USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1050 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 66 SER OG : rot 110:sc= 1.33 USER MOD Set 1.2: A 68 ASN : amide:sc= -0.295 X(o=1.7,f=2.1) USER MOD Set 1.3: A 71 GLN : amide:sc= 0.719 K(o=1.7,f=-0.16) USER MOD Set 2.1: A 9 TYR OH : rot -118:sc= 0.0906 USER MOD Set 2.2: A 29 LYS NZ :NH3+ 154:sc= 0 (180deg=-0.0427) USER MOD Set 2.3: A 32 THR OG1 : rot -150:sc= 0 USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 THR OG1 : rot 48:sc= 0.3 USER MOD Single : A 13 LYS NZ :NH3+ 174:sc= 0.897 (180deg=0.87) USER MOD Single : A 16 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ -170:sc=-0.00879 (180deg=-0.123) USER MOD Single : A 22 LYS NZ :NH3+ -178:sc= 1.66 (180deg=1.65) USER MOD Single : A 24 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0221) USER MOD Single : A 35 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00197) USER MOD Single : A 38 LYS NZ :NH3+ 178:sc= 0.773 (180deg=0.77) USER MOD Single : A 41 MET CE :methyl -160:sc= -1.13 (180deg=-2.17!) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 MET CE :methyl -156:sc= -0.168 (180deg=-0.691) USER MOD Single : A 75 THR OG1 : rot 89:sc= 1.07 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0.0771 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ -113:sc= 0.484 (180deg=-0.0565) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 MET CE :methyl -145:sc= -0.406 (180deg=-2.52!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ -147:sc= 0.779 (180deg=-0.0412) USER MOD Single : A 107 LYS NZ :NH3+ 163:sc= 0.983 (180deg=0.736) USER MOD Single : A 110 MET CE :methyl -170:sc= -0.532 (180deg=-0.687) USER MOD Single : A 118 LYS NZ :NH3+ -153:sc= 0 (180deg=-0.766) USER MOD Single : A 119 LYS NZ :NH3+ 147:sc= 0 (180deg=-1.02) USER MOD Single : A 120 TYR OH : rot 40:sc= 0.407 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ -164:sc= 0.299 (180deg=0.189) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 GLN : amide:sc= -0.657 K(o=-0.66,f=-0.039) USER MOD Single : A 136 TYR OH : rot -30:sc= -0.458 USER MOD ----------------------------------------------------------------- ATOM 29 N LYS A 3 4.126 2.985 -3.052 1.00 0.00 N ATOM 30 CA LYS A 3 3.722 4.012 -4.040 1.00 0.00 C ATOM 31 C LYS A 3 2.989 5.201 -3.385 1.00 0.00 C ATOM 32 O LYS A 3 2.856 6.257 -4.017 1.00 0.00 O ATOM 33 CB LYS A 3 2.802 3.390 -5.124 1.00 0.00 C ATOM 34 CG LYS A 3 1.551 2.667 -4.564 1.00 0.00 C ATOM 35 CD LYS A 3 0.509 2.310 -5.651 1.00 0.00 C ATOM 36 CE LYS A 3 -0.279 3.536 -6.142 1.00 0.00 C ATOM 37 NZ LYS A 3 -1.335 3.165 -7.118 1.00 0.00 N ATOM 0 HA LYS A 3 4.640 4.385 -4.494 1.00 0.00 H new ATOM 0 HB2 LYS A 3 2.477 4.178 -5.803 1.00 0.00 H new ATOM 0 HB3 LYS A 3 3.383 2.681 -5.713 1.00 0.00 H new ATOM 0 HG2 LYS A 3 1.864 1.754 -4.058 1.00 0.00 H new ATOM 0 HG3 LYS A 3 1.079 3.301 -3.814 1.00 0.00 H new ATOM 0 HD2 LYS A 3 1.017 1.847 -6.497 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -0.187 1.571 -5.253 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -0.734 4.039 -5.289 1.00 0.00 H new ATOM 0 HE3 LYS A 3 0.407 4.247 -6.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -1.842 4.020 -7.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.899 2.708 -7.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -2.005 2.507 -6.671 1.00 0.00 H new ATOM 51 N ILE A 4 2.494 5.012 -2.132 1.00 0.00 N ATOM 52 CA ILE A 4 1.664 6.013 -1.404 1.00 0.00 C ATOM 53 C ILE A 4 0.308 6.211 -2.178 1.00 0.00 C ATOM 54 O ILE A 4 -0.060 5.351 -2.987 1.00 0.00 O ATOM 55 CB ILE A 4 2.476 7.380 -1.134 1.00 0.00 C ATOM 56 CG1 ILE A 4 3.933 7.070 -0.631 1.00 0.00 C ATOM 57 CG2 ILE A 4 1.780 8.331 -0.111 1.00 0.00 C ATOM 58 CD1 ILE A 4 4.009 6.249 0.646 1.00 0.00 C ATOM 0 H ILE A 4 2.659 4.160 -1.597 1.00 0.00 H new ATOM 0 HA ILE A 4 1.420 5.643 -0.408 1.00 0.00 H new ATOM 0 HB ILE A 4 2.503 7.897 -2.093 1.00 0.00 H new ATOM 0 HG12 ILE A 4 4.468 6.540 -1.419 1.00 0.00 H new ATOM 0 HG13 ILE A 4 4.455 8.014 -0.470 1.00 0.00 H new ATOM 0 HG21 ILE A 4 2.384 9.229 0.020 1.00 0.00 H new ATOM 0 HG22 ILE A 4 0.794 8.608 -0.484 1.00 0.00 H new ATOM 0 HG23 ILE A 4 1.676 7.821 0.847 1.00 0.00 H new ATOM 0 HD11 ILE A 4 5.053 6.087 0.913 1.00 0.00 H new ATOM 0 HD12 ILE A 4 3.507 6.783 1.453 1.00 0.00 H new ATOM 0 HD13 ILE A 4 3.521 5.287 0.490 1.00 0.00 H new ATOM 70 N VAL A 5 -0.496 7.207 -1.775 1.00 0.00 N ATOM 71 CA VAL A 5 -1.537 7.877 -2.615 1.00 0.00 C ATOM 72 C VAL A 5 -1.810 9.284 -2.053 1.00 0.00 C ATOM 73 O VAL A 5 -2.133 10.197 -2.807 1.00 0.00 O ATOM 74 CB VAL A 5 -2.932 7.119 -2.771 1.00 0.00 C ATOM 75 CG1 VAL A 5 -2.891 6.033 -3.872 1.00 0.00 C ATOM 76 CG2 VAL A 5 -3.425 6.545 -1.428 1.00 0.00 C ATOM 0 H VAL A 5 -0.449 7.590 -0.831 1.00 0.00 H new ATOM 0 HA VAL A 5 -1.107 7.888 -3.616 1.00 0.00 H new ATOM 0 HB VAL A 5 -3.657 7.867 -3.092 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -3.864 5.546 -3.939 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -2.649 6.494 -4.829 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -2.131 5.292 -3.624 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -4.378 6.037 -1.577 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.692 5.836 -1.044 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -3.555 7.356 -0.711 1.00 0.00 H new ATOM 86 N GLY A 6 -1.704 9.429 -0.720 1.00 0.00 N ATOM 87 CA GLY A 6 -1.970 10.689 -0.043 1.00 0.00 C ATOM 88 C GLY A 6 -1.485 10.698 1.403 1.00 0.00 C ATOM 89 O GLY A 6 -0.679 9.858 1.812 1.00 0.00 O ATOM 0 H GLY A 6 -1.432 8.672 -0.093 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -1.485 11.499 -0.589 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -3.042 10.888 -0.063 1.00 0.00 H new ATOM 93 N VAL A 7 -1.980 11.673 2.176 1.00 0.00 N ATOM 94 CA VAL A 7 -1.739 11.762 3.632 1.00 0.00 C ATOM 95 C VAL A 7 -3.046 12.184 4.337 1.00 0.00 C ATOM 96 O VAL A 7 -3.840 12.939 3.782 1.00 0.00 O ATOM 97 CB VAL A 7 -0.548 12.754 3.970 1.00 0.00 C ATOM 98 CG1 VAL A 7 -0.893 14.221 3.646 1.00 0.00 C ATOM 99 CG2 VAL A 7 -0.064 12.611 5.439 1.00 0.00 C ATOM 0 H VAL A 7 -2.562 12.428 1.813 1.00 0.00 H new ATOM 0 HA VAL A 7 -1.436 10.782 4.000 1.00 0.00 H new ATOM 0 HB VAL A 7 0.277 12.462 3.320 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -0.045 14.858 3.896 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -1.118 14.316 2.584 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -1.761 14.528 4.229 1.00 0.00 H new ATOM 0 HG21 VAL A 7 0.752 13.310 5.623 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -0.889 12.830 6.117 1.00 0.00 H new ATOM 0 HG23 VAL A 7 0.285 11.593 5.609 1.00 0.00 H new ATOM 109 N THR A 8 -3.272 11.655 5.542 1.00 0.00 N ATOM 110 CA THR A 8 -4.466 11.939 6.353 1.00 0.00 C ATOM 111 C THR A 8 -4.057 12.638 7.669 1.00 0.00 C ATOM 112 O THR A 8 -3.107 12.223 8.342 1.00 0.00 O ATOM 113 CB THR A 8 -5.304 10.627 6.625 1.00 0.00 C ATOM 114 OG1 THR A 8 -6.415 10.893 7.501 1.00 0.00 O ATOM 115 CG2 THR A 8 -4.450 9.483 7.200 1.00 0.00 C ATOM 0 H THR A 8 -2.624 11.008 5.991 1.00 0.00 H new ATOM 0 HA THR A 8 -5.113 12.615 5.794 1.00 0.00 H new ATOM 0 HB THR A 8 -5.679 10.302 5.655 1.00 0.00 H new ATOM 0 HG1 THR A 8 -6.895 11.688 7.188 1.00 0.00 H new ATOM 0 HG21 THR A 8 -5.078 8.608 7.367 1.00 0.00 H new ATOM 0 HG22 THR A 8 -3.657 9.231 6.496 1.00 0.00 H new ATOM 0 HG23 THR A 8 -4.009 9.798 8.146 1.00 0.00 H new ATOM 123 N TYR A 9 -4.768 13.730 7.999 1.00 0.00 N ATOM 124 CA TYR A 9 -4.564 14.522 9.227 1.00 0.00 C ATOM 125 C TYR A 9 -5.936 14.792 9.878 1.00 0.00 C ATOM 126 O TYR A 9 -6.916 15.031 9.162 1.00 0.00 O ATOM 127 CB TYR A 9 -3.836 15.877 8.935 1.00 0.00 C ATOM 128 CG TYR A 9 -2.302 15.849 9.044 1.00 0.00 C ATOM 129 CD1 TYR A 9 -1.493 15.422 7.983 1.00 0.00 C ATOM 130 CD2 TYR A 9 -1.663 16.252 10.223 1.00 0.00 C ATOM 131 CE1 TYR A 9 -0.112 15.412 8.097 1.00 0.00 C ATOM 132 CE2 TYR A 9 -0.288 16.242 10.333 1.00 0.00 C ATOM 133 CZ TYR A 9 0.483 15.817 9.275 1.00 0.00 C ATOM 134 OH TYR A 9 1.856 15.799 9.400 1.00 0.00 O ATOM 0 H TYR A 9 -5.516 14.095 7.409 1.00 0.00 H new ATOM 0 HA TYR A 9 -3.927 13.952 9.903 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -4.104 16.203 7.930 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -4.217 16.629 9.626 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -1.953 15.096 7.062 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -2.259 16.577 11.063 1.00 0.00 H new ATOM 0 HE1 TYR A 9 0.497 15.088 7.266 1.00 0.00 H new ATOM 0 HE2 TYR A 9 0.183 16.567 11.249 1.00 0.00 H new ATOM 0 HH TYR A 9 2.111 15.178 10.114 1.00 0.00 H new ATOM 144 N PRO A 10 -6.024 14.732 11.247 1.00 0.00 N ATOM 145 CA PRO A 10 -7.212 15.187 12.000 1.00 0.00 C ATOM 146 C PRO A 10 -7.452 16.709 11.833 1.00 0.00 C ATOM 147 O PRO A 10 -8.591 17.150 11.653 1.00 0.00 O ATOM 148 CB PRO A 10 -6.885 14.832 13.483 1.00 0.00 C ATOM 149 CG PRO A 10 -5.772 13.833 13.403 1.00 0.00 C ATOM 150 CD PRO A 10 -4.991 14.183 12.155 1.00 0.00 C ATOM 0 HA PRO A 10 -8.126 14.711 11.645 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -6.583 15.716 14.044 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -7.755 14.415 13.991 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -5.138 13.883 14.288 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -6.162 12.817 13.348 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -4.209 14.913 12.362 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -4.504 13.307 11.727 1.00 0.00 H new ATOM 158 N ILE A 11 -6.337 17.481 11.872 1.00 0.00 N ATOM 159 CA ILE A 11 -6.338 18.963 11.896 1.00 0.00 C ATOM 160 C ILE A 11 -7.224 19.476 13.069 1.00 0.00 C ATOM 161 O ILE A 11 -8.375 19.880 12.857 1.00 0.00 O ATOM 162 CB ILE A 11 -6.757 19.604 10.504 1.00 0.00 C ATOM 163 CG1 ILE A 11 -5.900 18.985 9.347 1.00 0.00 C ATOM 164 CG2 ILE A 11 -6.628 21.159 10.531 1.00 0.00 C ATOM 165 CD1 ILE A 11 -6.270 19.453 7.954 1.00 0.00 C ATOM 0 H ILE A 11 -5.398 17.083 11.888 1.00 0.00 H new ATOM 0 HA ILE A 11 -5.313 19.292 12.067 1.00 0.00 H new ATOM 0 HB ILE A 11 -7.806 19.371 10.322 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -4.851 19.221 9.526 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -5.994 17.900 9.386 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -6.922 21.565 9.563 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -7.277 21.564 11.307 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -5.595 21.435 10.741 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -5.622 18.969 7.223 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -7.308 19.193 7.746 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -6.147 20.534 7.889 1.00 0.00 H new ATOM 177 N PRO A 12 -6.699 19.427 14.352 1.00 0.00 N ATOM 178 CA PRO A 12 -7.471 19.830 15.565 1.00 0.00 C ATOM 179 C PRO A 12 -7.717 21.358 15.662 1.00 0.00 C ATOM 180 O PRO A 12 -8.326 21.821 16.632 1.00 0.00 O ATOM 181 CB PRO A 12 -6.594 19.305 16.753 1.00 0.00 C ATOM 182 CG PRO A 12 -5.580 18.394 16.120 1.00 0.00 C ATOM 183 CD PRO A 12 -5.344 18.955 14.736 1.00 0.00 C ATOM 0 HA PRO A 12 -8.478 19.413 15.556 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -6.110 20.128 17.279 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -7.201 18.771 17.485 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -4.656 18.373 16.698 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -5.949 17.369 16.071 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -4.617 19.767 14.745 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -4.967 18.198 14.049 1.00 0.00 H new ATOM 191 N LYS A 13 -7.221 22.127 14.660 1.00 0.00 N ATOM 192 CA LYS A 13 -7.518 23.566 14.524 1.00 0.00 C ATOM 193 C LYS A 13 -8.994 23.778 14.137 1.00 0.00 C ATOM 194 O LYS A 13 -9.576 23.008 13.368 1.00 0.00 O ATOM 195 CB LYS A 13 -6.572 24.267 13.473 1.00 0.00 C ATOM 196 CG LYS A 13 -5.329 24.979 14.070 1.00 0.00 C ATOM 197 CD LYS A 13 -5.709 26.164 14.999 1.00 0.00 C ATOM 198 CE LYS A 13 -4.484 26.882 15.605 1.00 0.00 C ATOM 199 NZ LYS A 13 -4.885 27.954 16.556 1.00 0.00 N ATOM 0 H LYS A 13 -6.608 21.765 13.930 1.00 0.00 H new ATOM 0 HA LYS A 13 -7.333 24.028 15.494 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -6.232 23.518 12.758 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -7.156 24.999 12.915 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -4.736 24.257 14.632 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -4.700 25.345 13.259 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -6.301 26.884 14.434 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -6.342 25.795 15.806 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -3.855 26.156 16.120 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -3.883 27.313 14.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -4.038 28.343 17.