.591 13.360 1.00 23.11 O ATOM 0 H GLU A 54 6.370 7.072 10.849 1.00 71.51 H new ATOM 0 HA GLU A 54 6.728 9.968 10.834 1.00 32.33 H new ATOM 0 HB2 GLU A 54 8.745 7.712 10.393 1.00 13.11 H new ATOM 0 HB3 GLU A 54 9.128 9.393 10.709 1.00 13.11 H new ATOM 0 HG2 GLU A 54 8.209 9.222 12.977 1.00 74.02 H new ATOM 0 HG3 GLU A 54 7.681 7.579 12.672 1.00 74.02 H new ATOM 873 N PHE A 55 6.327 10.094 8.279 1.00 44.13 N ATOM 874 CA PHE A 55 6.336 10.339 6.832 1.00 63.22 C ATOM 875 C PHE A 55 7.580 11.187 6.444 1.00 74.21 C ATOM 876 O PHE A 55 7.476 12.368 6.104 1.00 44.51 O ATOM 877 CB PHE A 55 4.998 11.013 6.407 1.00 2.22 C ATOM 878 CG PHE A 55 4.685 10.864 4.923 1.00 4.53 C ATOM 879 CD1 PHE A 55 4.217 9.650 4.436 1.00 43.01 C ATOM 880 CD2 PHE A 55 4.853 11.911 4.025 1.00 42.33 C ATOM 881 CE1 PHE A 55 3.923 9.480 3.098 1.00 60.53 C ATOM 882 CE2 PHE A 55 4.559 11.743 2.688 1.00 11.44 C ATOM 883 CZ PHE A 55 4.090 10.525 2.225 1.00 12.43 C ATOM 0 H PHE A 55 5.672 10.681 8.796 1.00 44.13 H new ATOM 0 HA PHE A 55 6.412 9.395 6.293 1.00 63.22 H new ATOM 0 HB2 PHE A 55 4.183 10.581 6.987 1.00 2.22 H new ATOM 0 HB3 PHE A 55 5.039 12.073 6.656 1.00 2.22 H new ATOM 0 HD1 PHE A 55 4.081 8.823 5.117 1.00 43.01 H new ATOM 0 HD2 PHE A 55 5.217 12.865 4.377 1.00 42.33 H new ATOM 0 HE1 PHE A 55 3.563 8.527 2.740 1.00 60.53 H new ATOM 0 HE2 PHE A 55 4.695 12.564 2.000 1.00 11.44 H new ATOM 0 HZ PHE A 55 3.856 10.398 1.178 1.00 12.43 H new ATOM 893 N THR A 56 8.768 10.567 6.577 1.00 51.15 N ATOM 894 CA THR A 56 10.064 11.173 6.204 1.00 73.04 C ATOM 895 C THR A 56 10.971 10.133 5.504 1.00 43.11 C ATOM 896 O THR A 56 10.735 8.921 5.601 1.00 31.40 O ATOM 897 CB THR A 56 10.805 11.768 7.456 1.00 75.12 C ATOM 898 OG1 THR A 56 12.023 12.435 7.052 1.00 73.43 O ATOM 899 CG2 THR A 56 11.143 10.689 8.506 1.00 52.31 C ATOM 0 H THR A 56 8.858 9.622 6.950 1.00 51.15 H new ATOM 0 HA THR A 56 9.854 11.989 5.512 1.00 73.04 H new ATOM 0 HB THR A 56 10.121 12.483 7.914 1.00 75.12 H new ATOM 0 HG1 THR A 56 12.473 12.802 7.842 1.00 73.43 H new ATOM 0 HG21 THR A 56 11.654 11.151 9.351 1.00 52.31 H new ATOM 0 HG22 THR A 56 10.223 10.217 8.852 1.00 52.31 H new ATOM 0 HG23 THR A 56 11.791 9.936 8.058 1.00 52.31 H new ATOM 907 N VAL A 57 12.005 10.624 4.805 1.00 43.23 N ATOM 908 CA VAL A 57 13.013 9.778 4.122 1.00 60.24 C ATOM 909 C VAL A 57 13.840 8.960 5.159 1.00 53.52 C ATOM 910 O VAL A 57 14.655 9.515 5.907 1.00 13.12 O ATOM 911 CB VAL A 57 13.953 10.680 3.231 1.00 41.34 C ATOM 912 CG1 VAL A 57 15.111 9.878 2.591 1.00 63.34 C ATOM 913 CG2 VAL A 57 13.131 11.430 2.148 1.00 51.24 C ATOM 0 H VAL A 57 12.172 11.624 4.693 1.00 43.23 H new ATOM 0 HA VAL A 57 12.499 9.067 3.475 1.00 60.24 H new ATOM 0 HB VAL A 57 14.409 11.416 3.893 1.00 41.34 H new ATOM 0 HG11 VAL A 57 15.727 10.546 1.989 1.00 63.34 H new ATOM 0 HG12 VAL A 57 15.721 9.431 3.376 1.00 63.34 H new ATOM 0 HG13 VAL A 57 14.702 9.091 1.957 1.00 63.34 H new ATOM 0 HG21 VAL A 57 13.799 12.046 1.546 1.00 51.24 H new ATOM 0 HG22 VAL A 57 12.628 10.706 1.507 1.00 51.24 H new ATOM 0 HG23 VAL A 57 12.388 12.066 2.630 1.00 51.24 H new ATOM 923 N GLY A 58 13.582 7.640 5.214 1.00 52.31 N ATOM 924 CA GLY A 58 14.259 6.733 6.162 1.00 5.52 C ATOM 925 C GLY A 58 13.462 6.479 7.450 1.00 63.24 C ATOM 926 O GLY A 58 13.896 5.688 8.301 1.00 13.41 O ATOM 0 H GLY A 58 12.905 7.175 4.609 1.00 52.31 H new ATOM 0 HA2 GLY A 58 14.447 5.780 5.668 1.00 5.52 H new ATOM 0 HA3 GLY A 58 15.230 7.154 6.423 1.00 5.52 H new ATOM 930 N GLY A 59 12.290 7.139 7.590 1.00 63.00 N ATOM 931 CA GLY A 59 11.434 6.984 8.785 1.00 20.31 C ATOM 932 C GLY A 59 10.532 5.757 8.701 1.00 11.42 C ATOM 933 O GLY A 59 10.419 5.142 7.641 1.00 11.51 O ATOM 0 H GLY A 59 11.917 7.782 6.891 1.00 63.00 H new ATOM 0 HA2 GLY A 59 12.063 6.908 9.672 1.00 20.31 H new ATOM 0 HA3 GLY A 59 10.819 7.876 8.906 1.00 20.31 H new ATOM 937 N LYS A 60 9.887 5.381 9.822 1.00 22.21 N ATOM 938 CA LYS A 60 9.091 4.129 9.900 1.00 54.45 C ATOM 939 C LYS A 60 7.673 4.348 10.459 1.00 43.41 C ATOM 940 O LYS A 60 7.374 5.364 11.087 1.00 21.13 O ATOM 941 CB LYS A 60 9.841 3.052 10.743 1.00 64.11 C ATOM 942 CG LYS A 60 11.130 2.521 10.079 1.00 43.03 C ATOM 943 CD LYS A 60 11.734 1.306 10.818 1.00 11.34 C ATOM 944 CE LYS A 60 12.935 0.708 10.062 1.00 53.35 C ATOM 945 NZ LYS A 60 13.470 -0.510 10.714 1.00 3.23 N ATOM 0 H LYS A 60 9.898 5.921 10.687 1.00 22.21 H new ATOM 0 HA LYS A 60 8.976 3.775 8.876 1.00 54.45 H new ATOM 0 HB2 LYS A 60 10.093 3.477 11.715 1.00 64.11 H new ATOM 0 HB3 LYS A 60 9.167 2.215 10.926 1.00 64.11 H new ATOM 0 HG2 LYS A 60 10.912 2.241 9.048 1.00 43.03 H new ATOM 0 HG3 LYS A 60 11.869 3.321 10.042 1.00 43.03 H new ATOM 0 HD2 LYS A 60 12.049 1.609 11.816 1.00 11.34 H new ATOM 0 HD3 LYS A 60 10.968 0.541 10.944 1.00 11.34 H new ATOM 0 HE2 LYS A 60 12.634 0.467 9.042 1.00 53.35 H new ATOM 0 HE3 LYS A 60 13.725 1.456 9.993 1.00 53.35 H new ATOM 0 HZ1 LYS A 60 14.276 -0.872 10.165 1.00 3.23 H new ATOM 0 HZ2 LYS A 60 13.783 -0.278 11.678 1.00 3.23 H new ATOM 0 HZ3 LYS A 60 12.727 -1.236 10.757 1.00 3.23 H new ATOM 959 N ALA A 61 6.813 3.342 10.234 1.00 13.13 N ATOM 960 CA ALA A 61 5.414 3.340 10.700 1.00 11.25 C ATOM 961 C ALA A 61 5.064 1.982 11.351 1.00 1.41 C ATOM 962 O ALA A 61 5.360 0.927 10.792 1.00 24.11 O ATOM 963 CB ALA A 61 4.455 3.662 9.533 1.00 44.03 C ATOM 0 H ALA A 61 7.070 2.499 9.719 1.00 13.13 H new ATOM 0 HA ALA A 61 5.296 4.117 11.456 1.00 11.25 H new ATOM 0 HB1 ALA A 61 3.427 3.656 9.895 1.00 44.03 H new ATOM 0 HB2 ALA A 61 4.692 4.646 9.128 1.00 44.03 H new ATOM 0 HB3 ALA A 61 4.569 2.911 8.751 1.00 44.03 H new ATOM 969 N ALA A 62 4.439 2.021 12.539 1.00 63.22 N ATOM 970 CA ALA A 62 4.004 0.805 13.272 1.00 41.42 C ATOM 971 C ALA A 62 2.481 0.705 13.218 1.00 63.42 C ATOM 972 O ALA A 62 1.792 1.692 13.506 1.00 42.34 O ATOM 973 CB ALA A 62 4.478 0.840 14.737 1.00 1.41 C ATOM 0 H ALA A 62 4.218 2.891 13.024 1.00 63.22 H new ATOM 0 HA ALA A 62 4.450 -0.069 12.797 1.00 41.42 H new ATOM 0 HB1 ALA A 62 4.145 -0.063 15.249 1.00 1.41 H new ATOM 0 HB2 ALA A 62 5.566 0.893 14.766 1.00 1.41 H new ATOM 0 HB3 ALA A 62 4.059 1.715 15.234 1.00 1.41 H new ATOM 979 N TYR A 63 1.947 -0.474 12.855 1.00 15.23 N ATOM 980 CA TYR A 63 0.490 -0.677 12.787 1.00 61.11 C ATOM 981 C TYR A 63 0.081 -2.120 13.114 1.00 75.11 C ATOM 982 O TYR A 63 0.917 -3.012 13.296 1.00 0.31 O ATOM 983 CB TYR A 63 -0.074 -0.258 11.396 1.00 71.12 C ATOM 984 CG TYR A 63 0.236 -1.205 10.220 1.00 34.43 C ATOM 985 CD1 TYR A 63 1.434 -1.117 9.509 1.00 64.15 C ATOM 986 CD2 TYR A 63 -0.693 -2.172 9.807 1.00 45.40 C ATOM 987 CE1 TYR A 63 1.690 -1.950 8.436 1.00 14.05 C ATOM 988 CE2 TYR A 63 -0.432 -3.009 8.745 1.00 24.43 C ATOM 989 CZ TYR A 63 0.758 -2.893 8.059 1.00 13.43 C ATOM 990 OH TYR A 63 1.005 -3.720 6.988 1.00 10.32 O ATOM 0 H TYR A 63 2.498 -1.295 12.606 1.00 15.23 H new ATOM 0 HA TYR A 63 0.054 -0.033 13.551 1.00 61.11 H new ATOM 0 HB2 TYR A 63 -1.156 -0.161 11.481 1.00 71.12 H new ATOM 0 HB3 TYR A 63 0.317 0.730 11.152 1.00 71.12 H new ATOM 0 HD1 TYR A 63 2.173 -0.386 9.802 1.00 64.15 H new ATOM 0 HD2 TYR A 63 -1.632 -2.262 10.333 1.00 45.40 H new ATOM 0 HE1 TYR A 63 2.620 -1.862 7.893 1.00 14.05 H new ATOM 0 HE2 TYR A 63 -1.157 -3.753 8.451 1.00 24.43 H new ATOM 0 HH TYR A 63 1.522 -3.234 6.312 1.00 10.32 H new ATOM 1000 N TYR A 64 -1.239 -2.313 13.183 1.00 42.20 N ATOM 1001 CA TYR A 64 -1.876 -3.625 13.318 1.00 2.35 C ATOM 1002 C TYR A 64 -3.283 -3.583 12.691 1.00 62.35 C ATOM 1003 O TYR A 64 -3.899 -2.520 12.608 1.00 61.23 O ATOM 1004 CB TYR A 64 -1.928 -4.045 14.809 1.00 13.41 C ATOM 1005 CG TYR A 64 -2.663 -3.049 15.729 1.00 50.24 C ATOM 1006 CD1 TYR A 64 -4.045 -3.134 15.921 1.00 15.24 C ATOM 1007 CD2 TYR A 64 -1.976 -2.033 16.409 1.00 12.31 C ATOM 1008 CE1 TYR A 64 -4.710 -2.264 16.747 1.00 45.43 C ATOM 1009 CE2 TYR A 64 -2.648 -1.158 17.239 1.00 64.21 C ATOM 1010 CZ TYR A 64 -4.014 -1.279 17.408 1.00 32.42 C ATOM 1011 OH TYR A 64 -4.691 -0.419 18.246 1.00 2.01 O ATOM 0 H TYR A 64 -1.909 -1.545 13.146 1.00 42.20 H new ATOM 0 HA TYR A 64 -1.288 -4.374 12.786 1.00 2.35 H new ATOM 0 HB2 TYR A 64 -2.416 -5.017 14.883 1.00 13.41 H new ATOM 0 HB3 TYR A 64 -0.909 -4.172 15.173 1.00 13.41 H new ATOM 0 HD1 TYR A 64 -4.602 -3.903 15.407 1.00 15.24 H new ATOM 0 HD2 TYR A 64 -0.908 -1.934 16.282 1.00 12.31 H new ATOM 0 HE1 TYR A 64 -5.778 -2.352 16.878 1.00 45.43 H new ATOM 0 HE2 TYR A 64 -2.106 -0.380 17.756 1.00 64.21 H new ATOM 0 HH TYR A 64 -4.060 0.219 18.639 1.00 2.01 H new ATOM 1021 N MET A 65 -3.780 -4.744 12.258 1.00 34.40 N ATOM 1022 CA MET A 65 -5.087 -4.872 11.588 1.00 75.44 C ATOM 1023 C MET A 65 -6.044 -5.718 12.452 1.00 14.11 C ATOM 1024 O MET A 65 -5.925 -6.943 12.495 1.00 75.14 O ATOM 1025 CB MET A 65 -4.877 -5.527 10.197 1.00 23.14 C ATOM 1026 CG MET A 65 -3.955 -4.735 9.258 1.00 73.43 C ATOM 1027 SD MET A 65 -3.567 -5.623 7.735 1.00 62.21 S ATOM 1028 CE MET A 65 -5.203 -5.914 7.068 1.00 72.13 C ATOM 0 H MET A 65 -3.287 -5.631 12.361 1.00 34.40 H new ATOM 0 HA MET A 65 -5.534 -3.887 11.456 1.00 75.44 H new ATOM 0 HB2 MET A 65 -4.462 -6.525 10.337 1.00 23.14 H new ATOM 0 HB3 MET A 65 -5.847 -5.650 9.716 1.00 23.14 H new ATOM 0 HG2 MET A 65 -4.429 -3.786 9.008 1.00 73.43 H new ATOM 0 HG3 MET A 65 -3.028 -4.500 9.781 1.00 73.43 H new ATOM 0 HE1 MET A 65 -5.128 -6.138 6.004 1.00 72.13 H new ATOM 0 HE2 MET A 65 -5.662 -6.757 7.585 1.00 72.13 H new ATOM 0 HE3 MET A 65 -5.817 -5.024 7.208 1.00 72.13 H new ATOM 1038 N THR A 66 -6.971 -5.054 13.159 1.00 35.23 N ATOM 1039 CA THR A 66 -7.961 -5.741 14.019 1.00 24.31 C ATOM 1040 C THR A 66 -9.083 -6.358 13.146 1.00 22.14 C ATOM 1041 O THR A 66 -9.838 -5.640 12.490 1.00 22.14 O ATOM 1042 CB THR A 66 -8.563 -4.772 15.097 1.00 13.23 C ATOM 1043 OG1 THR A 66 -7.510 -4.300 15.965 1.00 70.32 O ATOM 1044 CG2 THR A 66 -9.655 -5.440 15.957 1.00 44.33 C ATOM 0 H THR A 66 -7.060 -4.038 13.155 1.00 35.23 H new ATOM 0 HA THR A 66 -7.448 -6.540 14.554 1.00 24.31 H new ATOM 0 HB THR A 66 -9.025 -3.945 14.558 1.00 13.23 H new ATOM 0 HG1 THR A 66 -7.887 -3.694 16.637 1.00 70.32 H new ATOM 0 HG21 THR A 66 -10.035 -4.723 16.685 1.00 44.33 H new ATOM 0 HG22 THR A 66 -10.471 -5.772 15.315 1.00 44.33 H new ATOM 0 HG23 THR A 66 -9.232 -6.298 16.480 1.00 44.33 H new ATOM 1052 N GLY A 67 -9.165 -7.701 13.153 1.00 52.31 N ATOM 1053 CA GLY A 67 -10.074 -8.450 12.273 1.00 0.13 C ATOM 1054 C GLY A 67 -11.551 -8.431 12.691 1.00 11.11 C ATOM 1055 O GLY A 67 -11.890 -7.901 13.756 1.00 11.14 O ATOM 0 H GLY A 67 -8.605 -8.293 13.766 1.00 52.31 H new ATOM 0 HA2 GLY A 67 -9.993 -8.045 11.264 1.00 0.13 H new ATOM 0 HA3 GLY A 67 -9.739 -9.486 12.228 1.00 0.13 H new ATOM 1059 N PRO A 68 -12.461 -9.044 11.862 1.00 40.42 N ATOM 1060 CA PRO A 68 -13.927 -9.097 12.150 1.00 72.04 C ATOM 1061 C PRO A 68 -14.264 -9.939 13.416 1.00 50.52 C ATOM 1062 O PRO A 68 -15.288 -9.717 14.075 1.00 54.40 O ATOM 1063 CB PRO A 68 -14.517 -9.737 10.856 1.00 23.42 C ATOM 1064 CG PRO A 68 -13.376 -10.519 10.263 1.00 52.34 C ATOM 1065 CD PRO A 68 -12.129 -9.724 10.577 1.00 23.31 C ATOM 0 HA PRO A 68 -14.341 -8.114 12.375 1.00 72.04 H new ATOM 0 HB2 PRO A 68 -15.364 -10.384 11.085 1.00 23.42 H new ATOM 0 HB3 PRO A 68 -14.876 -8.974 10.165 1.00 23.42 H new ATOM 0 HG2 PRO A 68 -13.321 -11.519 10.693 1.00 52.34 H new ATOM 0 HG3 PRO A 68 -13.502 -10.641 9.187 1.00 52.34 H new ATOM 0 HD2 PRO A 68 -11.257 -10.370 10.679 1.00 23.31 H new ATOM 0 HD3 PRO A 68 -11.903 -9.005 9.790 1.00 23.31 H new ATOM 1073 N ASP A 69 -13.382 -10.904 13.735 1.00 12.31 N ATOM 1074 CA ASP A 69 -13.494 -11.763 14.938 1.00 54.41 C ATOM 1075 C ASP A 69 -12.583 -11.255 16.090 1.00 32.42 C ATOM 1076 O ASP A 69 -12.582 -11.826 17.190 1.00 43.12 O ATOM 1077 CB ASP A 69 -13.135 -13.224 14.556 1.00 64.42 C ATOM 1078 CG ASP A 69 -11.653 -13.423 14.174 1.00 53.03 C ATOM 1079 OD1 ASP A 69 -11.113 -12.635 13.354 1.00 65.20 O ATOM 1080 OD2 ASP A 69 -11.013 -14.362 14.701 1.00 11.41 O ATOM 0 H ASP A 69 -12.564 -11.115 13.164 1.00 12.31 H new ATOM 0 HA ASP A 69 -14.521 -11.723 15.302 1.00 54.41 H new ATOM 0 HB2 ASP A 69 -13.375 -13.878 15.394 1.00 64.42 H new ATOM 0 HB3 ASP A 69 -13.761 -13.535 13.719 1.00 64.42 H new ATOM 1085 N GLY A 70 -11.807 -10.184 15.818 1.00 74.03 N ATOM 1086 CA GLY A 70 -10.873 -9.596 16.796 1.00 22.34 C ATOM 1087 C GLY A 70 -9.412 -10.036 16.624 1.00 65.15 C ATOM 1088 O GLY A 70 -8.581 -9.741 17.490 1.00 23.30 O ATOM 0 H GLY A 70 -11.812 -9.706 14.917 1.00 74.03 H new ATOM 0 HA2 GLY A 70 -10.924 -8.510 16.720 1.00 22.34 H new ATOM 0 HA3 GLY A 70 -11.203 -9.861 17.800 1.00 22.34 H new ATOM 1092 N THR A 71 -9.082 -10.745 15.515 1.00 44.55 N ATOM 1093 CA THR A 71 -7.679 -11.162 15.229 1.00 62.22 C ATOM 1094 C THR A 71 -6.806 -9.940 14.854 1.00 25.52 C ATOM 1095 O THR A 71 -6.903 -9.402 13.753 1.00 50.43 