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -5.376 28.711 16.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -5.521 27.558 17.277 1.00 0.00 H new ATOM 213 N ARG A 14 -9.563 24.866 14.668 1.00 0.00 N ATOM 214 CA ARG A 14 -10.915 25.368 14.338 1.00 0.00 C ATOM 215 C ARG A 14 -11.081 25.707 12.834 1.00 0.00 C ATOM 216 O ARG A 14 -12.197 25.949 12.362 1.00 0.00 O ATOM 217 CB ARG A 14 -11.213 26.611 15.236 1.00 0.00 C ATOM 218 CG ARG A 14 -10.069 27.665 15.289 1.00 0.00 C ATOM 219 CD ARG A 14 -10.316 28.789 16.319 1.00 0.00 C ATOM 220 NE ARG A 14 -9.097 29.598 16.576 1.00 0.00 N ATOM 221 CZ ARG A 14 -8.609 29.893 17.798 1.00 0.00 C ATOM 222 NH1 ARG A 14 -9.205 29.471 18.904 1.00 0.00 N ATOM 223 NH2 ARG A 14 -7.508 30.606 17.909 1.00 0.00 N ATOM 0 H ARG A 14 -9.087 25.444 15.361 1.00 0.00 H new ATOM 0 HA ARG A 14 -11.637 24.577 14.540 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -12.119 27.096 14.872 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -11.420 26.268 16.250 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -9.133 27.162 15.529 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -9.948 28.109 14.301 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -11.112 29.440 15.958 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -10.662 28.351 17.255 1.00 0.00 H new ATOM 0 HE ARG A 14 -8.591 29.958 15.767 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -10.054 28.909 18.843 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -8.815 29.708 19.816 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -7.026 30.934 17.072 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -7.137 30.831 18.832 1.00 0.00 H new ATOM 237 N PHE A 15 -9.957 25.721 12.100 1.00 0.00 N ATOM 238 CA PHE A 15 -9.909 26.003 10.657 1.00 0.00 C ATOM 239 C PHE A 15 -9.819 24.718 9.807 1.00 0.00 C ATOM 240 O PHE A 15 -9.396 24.766 8.646 1.00 0.00 O ATOM 241 CB PHE A 15 -8.717 26.939 10.382 1.00 0.00 C ATOM 242 CG PHE A 15 -8.869 28.304 11.037 1.00 0.00 C ATOM 243 CD1 PHE A 15 -9.716 29.266 10.482 1.00 0.00 C ATOM 244 CD2 PHE A 15 -8.207 28.613 12.212 1.00 0.00 C ATOM 245 CE1 PHE A 15 -9.878 30.496 11.076 1.00 0.00 C ATOM 246 CE2 PHE A 15 -8.378 29.840 12.804 1.00 0.00 C ATOM 247 CZ PHE A 15 -9.212 30.783 12.243 1.00 0.00 C ATOM 0 H PHE A 15 -9.038 25.533 12.501 1.00 0.00 H new ATOM 0 HA PHE A 15 -10.840 26.488 10.364 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -7.802 26.469 10.743 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -8.605 27.069 9.306 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -10.252 29.041 9.572 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -7.552 27.885 12.666 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -10.526 31.234 10.627 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -7.853 30.069 13.720 1.00 0.00 H new ATOM 0 HZ PHE A 15 -9.342 31.744 12.719 1.00 0.00 H new ATOM 257 N MET A 16 -10.249 23.580 10.387 1.00 0.00 N ATOM 258 CA MET A 16 -10.459 22.318 9.632 1.00 0.00 C ATOM 259 C MET A 16 -11.606 22.503 8.604 1.00 0.00 C ATOM 260 O MET A 16 -11.617 21.874 7.541 1.00 0.00 O ATOM 261 CB MET A 16 -10.779 21.139 10.604 1.00 0.00 C ATOM 262 CG MET A 16 -12.039 21.337 11.461 1.00 0.00 C ATOM 263 SD MET A 16 -12.456 19.896 12.467 1.00 0.00 S ATOM 264 CE MET A 16 -13.976 20.434 13.254 1.00 0.00 C ATOM 0 H MET A 16 -10.460 23.504 11.382 1.00 0.00 H new ATOM 0 HA MET A 16 -9.541 22.074 9.097 1.00 0.00 H new ATOM 0 HB2 MET A 16 -10.893 20.226 10.020 1.00 0.00 H new ATOM 0 HB3 MET A 16 -9.926 20.990 11.266 1.00 0.00 H new ATOM 0 HG2 MET A 16 -11.893 22.197 12.114 1.00 0.00 H new ATOM 0 HG3 MET A 16 -12.880 21.571 10.808 1.00 0.00 H new ATOM 0 HE1 MET A 16 -14.348 19.643 13.905 1.00 0.00 H new ATOM 0 HE2 MET A 16 -13.783 21.330 13.844 1.00 0.00 H new ATOM 0 HE3 MET A 16 -14.722 20.656 12.491 1.00 0.00 H new ATOM 274 N ASP A 17 -12.554 23.400 8.949 1.00 0.00 N ATOM 275 CA ASP A 17 -13.730 23.745 8.123 1.00 0.00 C ATOM 276 C ASP A 17 -13.329 24.491 6.835 1.00 0.00 C ATOM 277 O ASP A 17 -14.052 24.430 5.838 1.00 0.00 O ATOM 278 CB ASP A 17 -14.692 24.650 8.928 1.00 0.00 C ATOM 279 CG ASP A 17 -15.211 24.022 10.233 1.00 0.00 C ATOM 280 OD1 ASP A 17 -14.401 23.809 11.162 1.00 0.00 O ATOM 281 OD2 ASP A 17 -16.430 23.763 10.349 1.00 0.00 O ATOM 0 H ASP A 17 -12.522 23.915 9.829 1.00 0.00 H new ATOM 0 HA ASP A 17 -14.216 22.809 7.850 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -14.180 25.583 9.166 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -15.544 24.906 8.298 1.00 0.00 H new ATOM 286 N ARG A 18 -12.180 25.206 6.886 1.00 0.00 N ATOM 287 CA ARG A 18 -11.717 26.110 5.802 1.00 0.00 C ATOM 288 C ARG A 18 -11.602 25.409 4.439 1.00 0.00 C ATOM 289 O ARG A 18 -11.951 25.998 3.414 1.00 0.00 O ATOM 290 CB ARG A 18 -10.371 26.790 6.177 1.00 0.00 C ATOM 291 CG ARG A 18 -10.487 27.953 7.181 1.00 0.00 C ATOM 292 CD ARG A 18 -11.398 29.091 6.680 1.00 0.00 C ATOM 293 NE ARG A 18 -11.282 30.309 7.508 1.00 0.00 N ATOM 294 CZ ARG A 18 -12.296 30.930 8.137 1.00 0.00 C ATOM 295 NH1 ARG A 18 -13.530 30.435 8.101 1.00 0.00 N ATOM 296 NH2 ARG A 18 -12.057 32.048 8.809 1.00 0.00 N ATOM 0 H ARG A 18 -11.544 25.173 7.683 1.00 0.00 H new ATOM 0 HA ARG A 18 -12.486 26.876 5.699 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -9.704 26.035 6.593 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -9.903 27.162 5.266 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -10.876 27.573 8.126 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -9.493 28.352 7.383 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -11.142 29.330 5.648 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -12.434 28.751 6.681 1.00 0.00 H new ATOM 0 HE ARG A 18 -10.352 30.714 7.612 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -13.719 29.572 7.591 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -14.288 30.918 8.583 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -11.112 32.429 8.845 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -12.819 32.527 9.290 1.00 0.00 H new ATOM 310 N PHE A 19 -11.169 24.149 4.445 1.00 0.00 N ATOM 311 CA PHE A 19 -10.973 23.368 3.207 1.00 0.00 C ATOM 312 C PHE A 19 -12.327 23.105 2.500 1.00 0.00 C ATOM 313 O PHE A 19 -12.406 23.063 1.269 1.00 0.00 O ATOM 314 CB PHE A 19 -10.286 22.024 3.554 1.00 0.00 C ATOM 315 CG PHE A 19 -8.951 22.162 4.296 1.00 0.00 C ATOM 316 CD1 PHE A 19 -8.914 22.360 5.677 1.00 0.00 C ATOM 317 CD2 PHE A 19 -7.736 22.085 3.614 1.00 0.00 C ATOM 318 CE1 PHE A 19 -7.714 22.480 6.346 1.00 0.00 C ATOM 319 CE2 PHE A 19 -6.536 22.201 4.286 1.00 0.00 C ATOM 320 CZ PHE A 19 -6.528 22.401 5.650 1.00 0.00 C ATOM 0 H PHE A 19 -10.943 23.636 5.298 1.00 0.00 H new ATOM 0 HA PHE A 19 -10.341 23.939 2.527 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -10.966 21.430 4.165 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -10.118 21.468 2.632 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -9.839 22.420 6.230 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -7.735 21.932 2.545 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -7.704 22.636 7.415 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -5.604 22.135 3.744 1.00 0.00 H new ATOM 0 HZ PHE A 19 -5.589 22.496 6.175 1.00 0.00 H new ATOM 330 N PHE A 20 -13.396 23.026 3.311 1.00 0.00 N ATOM 331 CA PHE A 20 -14.782 22.776 2.853 1.00 0.00 C ATOM 332 C PHE A 20 -15.519 24.113 2.623 1.00 0.00 C ATOM 333 O PHE A 20 -16.482 24.188 1.855 1.00 0.00 O ATOM 334 CB PHE A 20 -15.519 21.931 3.927 1.00 0.00 C ATOM 335 CG PHE A 20 -14.722 20.714 4.400 1.00 0.00 C ATOM 336 CD1 PHE A 20 -14.511 19.638 3.550 1.00 0.00 C ATOM 337 CD2 PHE A 20 -14.185 20.651 5.688 1.00 0.00 C ATOM 338 CE1 PHE A 20 -13.790 18.537 3.962 1.00 0.00 C ATOM 339 CE2 PHE A 20 -13.461 19.547 6.100 1.00 0.00 C ATOM 340 CZ PHE A 20 -13.272 18.489 5.238 1.00 0.00 C ATOM 0 H PHE A 20 -13.324 23.136 4.323 1.00 0.00 H new ATOM 0 HA PHE A 20 -14.764 22.232 1.909 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -15.743 22.564 4.785 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -16.473 21.595 3.521 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -14.918 19.663 2.550 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -14.337 21.474 6.370 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -13.631 17.712 3.284 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -13.044 19.514 7.096 1.00 0.00 H new ATOM 0 HZ PHE A 20 -12.717 17.621 5.563 1.00 0.00 H new ATOM 350 N LYS A 21 -15.024 25.164 3.301 1.00 0.00 N ATOM 351 CA LYS A 21 -15.629 26.510 3.328 1.00 0.00 C ATOM 352 C LYS A 21 -15.392 27.238 1.996 1.00 0.00 C ATOM 353 O LYS A 21 -16.341 27.687 1.336 1.00 0.00 O ATOM 354 CB LYS A 21 -15.031 27.287 4.550 1.00 0.00 C ATOM 355 CG LYS A 21 -15.436 28.780 4.733 1.00 0.00 C ATOM 356 CD LYS A 21 -14.497 29.786 4.009 1.00 0.00 C ATOM 357 CE LYS A 21 -14.920 31.246 4.235 1.00 0.00 C ATOM 358 NZ LYS A 21 -16.296 31.504 3.722 1.00 0.00 N ATOM 0 H LYS A 21 -14.172 25.101 3.859 1.00 0.00 H new ATOM 0 HA LYS A 21 -16.710 26.444 3.448 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -15.311 26.751 5.457 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -13.944 27.242 4.476 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -16.452 28.918 4.363 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -15.450 29.014 5.798 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -13.476 29.647 4.364 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -14.494 29.572 2.940 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -14.879 31.477 5.299 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -14.215 31.911 3.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -16.485 32.527 3.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -16.375 31.149 2.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -16.989 31.016 4.325 1.00 0.00 H new ATOM 372 N LYS A 22 -14.113 27.345 1.610 1.00 0.00 N ATOM 373 CA LYS A 22 -13.684 28.089 0.403 1.00 0.00 C ATOM 374 C LYS A 22 -13.564 27.156 -0.813 1.00 0.00 C ATOM 375 O LYS A 22 -13.418 27.626 -1.944 1.00 0.00 O ATOM 376 CB LYS A 22 -12.338 28.804 0.697 1.00 0.00 C ATOM 377 CG LYS A 22 -11.172 27.845 1.013 1.00 0.00 C ATOM 378 CD LYS A 22 -9.978 28.514 1.720 1.00 0.00 C ATOM 379 CE LYS A 22 -10.324 29.060 3.113 1.00 0.00 C ATOM 380 NZ LYS A 22 -9.103 29.475 3.857 1.00 0.00 N ATOM 0 H LYS A 22 -13.340 26.920 2.122 1.00 0.00 H new ATOM 0 HA LYS A 22 -14.439 28.836 0.157 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -12.068 29.416 -0.164 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -12.475 29.482 1.539 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -11.543 27.034 1.640 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -10.824 27.395 0.083 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -9.168 27.791 1.812 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -9.608 29.330 1.099 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -10.997 29.911 3.014 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -10.856 28.297 3.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -9.371 29.807 4.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -8.457 28.665 3.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -8.628 30.244 3.343 1.00 0.00 H new ATOM 394 N GLY A 23 -13.595 25.828 -0.563 1.00 0.00 N ATOM 395 CA GLY A 23 -13.573 24.813 -1.628 1.00 0.00 C ATOM 396 C GLY A 23 -12.158 24.365 -2.005 1.00 0.00 C ATOM 397 O GLY A 23 -11.959 23.217 -2.425 1.00 0.00 O ATOM 0 H GLY A 23 -13.636 25.436 0.378 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -14.148 23.945 -1.306 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.068 25.213 -2.513 1.00 0.00 H new ATOM 401 N LYS A 24 -11.183 25.283 -1.868 1.00 0.00 N ATOM 402 CA LYS A 24 -9.768 25.031 -2.187 1.00 0.00 C ATOM 403 C LYS A 24 -8.886 25.864 -1.234 1.00 0.00 C ATOM 404 O LYS A 24 -8.956 27.100 -1.213 1.00 0.00 O ATOM 405 CB LYS A 24 -9.444 25.318 -3.694 1.00 0.00 C ATOM 406 CG LYS A 24 -9.621 26.784 -4.181 1.00 0.00 C ATOM 407 CD LYS A 24 -11.094 27.261 -4.249 1.00 0.00 C ATOM 408 CE LYS A 24 -11.224 28.746 -4.627 1.00 0.00 C ATOM 409 NZ LYS A 24 -10.654 29.037 -5.967 1.00 0.00 N ATOM 0 H LYS A 24 -11.359 26.229 -1.529 1.00 0.00 H new ATOM 0 HA LYS A 24 -9.552 23.973 -2.037 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -8.413 25.019 -3.883 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -10.079 24.677 -4.306 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -9.068 27.445 -3.514 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -9.174 26.882 -5.170 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -11.633 26.657 -4.979 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -11.570 27.094 -3.283 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -12.276 29.032 -4.612 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -10.717 29.355 -3.