O ATOM 1096 CB THR A 71 -7.582 -12.243 14.098 1.00 1.55 C ATOM 1097 OG1 THR A 71 -8.337 -13.399 14.474 1.00 51.52 O ATOM 1098 CG2 THR A 71 -6.124 -12.674 13.809 1.00 43.13 C ATOM 0 H THR A 71 -9.757 -11.039 14.809 1.00 44.55 H new ATOM 0 HA THR A 71 -7.304 -11.613 16.148 1.00 62.22 H new ATOM 0 HB THR A 71 -7.983 -11.792 13.191 1.00 1.55 H new ATOM 0 HG1 THR A 71 -8.277 -14.073 13.766 1.00 51.52 H new ATOM 0 HG21 THR A 71 -6.116 -13.424 13.018 1.00 43.13 H new ATOM 0 HG22 THR A 71 -5.544 -11.807 13.493 1.00 43.13 H new ATOM 0 HG23 THR A 71 -5.683 -13.095 14.712 1.00 43.13 H new ATOM 1106 N LYS A 72 -5.981 -9.498 15.803 1.00 74.24 N ATOM 1107 CA LYS A 72 -5.089 -8.339 15.644 1.00 53.41 C ATOM 1108 C LYS A 72 -3.763 -8.747 14.931 1.00 54.54 C ATOM 1109 O LYS A 72 -2.904 -9.397 15.533 1.00 74.04 O ATOM 1110 CB LYS A 72 -4.835 -7.769 17.060 1.00 11.22 C ATOM 1111 CG LYS A 72 -4.106 -6.415 17.112 1.00 33.42 C ATOM 1112 CD LYS A 72 -4.032 -5.836 18.556 1.00 4.42 C ATOM 1113 CE LYS A 72 -5.336 -5.129 19.014 1.00 20.45 C ATOM 1114 NZ LYS A 72 -6.565 -5.947 18.864 1.00 71.14 N ATOM 0 H LYS A 72 -5.909 -9.939 16.720 1.00 74.24 H new ATOM 0 HA LYS A 72 -5.545 -7.578 15.011 1.00 53.41 H new ATOM 0 HB2 LYS A 72 -5.794 -7.664 17.567 1.00 11.22 H new ATOM 0 HB3 LYS A 72 -4.253 -8.496 17.626 1.00 11.22 H new ATOM 0 HG2 LYS A 72 -3.096 -6.534 16.719 1.00 33.42 H new ATOM 0 HG3 LYS A 72 -4.619 -5.704 16.464 1.00 33.42 H new ATOM 0 HD2 LYS A 72 -3.805 -6.645 19.251 1.00 4.42 H new ATOM 0 HD3 LYS A 72 -3.206 -5.127 18.611 1.00 4.42 H new ATOM 0 HE2 LYS A 72 -5.231 -4.843 20.060 1.00 20.45 H new ATOM 0 HE3 LYS A 72 -5.455 -4.209 18.442 1.00 20.45 H new ATOM 0 HZ1 LYS A 72 -7.341 -5.509 19.400 1.00 71.14 H new ATOM 0 HZ2 LYS A 72 -6.826 -6.001 17.859 1.00 71.14 H new ATOM 0 HZ3 LYS A 72 -6.391 -6.906 19.228 1.00 71.14 H new ATOM 1128 N ALA A 73 -3.626 -8.366 13.644 1.00 54.33 N ATOM 1129 CA ALA A 73 -2.482 -8.763 12.781 1.00 65.24 C ATOM 1130 C ALA A 73 -1.425 -7.632 12.703 1.00 31.45 C ATOM 1131 O ALA A 73 -1.623 -6.632 12.010 1.00 12.21 O ATOM 1132 CB ALA A 73 -3.002 -9.136 11.378 1.00 13.31 C ATOM 0 H ALA A 73 -4.305 -7.772 13.168 1.00 54.33 H new ATOM 0 HA ALA A 73 -1.993 -9.633 13.219 1.00 65.24 H new ATOM 0 HB1 ALA A 73 -2.164 -9.427 10.745 1.00 13.31 H new ATOM 0 HB2 ALA A 73 -3.702 -9.968 11.459 1.00 13.31 H new ATOM 0 HB3 ALA A 73 -3.508 -8.277 10.937 1.00 13.31 H new ATOM 1138 N ARG A 74 -0.304 -7.808 13.425 1.00 75.25 N ATOM 1139 CA ARG A 74 0.757 -6.774 13.554 1.00 34.41 C ATOM 1140 C ARG A 74 1.609 -6.678 12.249 1.00 71.43 C ATOM 1141 O ARG A 74 2.108 -7.688 11.750 1.00 53.30 O ATOM 1142 CB ARG A 74 1.643 -7.106 14.806 1.00 42.43 C ATOM 1143 CG ARG A 74 2.329 -5.901 15.514 1.00 71.35 C ATOM 1144 CD ARG A 74 3.458 -5.230 14.707 1.00 32.44 C ATOM 1145 NE ARG A 74 4.177 -4.212 15.493 1.00 72.34 N ATOM 1146 CZ ARG A 74 5.007 -3.312 15.003 1.00 64.12 C ATOM 1147 NH1 ARG A 74 5.157 -3.148 13.724 1.00 14.01 N ATOM 1148 NH2 ARG A 74 5.671 -2.557 15.813 1.00 53.43 N ATOM 0 H ARG A 74 -0.101 -8.666 13.937 1.00 75.25 H new ATOM 0 HA ARG A 74 0.298 -5.796 13.698 1.00 34.41 H new ATOM 0 HB2 ARG A 74 1.020 -7.621 15.537 1.00 42.43 H new ATOM 0 HB3 ARG A 74 2.419 -7.807 14.498 1.00 42.43 H new ATOM 0 HG2 ARG A 74 1.570 -5.152 15.741 1.00 71.35 H new ATOM 0 HG3 ARG A 74 2.736 -6.242 16.466 1.00 71.35 H new ATOM 0 HD2 ARG A 74 4.163 -5.990 14.370 1.00 32.44 H new ATOM 0 HD3 ARG A 74 3.038 -4.767 13.814 1.00 32.44 H new ATOM 0 HE ARG A 74 4.020 -4.203 16.501 1.00 72.34 H new ATOM 0 HH11 ARG A 74 4.626 -3.723 13.070 1.00 14.01 H new ATOM 0 HH12 ARG A 74 5.806 -2.444 13.373 1.00 14.01 H new ATOM 0 HH21 ARG A 74 5.551 -2.660 16.821 1.00 53.43 H new ATOM 0 HH22 ARG A 74 6.316 -1.857 15.445 1.00 53.43 H new ATOM 1162 N GLY A 75 1.772 -5.447 11.724 1.00 74.34 N ATOM 1163 CA GLY A 75 2.613 -5.182 10.536 1.00 53.54 C ATOM 1164 C GLY A 75 3.503 -3.944 10.714 1.00 13.44 C ATOM 1165 O GLY A 75 3.281 -3.137 11.625 1.00 32.30 O ATOM 0 H GLY A 75 1.328 -4.613 12.107 1.00 74.34 H new ATOM 0 HA2 GLY A 75 3.240 -6.051 10.337 1.00 53.54 H new ATOM 0 HA3 GLY A 75 1.973 -5.044 9.665 1.00 53.54 H new ATOM 1169 N TRP A 76 4.513 -3.791 9.841 1.00 75.41 N ATOM 1170 CA TRP A 76 5.488 -2.668 9.890 1.00 35.23 C ATOM 1171 C TRP A 76 5.659 -1.994 8.497 1.00 14.42 C ATOM 1172 O TRP A 76 5.396 -2.609 7.457 1.00 12.02 O ATOM 1173 CB TRP A 76 6.865 -3.194 10.400 1.00 61.34 C ATOM 1174 CG TRP A 76 7.466 -4.272 9.513 1.00 43.40 C ATOM 1175 CD1 TRP A 76 7.262 -5.623 9.599 1.00 23.52 C ATOM 1176 CD2 TRP A 76 8.349 -4.078 8.393 1.00 50.04 C ATOM 1177 NE1 TRP A 76 7.929 -6.265 8.591 1.00 64.21 N ATOM 1178 CE2 TRP A 76 8.609 -5.339 7.845 1.00 73.42 C ATOM 1179 CE3 TRP A 76 8.935 -2.951 7.799 1.00 3.23 C ATOM 1180 CZ2 TRP A 76 9.427 -5.515 6.733 1.00 24.34 C ATOM 1181 CZ3 TRP A 76 9.749 -3.123 6.700 1.00 51.02 C ATOM 1182 CH2 TRP A 76 9.983 -4.397 6.172 1.00 11.42 C ATOM 0 H TRP A 76 4.684 -4.442 9.074 1.00 75.41 H new ATOM 0 HA TRP A 76 5.102 -1.915 10.577 1.00 35.23 H new ATOM 0 HB2 TRP A 76 7.562 -2.359 10.467 1.00 61.34 H new ATOM 0 HB3 TRP A 76 6.743 -3.590 11.408 1.00 61.34 H new ATOM 0 HD1 TRP A 76 6.662 -6.111 10.353 1.00 23.52 H new ATOM 0 HE1 TRP A 76 7.921 -7.271 8.422 1.00 64.21 H new ATOM 0 HE3 TRP A 76 8.751 -1.964 8.196 1.00 3.23 H new ATOM 0 HZ2 TRP A 76 9.616 -6.498 6.327 1.00 24.34 H new ATOM 0 HZ3 TRP A 76 10.212 -2.263 6.240 1.00 51.02 H new ATOM 0 HH2 TRP A 76 10.616 -4.501 5.303 1.00 11.42 H new ATOM 1193 N TRP A 77 6.107 -0.722 8.510 1.00 11.15 N ATOM 1194 CA TRP A 77 6.528 0.054 7.302 1.00 23.11 C ATOM 1195 C TRP A 77 7.958 0.645 7.467 1.00 34.12 C ATOM 1196 O TRP A 77 8.451 0.806 8.585 1.00 2.44 O ATOM 1197 CB TRP A 77 5.548 1.238 7.045 1.00 63.24 C ATOM 1198 CG TRP A 77 4.306 0.940 6.240 1.00 2.01 C ATOM 1199 CD1 TRP A 77 3.614 -0.229 6.141 1.00 61.51 C ATOM 1200 CD2 TRP A 77 3.611 1.880 5.424 1.00 30.15 C ATOM 1201 NE1 TRP A 77 2.539 -0.071 5.309 1.00 43.41 N ATOM 1202 CE2 TRP A 77 2.519 1.222 4.852 1.00 62.24 C ATOM 1203 CE3 TRP A 77 3.825 3.218 5.117 1.00 35.34 C ATOM 1204 CZ2 TRP A 77 1.633 1.873 4.000 1.00 44.34 C ATOM 1205 CZ3 TRP A 77 2.953 3.860 4.268 1.00 43.20 C ATOM 1206 CH2 TRP A 77 1.873 3.184 3.714 1.00 24.33 C ATOM 0 H TRP A 77 6.192 -0.185 9.373 1.00 11.15 H new ATOM 0 HA TRP A 77 6.518 -0.642 6.463 1.00 23.11 H new ATOM 0 HB2 TRP A 77 5.238 1.636 8.011 1.00 63.24 H new ATOM 0 HB3 TRP A 77 6.099 2.029 6.536 1.00 63.24 H new ATOM 0 HD1 TRP A 77 3.876 -1.147 6.646 1.00 61.51 H new ATOM 0 HE1 TRP A 77 1.863 -0.796 5.068 1.00 43.41 H new ATOM 0 HE3 TRP A 77 4.666 3.748 5.540 1.00 35.34 H new ATOM 0 HZ2 TRP A 77 0.783 1.357 3.579 1.00 44.34 H new ATOM 0 HZ3 TRP A 77 3.110 4.902 4.029 1.00 43.20 H new ATOM 0 HH2 TRP A 77 1.209 3.708 3.042 1.00 24.33 H new ATOM 1217 N GLN A 78 8.590 0.988 6.327 1.00 45.31 N ATOM 1218 CA GLN A 78 9.792 1.858 6.280 1.00 15.23 C ATOM 1219 C GLN A 78 9.799 2.693 4.978 1.00 41.41 C ATOM 1220 O GLN A 78 9.926 2.140 3.893 1.00 73.31 O ATOM 1221 CB GLN A 78 11.114 1.041 6.379 1.00 25.01 C ATOM 1222 CG GLN A 78 12.387 1.928 6.335 1.00 4.23 C ATOM 1223 CD GLN A 78 13.702 1.162 6.465 1.00 62.13 C ATOM 1224 OE1 GLN A 78 13.816 0.010 6.065 1.00 42.32 O ATOM 1225 NE2 GLN A 78 14.708 1.796 7.041 1.00 74.31 N ATOM 0 H GLN A 78 8.284 0.671 5.407 1.00 45.31 H new ATOM 0 HA GLN A 78 9.741 2.519 7.145 1.00 15.23 H new ATOM 0 HB2 GLN A 78 11.111 0.468 7.306 1.00 25.01 H new ATOM 0 HB3 GLN A 78 11.151 0.322 5.560 1.00 25.01 H new ATOM 0 HG2 GLN A 78 12.396 2.481 5.396 1.00 4.23 H new ATOM 0 HG3 GLN A 78 12.329 2.663 7.138 1.00 4.23 H new ATOM 0 HE21 GLN A 78 14.587 2.755 7.366 1.00 74.31 H new ATOM 0 HE22 GLN A 78 15.605 1.326 7.161 1.00 74.31 H new ATOM 1234 N PHE A 79 9.674 4.021 5.107 1.00 52.50 N ATOM 1235 CA PHE A 79 9.704 4.959 3.961 1.00 41.34 C ATOM 1236 C PHE A 79 11.150 5.152 3.447 1.00 74.41 C ATOM 1237 O PHE A 79 12.071 5.343 4.242 1.00 73.51 O ATOM 1238 CB PHE A 79 9.120 6.328 4.375 1.00 72.34 C ATOM 1239 CG PHE A 79 7.709 6.275 4.954 1.00 63.31 C ATOM 1240 CD1 PHE A 79 7.502 6.050 6.318 1.00 55.04 C ATOM 1241 CD2 PHE A 79 6.593 6.469 4.148 1.00 55.01 C ATOM 1242 CE1 PHE A 79 6.232 6.032 6.852 1.00 44.13 C ATOM 1243 CE2 PHE A 79 5.324 6.444 4.683 1.00 35.51 C ATOM 1244 CZ PHE A 79 5.144 6.230 6.035 1.00 4.21 C ATOM 0 H PHE A 79 9.549 4.482 6.008 1.00 52.50 H new ATOM 0 HA PHE A 79 9.099 4.533 3.161 1.00 41.34 H new ATOM 0 HB2 PHE A 79 9.783 6.782 5.112 1.00 72.34 H new ATOM 0 HB3 PHE A 79 9.115 6.983 3.504 1.00 72.34 H new ATOM 0 HD1 PHE A 79 8.352 5.888 6.964 1.00 55.04 H new ATOM 0 HD2 PHE A 79 6.723 6.641 3.090 1.00 55.01 H new ATOM 0 HE1 PHE A 79 6.092 5.863 7.909 1.00 44.13 H new ATOM 0 HE2 PHE A 79 4.467 6.592 4.043 1.00 35.51 H new ATOM 0 HZ PHE A 79 4.148 6.218 6.451 1.00 4.21 H new ATOM 1254 N THR A 80 11.343 5.101 2.118 1.00 54.53 N ATOM 1255 CA THR A 80 12.663 5.339 1.480 1.00 43.35 C ATOM 1256 C THR A 80 12.677 6.689 0.720 1.00 64.24 C ATOM 1257 O THR A 80 13.368 7.625 1.125 1.00 61.52 O ATOM 1258 CB THR A 80 13.052 4.170 0.507 1.00 14.51 C ATOM 1259 OG1 THR A 80 12.088 4.059 -0.552 1.00 62.23 O ATOM 1260 CG2 THR A 80 13.145 2.819 1.233 1.00 2.15 C ATOM 0 H THR A 80 10.597 4.895 1.453 1.00 54.53 H new ATOM 0 HA THR A 80 13.404 5.378 2.278 1.00 43.35 H new ATOM 0 HB THR A 80 14.034 4.412 0.101 1.00 14.51 H new ATOM 0 HG1 THR A 80 12.527 3.718 -1.359 1.00 62.23 H new ATOM 0 HG21 THR A 80 13.417 2.041 0.520 1.00 2.15 H new ATOM 0 HG22 THR A 80 13.904 2.877 2.013 1.00 2.15 H new ATOM 0 HG23 THR A 80 12.181 2.580 1.681 1.00 2.15 H new ATOM 1268 N THR A 81 11.889 6.789 -0.367 1.00 34.50 N ATOM 1269 CA THR A 81 11.868 7.981 -1.254 1.00 64.25 C ATOM 1270 C THR A 81 10.533 8.747 -1.130 1.00 30.54 C ATOM 1271 O THR A 81 9.499 8.289 -1.613 1.00 50.12 O ATOM 1272 CB THR A 81 12.097 7.590 -2.759 1.00 52.53 C ATOM 1273 OG1 THR A 81 13.321 6.855 -2.908 1.00 63.42 O ATOM 1274 CG2 THR A 81 12.130 8.820 -3.688 1.00 41.45 C ATOM 0 H THR A 81 11.248 6.051 -0.660 1.00 34.50 H new ATOM 0 HA THR A 81 12.685 8.625 -0.929 1.00 64.25 H new ATOM 0 HB THR A 81 11.250 6.969 -3.051 1.00 52.53 H new ATOM 0 HG1 THR A 81 13.240 6.234 -3.662 1.00 63.42 H new ATOM 0 HG21 THR A 81 12.291 8.495 -4.716 1.00 41.45 H new ATOM 0 HG22 THR A 81 11.182 9.353 -3.620 1.00 41.45 H new ATOM 0 HG23 THR A 81 12.941 9.483 -3.386 1.00 41.45 H new ATOM 1282 N ILE A 82 10.569 9.914 -0.473 1.00 53.10 N ATOM 1283 CA ILE A 82 9.415 10.835 -0.382 1.00 14.14 C ATOM 1284 C ILE A 82 9.788 12.182 -1.029 1.00 3.43 C ATOM 1285 O ILE A 82 10.634 12.916 -0.510 1.00 63.42 O ATOM 1286 CB ILE A 82 8.960 11.061 1.108 1.00 43.45 C ATOM 1287 CG1 ILE A 82 8.596 9.694 1.775 1.00 52.52 C ATOM 1288 CG2 ILE A 82 7.777 12.066 1.186 1.00 25.11 C ATOM 1289 CD1 ILE A 82 8.064 9.788 3.190 1.00 51.22 C ATOM 0 H ILE A 82 11.399 10.252 0.014 1.00 53.10 H new ATOM 0 HA ILE A 82 8.577 10.383 -0.913 1.00 14.14 H new ATOM 0 HB ILE A 82 9.791 11.498 1.662 1.00 43.45 H new ATOM 0 HG12 ILE A 82 7.851 9.193 1.156 1.00 52.52 H new ATOM 0 HG13 ILE A 82 9.484 9.062 1.779 1.00 52.52 H new ATOM 0 HG21 ILE A 82 7.484 12.203 2.227 1.00 25.11 H new ATOM 0 HG22 ILE A 82 8.085 13.024 0.767 1.00 25.11 H new ATOM 0 HG23 ILE A 82 6.931 11.677 0.619 1.00 25.11 H new ATOM 0 HD11 ILE A 82 7.842 8.788 3.562 1.00 51.22 H new ATOM 0 HD12 ILE A 82 8.812 10.255 3.830 1.00 51.22 H new ATOM 0 HD13 ILE A 82 7.154 10.388 3.198 1.00 51.22 H new ATOM 1301 N GLU A 83 9.171 12.491 -2.182 1.00 25.25 N ATOM 1302 CA GLU A 83 9.426 13.754 -2.918 1.00 33.33 C ATOM 1303 C GLU A 83 8.212 14.711 -2.853 1.00 54.25 C ATOM 1304 O GLU A 83 8.393 15.924 -2.679 1.00 22.22 O ATOM 1305 CB GLU A 83 9.817 13.447 -4.384 1.00 33.25 C ATOM 1306 CG GLU A 83 11.081 12.570 -4.521 1.00 60.30 C ATOM 1307 CD GLU A 83 11.590 12.415 -5.969 1.00 74.25 C ATOM 1308 OE1 GLU A 83 10.762 12.296 -6.898 1.00 42.35 O ATOM 1309 OE2 GLU A 83 12.823 12.403 -6.186 1.00 5.33 O ATOM 0 H GLU A 83 8.487 11.883 -2.632 1.00 25.25 H new ATOM 0 HA GLU A 83 10.259 14.264 -2.434 1.00 33.33 H new ATOM 0 HB2 GLU A 83 8.983 12.946 -4.875 1.00 33.25 H new ATOM 0 HB3 GLU A 83 9.979 14.387 -4.911 1.00 33.25 H new ATOM 0 HG2 GLU A 83 11.876 13.001 -3.913 1.00 60.30 H new ATOM 0 HG3 GLU A 83 10.869 11.581 -4.115 1.00 60.30 H new ATOM 1316 N ALA A 84 6.989 14.147 -3.009 1.00 41.01 N ATOM 1317 CA ALA A 84 5.693 14.888 -2.931 1.00 44.01 C ATOM 1318 C ALA A 84 5.492 15.921 -4.090 1.00 13.43 C ATOM 1319 O ALA A 84 6.441 16.576 -4.517 1.00 1.41 O ATOM 1320 CB ALA A 84 5.502 15.545 -1.540 1.00 10.21 C ATOM 0 H ALA A 84 6.867 13.152 -3.195 1.00 41.01 H new ATOM 0 HA ALA A 84 4.911 14.141 -3.064 1.00 44.01 H new ATOM 0 HB1 ALA A 84 4.550 16.076 -1.516 1.00 10.21 H new ATOM 0 HB2 ALA A 84 5.507 14.774 -0.770 1.00 10.21 H new ATOM 0 HB3 ALA A 84 6.314 16.248 -1.355 