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -10.794 30.042 -6.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -9.637 28.821 -5.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -11.131 28.451 -6.682 1.00 0.00 H new ATOM 423 N ASP A 25 -8.072 25.166 -0.437 1.00 0.00 N ATOM 424 CA ASP A 25 -7.342 25.752 0.710 1.00 0.00 C ATOM 425 C ASP A 25 -5.825 25.509 0.548 1.00 0.00 C ATOM 426 O ASP A 25 -5.395 24.971 -0.464 1.00 0.00 O ATOM 427 CB ASP A 25 -7.925 25.125 2.007 1.00 0.00 C ATOM 428 CG ASP A 25 -7.455 25.778 3.320 1.00 0.00 C ATOM 429 OD1 ASP A 25 -6.428 25.357 3.870 1.00 0.00 O ATOM 430 OD2 ASP A 25 -8.107 26.720 3.794 1.00 0.00 O ATOM 0 H ASP A 25 -7.894 24.170 -0.564 1.00 0.00 H new ATOM 0 HA ASP A 25 -7.471 26.833 0.761 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -9.013 25.181 1.961 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.661 24.068 2.031 1.00 0.00 H new ATOM 435 N VAL A 26 -5.015 25.970 1.515 1.00 0.00 N ATOM 436 CA VAL A 26 -3.562 25.737 1.562 1.00 0.00 C ATOM 437 C VAL A 26 -3.170 25.318 2.996 1.00 0.00 C ATOM 438 O VAL A 26 -3.239 26.128 3.929 1.00 0.00 O ATOM 439 CB VAL A 26 -2.747 27.017 1.112 1.00 0.00 C ATOM 440 CG1 VAL A 26 -1.226 26.834 1.326 1.00 0.00 C ATOM 441 CG2 VAL A 26 -3.058 27.386 -0.362 1.00 0.00 C ATOM 0 H VAL A 26 -5.357 26.525 2.300 1.00 0.00 H new ATOM 0 HA VAL A 26 -3.312 24.940 0.861 1.00 0.00 H new ATOM 0 HB VAL A 26 -3.068 27.844 1.745 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -0.702 27.734 1.005 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -1.026 26.655 2.383 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -0.876 25.983 0.742 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -2.485 28.269 -0.645 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -2.786 26.553 -1.011 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -4.122 27.595 -0.468 1.00 0.00 H new ATOM 451 N PHE A 27 -2.778 24.041 3.163 1.00 0.00 N ATOM 452 CA PHE A 27 -2.361 23.492 4.472 1.00 0.00 C ATOM 453 C PHE A 27 -0.838 23.619 4.620 1.00 0.00 C ATOM 454 O PHE A 27 -0.092 23.070 3.814 1.00 0.00 O ATOM 455 CB PHE A 27 -2.794 22.005 4.610 1.00 0.00 C ATOM 456 CG PHE A 27 -2.499 21.377 5.972 1.00 0.00 C ATOM 457 CD1 PHE A 27 -3.248 21.726 7.093 1.00 0.00 C ATOM 458 CD2 PHE A 27 -1.483 20.437 6.133 1.00 0.00 C ATOM 459 CE1 PHE A 27 -2.999 21.152 8.323 1.00 0.00 C ATOM 460 CE2 PHE A 27 -1.239 19.864 7.364 1.00 0.00 C ATOM 461 CZ PHE A 27 -1.994 20.222 8.459 1.00 0.00 C ATOM 0 H PHE A 27 -2.741 23.363 2.402 1.00 0.00 H new ATOM 0 HA PHE A 27 -2.849 24.061 5.264 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -3.864 21.933 4.416 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -2.291 21.421 3.839 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -4.037 22.458 6.998 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -0.879 20.154 5.284 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -3.594 21.433 9.180 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -0.452 19.131 7.470 1.00 0.00 H new ATOM 0 HZ PHE A 27 -1.798 19.774 9.422 1.00 0.00 H new ATOM 471 N VAL A 28 -0.383 24.333 5.659 1.00 0.00 N ATOM 472 CA VAL A 28 1.051 24.563 5.902 1.00 0.00 C ATOM 473 C VAL A 28 1.599 23.585 6.963 1.00 0.00 C ATOM 474 O VAL A 28 0.938 23.283 7.967 1.00 0.00 O ATOM 475 CB VAL A 28 1.337 26.060 6.299 1.00 0.00 C ATOM 476 CG1 VAL A 28 1.068 27.004 5.102 1.00 0.00 C ATOM 477 CG2 VAL A 28 0.509 26.488 7.534 1.00 0.00 C ATOM 0 H VAL A 28 -0.993 24.766 6.352 1.00 0.00 H new ATOM 0 HA VAL A 28 1.578 24.369 4.968 1.00 0.00 H new ATOM 0 HB VAL A 28 2.391 26.136 6.568 1.00 0.00 H new ATOM 0 HG11 VAL A 28 1.272 28.033 5.397 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.717 26.730 4.270 1.00 0.00 H new ATOM 0 HG13 VAL A 28 0.026 26.914 4.795 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.732 27.526 7.779 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.553 26.387 7.312 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.765 25.852 8.382 1.00 0.00 H new ATOM 487 N LYS A 29 2.804 23.061 6.684 1.00 0.00 N ATOM 488 CA LYS A 29 3.566 22.148 7.561 1.00 0.00 C ATOM 489 C LYS A 29 4.994 22.691 7.772 1.00 0.00 C ATOM 490 O LYS A 29 5.630 23.074 6.801 1.00 0.00 O ATOM 491 CB LYS A 29 3.639 20.712 6.925 1.00 0.00 C ATOM 492 CG LYS A 29 2.350 19.852 7.027 1.00 0.00 C ATOM 493 CD LYS A 29 2.164 19.127 8.395 1.00 0.00 C ATOM 494 CE LYS A 29 1.774 20.042 9.576 1.00 0.00 C ATOM 495 NZ LYS A 29 1.707 19.299 10.862 1.00 0.00 N ATOM 0 H LYS A 29 3.293 23.266 5.813 1.00 0.00 H new ATOM 0 HA LYS A 29 3.056 22.085 8.522 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.899 20.816 5.872 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.454 20.167 7.402 1.00 0.00 H new ATOM 0 HG2 LYS A 29 1.486 20.492 6.849 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.363 19.105 6.233 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.397 18.361 8.281 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.092 18.614 8.645 1.00 0.00 H new ATOM 0 HE2 LYS A 29 2.500 20.850 9.663 1.00 0.00 H new ATOM 0 HE3 LYS A 29 0.807 20.502 9.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 1.882 19.954 11.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 0.764 18.874 10.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.428 18.549 10.868 1.00 0.00 H new ATOM 509 N PRO A 30 5.533 22.726 9.035 1.00 0.00 N ATOM 510 CA PRO A 30 6.983 22.962 9.288 1.00 0.00 C ATOM 511 C PRO A 30 7.819 21.686 8.987 1.00 0.00 C ATOM 512 O PRO A 30 8.562 21.198 9.842 1.00 0.00 O ATOM 513 CB PRO A 30 7.010 23.353 10.792 1.00 0.00 C ATOM 514 CG PRO A 30 5.841 22.628 11.388 1.00 0.00 C ATOM 515 CD PRO A 30 4.772 22.604 10.308 1.00 0.00 C ATOM 0 HA PRO A 30 7.423 23.729 8.651 1.00 0.00 H new ATOM 0 HB2 PRO A 30 7.946 23.053 11.264 1.00 0.00 H new ATOM 0 HB3 PRO A 30 6.918 24.431 10.924 1.00 0.00 H new ATOM 0 HG2 PRO A 30 6.119 21.617 11.685 1.00 0.00 H new ATOM 0 HG3 PRO A 30 5.481 23.136 12.283 1.00 0.00 H new ATOM 0 HD2 PRO A 30 4.195 21.680 10.340 1.00 0.00 H new ATOM 0 HD3 PRO A 30 4.065 23.425 10.429 1.00 0.00 H new ATOM 523 N ALA A 31 7.678 21.179 7.739 1.00 0.00 N ATOM 524 CA ALA A 31 8.255 19.892 7.266 1.00 0.00 C ATOM 525 C ALA A 31 8.012 18.713 8.250 1.00 0.00 C ATOM 526 O ALA A 31 8.861 17.822 8.395 1.00 0.00 O ATOM 527 CB ALA A 31 9.750 20.051 6.929 1.00 0.00 C ATOM 0 H ALA A 31 7.148 21.663 7.014 1.00 0.00 H new ATOM 0 HA ALA A 31 7.723 19.630 6.352 1.00 0.00 H new ATOM 0 HB1 ALA A 31 10.149 19.097 6.586 1.00 0.00 H new ATOM 0 HB2 ALA A 31 9.869 20.798 6.144 1.00 0.00 H new ATOM 0 HB3 ALA A 31 10.292 20.371 7.819 1.00 0.00 H new ATOM 533 N THR A 32 6.823 18.711 8.901 1.00 0.00 N ATOM 534 CA THR A 32 6.387 17.617 9.810 1.00 0.00 C ATOM 535 C THR A 32 6.222 16.298 9.020 1.00 0.00 C ATOM 536 O THR A 32 6.371 15.194 9.560 1.00 0.00 O ATOM 537 CB THR A 32 5.033 17.981 10.508 1.00 0.00 C ATOM 538 OG1 THR A 32 5.083 19.323 11.010 1.00 0.00 O ATOM 539 CG2 THR A 32 4.668 17.027 11.667 1.00 0.00 C ATOM 0 H THR A 32 6.140 19.464 8.813 1.00 0.00 H new ATOM 0 HA THR A 32 7.153 17.487 10.574 1.00 0.00 H new ATOM 0 HB THR A 32 4.261 17.881 9.745 1.00 0.00 H new ATOM 0 HG1 THR A 32 4.512 19.397 11.803 1.00 0.00 H new ATOM 0 HG21 THR A 32 3.720 17.335 12.107 1.00 0.00 H new ATOM 0 HG22 THR A 32 4.578 16.010 11.286 1.00 0.00 H new ATOM 0 HG23 THR A 32 5.449 17.062 12.427 1.00 0.00 H new ATOM 547 N VAL A 33 5.904 16.457 7.728 1.00 0.00 N ATOM 548 CA VAL A 33 5.765 15.357 6.767 1.00 0.00 C ATOM 549 C VAL A 33 7.111 15.067 6.069 1.00 0.00 C ATOM 550 O VAL A 33 7.954 15.963 5.913 1.00 0.00 O ATOM 551 CB VAL A 33 4.661 15.692 5.696 1.00 0.00 C ATOM 552 CG1 VAL A 33 3.250 15.754 6.336 1.00 0.00 C ATOM 553 CG2 VAL A 33 4.996 17.006 4.948 1.00 0.00 C ATOM 0 H VAL A 33 5.733 17.373 7.314 1.00 0.00 H new ATOM 0 HA VAL A 33 5.460 14.466 7.316 1.00 0.00 H new ATOM 0 HB VAL A 33 4.652 14.883 4.966 1.00 0.00 H new ATOM 0 HG11 VAL A 33 2.512 15.987 5.568 1.00 0.00 H new ATOM 0 HG12 VAL A 33 3.012 14.790 6.787 1.00 0.00 H new ATOM 0 HG13 VAL A 33 3.232 16.528 7.103 1.00 0.00 H new ATOM 0 HG21 VAL A 33 4.218 17.215 4.214 1.00 0.00 H new ATOM 0 HG22 VAL A 33 5.051 17.827 5.662 1.00 0.00 H new ATOM 0 HG23 VAL A 33 5.955 16.902 4.441 1.00 0.00 H new ATOM 563 N TRP A 34 7.302 13.800 5.678 1.00 0.00 N ATOM 564 CA TRP A 34 8.478 13.343 4.917 1.00 0.00 C ATOM 565 C TRP A 34 8.301 13.696 3.411 1.00 0.00 C ATOM 566 O TRP A 34 7.259 14.241 3.008 1.00 0.00 O ATOM 567 CB TRP A 34 8.671 11.809 5.150 1.00 0.00 C ATOM 568 CG TRP A 34 9.973 11.237 4.618 1.00 0.00 C ATOM 569 CD1 TRP A 34 10.124 10.300 3.632 1.00 0.00 C ATOM 570 CD2 TRP A 34 11.307 11.597 5.023 1.00 0.00 C ATOM 571 NE1 TRP A 34 11.451 10.050 3.413 1.00 0.00 N ATOM 572 CE2 TRP A 34 12.198 10.824 4.256 1.00 0.00 C ATOM 573 CE3 TRP A 34 11.831 12.481 5.977 1.00 0.00 C ATOM 574 CZ2 TRP A 34 13.580 10.924 4.395 1.00 0.00 C ATOM 575 CZ3 TRP A 34 13.203 12.582 6.111 1.00 0.00 C ATOM 576 CH2 TRP A 34 14.064 11.799 5.329 1.00 0.00 C ATOM 0 H TRP A 34 6.638 13.053 5.882 1.00 0.00 H new ATOM 0 HA TRP A 34 9.379 13.851 5.262 1.00 0.00 H new ATOM 0 HB2 TRP A 34 8.615 11.610 6.220 1.00 0.00 H new ATOM 0 HB3 TRP A 34 7.841 11.279 4.683 1.00 0.00 H new ATOM 0 HD1 TRP A 34 9.311 9.825 3.102 1.00 0.00 H new ATOM 0 HE1 TRP A 34 11.824 9.391 2.729 1.00 0.00 H new ATOM 0 HE3 TRP A 34 11.174 13.073 6.597 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 14.247 10.331 3.786 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 13.618 13.274 6.829 1.00 0.00 H new ATOM 0 HH2 TRP A 34 15.131 11.888 5.467 1.00 0.00 H new ATOM 587 N LYS A 35 9.321 13.377 2.582 1.00 0.00 N ATOM 588 CA LYS A 35 9.347 13.691 1.130 1.00 0.00 C ATOM 589 C LYS A 35 8.340 12.862 0.296 1.00 0.00 C ATOM 590 O LYS A 35 8.312 12.985 -0.937 1.00 0.00 O ATOM 591 CB LYS A 35 10.791 13.508 0.562 1.00 0.00 C ATOM 592 CG LYS A 35 11.909 14.279 1.311 1.00 0.00 C ATOM 593 CD LYS A 35 11.627 15.796 1.486 1.00 0.00 C ATOM 594 CE LYS A 35 11.338 16.547 0.169 1.00 0.00 C ATOM 595 NZ LYS A 35 12.422 16.382 -0.837 1.00 0.00 N ATOM 0 H LYS A 35 10.158 12.890 2.902 1.00 0.00 H new ATOM 0 HA LYS A 35 9.038 14.732 1.040 1.00 0.00 H new ATOM 0 HB2 LYS A 35 11.035 12.446 0.575 1.00 0.00 H new ATOM 0 HB3 LYS A 35 10.794 13.823 -0.482 1.00 0.00 H new ATOM 0 HG2 LYS A 35 12.048 13.831 2.295 1.00 0.00 H new ATOM 0 HG3 LYS A 35 12.846 14.155 0.769 1.00 0.00 H new ATOM 0 HD2 LYS A 35 10.776 15.920 2.155 1.00 0.00 H new ATOM 0 HD3 LYS A 35 12.485 16.259 1.973 1.00 0.00 H new ATOM 0 HE2 LYS A 35 10.400 16.186 -0.252 1.00 0.00 H new ATOM 0 HE3 LYS A 35 11.204 17.608 0.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 12.185 16.920 -1.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 13.318 16.735 -0.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 12.523 15.375 -1.077 1.00 0.00 H new ATOM 609 N GLU A 36 7.507 12.032 0.967 1.00 0.00 N ATOM 610 CA GLU A 36 6.377 11.317 0.322 1.00 0.00 C ATOM 611 C GLU A 36 5.352 12.329 -0.230 1.00 0.00 C ATOM 612 O GLU A 36 4.602 12.028 -1.162 1.00 0.00 O ATOM 613 CB GLU A 36 5.686 10.361 1.332 1.00 0.00 C ATOM 614 CG GLU A 36 6.639 9.504 2.194 1.00 0.00 C ATOM 615 CD GLU A 36 7.555 8.569 1.383 1.00 0.00 C ATOM 616 OE1 GLU A 36 8.670 8.986 0.990 1.00 0.00 O ATOM 617 OE2 GLU A 36 7.176 7.409 1.146 1.00 0.00 O ATOM 0 H GLU A 36 7.597 11.839 1.965 1.00 0.00 H new ATOM 0 HA GLU A 36 6.772 10.725 -0.503 1.00 0.00 H new ATOM 0 HB2 GLU A 36 5.058 10.955 1.996 1.00 0.00 H new ATOM 0 HB3 GLU A 36 5.024 9.694 0.780 1.00 0.00 H new ATOM 0 HG2 GLU A 36 7.259 10.166 2.799 1.00 0.00 H new ATOM 0 HG3 GLU A 36 6.046 8.904 2.884 1.00 0.00 H new ATOM 624 N LEU A 37 5.325 13.522 0.395 1.00 0.00 N ATOM 625 CA LEU A 37 4.522 14.662 -0.058 1.00 0.00 C ATOM 626 C LEU A 37 5.004 15.155 -1.437 1.00 0.00 C ATOM 627 O LEU A 37 6.105 15.699 -1.558 1.00 0.00 O ATOM 628 CB LEU A 37 4.548 15.813 1.009 1.00 0.00 C ATOM 629 CG LEU A 37 3.211 16.078 1.766 1.00 0.00 C ATOM 630 CD1 LEU A 37 2.117 16.563 0.804 1.00 0.00 C ATOM 631 CD2 LEU A 37 2.759 14.835 2.558 1.00 0.00 C ATOM 0 H LEU A 37 5.867 13.718 1.236 1.00 0.00 H new ATOM 0 HA LEU A 37 3.488 14.337 -0.169 1.00 0.00 H new ATOM 0 HB2 LEU A 37 5.318 15.581 1.744 1.00 0.00 H new ATOM 0 HB3 LEU A 37 4.849 16.735 0.512 1.00 0.00 H new ATOM 0 HG LEU A 37 3.390 16.875 2.488 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.196 16.740 1.360 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.437 17.490 0.327 1.00 0.00 H new ATOM 0 HD13 LEU A 37 1.941 15.804 0.041 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.824 15.053 3.074 1.00 0.00 H new ATOM 0 HD22 LEU A 37 2.609 14.001 1.872 1.00 0.00 H new ATOM 0 HD23 LEU A 37 3.524 14.571 3.288 1.00 0.00 H new ATOM 643 N LYS A 38 4.171 14.942 -2.467 1.00 0.00 N ATOM 644 CA LYS A 38 4.431 15.424 -3.831 1.00 0.00 C ATOM 645 C LYS A 38 3.140 16.066 -4.391 1.00 0.00 C ATOM 646 O LYS A 38 2.037 15.658 -3.998 1.00 0.00 O ATOM 647 CB LYS A 38 4.968 14.242 -4.722 1.00 0.00 C ATOM 648 CG LYS A 38 3.956 13.108 -5.087 1.00 0.00 C ATOM 649 CD LYS A 38 3.145 13.387 -6.383 1.00 0.00 C ATOM 650 CE LYS A 38 4.036 13.572 -7.623 1.00 0.00 C ATOM 651 NZ LYS A 38 3.244 13.873 -8.840 1.00 0.00 N ATOM 0 H LYS A 38 3.294 14.428 -2.376 1.00 0.00 H new ATOM 0 HA LYS A 38 5.206 16.191 -3.831 1.00 0.00 H new ATOM 0 HB2 LYS A 38 5.351 14.665 -5.651 1.00 0.00 H new ATOM 0 HB3 LYS A 38 5.814 13.787 -4.207 1.00 0.00 H new ATOM 0 HG2 LYS A 38 4.501 12.171 -5.205 1.00 0.00 H new ATOM 0 HG3 LYS A 38 3.262 12.971 -4.257 1.00 0.00 H new ATOM 0 HD2 LYS A 38 2.456 12.561 -6.558 1.00 0.00 H new ATOM 0 HD3 LYS A 38 2.540 14.282 -6.240 1.00 0.00 H new ATOM 0 HE2 LYS A 38 4.744 14.381 -7.443 1.00 0.00 H new ATOM 0 HE3 LYS A 38 4.621 12.667 -7.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 3.886 14.023 -9.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 2.610 13.075 -9.048 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 2.679 14.732 -8.683 1.00 0.00 H new ATOM 665 N PRO A 39 3.244 17.059 -5.336 1.00 0.00 N ATOM 666 CA PRO A 39 2.061 17.666 -5.979 1.00 0.00 C ATOM 667 C PRO A 39 1.364 16.652 -6.920 1.00 0.00 C ATOM 668 O PRO A 39 1.874 16.333 -8.004 1.00 0.00 O ATOM 669 CB PRO A 39 2.645 18.883 -6.746 1.00 0.00 C ATOM 670 CG PRO A 39 4.076 18.520 -7.013 1.00 0.00 C ATOM 671 CD PRO A 39 4.513 17.648 -5.852 1.00 0.00 C ATOM 0 HA PRO A 39 1.288 17.965 -5.271 1.00 0.00 H new ATOM 0 HB2 PRO A 39 2.103 19.062 -7.675 1.00 0.00 H new ATOM 0 HB3 PRO A 39 2.573 19.795 -6.154 1.00 0.00 H new ATOM 0 HG2 PRO A 39 4.173 17.987 -7.959 1.00 0.00 H new ATOM 0 HG3 PRO A 39 4.697 19.413 -7.085 1.00 0.00 H new ATOM 0 HD2 PRO A 39 5.208 16.874 -6.176 1.00 0.00 H new ATOM 0 HD3 PRO A 39 5.021 18.232 -5.085 1.00 0.00 H new ATOM 679 N GLY A 40 0.244 16.084 -6.440 1.00 0.00 N ATOM 680 CA GLY A 40 -0.543 15.099 -7.194 1.00 0.00 C ATOM 681 C GLY A 40 -0.969 13.917 -6.334 1.00 0.00 C ATOM 682 O GLY A 40 -1.022 12.776 -6.811 1.00 0.00 O ATOM 0 H GLY A 40 -0.139 16.296 -5.519 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -1.428 15.583 -7.606 1.00 0.00 H new ATOM 0 HA3 GLY A 40 0.044 14.738 -8.038 1.00 0.00 H new ATOM 686 N MET A 41 -1.278 14.193 -5.052 1.00 0.00 N ATOM 687 CA MET A 41 -1.722 13.170 -4.083 1.00 0.00 C ATOM 688 C MET A 41 -3.141 13.489 -3.563 1.00 0.00 C ATOM 689 O MET A 41 -3.849 14.320 -4.138 1.00 0.00 O ATOM 690 CB MET A 41 -0.716 13.057 -2.901 1.00 0.00 C ATOM 691 CG MET A 41 0.681 12.538 -3.267 1.00 0.00 C ATOM 692 SD MET A 41 1.501 11.719 -1.880 1.00 0.00 S ATOM 693 CE MET A 41 1.307 12.909 -0.549 1.00 0.00 C ATOM 0 H MET A 41 -1.227 15.132 -4.658 1.00 0.00 H new ATOM 0 HA MET A 41 -1.755 12.208 -4.595 1.00 0.00 H new ATOM 0 HB2 MET A 41 -0.610 14.040 -2.442 1.00 0.00 H new ATOM 0 HB3 MET A 41 -1.143 12.397 -2.146 1.00 0.00 H new ATOM 0 HG2 MET A 41 0.599 11.840 -4.100 1.00 0.00 H new ATOM 0 HG3 MET A 41 1.296 13.370 -3.608 1.00 0.00 H new ATOM 0 HE1 MET A 41 2.044 12.709 0.228 1.00 0.00 H new ATOM 0 HE2 MET A 41 1.454 13.917 -0.938 1.00 0.00 H new ATOM 0 HE3 MET A 41 0.305 12.825 -0.129 1.00 0.00 H new ATOM 703 N LYS A 42 -3.558 12.779 -2.497 1.00 0.00 N ATOM 704 CA LYS A 42 -4.822 13.033 -1.772 1.00 0.00 C ATOM 705 C LYS A 42 -4.493 13.607 -0.387 1.00 0.00 C ATOM 706 O LYS A 42 -3.407 13.371 0.131 1.00 0.00 O ATOM 707 CB LYS A 42 -5.644 11.713 -1.581 1.00 0.00 C ATOM 708 CG LYS A 42 -5.423 10.648 -2.673 1.00 0.00 C ATOM 709 CD LYS A 42 -6.324 9.392 -2.507 1.00 0.00 C ATOM 710 CE LYS A 42 -7.832 9.713 -2.566 1.00 0.00 C ATOM 711 NZ LYS A 42 -8.677 8.501 -2.414 1.00 0.00 N ATOM 0 H LYS A 42 -3.021 12.003 -2.109 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.418 13.734 -2.357 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -5.388 11.280 -0.614 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -6.704 11.964 -1.548 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -5.613 11.095 -3.649 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -4.378 10.339 -2.662 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -6.081 8.673 -3.289 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -6.098 8.914 -1.554 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -8.080 10.426 -1.779 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -8.061 10.195 -3.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -9.681 8.769 -2.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -8.462 7.830 -3.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -8.481 8.054 -1.496 1.00 0.00 H new ATOM 725 N PHE A 43 -5.435 14.320 0.221 1.00 0.00 N ATOM 726 CA PHE A 43 -5.337 14.719 1.632 1.00 0.00 C ATOM 727 C PHE A 43 -6.684 14.446 2.282 1.00 0.00 C ATOM 728 O PHE A 43 -7.643 15.187 2.054 1.00 0.00 O ATOM 729 CB PHE A 43 -4.950 16.204 1.771 1.00 0.00 C ATOM 730 CG PHE A 43 -4.400 16.629 3.139 1.00 0.00 C ATOM 731 CD1 PHE A 43 -5.177 16.548 4.293 1.00 0.00 C ATOM 732 CD2 PHE A 43 -3.102 17.126 3.265 1.00 0.00 C ATOM 733 CE1 PHE A 43 -4.681 16.942 5.514 1.00 0.00 C ATOM 734 CE2 PHE A 43 -2.608 17.520 4.490 1.00 0.00 C ATOM 735 CZ PHE A 43 -3.399 17.430 5.612 1.00 0.00 C ATOM 0 H PHE A 43 -6.286 14.639 -0.242 1.00 0.00 H new ATOM 0 HA PHE A 43 -4.553 14.146 2.127 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -4.203 16.437 1.012 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -5.828 16.810 1.550 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -6.186 16.169 4.228 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -2.475 17.203 2.389 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -5.299 16.868 6.397 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -1.600 17.899 4.569 1.00 0.00 H new ATOM 0 HZ PHE A 43 -3.013 17.743 6.571 1.00 0.00 H new ATOM 745 N VAL A 44 -6.760 13.380 3.070 1.00 0.00 N ATOM 746 CA VAL A 44 -8.009 12.955 3.684 1.00 0.00 C ATOM 747 C VAL A 44 -8.119 13.539 5.095 1.00 0.00 C ATOM 748 O VAL A 44 -7.243 13.343 5.945 1.00 0.00 O ATOM 749 CB VAL A 44 -8.132 11.398 3.675 1.00 0.00 C ATOM 750 CG1 VAL A 44 -9.503 10.939 4.215 1.00 0.00 C ATOM 751 CG2 VAL A 44 -7.883 10.859 2.241 1.00 0.00 C ATOM 0 H VAL A 44 -5.961 12.789 3.300 1.00 0.00 H new ATOM 0 HA VAL A 44 -8.846 13.337 3.100 1.00 0.00 H new ATOM 0 HB VAL A 44 -7.373 10.986 4.340 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -9.556 9.850 4.195 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -9.626 11.290 5.240 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -10.296 11.352 3.592 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -7.970 9.772 2.240 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.621 11.282 1.560 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -6.883 11.143 1.914 1.00 0.00 H new ATOM 761 N PHE A 45 -9.188 14.305 5.312 1.00 0.00 N ATOM 762 CA PHE A 45 -9.438 14.998 6.572 1.00 0.00 C ATOM 763 C PHE A 45 -10.166 14.055 7.530 1.00 0.00 C ATOM 764 O PHE A 45 -11.357 13.760 7.353 1.00 0.00 O ATOM 765 CB PHE A 45 -10.254 16.288 6.315 1.00 0.00 C ATOM 766 CG PHE A 45 -9.619 17.187 5.263 1.00 0.00 C ATOM 767 CD1 PHE A 45 -8.459 17.894 5.547 1.00 0.00 C ATOM 768 CD2 PHE A 45 -10.144 17.278 3.978 1.00 0.00 C ATOM 769 CE1 PHE A 45 -7.858 18.676 4.587 1.00 0.00 C ATOM 770 CE2 PHE A 45 -9.537 18.055 3.022 1.00 0.00 C ATOM 771 CZ PHE A 45 -8.391 18.747 3.322 1.00 0.00 C ATOM 0 H PHE A 45 -9.911 14.462 4.610 1.00 0.00 H new ATOM 0 HA PHE A 45 -8.493 15.291 7.029 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -11.261 16.018 5.996 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -10.353 16.842 7.248 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -8.023 17.830 6.533 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -11.041 16.730 3.729 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -6.966 19.235 4.828 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -9.963 18.121 2.032 1.00 0.00 H new ATOM 0 HZ PHE A 45 -7.908 19.347 2.565 1.00 0.00 H new ATOM 781 N TYR A 46 -9.410 13.529 8.495 1.00 0.00 N ATOM 782 CA TYR A 46 -9.951 12.768 9.620 1.00 0.00 C ATOM 783 C TYR A 46 -10.640 13.773 10.559 1.00 0.00 C ATOM 784 O TYR A 46 -10.082 14.834 10.814 1.00 0.00 O ATOM 785 CB TYR A 46 -8.793 11.999 10.315 1.00 0.00 C ATOM 786 CG TYR A 46 -9.219 11.045 11.435 1.00 0.00 C ATOM 787 CD1 TYR A 46 -10.297 10.180 11.269 1.00 0.00 C ATOM 788 CD2 TYR A 46 -8.527 10.988 12.650 1.00 0.00 C ATOM 789 CE1 TYR A 46 -10.674 9.305 12.266 1.00 0.00 C ATOM 790 CE2 TYR A 46 -8.905 10.109 13.647 1.00 0.00 C ATOM 791 CZ TYR A 46 -9.978 9.268 13.449 1.00 0.00 C ATOM 792 OH TYR A 46 -10.364 8.396 14.446 1.00 0.00 O ATOM 0 H TYR A 46 -8.394 13.621 8.517 1.00 0.00 H new ATOM 0 HA TYR A 46 -10.682 12.024 9.304 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -8.254 11.428 9.559 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -8.092 12.725 10.726 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -10.849 10.194 10.341 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -7.683 11.642 12.811 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -11.518 8.648 12.116 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -8.360 10.081 14.579 1.00 0.00 H new ATOM 0 HH TYR A 46 -9.767 8.495 15.217 1.00 0.00 H new ATOM 896 N PHE A 54 -14.047 9.995 8.841 1.00 0.00 N ATOM 897 CA PHE A 54 -13.557 11.162 8.093 1.00 0.00 C ATOM 898 C PHE A 54 -14.639 12.252 8.018 1.00 0.00 C ATOM 899 O PHE A 54 -15.835 11.944 7.965 1.00 0.00 O ATOM 900 CB PHE A 54 -13.131 10.751 6.658 1.00 0.00 C ATOM 901 CG PHE A 54 -12.034 9.692 6.594 1.00 0.00 C ATOM 902 CD1 PHE A 54 -10.867 9.826 7.348 1.00 0.00 C ATOM 903 CD2 PHE A 54 -12.155 8.576 5.758 1.00 0.00 C ATOM 904 CE1 PHE A 54 -9.858 8.887 7.267 1.00 0.00 C ATOM 905 CE2 PHE A 54 -11.145 7.635 5.683 1.00 0.00 C ATOM 906 CZ PHE A 54 -9.998 7.791 6.434 1.00 0.00 C ATOM 0 HA PHE A 54 -12.690 11.560 8.621 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -14.007 10.379 6.127 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -12.790 11.640 6.127 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -10.752 10.676 8.004 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -13.048 8.448 5.164 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -8.959 9.008 7.854 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -11.254 6.777 5.036 1.00 0.00 H new ATOM 0 HZ PHE A 54 -9.208 7.057 6.372 1.00 0.00 H new ATOM 916 N VAL A 55 -14.205 13.521 8.035 1.00 0.00 N ATOM 917 CA VAL A 55 -15.082 14.676 7.754 1.00 0.00 C ATOM 918 C VAL A 55 -15.057 14.993 6.246 1.00 0.00 C ATOM 919 O VAL A 55 -16.005 15.571 5.703 1.00 0.00 O ATOM 920 CB VAL A 55 -14.662 15.923 8.618 1.00 0.00 C ATOM 921 CG1 VAL A 55 -13.196 16.343 8.371 1.00 0.00 C ATOM 922 CG2 VAL A 55 -15.629 17.115 8.446 1.00 0.00 C ATOM 0 H VAL A 55 -13.240 13.779 8.243 1.00 0.00 H new ATOM 0 HA VAL A 55 -16.105 14.424 8.033 1.00 0.00 H new ATOM 0 HB VAL A 55 -14.733 15.604 9.658 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -12.956 17.207 8.990 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.533 15.517 8.628 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -13.064 16.602 7.320 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -15.293 17.948 9.064 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -15.646 17.422 7.400 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -16.632 16.817 8.753 1.00 0.00 H new ATOM 932 N GLY A 56 -13.972 14.572 5.568 1.00 0.00 N ATOM 933 CA GLY A 56 -13.843 14.740 4.124 1.00 0.00 C ATOM 934 C GLY A 56 -12.501 14.278 3.591 1.00 0.00 C ATOM 935 O GLY A 56 -11.770 13.555 4.277 1.00 0.00 O ATOM 0 H GLY A 56 -13.174 14.113 6.007 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -14.637 14.182 3.627 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -13.986 15.791 3.872 1.00 0.00 H new ATOM 939 N GLU A 57 -12.199 14.682 2.353 1.00 0.00 N ATOM 940 CA GLU A 57 -10.889 14.474 1.714 1.00 0.00 C ATOM 941 C GLU A 57 -10.655 15.559 0.657 1.00 0.00 C ATOM 942 O GLU A 57 -11.502 16.415 0.458 1.00 0.00 O ATOM 943 CB GLU A 57 -10.744 13.056 1.097 1.00 0.00 C ATOM 944 CG GLU A 57 -11.706 12.719 -0.051 1.00 0.00 C ATOM 945 CD GLU A 57 -11.391 11.361 -0.703 1.00 0.00 C ATOM 946 OE1 GLU A 57 -11.458 10.328 -0.013 1.00 0.00 O ATOM 947 OE2 GLU A 57 -11.049 11.324 -1.898 1.00 0.00 O ATOM 0 H GLU A 57 -12.866 15.170 1.755 1.00 0.00 H new ATOM 0 HA GLU A 57 -10.126 14.550 2.488 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -9.723 12.942 0.734 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -10.884 12.321 1.889 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -12.728 12.709 0.327 