1.00 10.21 H new ATOM 1326 N PRO A 85 4.236 16.103 -4.626 1.00 64.12 N ATOM 1327 CA PRO A 85 2.995 15.430 -4.162 1.00 51.52 C ATOM 1328 C PRO A 85 2.670 14.127 -4.934 1.00 52.21 C ATOM 1329 O PRO A 85 1.557 13.624 -4.845 1.00 71.11 O ATOM 1330 CB PRO A 85 1.949 16.523 -4.453 1.00 13.41 C ATOM 1331 CG PRO A 85 2.414 17.144 -5.747 1.00 31.42 C ATOM 1332 CD PRO A 85 3.938 17.011 -5.771 1.00 64.35 C ATOM 0 HA PRO A 85 3.051 15.097 -3.126 1.00 51.52 H new ATOM 0 HB2 PRO A 85 0.949 16.101 -4.550 1.00 13.41 H new ATOM 0 HB3 PRO A 85 1.908 17.259 -3.650 1.00 13.41 H new ATOM 0 HG2 PRO A 85 1.967 16.638 -6.603 1.00 31.42 H new ATOM 0 HG3 PRO A 85 2.115 18.191 -5.804 1.00 31.42 H new ATOM 0 HD2 PRO A 85 4.288 16.592 -6.715 1.00 64.35 H new ATOM 0 HD3 PRO A 85 4.426 17.978 -5.651 1.00 64.35 H new ATOM 1340 N ASP A 86 3.652 13.593 -5.676 1.00 41.32 N ATOM 1341 CA ASP A 86 3.433 12.479 -6.617 1.00 1.23 C ATOM 1342 C ASP A 86 4.245 11.204 -6.244 1.00 60.00 C ATOM 1343 O ASP A 86 3.672 10.124 -6.110 1.00 13.51 O ATOM 1344 CB ASP A 86 3.754 12.975 -8.055 1.00 3.34 C ATOM 1345 CG ASP A 86 5.227 13.384 -8.263 1.00 34.45 C ATOM 1346 OD1 ASP A 86 5.697 14.323 -7.578 1.00 74.23 O ATOM 1347 OD2 ASP A 86 5.934 12.743 -9.076 1.00 44.10 O ATOM 0 H ASP A 86 4.618 13.919 -5.642 1.00 41.32 H new ATOM 0 HA ASP A 86 2.388 12.174 -6.561 1.00 1.23 H new ATOM 0 HB2 ASP A 86 3.503 12.187 -8.765 1.00 3.34 H new ATOM 0 HB3 ASP A 86 3.115 13.827 -8.286 1.00 3.34 H new ATOM 1352 N HIS A 87 5.578 11.335 -6.059 1.00 24.15 N ATOM 1353 CA HIS A 87 6.481 10.169 -5.878 1.00 14.31 C ATOM 1354 C HIS A 87 6.622 9.763 -4.381 1.00 21.44 C ATOM 1355 O HIS A 87 7.105 10.539 -3.545 1.00 53.33 O ATOM 1356 CB HIS A 87 7.869 10.468 -6.515 1.00 63.41 C ATOM 1357 CG HIS A 87 8.846 9.298 -6.579 1.00 11.04 C ATOM 1358 ND1 HIS A 87 10.130 9.433 -7.060 1.00 63.03 N ATOM 1359 CD2 HIS A 87 8.729 7.984 -6.240 1.00 74.32 C ATOM 1360 CE1 HIS A 87 10.754 8.278 -7.008 1.00 14.53 C ATOM 1361 NE2 HIS A 87 9.928 7.385 -6.519 1.00 14.35 N ATOM 0 H HIS A 87 6.055 12.236 -6.031 1.00 24.15 H new ATOM 0 HA HIS A 87 6.035 9.316 -6.390 1.00 14.31 H new ATOM 0 HB2 HIS A 87 7.709 10.837 -7.528 1.00 63.41 H new ATOM 0 HB3 HIS A 87 8.338 11.275 -5.952 1.00 63.41 H new ATOM 0 HD1 HIS A 87 10.537 10.302 -7.406 1.00 63.03 H new ATOM 0 HD2 HIS A 87 7.854 7.504 -5.828 1.00 74.32 H new ATOM 0 HE1 HIS A 87 11.773 8.095 -7.315 1.00 14.53 H new ATOM 0 HE2 HIS A 87 10.145 6.399 -6.370 1.00 14.35 H new ATOM 1370 N LEU A 88 6.215 8.516 -4.094 1.00 23.54 N ATOM 1371 CA LEU A 88 6.364 7.852 -2.784 1.00 12.42 C ATOM 1372 C LEU A 88 6.961 6.441 -2.995 1.00 5.43 C ATOM 1373 O LEU A 88 6.618 5.758 -3.960 1.00 22.22 O ATOM 1374 CB LEU A 88 4.987 7.739 -2.072 1.00 43.24 C ATOM 1375 CG LEU A 88 4.954 6.966 -0.710 1.00 35.32 C ATOM 1376 CD1 LEU A 88 5.892 7.605 0.337 1.00 41.04 C ATOM 1377 CD2 LEU A 88 3.515 6.852 -0.168 1.00 34.21 C ATOM 0 H LEU A 88 5.759 7.922 -4.787 1.00 23.54 H new ATOM 0 HA LEU A 88 7.030 8.445 -2.157 1.00 12.42 H new ATOM 0 HB2 LEU A 88 4.611 8.747 -1.899 1.00 43.24 H new ATOM 0 HB3 LEU A 88 4.291 7.252 -2.755 1.00 43.24 H new ATOM 0 HG LEU A 88 5.322 5.959 -0.903 1.00 35.32 H new ATOM 0 HD11 LEU A 88 5.839 7.039 1.267 1.00 41.04 H new ATOM 0 HD12 LEU A 88 6.916 7.594 -0.037 1.00 41.04 H new ATOM 0 HD13 LEU A 88 5.584 8.634 0.521 1.00 41.04 H new ATOM 0 HD21 LEU A 88 3.524 6.311 0.778 1.00 34.21 H new ATOM 0 HD22 LEU A 88 3.105 7.850 -0.011 1.00 34.21 H new ATOM 0 HD23 LEU A 88 2.897 6.315 -0.887 1.00 34.21 H new ATOM 1389 N GLU A 89 7.885 6.046 -2.110 1.00 75.33 N ATOM 1390 CA GLU A 89 8.409 4.667 -2.019 1.00 75.01 C ATOM 1391 C GLU A 89 8.516 4.264 -0.537 1.00 22.53 C ATOM 1392 O GLU A 89 8.942 5.070 0.300 1.00 3.21 O ATOM 1393 CB GLU A 89 9.803 4.530 -2.701 1.00 31.35 C ATOM 1394 CG GLU A 89 9.802 4.670 -4.228 1.00 33.12 C ATOM 1395 CD GLU A 89 11.179 4.441 -4.879 1.00 14.01 C ATOM 1396 OE1 GLU A 89 11.630 3.277 -4.954 1.00 72.43 O ATOM 1397 OE2 GLU A 89 11.820 5.422 -5.310 1.00 74.24 O ATOM 0 H GLU A 89 8.298 6.679 -1.426 1.00 75.33 H new ATOM 0 HA GLU A 89 7.719 4.007 -2.544 1.00 75.01 H new ATOM 0 HB2 GLU A 89 10.469 5.285 -2.284 1.00 31.35 H new ATOM 0 HB3 GLU A 89 10.222 3.558 -2.442 1.00 31.35 H new ATOM 0 HG2 GLU A 89 9.091 3.959 -4.647 1.00 33.12 H new ATOM 0 HG3 GLU A 89 9.449 5.667 -4.491 1.00 33.12 H new ATOM 1404 N PHE A 90 8.134 3.016 -0.231 1.00 34.35 N ATOM 1405 CA PHE A 90 8.227 2.454 1.132 1.00 4.13 C ATOM 1406 C PHE A 90 8.352 0.918 1.082 1.00 34.14 C ATOM 1407 O PHE A 90 8.248 0.312 0.017 1.00 73.40 O ATOM 1408 CB PHE A 90 7.006 2.881 2.011 1.00 43.41 C ATOM 1409 CG PHE A 90 5.638 2.394 1.517 1.00 11.41 C ATOM 1410 CD1 PHE A 90 5.124 1.152 1.911 1.00 51.14 C ATOM 1411 CD2 PHE A 90 4.863 3.183 0.670 1.00 32.43 C ATOM 1412 CE1 PHE A 90 3.890 0.722 1.469 1.00 71.34 C ATOM 1413 CE2 PHE A 90 3.629 2.750 0.231 1.00 64.34 C ATOM 1414 CZ PHE A 90 3.141 1.521 0.630 1.00 34.33 C ATOM 0 H PHE A 90 7.752 2.365 -0.917 1.00 34.35 H new ATOM 0 HA PHE A 90 9.127 2.858 1.596 1.00 4.13 H new ATOM 0 HB2 PHE A 90 7.161 2.509 3.024 1.00 43.41 H new ATOM 0 HB3 PHE A 90 6.986 3.969 2.071 1.00 43.41 H new ATOM 0 HD1 PHE A 90 5.702 0.522 2.570 1.00 51.14 H new ATOM 0 HD2 PHE A 90 5.233 4.147 0.353 1.00 32.43 H new ATOM 0 HE1 PHE A 90 3.510 -0.240 1.780 1.00 71.34 H new ATOM 0 HE2 PHE A 90 3.042 3.374 -0.427 1.00 64.34 H new ATOM 0 HZ PHE A 90 2.174 1.186 0.285 1.00 34.33 H new ATOM 1424 N ASP A 91 8.557 0.308 2.254 1.00 40.11 N ATOM 1425 CA ASP A 91 8.646 -1.149 2.421 1.00 20.15 C ATOM 1426 C ASP A 91 7.549 -1.619 3.384 1.00 21.23 C ATOM 1427 O ASP A 91 7.654 -1.410 4.597 1.00 51.10 O ATOM 1428 CB ASP A 91 10.036 -1.546 2.965 1.00 61.13 C ATOM 1429 CG ASP A 91 11.148 -1.222 1.965 1.00 14.22 C ATOM 1430 OD1 ASP A 91 11.586 -0.056 1.906 1.00 53.44 O ATOM 1431 OD2 ASP A 91 11.568 -2.116 1.197 1.00 54.14 O ATOM 0 H ASP A 91 8.668 0.820 3.129 1.00 40.11 H new ATOM 0 HA ASP A 91 8.507 -1.628 1.452 1.00 20.15 H new ATOM 0 HB2 ASP A 91 10.224 -1.021 3.901 1.00 61.13 H new ATOM 0 HB3 ASP A 91 10.048 -2.612 3.190 1.00 61.13 H new ATOM 1436 N ASP A 92 6.480 -2.200 2.833 1.00 34.42 N ATOM 1437 CA ASP A 92 5.434 -2.859 3.630 1.00 22.33 C ATOM 1438 C ASP A 92 5.889 -4.292 4.006 1.00 73.14 C ATOM 1439 O ASP A 92 6.702 -4.908 3.295 1.00 12.30 O ATOM 1440 CB ASP A 92 4.104 -2.885 2.831 1.00 72.25 C ATOM 1441 CG ASP A 92 2.938 -3.545 3.598 1.00 72.22 C ATOM 1442 OD1 ASP A 92 2.457 -2.956 4.595 1.00 10.14 O ATOM 1443 OD2 ASP A 92 2.513 -4.657 3.219 1.00 44.22 O ATOM 0 H ASP A 92 6.313 -2.229 1.827 1.00 34.42 H new ATOM 0 HA ASP A 92 5.267 -2.301 4.551 1.00 22.33 H new ATOM 0 HB2 ASP A 92 3.826 -1.864 2.571 1.00 72.25 H new ATOM 0 HB3 ASP A 92 4.262 -3.421 1.895 1.00 72.25 H new ATOM 1448 N GLY A 93 5.374 -4.803 5.128 1.00 62.22 N ATOM 1449 CA GLY A 93 5.681 -6.163 5.567 1.00 11.21 C ATOM 1450 C GLY A 93 4.922 -6.567 6.823 1.00 34.43 C ATOM 1451 O GLY A 93 4.407 -5.718 7.558 1.00 74.13 O ATOM 0 H GLY A 93 4.743 -4.294 5.747 1.00 62.22 H new ATOM 0 HA2 GLY A 93 5.442 -6.861 4.764 1.00 11.21 H new ATOM 0 HA3 GLY A 93 6.752 -6.246 5.753 1.00 11.21 H new ATOM 1455 N PHE A 94 4.873 -7.881 7.078 1.00 72.22 N ATOM 1456 CA PHE A 94 4.236 -8.448 8.285 1.00 43.00 C ATOM 1457 C PHE A 94 5.278 -8.619 9.401 1.00 72.43 C ATOM 1458 O PHE A 94 6.457 -8.870 9.130 1.00 71.15 O ATOM 1459 CB PHE A 94 3.580 -9.810 7.960 1.00 34.51 C ATOM 1460 CG PHE A 94 2.423 -9.717 6.967 1.00 3.04 C ATOM 1461 CD1 PHE A 94 1.124 -9.446 7.406 1.00 23.22 C ATOM 1462 CD2 PHE A 94 2.630 -9.903 5.602 1.00 71.21 C ATOM 1463 CE1 PHE A 94 0.075 -9.364 6.509 1.00 31.34 C ATOM 1464 CE2 PHE A 94 1.579 -9.825 4.708 1.00 52.33 C ATOM 1465 CZ PHE A 94 0.302 -9.557 5.160 1.00 73.32 C ATOM 0 H PHE A 94 5.272 -8.585 6.457 1.00 72.22 H new ATOM 0 HA PHE A 94 3.462 -7.760 8.625 1.00 43.00 H new ATOM 0 HB2 PHE A 94 4.339 -10.481 7.557 1.00 34.51 H new ATOM 0 HB3 PHE A 94 3.217 -10.258 8.885 1.00 34.51 H new ATOM 0 HD1 PHE A 94 0.937 -9.299 8.459 1.00 23.22 H new ATOM 0 HD2 PHE A 94 3.625 -10.111 5.238 1.00 71.21 H new ATOM 0 HE1 PHE A 94 -0.922 -9.149 6.863 1.00 31.34 H new ATOM 0 HE2 PHE A 94 1.757 -9.974 3.653 1.00 52.33 H new ATOM 0 HZ PHE A 94 -0.518 -9.498 4.460 1.00 73.32 H new ATOM 1475 N ALA A 95 4.825 -8.477 10.651 1.00 12.03 N ATOM 1476 CA ALA A 95 5.663 -8.648 11.850 1.00 2.24 C ATOM 1477 C ALA A 95 5.083 -9.742 12.765 1.00 50.14 C ATOM 1478 O ALA A 95 3.883 -10.035 12.712 1.00 55.01 O ATOM 1479 CB ALA A 95 5.778 -7.315 12.598 1.00 61.54 C ATOM 0 H ALA A 95 3.857 -8.238 10.865 1.00 12.03 H new ATOM 0 HA ALA A 95 6.660 -8.963 11.543 1.00 2.24 H new ATOM 0 HB1 ALA A 95 6.399 -7.447 13.484 1.00 61.54 H new ATOM 0 HB2 ALA A 95 6.232 -6.569 11.945 1.00 61.54 H new ATOM 0 HB3 ALA A 95 4.785 -6.979 12.898 1.00 61.54 H new ATOM 1485 N ASP A 96 5.951 -10.325 13.604 1.00 53.21 N ATOM 1486 CA ASP A 96 5.584 -11.411 14.546 1.00 52.33 C ATOM 1487 C ASP A 96 4.506 -10.942 15.577 1.00 53.51 C ATOM 1488 O ASP A 96 3.460 -11.584 15.745 1.00 65.40 O ATOM 1489 CB ASP A 96 6.878 -11.941 15.250 1.00 4.20 C ATOM 1490 CG ASP A 96 7.597 -10.906 16.163 1.00 61.50 C ATOM 1491 OD1 ASP A 96 7.705 -9.711 15.792 1.00 23.54 O ATOM 1492 OD2 ASP A 96 8.032 -11.279 17.271 1.00 31.44 O ATOM 0 H ASP A 96 6.935 -10.060 13.654 1.00 53.21 H new ATOM 0 HA ASP A 96 5.130 -12.229 13.987 1.00 52.33 H new ATOM 0 HB2 ASP A 96 6.617 -12.813 15.849 1.00 4.20 H new ATOM 0 HB3 ASP A 96 7.578 -12.278 14.486 1.00 4.20 H new ATOM 1497 N GLU A 97 4.796 -9.782 16.195 1.00 71.43 N ATOM 1498 CA GLU A 97 3.990 -9.118 17.251 1.00 24.45 C ATOM 1499 C GLU A 97 4.808 -7.970 17.887 1.00 41.43 C ATOM 1500 O GLU A 97 4.252 -6.939 18.274 1.00 33.55 O ATOM 1501 CB GLU A 97 3.485 -10.100 18.366 1.00 2.01 C ATOM 1502 CG GLU A 97 4.594 -10.827 19.162 1.00 12.03 C ATOM 1503 CD GLU A 97 4.100 -11.828 20.227 1.00 24.25 C ATOM 1504 OE1 GLU A 97 2.880 -11.883 20.517 1.00 22.03 O ATOM 1505 OE2 GLU A 97 4.942 -12.554 20.799 1.00 3.21 O ATOM 0 H GLU A 97 5.637 -9.253 15.965 1.00 71.43 H new ATOM 0 HA GLU A 97 3.098 -8.725 16.763 1.00 24.45 H new ATOM 0 HB2 GLU A 97 2.866 -9.540 19.067 1.00 2.01 H new ATOM 0 HB3 GLU A 97 2.843 -10.849 17.903 1.00 2.01 H new ATOM 0 HG2 GLU A 97 5.233 -11.359 18.457 1.00 12.03 H new ATOM 0 HG3 GLU A 97 5.215 -10.078 19.653 1.00 12.03 H new ATOM 1512 N HIS A 98 6.146 -8.151 17.974 1.00 24.10 N ATOM 1513 CA HIS A 98 7.058 -7.154 18.595 1.00 65.45 C ATOM 1514 C HIS A 98 7.659 -6.179 17.547 1.00 0.12 C ATOM 1515 O HIS A 98 8.280 -5.181 17.915 1.00 74.31 O ATOM 1516 CB HIS A 98 8.198 -7.865 19.370 1.00 33.50 C ATOM 1517 CG HIS A 98 7.733 -8.889 20.372 1.00 13.51 C ATOM 1518 ND1 HIS A 98 7.066 -8.572 21.533 1.00 24.12 N ATOM 1519 CD2 HIS A 98 7.815 -10.236 20.354 1.00 63.44 C ATOM 1520 CE1 HIS A 98 6.757 -9.681 22.177 1.00 61.34 C ATOM 1521 NE2 HIS A 98 7.202 -10.705 21.485 1.00 33.50 N ATOM 0 H HIS A 98 6.623 -8.981 17.621 1.00 24.10 H new ATOM 0 HA HIS A 98 6.460 -6.566 19.291 1.00 65.45 H new ATOM 0 HB2 HIS A 98 8.858 -8.352 18.652 1.00 33.50 H new ATOM 0 HB3 HIS A 98 8.791 -7.112 19.889 1.00 33.50 H new ATOM 0 HD2 HIS A 98 8.280 -10.836 19.586 1.00 63.44 H new ATOM 0 HE1 HIS A 98 6.227 -9.738 23.116 1.00 61.34 H new ATOM 0 HE2 HIS A 98 7.107 -11.686 21.747 1.00 33.50 H new ATOM 1530 N GLY A 99 7.467 -6.475 16.246 1.00 14.21 N ATOM 1531 CA GLY A 99 7.981 -5.618 15.150 1.00 51.43 C ATOM 1532 C GLY A 99 9.079 -6.277 14.304 1.00 52.23 C ATOM 1533 O GLY A 99 9.601 -5.650 13.373 1.00 73.32 O ATOM 0 H GLY A 99 6.960 -7.300 15.925 1.00 14.21 H new ATOM 0 HA2 GLY A 99 7.151 -5.342 14.499 1.00 51.43 H new ATOM 0 HA3 GLY A 99 8.371 -4.694 15.578 1.00 51.43 H new ATOM 1537 N ALA A 100 9.426 -7.538 14.631 1.00 54.43 N ATOM 1538 CA ALA A 100 10.408 -8.334 13.858 1.00 13.01 C ATOM 1539 C ALA A 100 9.761 -8.864 12.549 1.00 22.24 C ATOM 1540 O ALA A 100 8.761 -9.593 12.620 1.00 22.41 O ATOM 1541 CB ALA A 100 10.944 -9.499 14.710 1.00 65.51 C ATOM 0 H ALA A 100 9.037 -8.034 15.433 1.00 54.43 H new ATOM 0 HA ALA A 100 11.247 -7.691 13.591 1.00 13.01 H new ATOM 0 HB1 ALA A 100 11.664 -10.074 14.128 1.00 65.51 H new ATOM 0 HB2 ALA A 100 11.431 -9.104 15.602 1.00 65.51 H new ATOM 0 HB3 ALA A 100 10.117 -10.145 15.004 1.00 65.51 H new ATOM 1547 N PRO A 101 10.299 -8.479 11.340 1.00 2.35 N ATOM 1548 CA PRO A 101 9.768 -8.944 10.029 1.00 30.32 C ATOM 1549 C PRO A 101 9.693 -10.487 9.895 1.00 50.33 C ATOM 1550 O PRO A 101 10.704 -11.180 10.068 1.00 55.44 O ATOM 1551 CB PRO A 101 10.776 -8.349 9.000 1.00 52.30 C ATOM 1552 CG PRO A 101 11.348 -7.154 9.695 1.00 65.32 C ATOM 1553 CD PRO A 101 11.445 -7.544 11.153 1.00 11.04 C ATOM 0 HA PRO A 101 8.738 -8.619 9.885 1.00 30.32 H new ATOM 0 HB2 PRO A 101 11.553 -9.069 8.741 1.00 52.30 H new ATOM 0 HB3 PRO A 101 10.279 -8.069 8.071 1.00 52.30 H new ATOM 0 HG2 PRO A 101 12.327 -6.896 9.291 1.00 65.32 H new ATOM 0 HG3 PRO A 101 10.709 -6.280 9.564 1.00 65.32 H new ATOM 0 HD2 PRO A 101 12.397 -8.026 11.377 1.00 11.04 H new ATOM 0 HD3 PRO A 101 11.365 -6.676 11.807 1.00 11.04 H new ATOM 1561 N VAL A 102 8.480 -11.011 9.614 1.00 21.04 N ATOM 1562 CA VAL A 102 8.275 -12.438 9.286 1.00 73.12 C ATOM 1563 C VAL A 102 9.041 -12.779 7.983 1.00 70.43 C ATOM 1564 O VAL A 102 8.628 -12.386 6.890 1.00 31.44 O ATOM 1565 CB VAL A 102 6.741 -12.784 9.141 1.00 2.23 C ATOM 1566 CG1 VAL A 102 6.514 -14.273 8.749 1.00 54.21 C ATOM 1567 CG2 VAL A 102 5.975 -12.435 10.443 1.00 63.10 C ATOM 0 H VAL A 102 7.621 -10.461 9.608 1.00 21.04 H new ATOM 0 HA VAL A 102 8.665 -13.044 10.104 1.00 73.12 H new ATOM 0 HB VAL A 102 6.346 -12.172 8.330 1.00 2.23 H new ATOM 0 HG11 VAL A 102 5.445 -14.467 8.660 1.00 54.21 H new ATOM 0 HG12 VAL A 102 7.000 -14.476 7.795 1.00 54.21 H new ATOM 0 HG13 VAL A 102 6.938 -14.920 9.517 1.00 54.21 H new ATOM 0 HG21 VAL A 102 4.920 -12.681 10.322 1.00 63.10 H new ATOM 0 HG22 VAL A 102 6.388 -13.008 11.273 1.00 63.10 H new ATOM 0 HG23 VAL A 102 6.077 -11.370 10.651 1.00 63.10 H new ATOM 1577 N ASP A 103 10.171 -13.487 8.138 1.00 33.30 N ATOM 1578 CA ASP A 103 11.150 -13.733 7.052 1.00 24.40 C ATOM 1579 C ASP A 103 10.558 -14.643 5.944 1.00 53.50 C ATOM 1580 O ASP A 103 10.966 -14.576 4.779 1.00 34.31 O ATOM 1581 CB ASP A 103 12.431 -14.349 7.675 1.00 30.33 C ATOM 1582 CG ASP A 103 13.591 -14.508 6.679 1.00 31.22 C ATOM 1583 OD1 ASP A 103 14.264 -13.499 6.377 1.00 23.23 O ATOM 1584 OD2 ASP A 103 13.830 -15.637 6.193 1.00 4.33 O ATOM 0 H ASP A 103 10.439 -13.911 9.026 1.00 33.30 H new ATOM 0 HA ASP A 103 11.400 -12.789 6.568 1.00 24.40 H new ATOM 0 HB2 ASP A 103 12.759 -13.721 8.503 1.00 30.33 H new ATOM 0 HB3 ASP A 103 12.187 -15.326 8.093 1.00 30.33 H new ATOM 1589 N GLU A 104 9.595 -15.485 6.341 1.00 35.42 N ATOM 1590 CA GLU A 104 8.804 -16.334 5.431 1.00 21.14 C ATOM 1591 C GLU A 104 7.993 -15.486 4.418 1.00 42.23 C ATOM 1592 O GLU A 104 7.996 -15.754 3.210 1.00 73.22 O ATOM 1593 CB GLU A 104 7.851 -17.213 6.277 1.00 24.02 C ATOM 1594 CG GLU A 104 6.906 -18.113 5.465 1.00 33.42 C ATOM 1595 CD GLU A 104 5.961 -18.945 6.343 1.00 41.33 C ATOM 1596 OE1 GLU A 104 6.364 -20.042 6.797 1.00 20.42 O ATOM 1597 OE2 GLU A 104 4.823 -18.496 6.600 1.00 42.21 O ATOM 0 H GLU A 104 9.337 -15.600 7.321 1.00 35.42 H new ATOM 0 HA GLU A 104 9.484 -16.961 4.855 1.00 21.14 H new ATOM 0 HB2 GLU A 104 8.450 -17.841 6.936 1.00 24.02 H new ATOM 0 HB3 GLU A 104 7.251 -16.563 6.914 1.00 24.02 H new ATOM 0 HG2 GLU A 104 6.314 -17.493 4.791 1.00 33.42 H new ATOM 0 HG3 GLU A 104 7.499 -18.784 4.843 1.00 33.42 H new ATOM 1604 N LEU A 105 7.296 -14.467 4.940 1.00 54.33 N ATOM 1605 CA LEU A 105 6.484 -13.537 4.126 1.00 52.34 C ATOM 1606 C LEU A 105 7.361 -12.410 3.522 1.00 40.14 C ATOM 1607 O LEU A 105 6.922 -11.699 2.613 1.00 33.51 O ATOM 1608 CB LEU A 105 5.332 -12.967 4.999 1.00 54.13 C ATOM 1609 CG LEU A 105 4.414 -14.040 5.682 1.00 35.13 C ATOM 1610 CD1 LEU A 105 3.257 -13.396 6.470 1.00 40.11 C ATOM 1611 CD2 LEU A 105 3.887 -15.067 4.659 1.00 44.51 C ATOM 0 H LEU A 105 7.276 -14.260 5.939 1.00 54.33 H new ATOM 0 HA LEU A 105 6.050 -14.078 3.285 1.00 52.34 H new ATOM 0 HB2 LEU A 105 5.765 -12.336 5.775 1.00 54.13 H new ATOM 0 HB3 LEU A 105 4.710 -12.324 4.376 1.00 54.13 H new ATOM 0 HG LEU A 105 5.035 -14.574 6.401 1.00 35.13 H new ATOM 0 HD11 LEU A 105 2.648 -14.177 6.926 1.00 40.11 H new ATOM 0 HD12 LEU A 105 3.662 -12.751 7.249 1.00 40.11 H new ATOM 0 HD13 LEU A 105 2.641 -12.804 5.793 1.00 40.11 H new ATOM 0 HD21 LEU A 105 3.255 -15.795 5.167 1.00 44.51 H new ATOM 0 HD22 LEU A 105 3.305 -14.553 3.894 1.00 44.51 H new ATOM 0 HD23 LEU A 105 4.728 -15.580 4.192 1.00 44.51 H new ATOM 1623 N GLY A 106 8.595 -12.264 4.058 1.00 35.12 N ATOM 1624 CA GLY A 106 9.620 -11.367 3.503 1.00 13.21 C ATOM 1625 C GLY A 106 9.288 -9.870 3.579 1.00 44.32 C ATOM 1626 O GLY A 106 8.514 -9.428 4.437 1.00 43.21 O ATOM 0 H GLY A 106 8.903 -12.769 4.889 1.00 35.12 H new ATOM 0 HA2 GLY A 106 10.558 -11.542 4.030 1.00 13.21 H new ATOM 0 HA3 GLY A 106 9.787 -11.633 2.459 1.00 13.21 H new ATOM 1630 N VAL A 107 9.913 -9.091 2.675 1.00 75.44 N ATOM 1631 CA VAL A 107 9.709 -7.630 2.546 1.00 53.34 C ATOM 1632 C VAL A 107 9.173 -7.305 1.127 1.00 15.31 C ATOM 1633 O VAL A 107 9.597 -7.931 0.146 1.00 45.31 O ATOM 1634 CB VAL A 107 11.063 -6.848 2.789 1.00 44.53 C ATOM 1635 CG1 VAL A 107 10.869 -5.310 2.675 1.00 64.35 C ATOM 1636 CG2 VAL A 107 11.689 -7.227 4.160 1.00 63.12 C ATOM 0 H VAL A 107 10.584 -9.462 2.003 1.00 75.44 H new ATOM 0 HA VAL A 107 8.986 -7.314 3.298 1.00 53.34 H new ATOM 0 HB VAL A 107 11.756 -7.149 2.003 1.00 44.53 H new ATOM 0 HG11 VAL A 107 11.822 -4.809 2.848 1.00 64.35 H new ATOM 0 HG12 VAL A 107 10.505 -5.062 1.678 1.00 64.35 H new ATOM 0 HG13 VAL A 107 10.144 -4.979 3.419 1.00 64.35 H new ATOM 0 HG21 VAL A 107 12.618 -6.675 4.301 1.00 63.12 H new ATOM 0 HG22 VAL A 107 10.993 -6.975 4.960 1.00 63.12 H new ATOM 0 HG23 VAL A 107 11.896 -8.297 4.182 1.00 63.12 H new ATOM 1646 N THR A 108 8.235 -6.340 1.021 1.00 65.14 N ATOM 1647 CA THR A 108 7.729 -5.858 -0.285 1.00 2.45 C ATOM 1648 C THR A 108 7.795 -4.312 -0.385 1.00 53.31 C ATOM 1649 O THR A 108 7.173 -3.589 0.398 1.00 41.42 O ATOM 1650 CB THR A 108 6.286 -6.387 -0.613 1.00 42.42 C ATOM 1651 OG1 THR A 108 5.829 -5.836 -1.863 1.00 72.21 O ATOM 1652 CG2 THR A 108 5.254 -6.102 0.502 1.00 10.24 C ATOM 0 H THR A 108 7.811 -5.878 1.825 1.00 65.14 H new ATOM 0 HA THR A 108 8.393 -6.275 -1.042 1.00 2.45 H new ATOM 0 HB THR A 108 6.366 -7.471 -0.688 1.00 42.42 H new ATOM 0 HG1 THR A 108 6.579 -5.786 -2.492 1.00 72.21 H new ATOM 0 HG21 THR A 108 4.281 -6.495 0.207 1.00 10.24 H new ATOM 0 HG22 THR A 108 5.574 -6.583 1.426 1.00 10.24 H new ATOM 0 HG23 THR A 108 5.178 -5.026 0.661 1.00 10.24 H new ATOM 1660 N HIS A 109 8.588 -3.819 -1.358 1.00 61.12 N ATOM 1661 CA HIS A 109 8.812 -2.380 -1.581 1.00 32.55 C ATOM 1662 C HIS A 109 7.742 -1.800 -2.542 1.00 55.24 C ATOM 1663 O HIS A 109 7.833 -1.968 -3.757 1.00 41.52 O ATOM 1664 CB HIS A 109 10.238 -2.157 -2.151 1.00 1.24 C ATOM 1665 CG HIS A 109 10.674 -0.713 -2.195 1.00 12.20 C ATOM 1666 ND1 HIS A 109 11.380 -0.126 -1.178 1.00 31.40 N ATOM 1667 CD2 HIS A 109 10.511 0.262 -3.128 1.00 11.00 C ATOM 1668 CE1 HIS A 109 11.622 1.121 -1.475 1.00 73.31 C ATOM 1669 NE2 HIS A 109 11.114 1.388 -2.646 1.00 24.30 N ATOM 0 H HIS A 109 9.093 -4.414 -2.014 1.00 61.12 H new ATOM 0 HA HIS A 109 8.724 -1.857 -0.629 1.00 32.55 H new ATOM 0 HB2 HIS A 109 10.949 -2.720 -1.547 1.00 1.24 H new ATOM 0 HB3 HIS A 109 10.281 -2.568 -3.160 1.00 1.24 H new ATOM 0 HD1 HIS A 109 11.672 -0.593 -0.319 1.00 31.40 H new ATOM 0 HD2 HIS A 109 10.000 0.164 -4.074 1.00 11.00 H new ATOM 0 HE1 HIS A 109 12.158 1.821 -0.851 1.00 73.31 H new ATOM 1678 N ALA A 110 6.753 -1.090 -1.979 1.00 13.34 N ATOM 1679 CA ALA A 110 5.630 -0.515 -2.753 1.00 63.14 C ATOM 1680 C ALA A 110 5.922 0.952 -3.155 1.00 62.25 C ATOM 1681 O ALA A 110 6.199 1.802 -2.297 1.00 52.44 O ATOM 1682 CB ALA A 110 4.330 -0.627 -1.948 1.00 52.01 C ATOM 0 H ALA A 110 6.704 -0.896 -0.979 1.00 13.34 H new ATOM 0 HA ALA A 110 5.514 -1.083 -3.676 1.00 63.14 H new ATOM 0 HB1 ALA A 110 3.508 -0.202 -2.524 1.00 52.01 H new ATOM 0 HB2 ALA A 110 4.121 -1.676 -1.738 1.00 52.01 H new ATOM 0 HB3 ALA A 110 4.435 -0.083 -1.009 1.00 52.01 H new ATOM 1688 N THR A 111 5.838 1.238 -4.469 1.00 32.20 N ATOM 1689 CA THR A 111 6.119 2.576 -5.038 1.00 41.24 C ATOM 1690 C THR A 111 4.800 3.231 -5.497 1.00 32.20 C ATOM 1691 O THR A 111 4.212 2.817 -6.492 1.00 5.45 O ATOM 1692 CB THR A 111 7.116 2.491 -6.255 1.00 42.02 C ATOM 1693 OG1 THR A 111 8.337 1.857 -5.838 1.00 22.31 O ATOM 1694 CG2 THR A 111 7.444 3.879 -6.845 1.00 45.53 C ATOM 0 H THR A 111 5.573 0.547 -5.170 1.00 32.20 H new ATOM 0 HA THR A 111 6.586 3.180 -4.260 1.00 41.24 H new ATOM 0 HB THR A 111 6.626 1.905 -7.033 1.00 42.02 H new ATOM 0 HG1 THR A 111 8.954 1.804 -6.597 1.00 22.31 H new ATOM 0 HG21 THR A 111 8.135 3.765 -7.681 1.00 45.53 H new ATOM 0 HG22 THR A 111 6.526 4.352 -7.195 1.00 45.53 H new ATOM 0 HG23 THR A 111 7.903 4.502 -6.077 1.00 45.53 H new ATOM 1702 N VAL A 112 4.351 4.257 -4.764 1.00 65.31 N ATOM 1703 CA VAL A 112 3.084 4.972 -5.044 1.00 71.12 C ATOM 1704 C VAL A 112 3.359 6.266 -5.841 1.00 3.43 C ATOM 1705 O VAL A 112 4.073 7.147 -5.371 1.00 12.32 O ATOM 1706 CB VAL A 112 2.337 5.328 -3.714 1.00 54.45 C ATOM 1707 CG1 VAL A 112 0.982 6.033 -3.993 1.00 44.30 C ATOM 1708 CG2 VAL A 112 2.154 4.067 -2.836 1.00 24.21 C ATOM 0 H VAL A 112 4.853 4.622 -3.955 1.00 65.31 H new ATOM 0 HA VAL A 112 2.452 4.311 -5.637 1.00 71.12 H new ATOM 0 HB VAL A 112 2.955 6.035 -3.160 1.00 54.45 H new ATOM 0 HG11 VAL A 112 0.491 6.265 -3.048 1.00 44.30 H new ATOM 0 HG12 VAL A 112 1.159 6.955 -4.546 1.00 44.30 H new ATOM 0 HG13 VAL A 112 0.343 5.374 -4.581 1.00 44.30 H new ATOM 0 HG21 VAL A 112 1.633 4.336 -1.917 1.00 24.21 H new ATOM 0 HG22 VAL A 112 1.569 3.326 -3.381 1.00 24.21 H new ATOM 0 HG23 VAL A 112 3.131 3.650 -2.591 1.00 24.21 H new ATOM 1718 N LYS A 113 2.788 6.367 -7.052 1.00 44.04 N ATOM 1719 CA LYS A 113 2.999 7.525 -7.952 1.00 33.24 C ATOM 1720 C LYS A 113 1.647 8.112 -8.421 1.00 73.04 C ATOM 1721 O LYS A 113 0.730 7.367 -8.785 1.00 50.24 O ATOM 1722 CB LYS A 113 3.876 7.082 -9.149 1.00 4.35 C ATOM 1723 CG LYS A 113 5.256 6.508 -8.730 1.00 0.54 C ATOM 1724 CD LYS A 113 6.135 6.067 -9.917 1.00 11.15 C ATOM 1725 CE LYS A 113 5.423 5.090 -10.866 1.00 12.30 C ATOM 1726 NZ LYS A 113 6.306 4.647 -11.965 1.00 75.23 N ATOM 0 H LYS A 113 2.169 5.655 -7.439 1.00 44.04 H new ATOM 0 HA LYS A 113 3.517 8.317 -7.412 1.00 33.24 H new ATOM 0 HB2 LYS A 113 3.338 6.328 -9.724 1.00 4.35 H new ATOM 0 HB3 LYS A 113 4.032 7.935 -9.809 1.00 4.35 H new ATOM 0 HG2 LYS A 113 5.792 7.262 -8.154 1.00 0.54 H new ATOM 0 HG3 LYS A 113 5.099 5.655 -8.070 1.00 0.54 H new ATOM 0 HD2 LYS A 113 6.445 6.948 -10.479 1.00 11.15 H new ATOM 0 HD3 LYS A 113 7.041 5.597 -9.535 1.00 11.15 H new ATOM 0 HE2 LYS A 113 5.081 4.222 -10.303 1.00 12.30 H new ATOM 0 HE3 LYS A 113 4.537 5.569 -11.283 1.00 12.30 H new ATOM 0 HZ1 LYS A 113 5.788 3.989 -12.583 1.00 75.23 H new ATOM 0 HZ2 LYS A 113 6.613 5.473 -12.518 1.00 75.23 H new ATOM 0 HZ3 LYS A 113 7.139 4.167 -11.569 1.00 75.23 H new ATOM 1740 N LEU A 114 1.538 9.459 -8.408 1.00 54.31 N ATOM 1741 CA LEU A 114 0.272 10.182 -8.697 1.00 23.52 C ATOM 1742 C LEU A 114 0.375 11.027 -9.991 1.00 3.45 C ATOM 1743 O LEU A 114 1.323 11.802 -10.170 1.00 61.24 O ATOM 1744 CB LEU A 114 -0.117 11.096 -7.498 1.00 33.44 C ATOM 1745 CG LEU A 114 -0.357 10.376 -6.130 1.00 63.51 C ATOM 1746 CD1 LEU A 114 -0.746 11.377 -5.025 1.00 64.51 C ATOM 1747 CD2 LEU A 114 -1.422 9.274 -6.256 1.00 31.31 C ATOM 0 H LEU A 114 2.321 10.078 -8.198 1.00 54.31 H new ATOM 0 HA LEU A 114 -0.504 9.432 -8.847 1.00 23.52 H new ATOM 0 HB2 LEU A 114 0.671 11.836 -7.362 1.00 33.44 H new ATOM 0 HB3 LEU A 114 -1.024 11.640 -7.762 1.00 33.44 H new ATOM 0 HG LEU A 114 0.585 9.908 -5.845 1.00 63.51 H new ATOM 0 HD11 LEU A 114 -0.905 10.842 -4.089 1.00 64.51 H new ATOM 0 HD12 LEU A 114 0.055 12.105 -4.895 1.00 64.51 H new ATOM 0 HD13 LEU A 114 -1.663 11.893 -5.308 1.00 64.51 H new ATOM 0 HD21 LEU A 114 -1.565 8.794 -5.288 1.00 31.31 H new ATOM 0 HD22 LEU A 114 -2.363 9.714 -6.585 1.00 31.31 H new ATOM 0 HD23 LEU A 114 -1.094 8.532 -6.984 1.00 31.31 H new ATOM 1759 N GLU A 115 -0.619 10.862 -10.885 1.00 22.30 N ATOM 1760 CA GLU A 115 -0.727 11.603 -12.156 1.00 61.22 C ATOM 1761 C GLU A 115 -1.838 12.680 -12.059 1.00 12.44 C ATOM 1762 O GLU A 115 -2.998 12.339 -11.807 1.00 25.02 O ATOM 1763 CB GLU A 115 -1.050 10.642 -13.337 1.00 1.22 C ATOM 1764 CG GLU A 115 0.108 9.717 -13.781 1.00 71.13 C ATOM 1765 CD GLU A 115 0.438 8.554 -12.815 1.00 10.52 C ATOM 1766 OE1 GLU A 115 -0.209 7.483 -12.913 1.00 71.12 O ATOM 1767 OE2 GLU A 115 1.368 8.691 -11.990 1.00 5.24 O ATOM 0 H GLU A 115 -1.381 10.200 -10.742 1.00 22.30 H new ATOM 0 HA GLU A 115 0.234 12.083 -12.343 1.00 61.22 H new ATOM 0 HB2 GLU A 115 -1.900 10.021 -13.054 1.00 1.22 H new ATOM 0 HB3 GLU A 115 -1.363 11.240 -14.193 1.00 1.22 H new ATOM 0 HG2 GLU A 115 -0.139 9.297 -14.756 1.00 71.13 H new ATOM 0 HG3 GLU A 115 1.004 10.323 -13.912 1.00 71.13 H new ATOM 1774 N PRO A 116 -1.501 13.991 -12.251 1.00 51.44 N ATOM 1775 CA PRO A 116 -2.502 15.086 -12.248 1.00 42.41 C ATOM 1776 C PRO A 116 -3.395 15.068 -13.515 1.00 32.31 C ATOM 1777 O PRO A 116 -3.001 15.555 -14.579 1.00 32.53 O ATOM 1778 CB PRO A 116 -1.627 16.364 -12.160 1.00 32.24 C ATOM 1779 CG PRO A 116 -0.318 15.976 -12.783 1.00 54.43 C ATOM 1780 CD PRO A 116 -0.122 14.507 -12.469 1.00 25.44 C ATOM 0 HA PRO A 116 -3.215 15.006 -11.427 1.00 42.41 H new ATOM 0 HB2 