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -11.653 13.503 -0.807 1.00 0.00 H new ATOM 954 N ALA A 58 -9.481 15.526 0.013 1.00 0.00 N ATOM 955 CA ALA A 58 -9.065 16.519 -0.997 1.00 0.00 C ATOM 956 C ALA A 58 -7.909 15.968 -1.834 1.00 0.00 C ATOM 957 O ALA A 58 -7.564 14.789 -1.723 1.00 0.00 O ATOM 958 CB ALA A 58 -8.655 17.833 -0.323 1.00 0.00 C ATOM 0 H ALA A 58 -8.782 14.802 0.178 1.00 0.00 H new ATOM 0 HA ALA A 58 -9.911 16.719 -1.655 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -8.351 18.553 -1.083 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -9.499 18.233 0.239 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -7.822 17.649 0.356 1.00 0.00 H new ATOM 964 N ARG A 59 -7.325 16.824 -2.688 1.00 0.00 N ATOM 965 CA ARG A 59 -6.182 16.475 -3.539 1.00 0.00 C ATOM 966 C ARG A 59 -5.028 17.452 -3.284 1.00 0.00 C ATOM 967 O ARG A 59 -5.199 18.673 -3.401 1.00 0.00 O ATOM 968 CB ARG A 59 -6.592 16.482 -5.035 1.00 0.00 C ATOM 969 CG ARG A 59 -7.702 15.465 -5.384 1.00 0.00 C ATOM 970 CD ARG A 59 -7.281 13.997 -5.187 1.00 0.00 C ATOM 971 NE ARG A 59 -8.413 13.070 -5.393 1.00 0.00 N ATOM 972 CZ ARG A 59 -9.209 12.589 -4.424 1.00 0.00 C ATOM 973 NH1 ARG A 59 -9.002 12.902 -3.148 1.00 0.00 N ATOM 974 NH2 ARG A 59 -10.204 11.776 -4.735 1.00 0.00 N ATOM 0 H ARG A 59 -7.638 17.787 -2.806 1.00 0.00 H new ATOM 0 HA ARG A 59 -5.849 15.468 -3.289 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -6.931 17.482 -5.304 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -5.713 16.269 -5.644 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -8.577 15.669 -4.766 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -8.003 15.611 -6.421 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -6.479 13.752 -5.883 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -6.881 13.865 -4.182 1.00 0.00 H new ATOM 0 HE ARG A 59 -8.606 12.771 -6.349 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -8.229 13.516 -2.893 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -9.616 12.528 -2.425 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -10.365 11.516 -5.708 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -10.811 11.409 -4.002 1.00 0.00 H new ATOM 988 N ILE A 60 -3.874 16.886 -2.900 1.00 0.00 N ATOM 989 CA ILE A 60 -2.621 17.621 -2.717 1.00 0.00 C ATOM 990 C ILE A 60 -2.038 18.038 -4.071 1.00 0.00 C ATOM 991 O ILE A 60 -1.951 17.238 -5.006 1.00 0.00 O ATOM 992 CB ILE A 60 -1.587 16.759 -1.905 1.00 0.00 C ATOM 993 CG1 ILE A 60 -1.963 16.743 -0.394 1.00 0.00 C ATOM 994 CG2 ILE A 60 -0.116 17.227 -2.112 1.00 0.00 C ATOM 995 CD1 ILE A 60 -1.295 15.646 0.400 1.00 0.00 C ATOM 0 H ILE A 60 -3.788 15.888 -2.706 1.00 0.00 H new ATOM 0 HA ILE A 60 -2.833 18.525 -2.145 1.00 0.00 H new ATOM 0 HB ILE A 60 -1.642 15.742 -2.294 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -1.699 17.705 0.044 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -3.044 16.636 -0.301 1.00 0.00 H new ATOM 0 HG21 ILE A 60 0.553 16.595 -1.527 1.00 0.00 H new ATOM 0 HG22 ILE A 60 0.145 17.152 -3.168 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -0.014 18.262 -1.786 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -1.611 15.707 1.441 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -1.578 14.676 -0.009 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -0.213 15.762 0.342 1.00 0.00 H new ATOM 1007 N LYS A 61 -1.635 19.307 -4.123 1.00 0.00 N ATOM 1008 CA LYS A 61 -1.123 20.002 -5.303 1.00 0.00 C ATOM 1009 C LYS A 61 0.060 20.905 -4.855 1.00 0.00 C ATOM 1010 O LYS A 61 0.512 20.783 -3.703 1.00 0.00 O ATOM 1011 CB LYS A 61 -2.285 20.827 -5.929 1.00 0.00 C ATOM 1012 CG LYS A 61 -3.481 19.990 -6.423 1.00 0.00 C ATOM 1013 CD LYS A 61 -3.176 19.072 -7.635 1.00 0.00 C ATOM 1014 CE LYS A 61 -2.883 19.861 -8.919 1.00 0.00 C ATOM 1015 NZ LYS A 61 -2.783 18.986 -10.110 1.00 0.00 N ATOM 0 H LYS A 61 -1.658 19.909 -3.300 1.00 0.00 H new ATOM 0 HA LYS A 61 -0.757 19.308 -6.060 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -2.642 21.544 -5.189 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.892 21.403 -6.767 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -3.840 19.373 -5.599 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -4.293 20.666 -6.692 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -2.320 18.439 -7.400 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -4.025 18.410 -7.806 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -3.671 20.597 -9.078 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -1.951 20.413 -8.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -2.584 19.565 -10.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -2.014 18.300 -9.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -3.681 18.478 -10.244 1.00 0.00 H new ATOM 1029 N ARG A 62 0.479 21.840 -5.740 1.00 0.00 N ATOM 1030 CA ARG A 62 1.763 22.596 -5.652 1.00 0.00 C ATOM 1031 C ARG A 62 2.183 22.994 -4.204 1.00 0.00 C ATOM 1032 O ARG A 62 1.444 23.679 -3.486 1.00 0.00 O ATOM 1033 CB ARG A 62 1.678 23.849 -6.578 1.00 0.00 C ATOM 1034 CG ARG A 62 0.686 24.954 -6.127 1.00 0.00 C ATOM 1035 CD ARG A 62 0.341 25.953 -7.244 1.00 0.00 C ATOM 1036 NE ARG A 62 -0.517 25.338 -8.269 1.00 0.00 N ATOM 1037 CZ ARG A 62 -0.792 25.854 -9.470 1.00 0.00 C ATOM 1038 NH1 ARG A 62 -0.218 26.976 -9.885 1.00 0.00 N ATOM 1039 NH2 ARG A 62 -1.633 25.223 -10.271 1.00 0.00 N ATOM 0 H ARG A 62 -0.075 22.100 -6.556 1.00 0.00 H new ATOM 0 HA ARG A 62 2.551 21.922 -5.989 1.00 0.00 H new ATOM 0 HB2 ARG A 62 2.672 24.289 -6.655 1.00 0.00 H new ATOM 0 HB3 ARG A 62 1.396 23.520 -7.578 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -0.232 24.486 -5.771 1.00 0.00 H new ATOM 0 HG3 ARG A 62 1.115 25.496 -5.284 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -0.164 26.819 -6.816 1.00 0.00 H new ATOM 0 HD3 ARG A 62 1.259 26.316 -7.706 1.00 0.00 H new ATOM 0 HE ARG A 62 -0.939 24.438 -8.042 1.00 0.00 H new ATOM 0 HH11 ARG A 62 0.447 27.461 -9.283 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -0.442 27.353 -10.806 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -2.066 24.350 -9.970 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -1.849 25.609 -11.190 1.00 0.00 H new ATOM 1053 N VAL A 63 3.354 22.489 -3.766 1.00 0.00 N ATOM 1054 CA VAL A 63 3.903 22.775 -2.431 1.00 0.00 C ATOM 1055 C VAL A 63 4.962 23.908 -2.529 1.00 0.00 C ATOM 1056 O VAL A 63 5.978 23.780 -3.230 1.00 0.00 O ATOM 1057 CB VAL A 63 4.475 21.466 -1.737 1.00 0.00 C ATOM 1058 CG1 VAL A 63 3.354 20.405 -1.551 1.00 0.00 C ATOM 1059 CG2 VAL A 63 5.684 20.856 -2.500 1.00 0.00 C ATOM 0 H VAL A 63 3.942 21.874 -4.328 1.00 0.00 H new ATOM 0 HA VAL A 63 3.096 23.124 -1.787 1.00 0.00 H new ATOM 0 HB VAL A 63 4.843 21.770 -0.757 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.769 19.517 -1.074 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.563 20.817 -0.925 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.943 20.136 -2.524 1.00 0.00 H new ATOM 0 HG21 VAL A 63 6.031 19.964 -1.978 1.00 0.00 H new ATOM 0 HG22 VAL A 63 5.378 20.589 -3.512 1.00 0.00 H new ATOM 0 HG23 VAL A 63 6.491 21.587 -2.546 1.00 0.00 H new ATOM 1069 N VAL A 64 4.672 25.049 -1.880 1.00 0.00 N ATOM 1070 CA VAL A 64 5.565 26.219 -1.861 1.00 0.00 C ATOM 1071 C VAL A 64 6.500 26.125 -0.650 1.00 0.00 C ATOM 1072 O VAL A 64 6.056 26.185 0.499 1.00 0.00 O ATOM 1073 CB VAL A 64 4.733 27.554 -1.848 1.00 0.00 C ATOM 1074 CG1 VAL A 64 5.618 28.803 -1.596 1.00 0.00 C ATOM 1075 CG2 VAL A 64 3.940 27.690 -3.169 1.00 0.00 C ATOM 0 H VAL A 64 3.810 25.185 -1.353 1.00 0.00 H new ATOM 0 HA VAL A 64 6.171 26.228 -2.767 1.00 0.00 H new ATOM 0 HB VAL A 64 4.034 27.501 -1.014 1.00 0.00 H new ATOM 0 HG11 VAL A 64 4.994 29.697 -1.597 1.00 0.00 H new ATOM 0 HG12 VAL A 64 6.115 28.708 -0.630 1.00 0.00 H new ATOM 0 HG13 VAL A 64 6.368 28.883 -2.383 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.366 28.616 -3.155 1.00 0.00 H new ATOM 0 HG22 VAL A 64 4.634 27.706 -4.010 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.261 26.844 -3.275 1.00 0.00 H new ATOM 1085 N LEU A 65 7.795 25.943 -0.931 1.00 0.00 N ATOM 1086 CA LEU A 65 8.825 25.750 0.092 1.00 0.00 C ATOM 1087 C LEU A 65 9.409 27.115 0.507 1.00 0.00 C ATOM 1088 O LEU A 65 9.865 27.880 -0.351 1.00 0.00 O ATOM 1089 CB LEU A 65 9.941 24.820 -0.461 1.00 0.00 C ATOM 1090 CG LEU A 65 9.468 23.447 -1.049 1.00 0.00 C ATOM 1091 CD1 LEU A 65 10.662 22.606 -1.549 1.00 0.00 C ATOM 1092 CD2 LEU A 65 8.610 22.655 -0.036 1.00 0.00 C ATOM 0 H LEU A 65 8.159 25.926 -1.884 1.00 0.00 H new ATOM 0 HA LEU A 65 8.384 25.281 0.972 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.481 25.358 -1.240 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.652 24.623 0.342 1.00 0.00 H new ATOM 0 HG LEU A 65 8.835 23.667 -1.909 1.00 0.00 H new ATOM 0 HD11 LEU A 65 10.298 21.660 -1.950 1.00 0.00 H new ATOM 0 HD12 LEU A 65 11.190 23.153 -2.330 1.00 0.00 H new ATOM 0 HD13 LEU A 65 11.342 22.411 -0.720 1.00 0.00 H new ATOM 0 HD21 LEU A 65 8.302 21.709 -0.481 1.00 0.00 H new ATOM 0 HD22 LEU A 65 9.196 22.459 0.862 1.00 0.00 H new ATOM 0 HD23 LEU A 65 7.727 23.237 0.227 1.00 0.00 H new ATOM 1104 N SER A 66 9.367 27.411 1.817 1.00 0.00 N ATOM 1105 CA SER A 66 9.906 28.653 2.399 1.00 0.00 C ATOM 1106 C SER A 66 10.326 28.417 3.861 1.00 0.00 C ATOM 1107 O SER A 66 9.611 27.767 4.619 1.00 0.00 O ATOM 1108 CB SER A 66 8.857 29.788 2.330 1.00 0.00 C ATOM 1109 OG SER A 66 9.317 30.958 2.980 1.00 0.00 O ATOM 0 H SER A 66 8.953 26.788 2.510 1.00 0.00 H new ATOM 0 HA SER A 66 10.780 28.951 1.820 1.00 0.00 H new ATOM 0 HB2 SER A 66 8.632 30.014 1.288 1.00 0.00 H new ATOM 0 HB3 SER A 66 7.928 29.455 2.792 1.00 0.00 H new ATOM 0 HG SER A 66 9.497 31.653 2.313 1.00 0.00 H new ATOM 1115 N GLU A 67 11.485 28.979 4.245 1.00 0.00 N ATOM 1116 CA GLU A 67 11.991 28.941 5.631 1.00 0.00 C ATOM 1117 C GLU A 67 11.223 29.927 6.544 1.00 0.00 C ATOM 1118 O GLU A 67 11.371 29.884 7.773 1.00 0.00 O ATOM 1119 CB GLU A 67 13.513 29.245 5.635 1.00 0.00 C ATOM 1120 CG GLU A 67 14.409 28.071 5.182 1.00 0.00 C ATOM 1121 CD GLU A 67 15.804 28.516 4.711 1.00 0.00 C ATOM 1122 OE1 GLU A 67 16.699 28.727 5.558 1.00 0.00 O ATOM 1123 OE2 GLU A 67 16.011 28.658 3.484 1.00 0.00 O ATOM 0 H GLU A 67 12.101 29.475 3.601 1.00 0.00 H new ATOM 0 HA GLU A 67 11.826 27.942 6.034 1.00 0.00 H new ATOM 0 HB2 GLU A 67 13.700 30.099 4.984 1.00 0.00 H new ATOM 0 HB3 GLU A 67 13.808 29.541 6.642 1.00 0.00 H new ATOM 0 HG2 GLU A 67 14.519 27.368 6.007 1.00 0.00 H new ATOM 0 HG3 GLU A 67 13.913 27.536 4.372 1.00 0.00 H new ATOM 1130 N ASN A 68 10.420 30.827 5.937 1.00 0.00 N ATOM 1131 CA ASN A 68 9.556 31.770 6.674 1.00 0.00 C ATOM 1132 C ASN A 68 8.072 31.395 6.438 1.00 0.00 C ATOM 1133 O ASN A 68 7.602 31.432 5.294 1.00 0.00 O ATOM 1134 CB ASN A 68 9.811 33.234 6.213 1.00 0.00 C ATOM 1135 CG ASN A 68 11.267 33.695 6.371 1.00 0.00 C ATOM 1136 OD1 ASN A 68 11.960 33.308 7.312 1.00 0.00 O ATOM 1137 ND2 ASN A 68 11.742 34.524 5.447 1.00 0.00 N ATOM 0 H ASN A 68 10.354 30.919 4.923 1.00 0.00 H new ATOM 0 HA ASN A 68 9.790 31.703 7.736 1.00 0.00 H new ATOM 0 HB2 ASN A 68 9.522 33.330 5.166 1.00 0.00 H new ATOM 0 HB3 ASN A 68 9.166 33.901 6.784 1.00 0.00 H new ATOM 0 HD21 ASN A 68 12.704 34.856 5.506 1.00 0.00 H new ATOM 0 HD22 ASN A 68 11.144 34.828 4.678 1.00 0.00 H new ATOM 1144 N PRO A 69 7.298 31.065 7.522 1.00 0.00 N ATOM 1145 CA PRO A 69 5.846 30.743 7.410 1.00 0.00 C ATOM 1146 C PRO A 69 4.976 31.962 7.012 1.00 0.00 C ATOM 1147 O PRO A 69 3.814 31.808 6.624 1.00 0.00 O ATOM 1148 CB PRO A 69 5.489 30.241 8.830 1.00 0.00 C ATOM 1149 CG PRO A 69 6.498 30.889 9.728 1.00 0.00 C ATOM 1150 CD PRO A 69 7.774 30.941 8.928 1.00 0.00 C ATOM 0 HA PRO A 69 5.652 30.016 6.621 1.00 0.00 H new ATOM 0 HB2 PRO A 69 4.473 30.524 9.106 1.00 0.00 H new ATOM 0 HB3 PRO A 69 5.545 29.154 8.891 1.00 0.00 H new ATOM 0 HG2 PRO A 69 6.178 31.889 10.021 1.00 0.00 H new ATOM 0 HG3 PRO A 69 6.633 30.316 10.645 1.00 0.00 H new ATOM 0 HD2 PRO A 69 8.395 31.789 9.218 1.00 0.00 H new ATOM 0 HD3 PRO A 69 8.374 30.042 9.071 1.00 0.00 H new ATOM 1158 N MET A 70 5.571 33.165 7.084 1.00 0.00 N ATOM 1159 CA MET A 70 4.859 34.441 6.865 1.00 0.00 C ATOM 1160 C MET A 70 4.729 34.748 5.361 1.00 0.00 C ATOM 1161 O MET A 70 3.822 35.488 4.937 1.00 0.00 O ATOM 1162 CB MET A 70 5.613 35.572 7.604 1.00 0.00 C ATOM 1163 CG MET A 70 5.696 35.385 9.130 1.00 0.00 C ATOM 1164 SD MET A 70 6.859 36.526 9.915 1.00 0.00 S ATOM 1165 CE MET A 70 8.429 36.009 9.195 1.00 0.00 C ATOM 0 H MET A 70 6.562 33.283 7.296 1.00 0.00 H new ATOM 0 HA MET A 70 3.848 34.365 7.265 1.00 0.00 H new ATOM 0 HB2 MET A 70 6.624 35.642 7.203 1.00 0.00 H new ATOM 0 HB3 MET A 70 5.120 36.521 7.392 1.00 0.00 H new ATOM 0 HG2 MET A 70 4.706 35.528 9.563 1.00 0.00 H new ATOM 0 HG3 MET