PRO A 116 -2.087 17.196 -12.693 1.00 32.24 H new ATOM 0 HB3 PRO A 116 -1.494 16.682 -11.126 1.00 32.24 H new ATOM 0 HG2 PRO A 116 -0.333 16.146 -13.860 1.00 54.43 H new ATOM 0 HG3 PRO A 116 0.499 16.573 -12.378 1.00 54.43 H new ATOM 0 HD2 PRO A 116 0.372 13.987 -13.290 1.00 25.44 H new ATOM 0 HD3 PRO A 116 0.499 14.369 -11.584 1.00 25.44 H new ATOM 1788 N LEU A 117 -4.596 14.476 -13.394 1.00 1.11 N ATOM 1789 CA LEU A 117 -5.567 14.374 -14.514 1.00 70.21 C ATOM 1790 C LEU A 117 -6.512 15.611 -14.537 1.00 34.44 C ATOM 1791 O LEU A 117 -7.720 15.469 -14.779 1.00 54.31 O ATOM 1792 CB LEU A 117 -6.396 13.061 -14.375 1.00 24.51 C ATOM 1793 CG LEU A 117 -5.606 11.741 -14.128 1.00 43.42 C ATOM 1794 CD1 LEU A 117 -6.575 10.550 -13.945 1.00 33.11 C ATOM 1795 CD2 LEU A 117 -4.581 11.473 -15.252 1.00 54.12 C ATOM 0 H LEU A 117 -4.926 14.055 -12.526 1.00 1.11 H new ATOM 0 HA LEU A 117 -5.016 14.350 -15.454 1.00 70.21 H new ATOM 0 HB2 LEU A 117 -7.100 13.192 -13.553 1.00 24.51 H new ATOM 0 HB3 LEU A 117 -6.986 12.936 -15.283 1.00 24.51 H new ATOM 0 HG LEU A 117 -5.040 11.857 -13.204 1.00 43.42 H new ATOM 0 HD11 LEU A 117 -6.003 9.638 -13.774 1.00 33.11 H new ATOM 0 HD12 LEU A 117 -7.224 10.737 -13.089 1.00 33.11 H new ATOM 0 HD13 LEU A 117 -7.182 10.434 -14.843 1.00 33.11 H new ATOM 0 HD21 LEU A 117 -4.049 10.544 -15.046 1.00 54.12 H new ATOM 0 HD22 LEU A 117 -5.101 11.389 -16.206 1.00 54.12 H new ATOM 0 HD23 LEU A 117 -3.868 12.296 -15.299 1.00 54.12 H new ATOM 1807 N GLU A 118 -5.933 16.820 -14.315 1.00 1.24 N ATOM 1808 CA GLU A 118 -6.678 18.107 -14.196 1.00 23.40 C ATOM 1809 C GLU A 118 -7.635 18.111 -12.979 1.00 70.01 C ATOM 1810 O GLU A 118 -7.310 18.630 -11.906 1.00 55.02 O ATOM 1811 CB GLU A 118 -7.448 18.469 -15.516 1.00 43.33 C ATOM 1812 CG GLU A 118 -6.577 18.954 -16.687 1.00 42.44 C ATOM 1813 CD GLU A 118 -5.519 17.937 -17.167 1.00 52.22 C ATOM 1814 OE1 GLU A 118 -5.892 16.954 -17.845 1.00 23.41 O ATOM 1815 OE2 GLU A 118 -4.319 18.107 -16.859 1.00 42.43 O ATOM 0 H GLU A 118 -4.924 16.933 -14.212 1.00 1.24 H new ATOM 0 HA GLU A 118 -5.929 18.881 -14.031 1.00 23.40 H new ATOM 0 HB2 GLU A 118 -8.005 17.591 -15.842 1.00 43.33 H new ATOM 0 HB3 GLU A 118 -8.180 19.244 -15.287 1.00 43.33 H new ATOM 0 HG2 GLU A 118 -7.226 19.206 -17.526 1.00 42.44 H new ATOM 0 HG3 GLU A 118 -6.070 19.872 -16.390 1.00 42.44 H new ATOM 1822 N ASN A 119 -8.812 17.508 -13.171 1.00 45.41 N ATOM 1823 CA ASN A 119 -9.895 17.462 -12.173 1.00 64.24 C ATOM 1824 C ASN A 119 -9.978 16.077 -11.482 1.00 60.42 C ATOM 1825 O ASN A 119 -10.837 15.853 -10.626 1.00 61.22 O ATOM 1826 CB ASN A 119 -11.213 17.831 -12.900 1.00 22.20 C ATOM 1827 CG ASN A 119 -11.281 19.312 -13.296 1.00 14.40 C ATOM 1828 OD1 ASN A 119 -10.737 20.183 -12.624 1.00 54.21 O ATOM 1829 ND2 ASN A 119 -11.948 19.610 -14.390 1.00 32.13 N ATOM 0 H ASN A 119 -9.047 17.028 -14.040 1.00 45.41 H new ATOM 0 HA ASN A 119 -9.702 18.176 -11.372 1.00 64.24 H new ATOM 0 HB2 ASN A 119 -11.313 17.216 -13.794 1.00 22.20 H new ATOM 0 HB3 ASN A 119 -12.058 17.594 -12.253 1.00 22.20 H new ATOM 0 HD21 ASN A 119 -12.021 20.581 -14.695 1.00 32.13 H new ATOM 0 HD22 ASN A 119 -12.393 18.870 -14.934 1.00 32.13 H new ATOM 1836 N ARG A 120 -9.082 15.146 -11.870 1.00 44.44 N ATOM 1837 CA ARG A 120 -8.924 13.823 -11.211 1.00 22.14 C ATOM 1838 C ARG A 120 -7.425 13.535 -10.940 1.00 73.53 C ATOM 1839 O ARG A 120 -6.561 14.380 -11.206 1.00 35.23 O ATOM 1840 CB ARG A 120 -9.524 12.687 -12.083 1.00 31.02 C ATOM 1841 CG ARG A 120 -11.043 12.779 -12.343 1.00 62.24 C ATOM 1842 CD ARG A 120 -11.573 11.551 -13.101 1.00 22.12 C ATOM 1843 NE ARG A 120 -10.855 11.329 -14.369 1.00 44.31 N ATOM 1844 CZ ARG A 120 -10.993 10.286 -15.154 1.00 30.12 C ATOM 1845 NH1 ARG A 120 -11.799 9.313 -14.858 1.00 41.33 N ATOM 1846 NH2 ARG A 120 -10.314 10.231 -16.249 1.00 50.31 N ATOM 0 H ARG A 120 -8.443 15.287 -12.652 1.00 44.44 H new ATOM 0 HA ARG A 120 -9.464 13.854 -10.265 1.00 22.14 H new ATOM 0 HB2 ARG A 120 -9.009 12.680 -13.043 1.00 31.02 H new ATOM 0 HB3 ARG A 120 -9.313 11.733 -11.601 1.00 31.02 H new ATOM 0 HG2 ARG A 120 -11.568 12.873 -11.393 1.00 62.24 H new ATOM 0 HG3 ARG A 120 -11.259 13.680 -12.917 1.00 62.24 H new ATOM 0 HD2 ARG A 120 -11.476 10.667 -12.471 1.00 22.12 H new ATOM 0 HD3 ARG A 120 -12.636 11.682 -13.305 1.00 22.12 H new ATOM 0 HE ARG A 120 -10.194 12.048 -14.662 1.00 44.31 H new ATOM 0 HH11 ARG A 120 -12.345 9.347 -13.997 1.00 41.33 H new ATOM 0 HH12 ARG A 120 -11.887 8.514 -15.486 1.00 41.33 H new ATOM 0 HH21 ARG A 120 -9.680 10.992 -16.495 1.00 50.31 H new ATOM 0 HH22 ARG A 120 -10.411 9.427 -16.869 1.00 50.31 H new ATOM 1860 N THR A 121 -7.129 12.335 -10.395 1.00 12.22 N ATOM 1861 CA THR A 121 -5.739 11.860 -10.178 1.00 32.43 C ATOM 1862 C THR A 121 -5.658 10.324 -10.314 1.00 54.22 C ATOM 1863 O THR A 121 -6.542 9.601 -9.844 1.00 24.04 O ATOM 1864 CB THR A 121 -5.177 12.308 -8.784 1.00 54.21 C ATOM 1865 OG1 THR A 121 -5.185 13.740 -8.707 1.00 60.24 O ATOM 1866 CG2 THR A 121 -3.742 11.806 -8.515 1.00 72.03 C ATOM 0 H THR A 121 -7.840 11.669 -10.093 1.00 12.22 H new ATOM 0 HA THR A 121 -5.120 12.319 -10.949 1.00 32.43 H new ATOM 0 HB THR A 121 -5.824 11.864 -8.028 1.00 54.21 H new ATOM 0 HG1 THR A 121 -6.088 14.051 -8.486 1.00 60.24 H new ATOM 0 HG21 THR A 121 -3.414 12.151 -7.534 1.00 72.03 H new ATOM 0 HG22 THR A 121 -3.727 10.716 -8.540 1.00 72.03 H new ATOM 0 HG23 THR A 121 -3.071 12.196 -9.280 1.00 72.03 H new ATOM 1874 N ARG A 122 -4.584 9.845 -10.966 1.00 64.40 N ATOM 1875 CA ARG A 122 -4.329 8.413 -11.191 1.00 5.42 C ATOM 1876 C ARG A 122 -3.201 7.923 -10.257 1.00 11.43 C ATOM 1877 O ARG A 122 -2.109 8.474 -10.262 1.00 51.15 O ATOM 1878 CB ARG A 122 -3.933 8.197 -12.670 1.00 53.23 C ATOM 1879 CG ARG A 122 -3.604 6.740 -13.047 1.00 2.31 C ATOM 1880 CD ARG A 122 -3.171 6.605 -14.515 1.00 11.34 C ATOM 1881 NE ARG A 122 -4.228 7.010 -15.458 1.00 63.51 N ATOM 1882 CZ ARG A 122 -4.077 7.140 -16.755 1.00 1.24 C ATOM 1883 NH1 ARG A 122 -2.917 7.005 -17.322 1.00 21.33 N ATOM 1884 NH2 ARG A 122 -5.103 7.424 -17.482 1.00 63.41 N ATOM 0 H ARG A 122 -3.861 10.449 -11.356 1.00 64.40 H new ATOM 0 HA ARG A 122 -5.230 7.841 -10.971 1.00 5.42 H new ATOM 0 HB2 ARG A 122 -4.748 8.546 -13.304 1.00 53.23 H new ATOM 0 HB3 ARG A 122 -3.067 8.819 -12.894 1.00 53.23 H new ATOM 0 HG2 ARG A 122 -2.809 6.369 -12.400 1.00 2.31 H new ATOM 0 HG3 ARG A 122 -4.478 6.114 -12.869 1.00 2.31 H new ATOM 0 HD2 ARG A 122 -2.284 7.215 -14.686 1.00 11.34 H new ATOM 0 HD3 ARG A 122 -2.890 5.571 -14.713 1.00 11.34 H new ATOM 0 HE ARG A 122 -5.152 7.205 -15.072 1.00 63.51 H new ATOM 0 HH11 ARG A 122 -2.095 6.793 -16.757 1.00 21.33 H new ATOM 0 HH12 ARG A 122 -2.828 7.111 -18.333 1.00 21.33 H new ATOM 0 HH21 ARG A 122 -6.018 7.545 -17.048 1.00 63.41 H new ATOM 0 HH22 ARG A 122 -5.000 7.528 -18.491 1.00 63.41 H new ATOM 1898 N MET A 123 -3.474 6.879 -9.475 1.00 51.52 N ATOM 1899 CA MET A 123 -2.511 6.306 -8.519 1.00 41.23 C ATOM 1900 C MET A 123 -2.003 4.945 -9.033 1.00 60.14 C ATOM 1901 O MET A 123 -2.802 4.091 -9.424 1.00 5.30 O ATOM 1902 CB MET A 123 -3.189 6.127 -7.142 1.00 64.41 C ATOM 1903 CG MET A 123 -2.261 5.589 -6.036 1.00 43.44 C ATOM 1904 SD MET A 123 -3.149 5.176 -4.523 1.00 13.31 S ATOM 1905 CE MET A 123 -4.298 3.954 -5.153 1.00 33.12 C ATOM 0 H MET A 123 -4.374 6.400 -9.483 1.00 51.52 H new ATOM 0 HA MET A 123 -1.663 6.984 -8.417 1.00 41.23 H new ATOM 0 HB2 MET A 123 -3.594 7.088 -6.823 1.00 64.41 H new ATOM 0 HB3 MET A 123 -4.033 5.446 -7.253 1.00 64.41 H new ATOM 0 HG2 MET A 123 -1.743 4.703 -6.402 1.00 43.44 H new ATOM 0 HG3 MET A 123 -1.498 6.335 -5.813 1.00 43.44 H new ATOM 0 HE1 MET A 123 -5.292 4.394 -5.228 1.00 33.12 H new ATOM 0 HE2 MET A 123 -3.972 3.623 -6.139 1.00 33.12 H new ATOM 0 HE3 MET A 123 -4.329 3.101 -4.476 1.00 33.12 H new ATOM 1915 N THR A 124 -0.676 4.743 -9.010 1.00 3.02 N ATOM 1916 CA THR A 124 -0.050 3.462 -9.407 1.00 5.24 C ATOM 1917 C THR A 124 0.923 2.979 -8.313 1.00 53.41 C ATOM 1918 O THR A 124 1.938 3.627 -8.047 1.00 14.15 O ATOM 1919 CB THR A 124 0.699 3.586 -10.772 1.00 20.24 C ATOM 1920 OG1 THR A 124 -0.203 4.107 -11.762 1.00 40.11 O ATOM 1921 CG2 THR A 124 1.255 2.231 -11.255 1.00 13.52 C ATOM 0 H THR A 124 -0.007 5.455 -8.718 1.00 3.02 H new ATOM 0 HA THR A 124 -0.848 2.729 -9.528 1.00 5.24 H new ATOM 0 HB THR A 124 1.544 4.260 -10.627 1.00 20.24 H new ATOM 0 HG1 THR A 124 0.264 4.188 -12.620 1.00 40.11 H new ATOM 0 HG21 THR A 124 1.767 2.367 -12.207 1.00 13.52 H new ATOM 0 HG22 THR A 124 1.957 1.842 -10.517 1.00 13.52 H new ATOM 0 HG23 THR A 124 0.434 1.525 -11.382 1.00 13.52 H new ATOM 1929 N ILE A 125 0.587 1.842 -7.676 1.00 73.11 N ATOM 1930 CA ILE A 125 1.390 1.239 -6.586 1.00 14.41 C ATOM 1931 C ILE A 125 2.107 -0.025 -7.102 1.00 75.23 C ATOM 1932 O ILE A 125 1.445 -1.008 -7.430 1.00 24.53 O ATOM 1933 CB ILE A 125 0.465 0.851 -5.374 1.00 34.41 C ATOM 1934 CG1 ILE A 125 -0.435 2.056 -4.955 1.00 2.44 C ATOM 1935 CG2 ILE A 125 1.303 0.330 -4.172 1.00 55.33 C ATOM 1936 CD1 ILE A 125 -1.492 1.723 -3.915 1.00 70.20 C ATOM 0 H ILE A 125 -0.253 1.310 -7.901 1.00 73.11 H new ATOM 0 HA ILE A 125 2.127 1.970 -6.254 1.00 14.41 H new ATOM 0 HB ILE A 125 -0.188 0.040 -5.696 1.00 34.41 H new ATOM 0 HG12 ILE A 125 0.202 2.850 -4.566 1.00 2.44 H new ATOM 0 HG13 ILE A 125 -0.929 2.450 -5.843 1.00 2.44 H new ATOM 0 HG21 ILE A 125 0.637 0.070 -3.350 1.00 55.33 H new ATOM 0 HG22 ILE A 125 1.866 -0.552 -4.476 1.00 55.33 H new ATOM 0 HG23 ILE A 125 1.995 1.107 -3.847 1.00 55.33 H new ATOM 0 HD11 ILE A 125 -2.070 2.618 -3.684 1.00 70.20 H new ATOM 0 HD12 ILE A 125 -2.157 0.953 -4.306 1.00 70.20 H new ATOM 0 HD13 ILE A 125 -1.008 1.359 -3.008 1.00 70.20 H new ATOM 1948 N ILE A 126 3.453 0.009 -7.188 1.00 44.05 N ATOM 1949 CA ILE A 126 4.260 -1.140 -7.669 1.00 23.13 C ATOM 1950 C ILE A 126 4.986 -1.805 -6.472 1.00 14.20 C ATOM 1951 O ILE A 126 5.985 -1.281 -5.982 1.00 23.30 O ATOM 1952 CB ILE A 126 5.341 -0.722 -8.762 1.00 21.34 C ATOM 1953 CG1 ILE A 126 4.746 0.197 -9.896 1.00 42.00 C ATOM 1954 CG2 ILE A 126 5.994 -1.988 -9.378 1.00 54.53 C ATOM 1955 CD1 ILE A 126 4.583 1.663 -9.528 1.00 10.12 C ATOM 0 H ILE A 126 4.010 0.824 -6.930 1.00 44.05 H new ATOM 0 HA ILE A 126 3.567 -1.837 -8.140 1.00 23.13 H new ATOM 0 HB ILE A 126 6.099 -0.131 -8.248 1.00 21.34 H new ATOM 0 HG12 ILE A 126 5.392 0.129 -10.771 1.00 42.00 H new ATOM 0 HG13 ILE A 126 3.772 -0.198 -10.187 1.00 42.00 H new ATOM 0 HG21 ILE A 126 6.731 -1.691 -10.124 1.00 54.53 H new ATOM 0 HG22 ILE A 126 6.484 -2.563 -8.593 1.00 54.53 H new ATOM 0 HG23 ILE A 126 5.226 -2.600 -9.851 1.00 54.53 H new ATOM 0 HD11 ILE A 126 4.167 2.207 -10.376 1.00 10.12 H new ATOM 0 HD12 ILE A 126 3.910 1.751 -8.675 1.00 10.12 H new ATOM 0 HD13 ILE A 126 5.555 2.083 -9.269 1.00 10.12 H new ATOM 1967 N SER A 127 4.470 -2.952 -6.014 1.00 41.45 N ATOM 1968 CA SER A 127 5.019 -3.692 -4.857 1.00 61.42 C ATOM 1969 C SER A 127 6.023 -4.767 -5.330 1.00 53.33 C ATOM 1970 O SER A 127 5.629 -5.800 -5.867 1.00 4.43 O ATOM 1971 CB SER A 127 3.855 -4.335 -4.059 1.00 73.22 C ATOM 1972 OG SER A 127 2.929 -3.352 -3.623 1.00 14.51 O ATOM 0 H SER A 127 3.656 -3.400 -6.434 1.00 41.45 H new ATOM 0 HA SER A 127 5.554 -3.000 -4.206 1.00 61.42 H new ATOM 0 HB2 SER A 127 3.344 -5.069 -4.683 1.00 73.22 H new ATOM 0 HB3 SER A 127 4.253 -4.871 -3.198 1.00 73.22 H new ATOM 0 HG SER A 127 2.410 -3.703 -2.870 1.00 14.51 H new ATOM 1978 N THR A 128 7.322 -4.506 -5.134 1.00 3.03 N ATOM 1979 CA THR A 128 8.411 -5.425 -5.542 1.00 15.24 C ATOM 1980 C THR A 128 8.805 -6.365 -4.383 1.00 11.11 C ATOM 1981 O THR A 128 8.658 -6.013 -3.223 1.00 31.40 O ATOM 1982 CB THR A 128 9.671 -4.630 -6.024 1.00 20.13 C ATOM 1983 OG1 THR A 128 10.184 -3.821 -4.953 1.00 22.34 O ATOM 1984 CG2 THR A 128 9.349 -3.729 -7.235 1.00 23.11 C ATOM 0 H THR A 128 7.656 -3.652 -4.688 1.00 3.03 H new ATOM 0 HA THR A 128 8.035 -6.024 -6.372 1.00 15.24 H new ATOM 0 HB THR A 128 10.420 -5.360 -6.331 1.00 20.13 H new ATOM 0 HG1 THR A 128 10.153 -2.877 -5.213 1.00 22.34 H new ATOM 0 HG21 THR A 128 10.248 -3.194 -7.540 1.00 23.11 H new ATOM 0 HG22 THR A 128 8.995 -4.344 -8.062 1.00 23.11 H new ATOM 0 HG23 THR A 128 8.576 -3.012 -6.959 1.00 23.11 H new ATOM 1992 N PHE A 129 9.309 -7.565 -4.709 1.00 51.21 N ATOM 1993 CA PHE A 129 9.609 -8.620 -3.708 1.00 72.22 C ATOM 1994 C PHE A 129 11.093 -9.055 -3.771 1.00 44.11 C ATOM 1995 O PHE A 129 11.787 -8.802 -4.762 1.00 22.13 O ATOM 1996 CB PHE A 129 8.680 -9.847 -3.939 1.00 22.55 C ATOM 1997 CG PHE A 129 7.184 -9.526 -3.872 1.00 12.33 C ATOM 1998 CD1 PHE A 129 6.504 -9.524 -2.656 1.00 71.44 C ATOM 1999 CD2 PHE A 129 6.460 -9.218 -5.025 1.00 71.03 C ATOM 2000 CE1 PHE A 129 5.153 -9.227 -2.600 1.00 64.23 C ATOM 2001 CE2 PHE A 129 5.113 -8.922 -4.968 1.00 71.21 C ATOM 2002 CZ PHE A 129 4.459 -8.926 -3.755 1.00 31.34 C ATOM 0 H PHE A 129 9.522 -7.838 -5.668 1.00 51.21 H new ATOM 0 HA PHE A 129 9.425 -8.207 -2.716 1.00 72.22 H new ATOM 0 HB2 PHE A 129 8.904 -10.279 -4.914 1.00 22.55 H new ATOM 0 HB3 PHE A 129 8.910 -10.608 -3.193 1.00 22.55 H new ATOM 0 HD1 PHE A 129 7.037 -9.757 -1.746 1.00 71.44 H new ATOM 0 HD2 PHE A 129 6.964 -9.211 -5.980 1.00 71.03 H new ATOM 0 HE1 PHE A 129 4.640 -9.231 -1.650 1.00 64.23 H new ATOM 0 HE2 PHE A 129 4.572 -8.688 -5.873 1.00 71.21 H new ATOM 0 HZ PHE A 129 3.405 -8.694 -3.708 1.00 31.34 H new ATOM 2012 N GLU A 130 11.556 -9.712 -2.690 1.00 1.25 N ATOM 2013 CA GLU A 130 12.909 -10.315 -2.608 1.00 14.41 C ATOM 2014 C GLU A 130 13.079 -11.474 -3.619 1.00 72.30 C ATOM 2015 O GLU A 130 14.069 -11.528 -4.358 1.00 2.55 O ATOM 2016 CB GLU A 130 13.173 -10.827 -1.160 1.00 61.44 C ATOM 2017 CG GLU A 130 13.350 -9.719 -0.096 1.00 41.22 C ATOM 2018 CD GLU A 130 14.668 -8.939 -0.264 1.00 64.11 C ATOM 2019 OE1 GLU A 130 15.742 -9.498 0.078 1.00 52.11 O ATOM 2020 OE2 GLU A 130 14.645 -7.787 -0.740 1.00 5.42 O ATOM 0 H GLU A 130 11.003 -9.842 -1.843 1.00 1.25 H new ATOM 0 HA GLU A 130 13.636 -9.544 -2.861 1.00 14.41 H new ATOM 0 HB2 GLU A 130 12.344 -11.468 -0.861 1.00 61.44 H new ATOM 0 HB3 GLU A 130 14.069 -11.448 -1.168 1.00 61.44 H new ATOM 0 HG2 GLU A 130 12.512 -9.025 -0.157 1.00 41.22 H new ATOM 0 HG3 GLU A 130 13.322 -10.167 0.897 1.00 41.22 H new ATOM 2027 N SER A 131 12.089 -12.388 -3.654 1.00 2.12 N ATOM 2028 CA SER A 131 12.166 -13.623 -4.467 1.00 71.54 C ATOM 2029 C SER A 131 10.785 -14.069 -4.971 1.00 11.30 C ATOM 2030 O SER A 131 9.746 -13.659 -4.444 1.00 32.23 O ATOM 2031 CB SER A 131 12.805 -14.770 -3.650 1.00 13.21 C ATOM 2032 OG SER A 131 11.973 -15.166 -2.568 1.00 55.10 O ATOM 0 H SER A 131 11.221 -12.295 -3.126 1.00 2.12 H new ATOM 0 HA SER A 131 12.787 -13.394 -5.333 1.00 71.54 H new ATOM 0 HB2 SER A 131 12.987 -15.624 -4.302 1.00 13.21 H new ATOM 0 HB3 SER A 131 13.774 -14.449 -3.267 1.00 13.21 H new ATOM 0 HG SER A 131 12.404 -15.893 -2.073 1.00 55.10 H new ATOM 2038 N GLU A 132 10.824 -14.911 -6.013 1.00 74.01 N ATOM 2039 CA GLU A 132 9.664 -15.579 -6.628 1.00 3.41 C ATOM 2040 C GLU A 132 8.877 -16.421 -5.600 1.00 74.01 C ATOM 2041 O GLU A 132 7.664 -16.274 -5.496 1.00 15.34 O ATOM 2042 CB GLU A 132 10.188 -16.429 -7.836 1.00 50.02 C ATOM 2043 CG GLU A 132 9.153 -17.318 -8.589 1.00 53.13 C ATOM 2044 CD GLU A 132 8.931 -18.720 -7.979 1.00 12.13 C ATOM 2045 OE1 GLU A 132 9.851 -19.259 -7.318 1.00 73.31 O ATOM 2046 OE2 GLU A 132 7.850 -19.302 -8.183 1.00 54.21 O ATOM 0 H GLU A 132 11.701 -15.157 -6.471 1.00 74.01 H new ATOM 0 HA GLU A 132 8.950 -14.840 -6.992 1.00 3.41 H new ATOM 0 HB2 GLU A 132 10.635 -15.747 -8.559 1.00 50.02 H new ATOM 0 HB3 GLU A 132 10.986 -17.076 -7.472 1.00 50.02 H new ATOM 0 HG2 GLU A 132 8.197 -16.794 -8.615 1.00 53.13 H new ATOM 0 HG3 GLU A 132 9.481 -17.435 -9.622 1.00 53.13 H new ATOM 2053 N GLU A 133 9.585 -17.282 -4.832 1.00 13.42 N ATOM 2054 CA GLU A 133 8.953 -18.177 -3.822 1.00 40.23 C ATOM 2055 C GLU A 133 8.274 -17.383 -2.671 1.00 42.13 C ATOM 2056 O GLU A 133 7.236 -17.811 -2.148 1.00 61.42 O ATOM 2057 CB GLU A 133 9.986 -19.185 -3.257 1.00 62.15 C ATOM 2058 CG GLU A 133 11.199 -18.553 -2.546 1.00 72.33 C ATOM 2059 CD GLU A 133 12.161 -19.604 -1.966 1.00 45.22 C ATOM 2060 OE1 GLU A 133 13.001 -20.139 -2.723 1.00 30.00 O ATOM 2061 OE2 GLU A 133 12.066 -19.913 -0.760 1.00 11.52 O ATOM 0 H GLU A 133 10.599 -17.379 -4.890 1.00 13.42 H new ATOM 0 HA GLU A 133 8.167 -18.731 -4.335 1.00 40.23 H new ATOM 0 HB2 GLU A 133 9.478 -19.846 -2.555 1.00 62.15 H new ATOM 0 HB3 GLU A 133 10.348 -19.807 -4.076 1.00 62.15 H new ATOM 0 HG2 GLU A 133 11.740 -17.921 -3.251 1.00 72.33 H new ATOM 0 HG3 GLU A 133 10.847 -17.906 -1.743 1.00 72.33 H new ATOM 2068 N GLN A 134 8.855 -16.216 -2.302 1.00 63.21 N ATOM 2069 CA GLN A 134 8.248 -15.296 -1.308 1.00 64.12 C ATOM 2070 C GLN A 134 6.957 -14.700 -1.896 1.00 55.04 C ATOM 2071 O GLN A 134 5.892 -14.724 -1.277 1.00 2.12 O ATOM 2072 CB GLN A 134 9.232 -14.143 -0.958 1.00 52.23 C ATOM 2073 CG GLN A 134 8.679 -13.096 0.063 1.00 52.33 C ATOM 2074 CD GLN A 134 9.022 -11.638 -0.277 1.00 41.23 C ATOM 2075 OE1 GLN A 134 10.027 -11.358 -0.903 1.00 62.40 O ATOM 2076 NE2 GLN A 134 8.196 -10.697 0.145 1.00 11.30 N ATOM 0 H GLN A 134 9.745 -15.889 -2.678 1.00 63.21 H new ATOM 0 HA GLN A 134 8.025 -15.855 -0.399 1.00 64.12 H new ATOM 0 HB2 GLN A 134 10.147 -14.576 -0.554 1.00 52.23 H new ATOM 0 HB3 GLN A 134 9.504 -13.624 -1.877 1.00 52.23 H new ATOM 0 HG2 GLN A 134 7.595 -13.198 0.119 1.00 52.33 H new ATOM 0 HG3 GLN A 134 9.073 -13.328 1.053 1.00 52.33 H new ATOM 0 HE21 GLN A 134 7.358 -10.951 0.668 1.00 11.30 H new ATOM 0 HE22 GLN A 134 8.396 -9.717 -0.053 1.00 11.30 H new ATOM 2085 N MET A 135 7.106 -14.203 -3.135 1.00 2.11 N ATOM 2086 CA MET A 135 6.027 -13.623 -3.952 1.00 21.05 C ATOM 2087 C MET A 135 4.853 -14.620 -4.167 1.00 40.21 C ATOM 2088 O MET A 135 3.692 -14.202 -4.273 1.00 61.44 O ATOM 2089 CB MET A 135 6.645 -13.137 -5.300 1.00 1.34 C ATOM 2090 CG MET A 135 5.642 -12.707 -6.368 1.00 51.15 C ATOM 2091 SD MET A 135 6.355 -11.645 -7.643 1.00 22.40 S ATOM 2092 CE MET A 135 4.878 -10.921 -8.372 1.00 15.21 C ATOM 0 H MET A 135 8.008 -14.193 -3.610 1.00 2.11 H new ATOM 0 HA MET A 135 5.588 -12.774 -3.427 1.00 21.05 H new ATOM 0 HB2 MET A 135 7.310 -12.299 -5.093 1.00 1.34 H new ATOM 0 HB3 MET A 135 7.261 -13.939 -5.707 1.00 1.34 H new ATOM 0 HG2 MET A 135 5.223 -13.596 -6.840 1.00 51.15 H new ATOM 0 HG3 MET A 135 4.816 -12.181 -5.889 1.00 51.15 H new ATOM 0 HE1 MET A 135 5.164 -10.115 -9.048 1.00 15.21 H new ATOM 0 HE2 MET A 135 4.334 -11.685 -8.927 1.00 15.21 H new ATOM 0 HE3 MET A 135 4.240 -10.523 -7.583 1.00 15.21 H new ATOM 2102 N GLN A 136 5.161 -15.936 -4.200 1.00 30.23 N ATOM 2103 CA GLN A 136 4.125 -16.985 -4.308 1.00 71.43 C ATOM 2104 C GLN A 136 3.301 -17.065 -3.013 1.00 34.24 C ATOM 2105 O GLN A 136 2.087 -17.068 -3.075 1.00 45.15 O ATOM 2106 CB GLN A 136 4.723 -18.380 -4.644 1.00 24.41 C ATOM 2107 CG GLN A 136 5.490 -18.465 -5.980 1.00 41.45 C ATOM 2108 CD GLN A 136 4.776 -17.790 -7.164 1.00 70.41 C ATOM 2109 OE1 GLN A 136 3.969 -18.401 -7.860 1.00 31.31 O ATOM 2110 NE2 GLN A 136 5.097 -16.526 -7.415 1.00 54.15 N ATOM 0 H GLN A 136 6.115 -16.295 -4.154 1.00 30.23 H new ATOM 0 HA GLN A 136 3.475 -16.701 -5.136 1.00 71.43 H new ATOM 0 HB2 GLN A 136 5.397 -18.672 -3.838 1.00 24.41 H new ATOM 0 HB3 GLN A 136 3.913 -19.109 -4.662 1.00 24.41 H new ATOM 0 HG2 GLN A 136 6.470 -18.006 -5.852 1.00 41.45 H new ATOM 0 HG3 GLN A 136 5.658 -19.514 -6.223 1.00 41.45 H new ATOM 0 HE21 GLN A 136 5.770 -16.043 -6.820 1.00 54.15 H new ATOM 0 HE22 GLN A 136 4.670 -16.038 -8.202 1.00 54.15 H new ATOM 2119 N LYS A 137 3.979 -17.103 -1.842 1.00 60.53 N ATOM 2120 CA LYS A 137 3.295 -17.202 -0.522 1.00 14.43 C ATOM 2121 C LYS A 137 2.354 -15.988 -0.266 1.00 55.14 C ATOM 2122 O LYS A 137 1.271 -16.139 0.323 1.00 20.21 O ATOM 2123 CB LYS A 137 4.332 -17.369 0.630 1.00 10.40 C ATOM 2124 CG LYS A 137 3.714 -17.526 2.040 1.00 51.31 C ATOM 2125 CD LYS A 137 2.707 -18.700 2.131 1.00 61.01 C ATOM 2126 CE LYS A 137 2.005 -18.770 3.493 1.00 30.04 C ATOM 2127 NZ LYS A 137 2.939 -19.082 4.600 1.00 24.32 N ATOM 0 H LYS A 137 4.996 -17.067 -1.780 1.00 60.53 H new ATOM 0 HA LYS A 137 2.668 -18.093 -0.543 1.00 14.43 H new ATOM 0 HB2 LYS A 137 4.950 -18.242 0.420 1.00 10.40 H new ATOM 0 HB3 LYS A 137 4.994 -16.503 0.633 1.00 10.40 H new ATOM 0 HG2 LYS A 137 4.512 -17.682 2.766 1.00 51.31 H new ATOM 0 HG3 LYS A 137 3.210 -16.600 2.315 1.00 51.31 H new ATOM 0 HD2 LYS A 137 1.959 -18.594 1.346 1.00 61.01 H new ATOM 0 HD3 LYS A 137 3.231 -19.638 1.948 1.00 61.01 H new ATOM 0 HE2 LYS A 137 1.514 -17.818 3.694 1.00 30.04 H new ATOM 0 HE3 LYS A 137 1.224 -19.530 3.456 1.00 30.04 H new ATOM 0 HZ1 LYS A 137 2.410 -19.495 5.395 1.00 24.32 H new ATOM 0 HZ2 LYS A 137 3.654 -19.761 4.270 1.00 24.32 H new ATOM 0 HZ3 LYS A 137 3.410 -18.209 4.914 1.00 24.32 H new ATOM 2141 N MET A 138 2.777 -14.800 -0.732 1.00 2.02 N ATOM 2142 CA MET A 138 1.936 -13.577 -0.719 1.00 45.52 C ATOM 2143 C MET A 138 0.619 -13.818 -1.515 1.00 21.44 C ATOM 2144 O MET A 138 -0.482 -13.490 -1.064 1.00 44.31 O ATOM 2145 CB MET A 138 2.729 -12.392 -1.351 1.00 3.42 C ATOM 2146 CG MET A 138 4.134 -12.104 -0.754 1.00 65.44 C ATOM 2147 SD MET A 138 4.154 -10.881 0.583 1.00 53.31 S ATOM 2148 CE MET A 138 3.402 -11.753 1.955 1.00 3.14 C ATOM 0 H MET A 138 3.706 -14.654 -1.128 1.00 2.02 H new ATOM 0 HA MET A 138 1.680 -13.333 0.312 1.00 45.52 H new ATOM 0 HB2 MET A 138 2.845 -12.588 -2.417 1.00 3.42 H new ATOM 0 HB3 MET A 138 2.126 -11.489 -1.257 1.00 3.42 H new ATOM 0 HG2 MET A 138 4.553 -13.038 -0.380 1.00 65.44 H new ATOM 0 HG3 MET A 138 4.789 -11.759 -1.554 1.00 65.44 H new ATOM 0 HE1 MET A 138 3.507 -11.161 2.864 1.00 3.14 H new ATOM 0 HE2 MET A 138 2.344 -11.915 1.748 1.00 3.14 H new ATOM 0 HE3 MET A 138 3.896 -12.715 2.090 1.00 3.14 H new ATOM 2158 N ALA A 139 0.782 -14.427 -2.698 1.00 54.43 N ATOM 2159 CA ALA A 139 -0.319 -14.755 -3.627 1.00 24.20 C ATOM 2160 C ALA A 139 -1.214 -15.926 -3.125 1.00 41.41 C ATOM 2161 O ALA A 139 -2.418 -15.948 -3.403 1.00 61.03 O ATOM 2162 CB ALA A 139 0.280 -15.079 -5.003 1.00 72.43 C ATOM 0 H ALA A 139 1.697 -14.712 -3.046 1.00 54.43 H new ATOM 0 HA ALA A 139 -0.975 -13.887 -3.691 1.00 24.20 H new ATOM 0 HB1 ALA A 139 -0.521 -15.323 -5.700 1.00 72.43 H new ATOM 0 HB2 ALA A 139 0.831 -14.214 -5.373 1.00 72.43 H new ATOM 0 HB3 ALA A 139 0.956 -15.930 -4.914 1.00 72.43 H new ATOM 2168 N GLU A 140 -0.617 -16.885 -2.379 1.00 13.11 N ATOM 2169 CA GLU A 140 -1.337 -18.071 -1.839 1.00 74.22 C ATOM 2170 C GLU A 140 -2.387 -17.657 -0.791 1.00 30.31 C ATOM 2171 O GLU A 140 -3.509 -18.174 -0.774 1.00 1.12 O ATOM 2172 CB GLU A 140 -0.342 -19.087 -1.203 1.00 34.13 C ATOM 2173 CG GLU A 140 0.676 -19.718 -2.175 1.00 44.35 C ATOM 2174 CD GLU A 140 0.045 -20.615 -3.255 1.00 71.21 C ATOM 2175 OE1 GLU A 140 -0.372 -20.101 -4.320 1.00 21.22 O ATOM 2176 OE2 GLU A 140 -0.027 -21.844 -3.054 1.00 42.50 O ATOM 0 H GLU A 140 0.373 -16.862 -2.133 1.00 13.11 H new ATOM 0 HA GLU A 140 -1.846 -18.548 -2.677 1.00 74.22 H new ATOM 0 HB2 GLU A 140 0.206 -18.582 -0.408 1.00 34.13 H new ATOM 0 HB3 GLU A 140 -0.916 -19.887 -0.736 1.00 34.13 H new ATOM 0 HG2 GLU A 140 1.237 -18.921 -2.663 1.00 44.35 H new ATOM 0 HG3 GLU A 140 1.392 -20.307 -1.602 1.00 44.35 H new ATOM 2183 N MET A 141 -1.992 -16.723 0.088 1.00 14.14 N ATOM 2184 CA MET A 141 -2.895 -16.123 1.097 1.00 30.10 C ATOM 2185 C MET A 141 -3.903 -15.147 0.432 1.00 2.22 C ATOM 2186 O MET A 141 -4.978 -14.879 0.978 1.00 64.10 O ATOM 2187 CB MET A 141 -2.058 -15.383 2.173 1.00 21.13 C ATOM 2188 CG MET A 141 -0.990 -16.251 2.860 1.00 31.25 C ATOM 2189 SD MET A 141 -0.038 -15.341 4.102 1.00 43.25 S ATOM 2190 CE MET A 141 0.622 -13.976 3.139 1.00 33.41 C ATOM 0 H MET A 141 -1.040 -16.359 0.124 1.00 14.14 H new ATOM 0 HA MET A 141 -3.465 -16.922 1.571 1.00 30.10 H new ATOM 0 HB2 MET A 141 -1.568 -14.527 1.709 1.00 21.13 H new ATOM 0 HB3 MET A 141 -2.733 -14.990 2.933 1.00 21.13 H new ATOM 0 HG2 MET A 141 -1.473 -17.106 3.334 1.00 31.25 H new ATOM 0 HG3 MET A 141 -0.310 -16.647 2.106 1.00 31.25 H new ATOM 0 HE1 MET A 141 1.352 -13.429 3.736 1.00 33.41 H new ATOM 0 HE2 MET A 141 1.104 -14.363 2.241 1.00 33.41 H new ATOM 0 HE3 MET A 141 -0.189 -13.306 2.855 1.00 33.41 H new ATOM 2200 N GLY A 142 -3.535 -14.629 -0.758 1.00 70.32 N ATOM 2201 CA GLY A 142 -4.363 -13.656 -1.483 1.00 12.31 C ATOM 2202 C GLY A 142 -4.148 -12.221 -1.004 1.00 71.33 C ATOM 2203 O GLY A 142 -5.051 -11.385 -1.113 1.00 72.03 O ATOM 0 H GLY A 142 -2.666 -14.872 -1.234 1.00 70.32 H new ATOM 0 HA2 GLY A 142 -4.138 -13.716 -2.548 1.00 12.31 H new ATOM 0 HA3 GLY A 142 -5.414 -13.920 -1.364 1.00 12.31 H new ATOM 2207 N MET A 143 -2.937 -11.944 -0.473 1.00 71.14 N ATOM 2208 CA MET A 143 -2.508 -10.589 -0.039 1.00 53.43 C ATOM 2209 C MET A 143 -2.561 -9.583 -1.216 1.00 24.45 C ATOM 2210 O MET A 143 -2.856 -8.402 -1.020 1.00 34.50 O ATOM 2211 CB MET A 143 -1.065 -10.647 0.538 1.00 10.00 C ATOM 2212 CG MET A 143 -0.486 -9.286 0.983 1.00 71.11 C ATOM 2213 SD MET A 143 1.281 -9.369 1.332 1.00 24.43 S ATOM 2214 CE MET A 143 1.686 -7.647 1.655 1.00 4.23 C ATOM 0 H MET A 143 -2.222 -12.657 -0.331 1.00 71.14 H new ATOM 0 HA MET A 143 -3.196 -10.248 0.735 1.00 53.43 H new ATOM 0 HB2 MET A 143 -1.058 -11.325 1.392 1.00 10.00 H new ATOM 0 HB3 MET A 143 -0.405 -11.077 -0.216 1.00 10.00 H new ATOM 0 HG2 MET A 143 -0.665 -8.546 0.203 1.00 71.11 H new ATOM 0 HG3 MET A 143 -1.013 -8.944 1.873 1.00 71.11 H new ATOM 0 HE1 MET A 143 2.748 -7.560 1.884 1.00 4.23 H new ATOM 0 HE2 MET A 143 1.454 -7.047 0.775 1.00 4.23 H new ATOM 0 HE3 MET A 143 1.102 -7.289 2.502 1.00 4.23 H new ATOM 2224 N GLU A 144 -2.268 -10.080 -2.433 1.00 3.11 N ATOM 2225 CA GLU A 144 -2.348 -9.282 -3.673 1.00 3.23 C ATOM 2226 C GLU A 144 -3.787 -8.724 -3.908 1.00 74.12 C ATOM 2227 O GLU A 144 -3.963 -7.546 -4.256 1.00 32.04 O ATOM 2228 CB GLU A 144 -1.877 -10.130 -4.889 1.00 4.01 C ATOM 2229 CG GLU A 144 -2.724 -11.381 -5.195 1.00 71.34 C ATOM 2230 CD GLU A 144 -2.387 -12.004 -6.556 1.00 72.23 C ATOM 2231 OE1 GLU A 144 -2.940 -11.552 -7.581 1.00 50.02 O ATOM 2232 OE2 GLU A 144 -1.562 -12.930 -6.610 1.00 52.23 O ATOM 0 H GLU A 144 -1.970 -11.044 -2.585 1.00 3.11 H new ATOM 0 HA GLU A 144 -1.683 -8.425 -3.564 1.00 3.23 H new ATOM 0 HB2 GLU A 144 -1.870 -9.492 -5.773 1.00 4.01 H new ATOM 0 HB3 GLU A 144 -0.848 -10.444 -4.714 1.00 4.01 H new ATOM 0 HG2 GLU A 144 -2.567 -12.122 -4.411 1.00 71.34 H new ATOM 0 HG3 GLU A 144 -3.781 -11.114 -5.174 1.00 71.34 H new ATOM 2239 N GLU A 145 -4.803 -9.586 -3.684 1.00 63.22 N ATOM 2240 CA GLU A 145 -6.231 -9.227 -3.809 1.00 33.13 C ATOM 2241 C GLU A 145 -6.708 -8.385 -2.604 1.00 13.22 C ATOM 2242 O GLU A 145 -7.558 -7.520 -2.758 1.00 21.25 O ATOM 2243 CB GLU A 145 -7.083 -10.516 -3.953 1.00 60.14 C ATOM 2244 CG GLU A 145 -6.716 -11.381 -5.177 1.00 22.04 C ATOM 2245 CD GLU A 145 -7.616 -12.618 -5.330 1.00 35.20 C ATOM 2246 OE1 GLU A 145 -8.713 -12.495 -5.918 1.00 61.22 O ATOM 2247 OE2 GLU A 145 -7.240 -13.713 -4.856 1.00 34.31 O ATOM 0 H GLU A 145 -4.653 -10.557 -3.410 1.00 63.22 H new ATOM 0 HA GLU A 145 -6.357 -8.615 -4.702 1.00 33.13 H new ATOM 0 HB2 GLU A 145 -6.969 -11.116 -3.050 1.00 60.14 H new ATOM 0 HB3 GLU A 145 -8.135 -10.238 -4.021 1.00 60.14 H new ATOM 0 HG2 GLU A 145 -6.787 -10.773 -6.079 1.00 22.04 H new ATOM 0 HG3 GLU A 145 -5.678 -11.702 -5.090 1.00 22.04 H new ATOM 2254 N GLY A 146 -6.126 -8.647 -1.416 1.00 64.41 N ATOM 2255 CA GLY A 146 -6.422 -7.869 -0.202 1.00 12.33 C ATOM 2256 C GLY A 146 -5.931 -6.418 -0.291 1.00 60.51 C ATOM 2257 O GLY A 146 -6.577 -5.497 0.229 1.00 45.40 O ATOM 0 H GLY A 146 -5.447 -9.394 -1.274 1.00 64.41 H new ATOM 0 HA2 GLY A 146 -7.498 -7.874 -0.026 1.00 12.33 H new ATOM 0 HA3 GLY A 146 -5.957 -8.353 0.657 1.00 12.33 H new ATOM 2261 N MET A 147 -4.779 -6.221 -0.973 1.00 2.44 N ATOM 2262 CA MET A 147 -4.222 -4.875 -1.243 1.00 21.44 C ATOM 2263 C MET A 147 -5.058 -4.164 -2.331 1.00 52.13 C ATOM 2264 O MET A 147 -5.198 -2.944 -2.316 1.00 1.31 O ATOM 2265 CB MET A 147 -2.727 -4.949 -1.683 1.00 12.20 C ATOM 2266 CG MET A 147 -1.961 -3.618 -1.516 1.00 42.42 C ATOM 2267 SD MET A 147 -0.258 -3.678 -2.127 1.00 65.21 S ATOM 2268 CE MET A 147 -0.504 -3.694 -3.902 1.00 32.11 C ATOM 0 H MET A 147 -4.214 -6.983 -1.348 1.00 2.44 H new ATOM 0 HA MET A 147 -4.270 -4.303 -0.316 1.00 21.44 H new ATOM 0 HB2 MET A 147 -2.225 -5.722 -1.101 1.00 12.20 H new ATOM 0 HB3 MET A 147 -2.680 -5.256 -2.728 1.00 12.20 H new ATOM 0 HG2 MET A 147 -2.499 -2.830 -2.043 1.00 42.42 H new ATOM 0 HG3 MET A 147 -1.950 -3.345 -0.461 1.00 42.42 H new ATOM 0 HE1 MET A 147 0.460 -3.784 -4.402 1.00 32.11 H new ATOM 0 HE2 MET A 147 -1.134 -4.540 -4.174 1.00 32.11 H new ATOM 0 HE3 MET A 147 -0.988 -2.767 -4.211 1.00 32.11 H new ATOM 2278 N ARG A 148 -5.603 -4.956 -3.276 1.00 44.15 N ATOM 2279 CA ARG A 148 -6.519 -4.451 -4.318 1.00 50.51 C ATOM 2280 C ARG A 148 -7.846 -3.958 -3.685 1.00 74.12 C ATOM 2281 O ARG A 148 -8.344 -2.904 -4.056 1.00 45.30 O ATOM 2282 CB ARG A 148 -6.794 -5.553 -5.376 1.00 62.32 C ATOM 2283 CG ARG A 148 -7.691 -5.107 -6.557 1.00 2.53 C ATOM 2284 CD ARG A 148 -8.025 -6.263 -7.517 1.00 42.22 C ATOM 2285 NE ARG A 148 -8.873 -5.837 -8.645 1.00 64.10 N ATOM 2286 CZ ARG A 148 -10.190 -5.917 -8.695 1.00 53.40 C ATOM 2287 NH1 ARG A 148 -10.886 -6.299 -7.671 1.00 62.32 N ATOM 2288 NH2 ARG A 148 -10.802 -5.577 -9.781 1.00 75.23 N ATOM 0 H ARG A 148 -5.422 -5.958 -3.338 1.00 44.15 H new ATOM 0 HA ARG A 148 -6.044 -3.606 -4.816 1.00 50.51 H new ATOM 0 HB2 ARG A 148 -5.841 -5.902 -5.773 1.00 62.32 H new ATOM 0 HB3 ARG A 148 -7.264 -6.403 -4.882 1.00 62.32 H new ATOM 0 HG2 ARG A 148 -8.617 -4.686 -6.166 1.00 2.53 H new ATOM 0 HG3 ARG A 148 -7.189 -4.314 -7.111 1.00 2.53 H new ATOM 0 HD2 ARG A 148 -7.099 -6.688 -7.904 1.00 42.22 H new ATOM 0 HD3 ARG A 148 -8.532 -7.054 -6.965 1.00 42.22 H new ATOM 0 HE ARG A 148 -8.400 -5.445 -9.460 1.00 64.10 H new ATOM 0 HH11 ARG A 148 -10.417 -6.547 -6.800 1.00 62.32 H new ATOM 0 HH12 ARG A 148 -11.903 -6.352 -7.736 1.00 62.32 H new ATOM 0 HH21 ARG A 148 -10.268 -5.251 -10.587 1.00 75.23 H new ATOM 0 HH22 ARG A 148 -11.819 -5.634 -9.833 1.00 75.23 H new ATOM 2302 N GLU A 149 -8.383 -4.736 -2.711 1.00 3.14 N ATOM 2303 CA GLU A 149 -9.622 -4.387 -1.957 1.00 61.14 C ATOM 2304 C GLU A 149 -9.425 -3.130 -1.087 1.00 21.42 C ATOM 2305 O GLU A 149 -10.374 -2.374 -0.845 1.00 20.12 O ATOM 2306 CB GLU A 149 -10.085 -5.575 -1.071 1.00 2.11 C ATOM 2307 CG GLU A 149 -10.533 -6.826 -1.841 1.00 64.42 C ATOM 2308 CD GLU A 149 -10.960 -7.967 -0.905 1.00 54.42 C ATOM 2309 OE1 GLU A 149 -10.091 -8.525 -0.200 1.00 11.11 O ATOM 2310 OE2 GLU A 149 -12.167 -8.299 -0.844 1.00 74.24 O ATOM 0 H GLU A 149 -7.972 -5.624 -2.424 1.00 3.14 H new ATOM 0 HA GLU A 149 -10.395 -4.172 -2.695 1.00 61.14 H new ATOM 0 HB2 GLU A 149 -9.268 -5.851 -0.404 1.00 2.11 H new ATOM 0 HB3 GLU A 149 -10.910 -5.239 -0.442 1.00 2.11 H new ATOM 0 HG2 GLU A 149 -11.364 -6.567 -2.497 1.00 64.42 H new ATOM 0 HG3 GLU A 149 -9.718 -7.168 -2.479 1.00 64.42 H new ATOM 2317 N ALA A 150 -8.186 -2.944 -0.601 1.00 10.41 N ATOM 2318 CA ALA A 150 -7.762 -1.702 0.078 1.00 44.41 C ATOM 2319 C ALA A 150 -7.924 -0.482 -0.867 1.00 54.04 C ATOM 2320 O ALA A 150 -8.464 0.559 -0.483 1.00 34.05 O ATOM 2321 CB ALA A 150 -6.305 -1.842 0.552 1.00 21.12 C ATOM 0 H ALA A 150 -7.450 -3.647 -0.666 1.00 10.41 H new ATOM 0 HA ALA A 150 -8.398 -1.536 0.948 1.00 44.41 H new ATOM 0 HB1 ALA A 150 -5.995 -0.924 1.052 1.00 21.12 H new ATOM 0 HB2 ALA A 150 -6.227 -2.678 1.247 1.00 21.12 H new ATOM 0 HB3 ALA A 150 -5.659 -2.023 -0.307 1.00 21.12 H new ATOM 2327 N ILE A 151 -7.467 -0.661 -2.120 1.00 41.25 N ATOM 2328 CA ILE A 151 -7.546 0.370 -3.182 1.00 1.40 C ATOM 2329 C ILE A 151 -8.999 0.540 -3.714 1.00 33.02 C ATOM 2330 O ILE A 151 -9.389 1.620 -4.179 1.00 53.30 O ATOM 2331 CB ILE A 151 -6.539 0.019 -4.342 1.00 71.25 C ATOM 2332 CG1 ILE A 151 -5.090 -0.131 -3.769 1.00 22.12 C ATOM 2333 CG2 ILE A 151 -6.567 1.082 -5.466 1.00 4.43 C ATOM 2334 CD1 ILE A 151 -4.071 -0.692 -4.745 1.00 54.21 C ATOM 0 H ILE A 151 -7.029 -1.529 -2.430 1.00 41.25 H new ATOM 0 HA ILE A 151 -7.260 1.330 -2.753 1.00 1.40 H new ATOM 0 HB ILE A 151 -6.852 -0.929 -4.780 1.00 71.25 H new ATOM 0 HG12 ILE A 151 -4.746 0.846 -3.429 1.00 22.12 H new ATOM 0 HG13 ILE A 151 -5.127 -0.778 -2.893 1.00 22.12 H new ATOM 0 HG21 ILE A 151 -5.859 0.804 -6.247 1.00 4.43 H new ATOM 0 HG22 ILE A 151 -7.570 1.138 -5.889 1.00 4.43 H new ATOM 0 HG23 ILE A 151 -6.291 2.053 -5.055 1.00 4.43 H new ATOM 0 HD11 ILE A 151 -3.098 -0.759 -4.257 1.00 54.21 H new ATOM 0 HD12 ILE A 151 -4.384 -1.685 -5.067 1.00 54.21 H new ATOM 0 HD13 ILE A 151 -3.998 -0.036 -5.612 1.00 54.21 H new ATOM 2346 N GLU A 152 -9.802 -0.532 -3.614 1.00 40.44 N ATOM 2347 CA GLU A 152 -11.247 -0.497 -3.934 1.00 22.44 C ATOM 2348 C GLU A 152 -12.029 0.291 -2.852 1.00 43.10 C ATOM 2349 O GLU A 152 -13.076 0.881 -3.140 1.00 23.41 O ATOM 2350 CB GLU A 152 -11.804 -1.948 -4.091 1.00 51.43 C ATOM 2351 CG GLU A 152 -11.265 -2.698 -5.333 1.00 64.33 C ATOM 2352 CD GLU A 152 -11.712 -4.170 -5.422 1.00 62.03 C ATOM 2353 OE1 GLU A 152 -12.837 -4.436 -5.908 1.00 4.03 O ATOM 2354 OE2 GLU A 152 -10.930 -5.071 -5.032 1.00 51.22 O ATOM 0 H GLU A 152 -9.473 -1.448 -3.310 1.00 40.44 H new ATOM 0 HA GLU A 152 -11.381 0.021 -4.883 1.00 22.44 H new ATOM 0 HB2 GLU A 152 -11.555 -2.520 -3.197 1.00 51.43 H new ATOM 0 HB3 GLU A 152 -12.892 -1.904 -4.149 1.00 51.43 H new ATOM 0 HG2 GLU A 152 -11.594 -2.175 -6.231 1.00 64.33 H new ATOM 0 HG3 GLU A 152 -10.176 -2.660 -5.323 1.00 64.33 H new ATOM 2361 N GLN A 153 -11.491 0.315 -1.617 1.00 40.04 N ATOM 2362 CA GLN A 153 -12.087 1.063 -0.486 1.00 34.23 C ATOM 2363 C GLN A 153 -11.562 2.527 -0.430 1.00 11.22 C ATOM 2364 O GLN A 153 -12.161 3.380 0.234 1.00 41.53 O ATOM 2365 CB GLN A 153 -11.828 0.304 0.842 1.00 71.32 C ATOM 2366 CG GLN A 153 -12.560 0.891 2.072 1.00 64.20 C ATOM 2367 CD GLN A 153 -12.639 -0.082 3.244 1.00 13.43 C ATOM 2368 OE1 GLN A 153 -13.595 -0.832 3.374 1.00 14.10 O ATOM 2369 NE2 GLN A 153 -11.635 -0.092 4.085 1.00 5.05 N ATOM 0 H GLN A 153 -10.634 -0.181 -1.373 1.00 40.04 H new ATOM 0 HA GLN A 153 -13.164 1.127 -0.639 1.00 34.23 H new ATOM 0 HB2 GLN A 153 -12.132 -0.735 0.717 1.00 71.32 H new ATOM 0 HB3 GLN A 153 -10.756 0.301 1.041 1.00 71.32 H new ATOM 0 HG2 GLN A 153 -12.047 1.797 2.394 1.00 64.20 H new ATOM 0 HG3 GLN A 153 -13.569 1.183 1.781 1.00 64.20 H new ATOM 0 HE21 GLN A 153 -10.851 0.546 3.950 1.00 5.05 H new ATOM 0 HE22 GLN A 153 -11.637 -0.738 4.874 1.00 5.05 H new ATOM 2378 N ILE A 154 -10.446 2.819 -1.148 1.00 62.54 N ATOM 2379 CA ILE A 154 -9.970 4.219 -1.373 1.00 35.21 C ATOM 2380 C ILE A 154 -11.058 5.073 -2.064 1.00 42.33 C ATOM 2381 O ILE A 154 -11.135 6.290 -1.857 1.00 32.42 O ATOM 2382 CB ILE A 154 -8.643 4.255 -2.226 1.00 74.32 C ATOM 2383 CG1 ILE A 154 -7.475 3.625 -1.423 1.00 64.14 C ATOM 2384 CG2 ILE A 154 -8.270 5.683 -2.696 1.00 40.35 C ATOM 2385 CD1 ILE A 154 -6.136 3.624 -2.137 1.00 44.52 C ATOM 0 H ILE A 154 -9.857 2.108 -1.582 1.00 62.54 H new ATOM 0 HA ILE A 154 -9.758 4.642 -0.391 1.00 35.21 H new ATOM 0 HB ILE A 154 -8.825 3.667 -3.126 1.00 74.32 H new ATOM 0 HG12 ILE A 154 -7.368 4.164 -0.482 1.00 64.14 H new ATOM 0 HG13 ILE A 154 -7.738 2.597 -1.173 1.00 64.14 H new ATOM 0 HG21 ILE A 154 -7.349 5.646 -3.278 1.00 40.35 H new ATOM 0 HG22 ILE A 154 -9.073 6.084 -3.314 1.00 40.35 H new ATOM 0 HG23 ILE A 154 -8.125 6.326 -1.828 1.00 40.35 H new ATOM 0 HD11 ILE A 154 -5.383 3.164 -1.497 1.00 44.52 H new ATOM 0 HD12 ILE A 154 -6.219 3.058 -3.065 1.00 44.52 H new ATOM 0 HD13 ILE A 154 -5.843 4.649 -2.363 1.00 44.52 H new ATOM 2397 N ASP A 155 -11.902 4.408 -2.875 1.00 12.34 N ATOM 2398 CA ASP A 155 -13.064 5.035 -3.532 1.00 14.34 C ATOM 2399 C ASP A 155 -14.003 5.665 -2.466 1.00 2.42 C ATOM 2400 O ASP A 155 -14.415 6.809 -2.590 1.00 5.34 O ATOM 2401 CB ASP A 155 -13.811 3.967 -4.380 1.00 22.43 C ATOM 2402 CG ASP A 155 -14.714 4.581 -5.460 1.00 3.14 C ATOM 2403 OD1 ASP A 155 -14.203 4.858 -6.567 1.00 23.11 O ATOM 2404 OD2 ASP A 155 -15.925 4.784 -5.217 1.00 23.40 O ATOM 0 H ASP A 155 -11.797 3.417 -3.094 1.00 12.34 H new ATOM 0 HA ASP A 155 -12.729 5.833 -4.194 1.00 14.34 H new ATOM 0 HB2 ASP A 155 -13.080 3.312 -4.855 1.00 22.43 H new ATOM 0 HB3 ASP A 155 -14.415 3.345 -3.720 1.00 22.43 H new ATOM 2409 N ALA A 156 -14.261 4.904 -1.385 1.00 74.51 N ATOM 2410 CA ALA A 156 -15.066 5.358 -0.218 1.00 31.33 C ATOM 2411 C ALA A 156 -14.358 6.462 0.602 1.00 4.41 C ATOM 2412 O ALA A 156 -15.019 7.287 1.207 1.00 52.11 O ATOM 2413 CB ALA A 156 -15.400 4.161 0.689 1.00 32.30 C ATOM 0 H ALA A 156 -13.917 3.948 -1.289 1.00 74.51 H new ATOM 0 HA ALA A 156 -15.985 5.792 -0.613 1.00 31.33 H new ATOM 0 HB1 ALA A 156 -15.989 4.503 1.540 1.00 32.30 H new ATOM 0 HB2 ALA A 156 -15.972 3.425 0.124 1.00 32.30 H new ATOM 0 HB3 ALA A 156 -14.476 3.706 1.046 1.00 32.30 H new ATOM 2419 N VAL A 157 -13.017 6.438 0.639 1.00 63.31 N ATOM 2420 CA VAL A 157 -12.210 7.422 1.414 1.00 33.51 C ATOM 2421 C VAL A 157 -12.169 8.810 0.709 1.00 61.34 C ATOM 2422 O VAL A 157 -12.318 9.848 1.355 1.00 3.34 O ATOM 2423 CB VAL A 157 -10.746 6.880 1.646 1.00 63.34 C ATOM 2424 CG1 VAL A 157 -9.857 7.894 2.418 1.00 64.43 C ATOM 2425 CG2 VAL A 157 -10.781 5.521 2.381 1.00 43.22 C ATOM 0 H VAL A 157 -12.456 5.747 0.141 1.00 63.31 H new ATOM 0 HA VAL A 157 -12.693 7.554 2.382 1.00 33.51 H new ATOM 0 HB VAL A 157 -10.296 6.741 0.663 1.00 63.34 H new ATOM 0 HG11 VAL A 157 -8.860 7.475 2.553 1.00 64.43 H new ATOM 0 HG12 VAL A 157 -9.787 8.822 1.851 1.00 64.43 H new ATOM 0 HG13 VAL A 157 -10.300 8.097 3.393 1.00 64.43 H new ATOM 0 HG21 VAL A 157 -9.763 5.163 2.532 1.00 43.22 H new ATOM 0 HG22 VAL A 157 -11.270 5.643 3.347 1.00 43.22 H new ATOM 0 HG23 VAL A 157 -11.335 4.798 1.782 1.00 43.22 H new ATOM 2435 N LEU A 158 -11.985 8.805 -0.625 1.00 12.31 N ATOM 2436 CA LEU A 158 -11.888 10.042 -1.445 1.00 61.53 C ATOM 2437 C LEU A 158 -13.274 10.574 -1.884 1.00 2.30 C ATOM 2438 O LEU A 158 -13.389 11.721 -2.327 1.00 42.32 O ATOM 2439 CB LEU A 158 -10.982 9.792 -2.682 1.00 60.12 C ATOM 2440 CG LEU A 158 -9.489 9.468 -2.356 1.00 2.15 C ATOM 2441 CD1 LEU A 158 -8.683 9.174 -3.631 1.00 1.11 C ATOM 2442 CD2 LEU A 158 -8.835 10.604 -1.539 1.00 24.34 C ATOM 0 H LEU A 158 -11.899 7.947 -1.170 1.00 12.31 H new ATOM 0 HA LEU A 158 -11.440 10.813 -0.818 1.00 