A 70 5.995 34.360 9.350 1.00 0.00 H new ATOM 0 HE1 MET A 70 9.245 36.295 9.858 1.00 0.00 H new ATOM 0 HE2 MET A 70 8.430 34.927 9.064 1.00 0.00 H new ATOM 0 HE3 MET A 70 8.562 36.492 8.227 1.00 0.00 H new ATOM 1175 N GLN A 71 5.629 34.143 4.553 1.00 0.00 N ATOM 1176 CA GLN A 71 5.624 34.309 3.088 1.00 0.00 C ATOM 1177 C GLN A 71 4.419 33.587 2.455 1.00 0.00 C ATOM 1178 O GLN A 71 4.002 33.913 1.343 1.00 0.00 O ATOM 1179 CB GLN A 71 6.965 33.831 2.460 1.00 0.00 C ATOM 1180 CG GLN A 71 8.213 34.503 3.074 1.00 0.00 C ATOM 1181 CD GLN A 71 9.521 34.273 2.296 1.00 0.00 C ATOM 1182 OE1 GLN A 71 9.688 33.284 1.594 1.00 0.00 O ATOM 1183 NE2 GLN A 71 10.469 35.189 2.440 1.00 0.00 N ATOM 0 H GLN A 71 6.371 33.533 4.897 1.00 0.00 H new ATOM 0 HA GLN A 71 5.524 35.373 2.873 1.00 0.00 H new ATOM 0 HB2 GLN A 71 7.048 32.751 2.581 1.00 0.00 H new ATOM 0 HB3 GLN A 71 6.946 34.031 1.389 1.00 0.00 H new ATOM 0 HG2 GLN A 71 8.033 35.576 3.144 1.00 0.00 H new ATOM 0 HG3 GLN A 71 8.343 34.134 4.092 1.00 0.00 H new ATOM 0 HE21 GLN A 71 10.305 36.004 3.031 1.00 0.00 H new ATOM 0 HE22 GLN A 71 11.362 35.078 1.960 1.00 0.00 H new ATOM 1192 N PHE A 72 3.843 32.622 3.188 1.00 0.00 N ATOM 1193 CA PHE A 72 2.616 31.923 2.773 1.00 0.00 C ATOM 1194 C PHE A 72 1.383 32.824 2.953 1.00 0.00 C ATOM 1195 O PHE A 72 0.374 32.638 2.277 1.00 0.00 O ATOM 1196 CB PHE A 72 2.438 30.622 3.588 1.00 0.00 C ATOM 1197 CG PHE A 72 3.636 29.681 3.548 1.00 0.00 C ATOM 1198 CD1 PHE A 72 4.383 29.509 2.379 1.00 0.00 C ATOM 1199 CD2 PHE A 72 4.011 28.964 4.676 1.00 0.00 C ATOM 1200 CE1 PHE A 72 5.457 28.648 2.351 1.00 0.00 C ATOM 1201 CE2 PHE A 72 5.081 28.105 4.642 1.00 0.00 C ATOM 1202 CZ PHE A 72 5.806 27.946 3.482 1.00 0.00 C ATOM 0 H PHE A 72 4.214 32.304 4.084 1.00 0.00 H new ATOM 0 HA PHE A 72 2.711 31.673 1.716 1.00 0.00 H new ATOM 0 HB2 PHE A 72 2.233 30.884 4.626 1.00 0.00 H new ATOM 0 HB3 PHE A 72 1.563 30.091 3.214 1.00 0.00 H new ATOM 0 HD1 PHE A 72 4.115 30.057 1.488 1.00 0.00 H new ATOM 0 HD2 PHE A 72 3.453 29.084 5.593 1.00 0.00 H new ATOM 0 HE1 PHE A 72 6.026 28.524 1.441 1.00 0.00 H new ATOM 0 HE2 PHE A 72 5.355 27.552 5.528 1.00 0.00 H new ATOM 0 HZ PHE A 72 6.648 27.270 3.460 1.00 0.00 H new ATOM 1212 N PHE A 73 1.470 33.793 3.880 1.00 0.00 N ATOM 1213 CA PHE A 73 0.360 34.716 4.183 1.00 0.00 C ATOM 1214 C PHE A 73 0.345 35.920 3.229 1.00 0.00 C ATOM 1215 O PHE A 73 -0.717 36.506 2.988 1.00 0.00 O ATOM 1216 CB PHE A 73 0.417 35.163 5.662 1.00 0.00 C ATOM 1217 CG PHE A 73 0.233 34.009 6.647 1.00 0.00 C ATOM 1218 CD1 PHE A 73 -0.884 33.176 6.564 1.00 0.00 C ATOM 1219 CD2 PHE A 73 1.165 33.753 7.647 1.00 0.00 C ATOM 1220 CE1 PHE A 73 -1.053 32.127 7.445 1.00 0.00 C ATOM 1221 CE2 PHE A 73 0.985 32.703 8.524 1.00 0.00 C ATOM 1222 CZ PHE A 73 -0.120 31.892 8.424 1.00 0.00 C ATOM 0 H PHE A 73 2.307 33.959 4.439 1.00 0.00 H new ATOM 0 HA PHE A 73 -0.576 34.179 4.027 1.00 0.00 H new ATOM 0 HB2 PHE A 73 1.376 35.645 5.852 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -0.357 35.910 5.839 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -1.626 33.355 5.800 1.00 0.00 H new ATOM 0 HD2 PHE A 73 2.038 34.382 7.738 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -1.921 31.490 7.364 1.00 0.00 H new ATOM 0 HE2 PHE A 73 1.718 32.517 9.295 1.00 0.00 H new ATOM 0 HZ PHE A 73 -0.254 31.072 9.114 1.00 0.00 H new ATOM 1232 N GLU A 74 1.522 36.305 2.697 1.00 0.00 N ATOM 1233 CA GLU A 74 1.590 37.347 1.642 1.00 0.00 C ATOM 1234 C GLU A 74 1.202 36.758 0.268 1.00 0.00 C ATOM 1235 O GLU A 74 0.595 37.445 -0.560 1.00 0.00 O ATOM 1236 CB GLU A 74 2.991 38.011 1.592 1.00 0.00 C ATOM 1237 CG GLU A 74 4.133 37.088 1.146 1.00 0.00 C ATOM 1238 CD GLU A 74 5.518 37.735 1.280 1.00 0.00 C ATOM 1239 OE1 GLU A 74 6.078 37.744 2.399 1.00 0.00 O ATOM 1240 OE2 GLU A 74 6.053 38.244 0.278 1.00 0.00 O ATOM 0 H GLU A 74 2.426 35.921 2.971 1.00 0.00 H new ATOM 0 HA GLU A 74 0.870 38.126 1.893 1.00 0.00 H new ATOM 0 HB2 GLU A 74 2.948 38.864 0.914 1.00 0.00 H new ATOM 0 HB3 GLU A 74 3.226 38.402 2.582 1.00 0.00 H new ATOM 0 HG2 GLU A 74 4.107 36.174 1.740 1.00 0.00 H new ATOM 0 HG3 GLU A 74 3.973 36.798 0.108 1.00 0.00 H new ATOM 1247 N THR A 75 1.549 35.471 0.046 1.00 0.00 N ATOM 1248 CA THR A 75 1.274 34.773 -1.224 1.00 0.00 C ATOM 1249 C THR A 75 -0.197 34.295 -1.291 1.00 0.00 C ATOM 1250 O THR A 75 -0.935 34.649 -2.217 1.00 0.00 O ATOM 1251 CB THR A 75 2.256 33.572 -1.416 1.00 0.00 C ATOM 1252 OG1 THR A 75 3.608 34.054 -1.401 1.00 0.00 O ATOM 1253 CG2 THR A 75 2.015 32.797 -2.725 1.00 0.00 C ATOM 0 H THR A 75 2.024 34.892 0.739 1.00 0.00 H new ATOM 0 HA THR A 75 1.433 35.480 -2.038 1.00 0.00 H new ATOM 0 HB THR A 75 2.075 32.881 -0.592 1.00 0.00 H new ATOM 0 HG1 THR A 75 3.942 34.063 -0.480 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.729 31.976 -2.799 1.00 0.00 H new ATOM 0 HG22 THR A 75 1.001 32.398 -2.730 1.00 0.00 H new ATOM 0 HG23 THR A 75 2.145 33.468 -3.574 1.00 0.00 H new ATOM 1261 N PHE A 76 -0.617 33.497 -0.293 1.00 0.00 N ATOM 1262 CA PHE A 76 -1.982 32.931 -0.227 1.00 0.00 C ATOM 1263 C PHE A 76 -2.820 33.713 0.806 1.00 0.00 C ATOM 1264 O PHE A 76 -3.758 34.428 0.439 1.00 0.00 O ATOM 1265 CB PHE A 76 -1.933 31.429 0.153 1.00 0.00 C ATOM 1266 CG PHE A 76 -0.946 30.598 -0.656 1.00 0.00 C ATOM 1267 CD1 PHE A 76 -1.240 30.221 -1.961 1.00 0.00 C ATOM 1268 CD2 PHE A 76 0.269 30.181 -0.104 1.00 0.00 C ATOM 1269 CE1 PHE A 76 -0.356 29.453 -2.690 1.00 0.00 C ATOM 1270 CE2 PHE A 76 1.152 29.415 -0.839 1.00 0.00 C ATOM 1271 CZ PHE A 76 0.835 29.051 -2.130 1.00 0.00 C ATOM 0 H PHE A 76 -0.023 33.225 0.490 1.00 0.00 H new ATOM 0 HA PHE A 76 -2.446 33.021 -1.209 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -1.678 31.344 1.209 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -2.930 31.005 0.031 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -2.172 30.533 -2.410 1.00 0.00 H new ATOM 0 HD2 PHE A 76 0.520 30.461 0.908 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -0.599 29.167 -3.703 1.00 0.00 H new ATOM 0 HE2 PHE A 76 2.089 29.102 -0.403 1.00 0.00 H new ATOM 0 HZ PHE A 76 1.523 28.448 -2.704 1.00 0.00 H new ATOM 1281 N GLY A 77 -2.448 33.569 2.101 1.00 0.00 N ATOM 1282 CA GLY A 77 -3.120 34.250 3.219 1.00 0.00 C ATOM 1283 C GLY A 77 -4.543 33.773 3.438 1.00 0.00 C ATOM 1284 O GLY A 77 -4.804 32.925 4.292 1.00 0.00 O ATOM 0 H GLY A 77 -1.672 32.975 2.393 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -2.545 34.091 4.132 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -3.128 35.324 3.030 1.00 0.00 H new ATOM 1288 N ASP A 78 -5.452 34.329 2.625 1.00 0.00 N ATOM 1289 CA ASP A 78 -6.883 33.961 2.590 1.00 0.00 C ATOM 1290 C ASP A 78 -7.068 32.459 2.310 1.00 0.00 C ATOM 1291 O ASP A 78 -7.979 31.827 2.852 1.00 0.00 O ATOM 1292 CB ASP A 78 -7.602 34.799 1.498 1.00 0.00 C ATOM 1293 CG ASP A 78 -9.062 34.373 1.234 1.00 0.00 C ATOM 1294 OD1 ASP A 78 -9.950 34.725 2.042 1.00 0.00 O ATOM 1295 OD2 ASP A 78 -9.332 33.698 0.209 1.00 0.00 O ATOM 0 H ASP A 78 -5.213 35.063 1.958 1.00 0.00 H new ATOM 0 HA ASP A 78 -7.319 34.173 3.566 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -7.589 35.848 1.793 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -7.039 34.723 0.568 1.00 0.00 H new ATOM 1300 N ARG A 79 -6.187 31.906 1.457 1.00 0.00 N ATOM 1301 CA ARG A 79 -6.243 30.493 1.050 1.00 0.00 C ATOM 1302 C ARG A 79 -5.668 29.566 2.129 1.00 0.00 C ATOM 1303 O ARG A 79 -6.116 28.431 2.244 1.00 0.00 O ATOM 1304 CB ARG A 79 -5.512 30.282 -0.303 1.00 0.00 C ATOM 1305 CG ARG A 79 -6.123 31.071 -1.478 1.00 0.00 C ATOM 1306 CD ARG A 79 -7.627 30.772 -1.675 1.00 0.00 C ATOM 1307 NE ARG A 79 -8.159 31.342 -2.931 1.00 0.00 N ATOM 1308 CZ ARG A 79 -9.415 31.793 -3.115 1.00 0.00 C ATOM 1309 NH1 ARG A 79 -10.265 31.910 -2.096 1.00 0.00 N ATOM 1310 NH2 ARG A 79 -9.810 32.142 -4.330 1.00 0.00 N ATOM 0 H ARG A 79 -5.419 32.426 1.032 1.00 0.00 H new ATOM 0 HA ARG A 79 -7.293 30.231 0.921 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -4.468 30.572 -0.189 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -5.523 29.220 -0.548 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -5.988 32.138 -1.303 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -5.585 30.827 -2.394 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -7.782 29.693 -1.675 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -8.187 31.175 -0.831 1.00 0.00 H new ATOM 0 HE ARG A 79 -7.521 31.399 -3.725 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -9.969 31.656 -1.153 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -11.212 32.254 -2.258 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -9.165 32.068 -5.117 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -10.759 32.485 -4.479 1.00 0.00 H new ATOM 1324 N VAL A 80 -4.686 30.057 2.922 1.00 0.00 N ATOM 1325 CA VAL A 80 -4.095 29.262 4.029 1.00 0.00 C ATOM 1326 C VAL A 80 -5.178 29.003 5.100 1.00 0.00 C ATOM 1327 O VAL A 80 -5.996 29.894 5.363 1.00 0.00 O ATOM 1328 CB VAL A 80 -2.848 29.967 4.686 1.00 0.00 C ATOM 1329 CG1 VAL A 80 -2.190 29.071 5.763 1.00 0.00 C ATOM 1330 CG2 VAL A 80 -1.810 30.391 3.623 1.00 0.00 C ATOM 0 H VAL A 80 -4.288 30.991 2.819 1.00 0.00 H new ATOM 0 HA VAL A 80 -3.740 28.321 3.608 1.00 0.00 H new ATOM 0 HB VAL A 80 -3.215 30.869 5.177 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -1.334 29.590 6.194 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -2.915 28.853 6.547 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -1.857 28.139 5.307 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -0.964 30.874 4.113 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -1.462 29.511 3.082 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -2.270 31.088 2.923 1.00 0.00 H new ATOM 1340 N PHE A 81 -5.196 27.779 5.686 1.00 0.00 N ATOM 1341 CA PHE A 81 -6.247 27.368 6.637 1.00 0.00 C ATOM 1342 C PHE A 81 -6.330 28.321 7.838 1.00 0.00 C ATOM 1343 O PHE A 81 -7.413 28.789 8.192 1.00 0.00 O ATOM 1344 CB PHE A 81 -6.081 25.875 7.071 1.00 0.00 C ATOM 1345 CG PHE A 81 -4.943 25.535 8.038 1.00 0.00 C ATOM 1346 CD1 PHE A 81 -3.640 25.356 7.576 1.00 0.00 C ATOM 1347 CD2 PHE A 81 -5.187 25.357 9.404 1.00 0.00 C ATOM 1348 CE1 PHE A 81 -2.619 25.028 8.449 1.00 0.00 C ATOM 1349 CE2 PHE A 81 -4.164 25.029 10.273 1.00 0.00 C ATOM 1350 CZ PHE A 81 -2.882 24.858 9.795 1.00 0.00 C ATOM 0 H PHE A 81 -4.491 27.062 5.513 1.00 0.00 H new ATOM 0 HA PHE A 81 -7.203 27.438 6.118 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -7.017 25.553 7.528 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -5.945 25.277 6.170 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -3.425 25.475 6.524 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -6.190 25.478 9.785 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -1.612 24.904 8.078 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -4.369 24.907 11.326 1.00 0.00 H new ATOM 0 HZ PHE A 81 -2.084 24.591 10.472 1.00 0.00 H new ATOM 1360 N LEU A 82 -5.174 28.663 8.411 1.00 0.00 N ATOM 1361 CA LEU A 82 -5.092 29.580 9.561 1.00 0.00 C ATOM 1362 C LEU A 82 -4.566 30.951 9.092 1.00 0.00 C ATOM 1363 O LEU A 82 -4.037 31.067 7.980 1.00 0.00 O ATOM 1364 CB LEU A 82 -4.211 28.960 10.701 1.00 0.00 C ATOM 1365 CG LEU A 82 -2.650 29.131 10.637 1.00 0.00 C ATOM 1366 CD1 LEU A 82 -1.979 28.538 11.894 1.00 0.00 C ATOM 1367 CD2 LEU A 82 -2.041 28.527 9.363 1.00 0.00 C ATOM 0 H LEU A 82 -4.268 28.316 8.096 1.00 0.00 H new ATOM 0 HA LEU A 82 -6.086 29.731 9.981 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -4.550 29.384 11.646 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -4.424 27.892 10.737 1.00 0.00 H new ATOM 0 HG LEU A 82 -2.454 30.203 10.606 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -0.899 28.669 11.826 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -2.351 29.050 12.781 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -2.212 27.476 11.964 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -0.961 28.674 9.371 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -2.262 27.460 9.324 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -2.467 29.018 8.488 1.00 0.00 H new ATOM 1379 N THR A 83 -4.737 31.991 9.926 1.00 0.00 N ATOM 1380 CA THR A 83 -4.211 33.345 9.633 1.00 0.00 C ATOM 1381 C THR A 83 -2.883 33.570 10.399 1.00 0.00 C ATOM 1382 O THR A 83 -2.415 32.675 11.115 1.00 0.00 O ATOM 1383 CB THR A 83 -5.277 34.453 9.961 1.00 0.00 C ATOM 1384 OG1 THR A 83 -4.848 35.723 9.438 1.00 0.00 O ATOM 1385 CG2 THR A 83 -5.555 34.587 11.470 1.00 0.00 C ATOM 0 H THR A 83 -5.237 31.924 10.813 1.00 0.00 H new ATOM 0 HA THR A 83 -4.002 33.421 8.566 1.00 0.00 H new ATOM 0 HB THR A 83 -6.207 34.143 9.485 1.00 0.00 H new ATOM 0 HG1 THR A 83 -5.519 36.406 9.646 1.00 0.00 H new ATOM 0 HG21 THR A 83 -6.299 35.367 11.635 1.00 0.00 H new ATOM 0 HG22 THR A 83 -5.931 33.640 11.856 1.00 0.00 H new ATOM 0 HG23 THR A 83 -4.633 34.850 11.988 1.00 0.00 H new ATOM 1393 N LYS A 84 -2.272 34.763 10.246 1.00 0.00 N ATOM 1394 CA LYS A 84 -0.955 35.075 10.846 1.00 0.00 C ATOM 1395 C LYS A 84 -1.047 35.170 12.389 1.00 0.00 C ATOM 1396 O LYS A 84 -0.084 34.862 13.094 1.00 0.00 O ATOM 1397 CB LYS A 84 -0.387 36.382 10.238 1.00 0.00 C ATOM 1398 CG LYS A 84 1.071 36.707 10.648 1.00 0.00 C ATOM 1399 CD LYS A 84 1.591 38.025 10.026 1.00 0.00 C ATOM 1400 CE LYS A 84 1.626 37.981 8.491 1.00 0.00 C ATOM 1401 NZ LYS A 84 2.078 39.267 7.912 1.00 0.00 N ATOM 0 H LYS A 84 -2.672 35.532 9.708 1.00 0.00 H new ATOM 0 HA LYS A 84 -0.271 34.259 10.613 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -0.438 36.313 9.151 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -1.027 37.213 10.535 1.00 0.00 H new ATOM 0 HG2 LYS A 84 1.131 36.775 11.734 1.00 0.00 H new ATOM 0 HG3 LYS A 84 1.720 35.886 10.344 1.00 0.00 H new ATOM 0 HD2 LYS A 84 0.955 38.850 10.348 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.593 38.230 10.403 1.00 0.00 H new ATOM 0 HE2 LYS A 84 2.293 37.182 8.166 1.00 0.00 H new ATOM 0 HE3 LYS A 84 0.633 37.741 8.