61.53 H new ATOM 0 HB2 LEU A 158 -11.399 8.966 -3.258 1.00 60.12 H new ATOM 0 HB3 LEU A 158 -11.015 10.674 -3.321 1.00 60.12 H new ATOM 0 HG LEU A 158 -9.480 8.566 -1.744 1.00 2.15 H new ATOM 0 HD11 LEU A 158 -7.649 8.953 -3.365 1.00 1.11 H new ATOM 0 HD12 LEU A 158 -9.117 8.317 -4.146 1.00 1.11 H new ATOM 0 HD13 LEU A 158 -8.711 10.044 -4.288 1.00 1.11 H new ATOM 0 HD21 LEU A 158 -7.797 10.349 -1.328 1.00 24.34 H new ATOM 0 HD22 LEU A 158 -8.872 11.531 -2.111 1.00 24.34 H new ATOM 0 HD23 LEU A 158 -9.374 10.735 -0.601 1.00 24.34 H new ATOM 2454 N SER A 159 -14.313 9.727 -1.782 1.00 62.44 N ATOM 2455 CA SER A 159 -15.725 10.107 -2.078 1.00 55.10 C ATOM 2456 C SER A 159 -16.559 10.063 -0.781 1.00 72.03 C ATOM 2457 O SER A 159 -17.773 9.858 -0.821 1.00 3.54 O ATOM 2458 CB SER A 159 -16.311 9.116 -3.123 1.00 11.42 C ATOM 2459 OG SER A 159 -17.569 9.537 -3.634 1.00 62.44 O ATOM 0 H SER A 159 -14.208 8.755 -1.492 1.00 62.44 H new ATOM 0 HA SER A 159 -15.757 11.119 -2.482 1.00 55.10 H new ATOM 0 HB2 SER A 159 -15.607 9.006 -3.948 1.00 11.42 H new ATOM 0 HB3 SER A 159 -16.420 8.133 -2.664 1.00 11.42 H new ATOM 0 HG SER A 159 -18.169 9.753 -2.890 1.00 62.44 H new ATOM 2465 N GLU A 160 -15.893 10.327 0.360 1.00 2.13 N ATOM 2466 CA GLU A 160 -16.387 9.954 1.712 1.00 53.04 C ATOM 2467 C GLU A 160 -17.716 10.640 2.099 1.00 62.33 C ATOM 2468 O GLU A 160 -17.758 11.853 2.315 1.00 25.32 O ATOM 2469 CB GLU A 160 -15.292 10.231 2.771 1.00 62.54 C ATOM 2470 CG GLU A 160 -15.399 9.380 4.054 1.00 24.41 C ATOM 2471 CD GLU A 160 -14.413 9.819 5.150 1.00 73.15 C ATOM 2472 OE1 GLU A 160 -13.201 9.538 5.015 1.00 55.22 O ATOM 2473 OE2 GLU A 160 -14.833 10.463 6.141 1.00 0.15 O ATOM 0 H GLU A 160 -14.993 10.807 0.376 1.00 2.13 H new ATOM 0 HA GLU A 160 -16.606 8.887 1.681 1.00 53.04 H new ATOM 0 HB2 GLU A 160 -14.316 10.057 2.317 1.00 62.54 H new ATOM 0 HB3 GLU A 160 -15.332 11.285 3.047 1.00 62.54 H new ATOM 0 HG2 GLU A 160 -16.416 9.443 4.441 1.00 24.41 H new ATOM 0 HG3 GLU A 160 -15.216 8.334 3.806 1.00 24.41 H new ATOM 2480 N PRO A 161 -18.833 9.853 2.156 1.00 53.32 N ATOM 2481 CA PRO A 161 -20.155 10.321 2.594 1.00 71.52 C ATOM 2482 C PRO A 161 -20.507 9.826 4.035 1.00 5.25 C ATOM 2483 O PRO A 161 -19.660 9.859 4.934 1.00 63.23 O ATOM 2484 CB PRO A 161 -21.015 9.648 1.504 1.00 1.21 C ATOM 2485 CG PRO A 161 -20.394 8.279 1.340 1.00 61.43 C ATOM 2486 CD PRO A 161 -18.925 8.427 1.740 1.00 61.00 C ATOM 0 HA PRO A 161 -20.273 11.401 2.678 1.00 71.52 H new ATOM 0 HB2 PRO A 161 -22.060 9.578 1.807 1.00 1.21 H new ATOM 0 HB3 PRO A 161 -20.990 10.212 0.571 1.00 1.21 H new ATOM 0 HG2 PRO A 161 -20.897 7.545 1.970 1.00 61.43 H new ATOM 0 HG3 PRO A 161 -20.484 7.931 0.311 1.00 61.43 H new ATOM 0 HD2 PRO A 161 -18.658 7.752 2.553 1.00 61.00 H new ATOM 0 HD3 PRO A 161 -18.256 8.205 0.908 1.00 61.00 H new ATOM 2494 N ALA A 162 -21.765 9.394 4.241 1.00 41.04 N ATOM 2495 CA ALA A 162 -22.208 8.726 5.484 1.00 73.00 C ATOM 2496 C ALA A 162 -22.236 7.182 5.307 1.00 65.23 C ATOM 2497 O ALA A 162 -21.723 6.441 6.155 1.00 50.14 O ATOM 2498 CB ALA A 162 -23.597 9.245 5.886 1.00 50.32 C ATOM 0 H ALA A 162 -22.507 9.498 3.549 1.00 41.04 H new ATOM 0 HA ALA A 162 -21.496 8.959 6.276 1.00 73.00 H new ATOM 0 HB1 ALA A 162 -23.919 8.750 6.802 1.00 50.32 H new ATOM 0 HB2 ALA A 162 -23.549 10.321 6.052 1.00 50.32 H new ATOM 0 HB3 ALA A 162 -24.310 9.032 5.089 1.00 50.32 H new ATOM 2504 N ASN A 163 -22.847 6.722 4.195 1.00 12.21 N ATOM 2505 CA ASN A 163 -23.021 5.281 3.883 1.00 51.34 C ATOM 2506 C ASN A 163 -21.664 4.583 3.566 1.00 41.53 C ATOM 2507 O ASN A 163 -21.290 3.606 4.234 1.00 40.42 O ATOM 2508 CB ASN A 163 -24.016 5.126 2.695 1.00 32.12 C ATOM 2509 CG ASN A 163 -24.191 3.676 2.213 1.00 74.05 C ATOM 2510 OD1 ASN A 163 -25.038 2.944 2.700 1.00 15.04 O ATOM 2511 ND2 ASN A 163 -23.397 3.261 1.240 1.00 40.33 N ATOM 0 H ASN A 163 -23.236 7.340 3.483 1.00 12.21 H new ATOM 0 HA ASN A 163 -23.428 4.787 4.765 1.00 51.34 H new ATOM 0 HB2 ASN A 163 -24.988 5.519 2.994 1.00 32.12 H new ATOM 0 HB3 ASN A 163 -23.669 5.736 1.861 1.00 32.12 H new ATOM 0 HD21 ASN A 163 -23.485 2.311 0.880 1.00 40.33 H new ATOM 0 HD22 ASN A 163 -22.697 3.891 0.849 1.00 40.33 H new ATOM 2518 N ALA A 164 -20.967 5.100 2.524 1.00 45.11 N ATOM 2519 CA ALA A 164 -19.687 4.555 2.009 1.00 70.31 C ATOM 2520 C ALA A 164 -19.893 3.165 1.356 1.00 23.31 C ATOM 2521 O ALA A 164 -20.064 3.072 0.136 1.00 25.51 O ATOM 2522 CB ALA A 164 -18.580 4.546 3.091 1.00 11.04 C ATOM 0 H ALA A 164 -21.284 5.921 2.009 1.00 45.11 H new ATOM 0 HA ALA A 164 -19.335 5.226 1.226 1.00 70.31 H new ATOM 0 HB1 ALA A 164 -17.661 4.139 2.668 1.00 11.04 H new ATOM 0 HB2 ALA A 164 -18.400 5.564 3.436 1.00 11.04 H new ATOM 0 HB3 ALA A 164 -18.898 3.929 3.931 1.00 11.04 H new ATOM 2528 N LEU A 165 -19.924 2.095 2.187 1.00 50.44 N ATOM 2529 CA LEU A 165 -20.101 0.695 1.723 1.00 74.41 C ATOM 2530 C LEU A 165 -20.505 -0.245 2.887 1.00 62.25 C ATOM 2531 O LEU A 165 -20.331 0.096 4.062 1.00 70.13 O ATOM 2532 CB LEU A 165 -18.806 0.187 0.987 1.00 53.10 C ATOM 2533 CG LEU A 165 -17.408 0.389 1.706 1.00 2.33 C ATOM 2534 CD1 LEU A 165 -17.184 -0.572 2.900 1.00 53.24 C ATOM 2535 CD2 LEU A 165 -16.239 0.280 0.691 1.00 73.23 C ATOM 0 H LEU A 165 -19.827 2.177 3.199 1.00 50.44 H new ATOM 0 HA LEU A 165 -20.921 0.679 1.006 1.00 74.41 H new ATOM 0 HB2 LEU A 165 -18.930 -0.878 0.793 1.00 53.10 H new ATOM 0 HB3 LEU A 165 -18.757 0.684 0.018 1.00 53.10 H new ATOM 0 HG LEU A 165 -17.427 1.397 2.121 1.00 2.33 H new ATOM 0 HD11 LEU A 165 -16.208 -0.378 3.345 1.00 53.24 H new ATOM 0 HD12 LEU A 165 -17.961 -0.412 3.647 1.00 53.24 H new ATOM 0 HD13 LEU A 165 -17.225 -1.603 2.550 1.00 53.24 H new ATOM 0 HD21 LEU A 165 -15.291 0.422 1.211 1.00 73.23 H new ATOM 0 HD22 LEU A 165 -16.253 -0.705 0.225 1.00 73.23 H new ATOM 0 HD23 LEU A 165 -16.351 1.046 -0.076 1.00 73.23 H new ATOM 2547 N GLU A 166 -21.036 -1.440 2.538 1.00 73.14 N ATOM 2548 CA GLU A 166 -21.383 -2.498 3.511 1.00 53.13 C ATOM 2549 C GLU A 166 -21.531 -3.871 2.799 1.00 24.02 C ATOM 2550 O GLU A 166 -20.652 -4.730 2.909 1.00 1.43 O ATOM 2551 CB GLU A 166 -22.682 -2.136 4.289 1.00 2.54 C ATOM 2552 CG GLU A 166 -23.073 -3.159 5.372 1.00 21.03 C ATOM 2553 CD GLU A 166 -24.384 -2.814 6.098 1.00 34.11 C ATOM 2554 OE1 GLU A 166 -25.457 -2.932 5.471 1.00 0.51 O ATOM 2555 OE2 GLU A 166 -24.352 -2.426 7.292 1.00 5.40 O ATOM 0 H GLU A 166 -21.236 -1.696 1.571 1.00 73.14 H new ATOM 0 HA GLU A 166 -20.570 -2.573 4.233 1.00 53.13 H new ATOM 0 HB2 GLU A 166 -22.552 -1.160 4.756 1.00 2.54 H new ATOM 0 HB3 GLU A 166 -23.504 -2.043 3.579 1.00 2.54 H new ATOM 0 HG2 GLU A 166 -23.169 -4.143 4.913 1.00 21.03 H new ATOM 0 HG3 GLU A 166 -22.268 -3.226 6.104 1.00 21.03 H new ATOM 2562 N HIS A 167 -22.648 -4.066 2.058 1.00 24.53 N ATOM 2563 CA HIS A 167 -22.934 -5.327 1.324 1.00 13.55 C ATOM 2564 C HIS A 167 -22.901 -5.094 -0.207 1.00 62.41 C ATOM 2565 O HIS A 167 -23.839 -4.534 -0.783 1.00 14.14 O ATOM 2566 CB HIS A 167 -24.315 -5.904 1.740 1.00 35.20 C ATOM 2567 CG HIS A 167 -24.438 -6.262 3.200 1.00 44.51 C ATOM 2568 ND1 HIS A 167 -25.385 -5.715 4.038 1.00 65.22 N ATOM 2569 CD2 HIS A 167 -23.758 -7.153 3.951 1.00 43.10 C ATOM 2570 CE1 HIS A 167 -25.285 -6.258 5.233 1.00 41.11 C ATOM 2571 NE2 HIS A 167 -24.308 -7.135 5.209 1.00 22.22 N ATOM 0 H HIS A 167 -23.375 -3.358 1.951 1.00 24.53 H new ATOM 0 HA HIS A 167 -22.158 -6.047 1.585 1.00 13.55 H new ATOM 0 HB2 HIS A 167 -25.087 -5.175 1.493 1.00 35.20 H new ATOM 0 HB3 HIS A 167 -24.515 -6.794 1.144 1.00 35.20 H new ATOM 0 HD2 HIS A 167 -22.933 -7.768 3.623 1.00 43.10 H new ATOM 0 HE1 HIS A 167 -25.902 -6.022 6.088 1.00 41.11 H new ATOM 0 HE2 HIS A 167 -24.007 -7.709 5.996 1.00 22.22 H new ATOM 2580 N HIS A 168 -21.800 -5.517 -0.851 1.00 63.24 N ATOM 2581 CA HIS A 168 -21.659 -5.487 -2.326 1.00 23.05 C ATOM 2582 C HIS A 168 -20.988 -6.786 -2.825 1.00 70.03 C ATOM 2583 O HIS A 168 -21.504 -7.449 -3.731 1.00 63.14 O ATOM 2584 CB HIS A 168 -20.831 -4.251 -2.776 1.00 51.43 C ATOM 2585 CG HIS A 168 -20.760 -4.061 -4.276 1.00 4.51 C ATOM 2586 ND1 HIS A 168 -19.781 -4.627 -5.068 1.00 65.54 N ATOM 2587 CD2 HIS A 168 -21.559 -3.368 -5.122 1.00 75.34 C ATOM 2588 CE1 HIS A 168 -19.978 -4.293 -6.325 1.00 53.43 C ATOM 2589 NE2 HIS A 168 -21.048 -3.530 -6.386 1.00 43.53 N ATOM 0 H HIS A 168 -20.982 -5.889 -0.370 1.00 63.24 H new ATOM 0 HA HIS A 168 -22.655 -5.412 -2.763 1.00 23.05 H new ATOM 0 HB2 HIS A 168 -21.263 -3.356 -2.328 1.00 51.43 H new ATOM 0 HB3 HIS A 168 -19.818 -4.345 -2.385 1.00 51.43 H new ATOM 0 HD1 HIS A 168 -19.020 -5.215 -4.729 1.00 65.54 H new ATOM 0 HD2 HIS A 168 -22.434 -2.795 -4.853 1.00 75.34 H new ATOM 0 HE1 HIS A 168 -19.366 -4.593 -7.163 1.00 53.43 H new ATOM 2598 N HIS A 169 -19.822 -7.120 -2.216 1.00 75.31 N ATOM 2599 CA HIS A 169 -18.996 -8.307 -2.579 1.00 14.14 C ATOM 2600 C HIS A 169 -18.497 -8.240 -4.054 1.00 3.23 C ATOM 2601 O HIS A 169 -18.484 -7.167 -4.671 1.00 64.32 O ATOM 2602 CB HIS A 169 -19.769 -9.635 -2.306 1.00 15.24 C ATOM 2603 CG HIS A 169 -20.156 -9.850 -0.863 1.00 32.41 C ATOM 2604 ND1 HIS A 169 -19.434 -10.646 -0.006 1.00 44.21 N ATOM 2605 CD2 HIS A 169 -21.214 -9.398 -0.143 1.00 32.45 C ATOM 2606 CE1 HIS A 169 -20.020 -10.681 1.170 1.00 23.12 C ATOM 2607 NE2 HIS A 169 -21.101 -9.933 1.116 1.00 51.32 N ATOM 0 H HIS A 169 -19.423 -6.572 -1.454 1.00 75.31 H new ATOM 0 HA HIS A 169 -18.113 -8.293 -1.940 1.00 14.14 H new ATOM 0 HB2 HIS A 169 -20.672 -9.647 -2.917 1.00 15.24 H new ATOM 0 HB3 HIS A 169 -19.153 -10.473 -2.632 1.00 15.24 H new ATOM 0 HD2 HIS A 169 -21.997 -8.742 -0.494 1.00 32.45 H new ATOM 0 HE1 HIS A 169 -19.673 -11.230 2.033 1.00 23.12 H new ATOM 0 HE2 HIS A 169 -21.751 -9.776 1.886 1.00 51.32 H new ATOM 2616 N HIS A 170 -18.031 -9.383 -4.586 1.00 21.43 N ATOM 2617 CA HIS A 170 -17.683 -9.532 -6.015 1.00 23.02 C ATOM 2618 C HIS A 170 -18.200 -10.905 -6.515 1.00 52.42 C ATOM 2619 O HIS A 170 -18.855 -10.997 -7.557 1.00 33.12 O ATOM 2620 CB HIS A 170 -16.148 -9.385 -6.216 1.00 2.10 C ATOM 2621 CG HIS A 170 -15.737 -9.160 -7.653 1.00 20.12 C ATOM 2622 ND1 HIS A 170 -15.317 -10.172 -8.484 1.00 62.31 N ATOM 2623 CD2 HIS A 170 -15.681 -8.028 -8.398 1.00 54.10 C ATOM 2624 CE1 HIS A 170 -15.030 -9.682 -9.672 1.00 12.34 C ATOM 2625 NE2 HIS A 170 -15.237 -8.385 -9.648 1.00 42.21 N ATOM 0 H HIS A 170 -17.884 -10.232 -4.040 1.00 21.43 H new ATOM 0 HA HIS A 170 -18.159 -8.746 -6.601 1.00 23.02 H new ATOM 0 HB2 HIS A 170 -15.791 -8.551 -5.611 1.00 2.10 H new ATOM 0 HB3 HIS A 170 -15.655 -10.283 -5.844 1.00 2.10 H new ATOM 0 HD2 HIS A 170 -15.938 -7.032 -8.070 1.00 54.10 H new ATOM 0 HE1 HIS A 170 -14.683 -10.250 -10.522 1.00 12.34 H new ATOM 0 HE2 HIS A 170 -15.092 -7.747 -10.430 1.00 42.21 H new ATOM 2634 N HIS A 171 -17.882 -11.964 -5.743 1.00 44.01 N ATOM 2635 CA HIS A 171 -18.433 -13.339 -5.919 1.00 52.23 C ATOM 2636 C HIS A 171 -18.589 -14.034 -4.540 1.00 32.24 C ATOM 2637 O HIS A 171 -18.158 -13.504 -3.509 1.00 3.13 O ATOM 2638 CB HIS A 171 -17.529 -14.203 -6.853 1.00 42.10 C ATOM 2639 CG HIS A 171 -17.621 -13.858 -8.319 1.00 14.12 C ATOM 2640 ND1 HIS A 171 -18.661 -14.282 -9.120 1.00 24.40 N ATOM 2641 CD2 HIS A 171 -16.818 -13.120 -9.125 1.00 74.21 C ATOM 2642 CE1 HIS A 171 -18.495 -13.826 -10.340 1.00 62.42 C ATOM 2643 NE2 HIS A 171 -17.391 -13.119 -10.371 1.00 53.44 N ATOM 0 H HIS A 171 -17.226 -11.895 -4.965 1.00 44.01 H new ATOM 0 HA HIS A 171 -19.412 -13.247 -6.390 1.00 52.23 H new ATOM 0 HB2 HIS A 171 -16.493 -14.095 -6.533 1.00 42.10 H new ATOM 0 HB3 HIS A 171 -17.795 -15.252 -6.724 1.00 42.10 H new ATOM 0 HD2 HIS A 171 -15.901 -12.626 -8.840 1.00 74.21 H new ATOM 0 HE1 HIS A 171 -19.155 -14.003 -11.176 1.00 62.42 H new ATOM 0 HE2 HIS A 171 -17.017 -12.643 -11.192 1.00 53.44 H new ATOM 2652 N HIS A 172 -19.216 -15.229 -4.537 1.00 33.33 N ATOM 2653 CA HIS A 172 -19.382 -16.062 -3.316 1.00 14.03 C ATOM 2654 C HIS A 172 -18.202 -17.039 -3.147 1.00 71.11 C ATOM 2655 O HIS A 172 -18.000 -17.951 -3.956 1.00 65.13 O ATOM 2656 CB HIS A 172 -20.725 -16.835 -3.372 1.00 13.24 C ATOM 2657 CG HIS A 172 -21.949 -15.956 -3.367 1.00 21.35 C ATOM 2658 ND1 HIS A 172 -22.864 -15.918 -4.399 1.00 33.11 N ATOM 2659 CD2 HIS A 172 -22.419 -15.101 -2.431 1.00 30.31 C ATOM 2660 CE1 HIS A 172 -23.835 -15.084 -4.099 1.00 21.04 C ATOM 2661 NE2 HIS A 172 -23.593 -14.577 -2.912 1.00 41.22 N ATOM 0 H HIS A 172 -19.622 -15.647 -5.374 1.00 33.33 H new ATOM 0 HA HIS A 172 -19.395 -15.399 -2.451 1.00 14.03 H new ATOM 0 HB2 HIS A 172 -20.739 -17.451 -4.271 1.00 13.24 H new ATOM 0 HB3 HIS A 172 -20.776 -17.513 -2.520 1.00 13.24 H new ATOM 0 HD2 HIS A 172 -21.957 -14.873 -1.482 1.00 30.31 H new ATOM 0 HE1 HIS A 172 -24.687 -14.855 -4.722 1.00 21.04 H new ATOM 0 HE2 HIS A 172 -24.183 -13.902 -2.425 1.00 41.22 H new TER 2670 HIS A 172