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 2.088 39.196 6.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 1.428 40.025 8.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 3.036 39.484 8.253 1.00 0.00 H new ATOM 1415 N ASP A 85 -2.228 35.583 12.900 1.00 0.00 N ATOM 1416 CA ASP A 85 -2.509 35.607 14.360 1.00 0.00 C ATOM 1417 C ASP A 85 -2.610 34.181 14.933 1.00 0.00 C ATOM 1418 O ASP A 85 -2.273 33.930 16.097 1.00 0.00 O ATOM 1419 CB ASP A 85 -3.779 36.438 14.694 1.00 0.00 C ATOM 1420 CG ASP A 85 -3.479 37.938 14.882 1.00 0.00 C ATOM 1421 OD1 ASP A 85 -2.924 38.319 15.942 1.00 0.00 O ATOM 1422 OD2 ASP A 85 -3.758 38.738 13.966 1.00 0.00 O ATOM 0 H ASP A 85 -3.006 35.906 12.325 1.00 0.00 H new ATOM 0 HA ASP A 85 -1.665 36.102 14.840 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -4.509 36.316 13.893 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -4.235 36.047 15.603 1.00 0.00 H new ATOM 1427 N GLU A 86 -3.054 33.253 14.101 1.00 0.00 N ATOM 1428 CA GLU A 86 -3.096 31.831 14.450 1.00 0.00 C ATOM 1429 C GLU A 86 -1.684 31.213 14.403 1.00 0.00 C ATOM 1430 O GLU A 86 -1.401 30.253 15.124 1.00 0.00 O ATOM 1431 CB GLU A 86 -4.063 31.100 13.513 1.00 0.00 C ATOM 1432 CG GLU A 86 -5.507 31.608 13.589 1.00 0.00 C ATOM 1433 CD GLU A 86 -6.153 31.369 14.961 1.00 0.00 C ATOM 1434 OE1 GLU A 86 -6.303 30.189 15.345 1.00 0.00 O ATOM 1435 OE2 GLU A 86 -6.521 32.340 15.650 1.00 0.00 O ATOM 0 H GLU A 86 -3.397 33.458 13.163 1.00 0.00 H new ATOM 0 HA GLU A 86 -3.460 31.723 15.472 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -3.706 31.202 12.488 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -4.050 30.036 13.751 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -5.524 32.675 13.366 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -6.102 31.113 12.822 1.00 0.00 H new ATOM 1442 N LEU A 87 -0.811 31.779 13.547 1.00 0.00 N ATOM 1443 CA LEU A 87 0.602 31.377 13.471 1.00 0.00 C ATOM 1444 C LEU A 87 1.360 31.810 14.748 1.00 0.00 C ATOM 1445 O LEU A 87 2.098 31.005 15.329 1.00 0.00 O ATOM 1446 CB LEU A 87 1.301 31.979 12.221 1.00 0.00 C ATOM 1447 CG LEU A 87 2.832 31.665 12.101 1.00 0.00 C ATOM 1448 CD1 LEU A 87 3.090 30.162 11.853 1.00 0.00 C ATOM 1449 CD2 LEU A 87 3.527 32.558 11.054 1.00 0.00 C ATOM 0 H LEU A 87 -1.065 32.521 12.895 1.00 0.00 H new ATOM 0 HA LEU A 87 0.626 30.290 13.387 1.00 0.00 H new ATOM 0 HB2 LEU A 87 0.798 31.607 11.328 1.00 0.00 H new ATOM 0 HB3 LEU A 87 1.168 33.061 12.235 1.00 0.00 H new ATOM 0 HG LEU A 87 3.284 31.908 13.062 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.163 29.985 11.776 1.00 0.00 H new ATOM 0 HD12 LEU A 87 2.685 29.582 12.682 1.00 0.00 H new ATOM 0 HD13 LEU A 87 2.604 29.858 10.926 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.586 32.305 11.005 1.00 0.00 H new ATOM 0 HD22 LEU A 87 3.070 32.397 10.078 1.00 0.00 H new ATOM 0 HD23 LEU A 87 3.417 33.605 11.338 1.00 0.00 H new ATOM 1461 N LYS A 88 1.171 33.081 15.176 1.00 0.00 N ATOM 1462 CA LYS A 88 1.914 33.640 16.329 1.00 0.00 C ATOM 1463 C LYS A 88 1.538 32.910 17.628 1.00 0.00 C ATOM 1464 O LYS A 88 2.420 32.603 18.425 1.00 0.00 O ATOM 1465 CB LYS A 88 1.754 35.199 16.451 1.00 0.00 C ATOM 1466 CG LYS A 88 0.307 35.750 16.454 1.00 0.00 C ATOM 1467 CD LYS A 88 -0.397 35.754 17.842 1.00 0.00 C ATOM 1468 CE LYS A 88 -0.133 37.033 18.629 1.00 0.00 C ATOM 1469 NZ LYS A 88 -0.879 38.192 18.066 1.00 0.00 N ATOM 0 H LYS A 88 0.516 33.733 14.744 1.00 0.00 H new ATOM 0 HA LYS A 88 2.975 33.466 16.148 1.00 0.00 H new ATOM 0 HB2 LYS A 88 2.243 35.521 17.371 1.00 0.00 H new ATOM 0 HB3 LYS A 88 2.293 35.662 15.625 1.00 0.00 H new ATOM 0 HG2 LYS A 88 0.323 36.770 16.069 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -0.292 35.158 15.762 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -1.471 35.634 17.701 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -0.054 34.897 18.422 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -0.422 36.886 19.670 1.00 0.00 H new ATOM 0 HE3 LYS A 88 0.935 37.250 18.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -0.206 38.877 17.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -1.522 37.861 17.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -1.431 38.649 18.820 1.00 0.00 H new ATOM 1483 N GLU A 89 0.235 32.583 17.813 1.00 0.00 N ATOM 1484 CA GLU A 89 -0.219 31.825 19.002 1.00 0.00 C ATOM 1485 C GLU A 89 0.291 30.368 18.947 1.00 0.00 C ATOM 1486 O GLU A 89 0.607 29.785 19.981 1.00 0.00 O ATOM 1487 CB GLU A 89 -1.766 31.856 19.173 1.00 0.00 C ATOM 1488 CG GLU A 89 -2.566 31.170 18.052 1.00 0.00 C ATOM 1489 CD GLU A 89 -4.086 31.156 18.299 1.00 0.00 C ATOM 1490 OE1 GLU A 89 -4.719 32.235 18.227 1.00 0.00 O ATOM 1491 OE2 GLU A 89 -4.651 30.069 18.569 1.00 0.00 O ATOM 0 H GLU A 89 -0.511 32.829 17.162 1.00 0.00 H new ATOM 0 HA GLU A 89 0.209 32.318 19.875 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -2.020 31.381 20.121 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -2.087 32.896 19.242 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -2.364 31.679 17.109 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -2.215 30.144 17.942 1.00 0.00 H new ATOM 1498 N TYR A 90 0.384 29.807 17.720 1.00 0.00 N ATOM 1499 CA TYR A 90 0.921 28.449 17.476 1.00 0.00 C ATOM 1500 C TYR A 90 2.408 28.352 17.891 1.00 0.00 C ATOM 1501 O TYR A 90 2.812 27.397 18.556 1.00 0.00 O ATOM 1502 CB TYR A 90 0.740 28.080 15.977 1.00 0.00 C ATOM 1503 CG TYR A 90 1.360 26.746 15.537 1.00 0.00 C ATOM 1504 CD1 TYR A 90 0.846 25.525 15.979 1.00 0.00 C ATOM 1505 CD2 TYR A 90 2.467 26.711 14.674 1.00 0.00 C ATOM 1506 CE1 TYR A 90 1.409 24.320 15.582 1.00 0.00 C ATOM 1507 CE2 TYR A 90 3.028 25.508 14.274 1.00 0.00 C ATOM 1508 CZ TYR A 90 2.498 24.317 14.732 1.00 0.00 C ATOM 1509 OH TYR A 90 3.066 23.115 14.337 1.00 0.00 O ATOM 0 H TYR A 90 0.088 30.285 16.869 1.00 0.00 H new ATOM 0 HA TYR A 90 0.366 27.738 18.088 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -0.327 28.054 15.755 1.00 0.00 H new ATOM 0 HB3 TYR A 90 1.172 28.877 15.372 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -0.006 25.518 16.643 1.00 0.00 H new ATOM 0 HD2 TYR A 90 2.889 27.638 14.315 1.00 0.00 H new ATOM 0 HE1 TYR A 90 0.997 23.387 15.937 1.00 0.00 H new ATOM 0 HE2 TYR A 90 3.877 25.502 13.606 1.00 0.00 H new ATOM 0 HH TYR A 90 3.822 23.291 13.739 1.00 0.00 H new ATOM 1519 N MET A 91 3.201 29.369 17.515 1.00 0.00 N ATOM 1520 CA MET A 91 4.657 29.401 17.772 1.00 0.00 C ATOM 1521 C MET A 91 4.956 29.760 19.243 1.00 0.00 C ATOM 1522 O MET A 91 5.907 29.229 19.835 1.00 0.00 O ATOM 1523 CB MET A 91 5.367 30.382 16.800 1.00 0.00 C ATOM 1524 CG MET A 91 5.297 29.967 15.317 1.00 0.00 C ATOM 1525 SD MET A 91 6.260 31.047 14.229 1.00 0.00 S ATOM 1526 CE MET A 91 5.502 32.647 14.519 1.00 0.00 C ATOM 0 H MET A 91 2.854 30.193 17.024 1.00 0.00 H new ATOM 0 HA MET A 91 5.053 28.402 17.590 1.00 0.00 H new ATOM 0 HB2 MET A 91 4.921 31.371 16.910 1.00 0.00 H new ATOM 0 HB3 MET A 91 6.414 30.470 17.092 1.00 0.00 H new ATOM 0 HG2 MET A 91 5.658 28.944 15.215 1.00 0.00 H new ATOM 0 HG3 MET A 91 4.256 29.971 14.994 1.00 0.00 H new ATOM 0 HE1 MET A 91 5.501 33.222 13.593 1.00 0.00 H new ATOM 0 HE2 MET A 91 4.476 32.507 14.860 1.00 0.00 H new ATOM 0 HE3 MET A 91 6.067 33.185 15.280 1.00 0.00 H new ATOM 1536 N LYS A 92 4.127 30.649 19.835 1.00 0.00 N ATOM 1537 CA LYS A 92 4.218 30.983 21.278 1.00 0.00 C ATOM 1538 C LYS A 92 3.759 29.790 22.135 1.00 0.00 C ATOM 1539 O LYS A 92 4.149 29.664 23.296 1.00 0.00 O ATOM 1540 CB LYS A 92 3.407 32.261 21.648 1.00 0.00 C ATOM 1541 CG LYS A 92 3.871 33.593 20.984 1.00 0.00 C ATOM 1542 CD LYS A 92 5.353 34.003 21.272 1.00 0.00 C ATOM 1543 CE LYS A 92 6.361 33.534 20.195 1.00 0.00 C ATOM 1544 NZ LYS A 92 7.751 33.948 20.515 1.00 0.00 N ATOM 0 H LYS A 92 3.389 31.148 19.339 1.00 0.00 H new ATOM 0 HA LYS A 92 5.265 31.197 21.490 1.00 0.00 H new ATOM 0 HB2 LYS A 92 2.363 32.092 21.382 1.00 0.00 H new ATOM 0 HB3 LYS A 92 3.444 32.388 22.730 1.00 0.00 H new ATOM 0 HG2 LYS A 92 3.738 33.508 19.906 1.00 0.00 H new ATOM 0 HG3 LYS A 92 3.217 34.396 21.323 1.00 0.00 H new ATOM 0 HD2 LYS A 92 5.408 35.088 21.357 1.00 0.00 H new ATOM 0 HD3 LYS A 92 5.651 33.592 22.236 1.00 0.00 H new ATOM 0 HE2 LYS A 92 6.318 32.448 20.106 1.00 0.00 H new ATOM 0 HE3 LYS A 92 6.074 33.945 19.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 8.393 33.614 19.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 7.799 34.985 20.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 8.035 33.535 21.426 1.00 0.00 H new ATOM 1558 N SER A 93 2.933 28.912 21.542 1.00 0.00 N ATOM 1559 CA SER A 93 2.518 27.655 22.178 1.00 0.00 C ATOM 1560 C SER A 93 3.696 26.669 22.272 1.00 0.00 C ATOM 1561 O SER A 93 3.785 25.890 23.220 1.00 0.00 O ATOM 1562 CB SER A 93 1.338 27.019 21.401 1.00 0.00 C ATOM 1563 OG SER A 93 0.918 25.785 21.964 1.00 0.00 O ATOM 0 H SER A 93 2.537 29.054 20.613 1.00 0.00 H new ATOM 0 HA SER A 93 2.186 27.881 23.191 1.00 0.00 H new ATOM 0 HB2 SER A 93 0.498 27.714 21.390 1.00 0.00 H new ATOM 0 HB3 SER A 93 1.634 26.860 20.364 1.00 0.00 H new ATOM 0 HG SER A 93 0.172 25.424 21.441 1.00 0.00 H new ATOM 1798 N LYS A 106 16.250 27.729 12.082 1.00 0.00 N ATOM 1799 CA LYS A 106 14.900 27.890 11.499 1.00 0.00 C ATOM 1800 C LYS A 106 14.398 26.524 11.004 1.00 0.00 C ATOM 1801 O LYS A 106 15.030 25.483 11.256 1.00 0.00 O ATOM 1802 CB LYS A 106 14.891 28.941 10.335 1.00 0.00 C ATOM 1803 CG LYS A 106 15.616 28.518 9.019 1.00 0.00 C ATOM 1804 CD LYS A 106 17.125 28.859 8.991 1.00 0.00 C ATOM 1805 CE LYS A 106 17.393 30.368 8.825 1.00 0.00 C ATOM 1806 NZ LYS A 106 16.832 30.890 7.546 1.00 0.00 N ATOM 0 HA LYS A 106 14.231 28.268 12.272 1.00 0.00 H new ATOM 0 HB2 LYS A 106 13.854 29.177 10.094 1.00 0.00 H new ATOM 0 HB3 LYS A 106 15.351 29.860 10.699 1.00 0.00 H new ATOM 0 HG2 LYS A 106 15.495 27.444 8.879 1.00 0.00 H new ATOM 0 HG3 LYS A 106 15.128 29.006 8.175 1.00 0.00 H new ATOM 0 HD2 LYS A 106 17.589 28.512 9.914 1.00 0.00 H new ATOM 0 HD3 LYS A 106 17.600 28.318 8.173 1.00 0.00 H new ATOM 0 HE2 LYS A 106 16.954 30.910 9.663 1.00 0.00 H new ATOM 0 HE3 LYS A 106 18.467 30.552 8.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 17.439 31.654 7.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 16.791 30.122 6.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 15.874 31.258 7.712 1.00 0.00 H new ATOM 1820 N LYS A 107 13.265 26.527 10.289 1.00 0.00 N ATOM 1821 CA LYS A 107 12.705 25.319 9.680 1.00 0.00 C ATOM 1822 C LYS A 107 12.267 25.642 8.249 1.00 0.00 C ATOM 1823 O LYS A 107 11.835 26.758 7.968 1.00 0.00 O ATOM 1824 CB LYS A 107 11.520 24.752 10.541 1.00 0.00 C ATOM 1825 CG LYS A 107 11.616 23.231 10.807 1.00 0.00 C ATOM 1826 CD LYS A 107 11.608 22.377 9.520 1.00 0.00 C ATOM 1827 CE LYS A 107 12.018 20.923 9.771 1.00 0.00 C ATOM 1828 NZ LYS A 107 11.118 20.239 10.735 1.00 0.00 N ATOM 0 H LYS A 107 12.713 27.368 10.118 1.00 0.00 H new ATOM 0 HA LYS A 107 13.466 24.539 9.646 1.00 0.00 H new ATOM 0 HB2 LYS A 107 11.492 25.278 11.495 1.00 0.00 H new ATOM 0 HB3 LYS A 107 10.579 24.964 10.033 1.00 0.00 H new ATOM 0 HG2 LYS A 107 12.530 23.025 11.364 1.00 0.00 H new ATOM 0 HG3 LYS A 107 10.782 22.928 11.440 1.00 0.00 H new ATOM 0 HD2 LYS A 107 10.610 22.398 9.082 1.00 0.00 H new ATOM 0 HD3 LYS A 107 12.286 22.820 8.791 1.00 0.00 H new ATOM 0 HE2 LYS A 107 12.015 20.379 8.826 1.00 0.00 H new ATOM 0 HE3 LYS A 107 13.040 20.897 10.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 11.246 19.210 10.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 11.347 20.546 11.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 10.130 20.482 10.520 1.00 0.00 H new ATOM 1842 N LEU A 108 12.438 24.661 7.356 1.00 0.00 N ATOM 1843 CA LEU A 108 11.871 24.690 6.005 1.00 0.00 C ATOM 1844 C LEU A 108 10.376 24.328 6.130 1.00 0.00 C ATOM 1845 O LEU A 108 10.024 23.161 6.314 1.00 0.00 O ATOM 1846 CB LEU A 108 12.643 23.691 5.064 1.00 0.00 C ATOM 1847 CG LEU A 108 12.508 23.887 3.505 1.00 0.00 C ATOM 1848 CD1 LEU A 108 11.083 23.633 2.982 1.00 0.00 C ATOM 1849 CD2 LEU A 108 13.018 25.275 3.079 1.00 0.00 C ATOM 0 H LEU A 108 12.978 23.818 7.553 1.00 0.00 H new ATOM 0 HA LEU A 108 11.973 25.677 5.555 1.00 0.00 H new ATOM 0 HB2 LEU A 108 13.702 23.745 5.317 1.00 0.00 H new ATOM 0 HB3 LEU A 108 12.309 22.681 5.304 1.00 0.00 H new ATOM 0 HG LEU A 108 13.139 23.127 3.044 1.00 0.00 H new ATOM 0 HD11 LEU A 108 11.059 23.785 1.903 1.00 0.00 H new ATOM 0 HD12 LEU A 108 10.789 22.609 3.211 1.00 0.00 H new ATOM 0 HD13 LEU A 108 10.391 24.325 3.461 1.00 0.00 H new ATOM 0 HD21 LEU A 108 12.914 25.385 2.000 1.00 0.00 H new ATOM 0 HD22 LEU A 108 12.434 26.047 3.580 1.00 0.00 H new ATOM 0 HD23 LEU A 108 14.068 25.377 3.355 1.00 0.00 H new ATOM 1861 N TRP A 109 9.522 25.350 6.102 1.00 0.00 N ATOM 1862 CA TRP A 109 8.064 25.183 6.054 1.00 0.00 C ATOM 1863 C TRP A 109 7.624 24.947 4.596 1.00 0.00 C ATOM 1864 O TRP A 109 8.340 25.291 3.654 1.00 0.00 O ATOM 1865 CB TRP A 109 7.346 26.430 6.628 1.00 0.00 C ATOM 1866 CG TRP A 109 7.583 26.727 8.092 1.00 0.00 C ATOM 1867 CD1 TRP A 109 8.766 27.055 8.679 1.00 0.00 C ATOM 1868 CD2 TRP A 109 6.594 26.774 9.140 1.00 0.00 C ATOM 1869 NE1 TRP A 109 8.588 27.284 10.016 1.00 0.00 N ATOM 1870 CE2 TRP A 109 7.269 27.118 10.327 1.00 0.00 C ATOM 1871 CE3 TRP A 109 5.212 26.545 9.194 1.00 0.00 C ATOM 1872 CZ2 TRP A 109 6.611 27.260 11.548 1.00 0.00 C ATOM 1873 CZ3 TRP A 109 4.559 26.689 10.407 1.00 0.00 C ATOM 1874 CH2 TRP A 109 5.262 27.038 11.574 1.00 0.00 C ATOM 0 H TRP A 109 9.821 26.325 6.112 1.00 0.00 H new ATOM 0 HA TRP A 109 7.790 24.322 6.664 1.00 0.00 H new ATOM 0 HB2 TRP A 109 7.656 27.300 6.048 1.00 0.00 H new ATOM 0 HB3 TRP A 109 6.274 26.309 6.473 1.00 0.00 H new ATOM 0 HD1 TRP A 109 9.712 27.125 8.162 1.00 0.00 H new ATOM 0 HE1 TRP A 109 9.324 27.538 10.675 1.00 0.00 H new ATOM 0 HE3 TRP A 109 4.666 26.261 8.306 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 7.149 27.536 12.443 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 3.492 26.531 10.457 1.00 0.00 H new ATOM 0 HH2 TRP A 109 4.727 27.132 12.507 1.00 0.00 H new ATOM 1885 N MET A 110 6.432 24.372 4.419 1.00 0.00 N ATOM 1886 CA MET A 110 5.889 24.013 3.100 1.00 0.00 C ATOM 1887 C MET A 110 4.375 24.248 3.067 1.00 0.00 C ATOM 1888 O MET A 110 3.652 23.810 3.958 1.00 0.00 O ATOM 1889 CB MET A 110 6.245 22.536 2.757 1.00 0.00 C ATOM 1890 CG MET A 110 6.057 21.536 3.908 1.00 0.00 C ATOM 1891 SD MET A 110 6.293 19.820 3.400 1.00 0.00 S ATOM 1892 CE MET A 110 4.837 19.561 2.393 1.00 0.00 C ATOM 0 H MET A 110 5.809 24.139 5.192 1.00 0.00 H new ATOM 0 HA MET A 110 6.341 24.651 2.341 1.00 0.00 H new ATOM 0 HB2 MET A 110 5.631 22.217 1.915 1.00 0.00 H new ATOM 0 HB3 MET A 110 7.283 22.496 2.428 1.00 0.00 H new ATOM 0 HG2 MET A 110 6.761 21.773 4.706 1.00 0.00 H new ATOM 0 HG3 MET A 110 5.055 21.652 4.322 1.00 0.00 H new ATOM 0 HE1 MET A 110 4.745 18.502 2.152 1.00 0.00 H new ATOM 0 HE2 MET A 110 3.953 19.887 2.941 1.00 0.00 H new ATOM 0 HE3 MET A 110 4.925 20.136 1.471 1.00 0.00 H new ATOM 1902 N ALA A 111 3.917 24.936 2.017 1.00 0.00 N ATOM 1903 CA ALA A 111 2.512 25.294 1.829 1.00 0.00 C ATOM 1904 C ALA A 111 1.905 24.418 0.735 1.00 0.00 C ATOM 1905 O ALA A 111 2.122 24.654 -0.454 1.00 0.00 O ATOM 1906 CB ALA A 111 2.409 26.778 1.468 1.00 0.00 C ATOM 0 H ALA A 111 4.522 25.264 1.264 1.00 0.00 H new ATOM 0 HA ALA A 111 1.956 25.125 2.751 1.00 0.00 H new ATOM 0 HB1 ALA A 111 1.362 27.046 1.327 1.00 0.00 H new ATOM 0 HB2 ALA A 111 2.833 27.379 2.273 1.00 0.00 H new ATOM 0 HB3 ALA A 111 2.959 26.967 0.546 1.00 0.00 H new ATOM 1912 N ILE A 112 1.139 23.420 1.160 1.00 0.00 N ATOM 1913 CA ILE A 112 0.510 22.439 0.269 1.00 0.00 C ATOM 1914 C ILE A 112 -0.771 23.037 -0.323 1.00 0.00 C ATOM 1915 O ILE A 112 -1.616 23.513 0.441 1.00 0.00 O ATOM 1916 CB ILE A 112 0.136 21.132 1.067 1.00 0.00 C ATOM 1917 CG1 ILE A 112 1.346 20.615 1.913 1.00 0.00 C ATOM 1918 CG2 ILE A 112 -0.392 20.035 0.119 1.00 0.00 C ATOM 1919 CD1 ILE A 112 1.004 19.486 2.882 1.00 0.00 C ATOM 0 H ILE A 112 0.931 23.263 2.146 1.00 0.00 H new ATOM 0 HA ILE A 112 1.213 22.188 -0.525 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.665 21.386 1.761 1.00 0.00 H new ATOM 0 HG12 ILE A 112 2.127 20.271 1.235 1.00 0.00 H new ATOM 0 HG13 ILE A 112 1.761 21.449 2.479 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -0.642 19.145 0.696 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -1.283 20.396 -0.395 1.00 0.00 H new ATOM 0 HG23 ILE A 112 0.375 19.788 -0.615 1.00 0.00 H new ATOM 0 HD11 ILE A 112 1.901 19.190 3.427 1.00 0.00 H new ATOM 0 HD12 ILE A 112 0.247 19.829 3.588 1.00 0.00 H new ATOM 0 HD13 ILE A 112 0.619 18.632 2.324 1.00 0.00 H new ATOM 1931 N GLU A 113 -0.930 23.009 -1.661 1.00 0.00 N ATOM 1932 CA GLU A 113 -2.184 23.459 -2.286 1.00 0.00 C ATOM 1933 C GLU A 113 -3.209 22.321 -2.215 1.00 0.00 C ATOM 1934 O GLU A 113 -2.938 21.205 -2.638 1.00 0.00 O ATOM 1935 CB GLU A 113 -1.990 23.929 -3.752 1.00 0.00 C ATOM 1936 CG GLU A 113 -3.312 24.290 -4.477 1.00 0.00 C ATOM 1937 CD GLU A 113 -3.122 24.781 -5.921 1.00 0.00 C ATOM 1938 OE1 GLU A 113 -2.646 24.003 -6.765 1.00 0.00 O ATOM 1939 OE2 GLU A 113 -3.446 25.950 -6.216 1.00 0.00 O ATOM 0 H GLU A 113 -0.219 22.686 -2.317 1.00 0.00 H new ATOM 0 HA GLU A 113 -2.544 24.327 -1.734 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -1.333 24.799 -3.760 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -1.484 23.142 -4.311 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -3.960 23.414 -4.485 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -3.827 25.063 -3.907 1.00 0.00 H new ATOM 1946 N LEU A 114 -4.352 22.605 -1.617 1.00 0.00 N ATOM 1947 CA LEU A 114 -5.489 21.689 -1.542 1.00 0.00 C ATOM 1948 C LEU A 114 -6.586 22.149 -2.520 1.00 0.00 C ATOM 1949 O LEU A 114 -6.957 23.327 -2.538 1.00 0.00 O ATOM 1950 CB LEU A 114 -6.032 21.606 -0.077 1.00 0.00 C ATOM 1951 CG LEU A 114 -5.298 20.607 0.866 1.00 0.00 C ATOM 1952 CD1 LEU A 114 -5.350 19.201 0.275 1.00 0.00 C ATOM 1953 CD2 LEU A 114 -3.844 21.016 1.170 1.00 0.00 C ATOM 0 H LEU A 114 -4.525 23.499 -1.157 1.00 0.00 H new ATOM 0 HA LEU A 114 -5.166 20.688 -1.829 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -5.978 22.600 0.366 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -7.086 21.331 -0.116 1.00 0.00 H new ATOM 0 HG LEU A 114 -5.824 20.624 1.820 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -4.835 18.508 0.940 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -6.389 18.892 0.163 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -4.863 19.198 -0.700 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -3.389 20.279 1.832 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -3.278 21.066 0.240 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -3.834 21.993 1.654 1.00 0.00 H new ATOM 1965 N GLU A 115 -7.057 21.217 -3.349 1.00 0.00 N ATOM 1966 CA GLU A 115 -8.189 21.424 -4.273 1.00 0.00 C ATOM 1967 C GLU A 115 -9.072 20.164 -4.253 1.00 0.00 C ATOM 1968 O GLU A 115 -8.721 19.180 -3.589 1.00 0.00 O ATOM 1969 CB GLU A 115 -7.663 21.705 -5.711 1.00 0.00 C ATOM 1970 CG GLU A 115 -7.033 20.484 -6.412 1.00 0.00 C ATOM 1971 CD GLU A 115 -6.610 20.757 -7.865 1.00 0.00 C ATOM 1972 OE1 GLU A 115 -5.913 21.763 -8.111 1.00 0.00 O ATOM 1973 OE2 GLU A 115 -6.940 19.954 -8.764 1.00 0.00 O ATOM 0 H GLU A 115 -6.661 20.279 -3.404 1.00 0.00 H new ATOM 0 HA GLU A 115 -8.777 22.286 -3.958 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -8.488 22.072 -6.321 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -6.922 22.503 -5.664 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -6.161 20.159 -5.844 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -7.747 19.660 -6.399 1.00 0.00 H new ATOM 1980 N ASP A 116 -10.216 20.216 -4.971 1.00 0.00 N ATOM 1981 CA ASP A 116 -11.112 19.044 -5.184 1.00 0.00 C ATOM 1982 C ASP A 116 -11.586 18.462 -3.828 1.00 0.00 C ATOM 1983 O ASP A 116 -11.751 17.246 -3.660 1.00 0.00 O ATOM 1984 CB ASP A 116 -10.363 17.994 -6.070 1.00 0.00 C ATOM 1985 CG ASP A 116 -11.238 16.827 -6.576 1.00 0.00 C ATOM 1986 OD1 ASP A 116 -12.051 17.040 -7.496 1.00 0.00 O ATOM 1987 OD2 ASP A 116 -11.103 15.684 -6.081 1.00 0.00 O ATOM 0 H ASP A 116 -10.549 21.068 -5.421 1.00 0.00 H new ATOM 0 HA ASP A 116 -12.016 19.348 -5.712 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -9.934 18.507 -6.931 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -9.532 17.583 -5.497 1.00 0.00 H new ATOM 1992 N VAL A 117 -11.819 19.365 -2.862 1.00 0.00 N ATOM 1993 CA VAL A 117 -12.103 18.990 -1.474 1.00 0.00 C ATOM 1994 C VAL A 117 -13.519 18.381 -1.350 1.00 0.00 C ATOM 1995 O VAL A 117 -14.533 19.090 -1.442 1.00 0.00 O ATOM 1996 CB VAL A 117 -11.932 20.198 -0.485 1.00 0.00 C ATOM 1997 CG1 VAL A 117 -12.107 19.734 0.976 1.00 0.00 C ATOM 1998 CG2 VAL A 117 -10.568 20.917 -0.678 1.00 0.00 C ATOM 0 H VAL A 117 -11.815 20.372 -3.024 1.00 0.00 H new ATOM 0 HA VAL A 117 -11.370 18.235 -1.190 1.00 0.00 H new ATOM 0 HB VAL A 117 -12.714 20.922 -0.715 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -11.985 20.586 1.645 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -13.103 19.310 1.106 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -11.357 18.978 1.210 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -10.491 21.746 0.026 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -9.756 20.212 -0.498 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -10.499 21.298 -1.697 1.00 0.00 H new ATOM 2008 N LYS A 118 -13.554 17.048 -1.190 1.00 0.00 N ATOM 2009 CA LYS A 118 -14.786 16.272 -0.999 1.00 0.00 C ATOM 2010 C LYS A 118 -15.209 16.289 0.481 1.00 0.00 C ATOM 2011 O LYS A 118 -14.400 16.556 1.379 1.00 0.00 O ATOM 2012 CB LYS A 118 -14.585 14.796 -1.508 1.00 0.00 C ATOM 2013 CG LYS A 118 -15.647 14.311 -2.525 1.00 0.00 C ATOM 2014 CD LYS A 118 -15.641 15.142 -3.830 1.00 0.00 C ATOM 2015 CE LYS A 118 -14.292 15.073 -4.580 1.00 0.00 C ATOM 2016 NZ LYS A 118 -14.282 15.921 -5.799 1.00 0.00 N ATOM 0 H LYS A 118 -12.712 16.472 -1.190 1.00 0.00 H new ATOM 0 HA LYS A 118 -15.583 16.731 -1.584 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -13.599 14.716 -1.967 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -14.592 14.126 -0.648 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -15.464 13.263 -2.764 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -16.635 14.366 -2.068 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -16.435 14.784 -4.486 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -15.867 16.182 -3.594 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -13.491 15.390 -3.913 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -14.085 14.039 -4.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -13.609 15.530 -6.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -15.234 15.940 -6.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -13.996 16.888 -5.547 1.00 0.00 H new ATOM 2030 N LYS A 119 -16.489 15.986 0.711 1.00 0.00 N ATOM 2031 CA LYS A 119 -17.096 15.922 2.051 1.00 0.00 C ATOM 2032 C LYS A 119 -17.596 14.497 2.350 1.00 0.00 C ATOM 2033 O LYS A 119 -18.390 13.935 1.590 1.00 0.00 O ATOM 2034 CB LYS A 119 -18.263 16.965 2.175 1.00 0.00 C ATOM 2035 CG LYS A 119 -17.867 18.314 2.827 1.00 0.00 C ATOM 2036 CD LYS A 119 -17.531 18.179 4.337 1.00 0.00 C ATOM 2037 CE LYS A 119 -18.611 17.456 5.162 1.00 0.00 C ATOM 2038 NZ LYS A 119 -18.319 17.519 6.609 1.00 0.00 N ATOM 0 H LYS A 119 -17.147 15.774 -0.039 1.00 0.00 H new ATOM 0 HA LYS A 119 -16.335 16.175 2.790 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -18.661 17.162 1.180 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -19.069 16.519 2.758 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -17.004 18.726 2.303 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -18.684 19.025 2.704 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -16.589 17.641 4.441 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -17.377 19.174 4.754 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -19.583 17.908 4.966 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -18.674 16.414 4.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -19.211 17.560 7.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -17.785 16.673 6.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -17.755 18.369 6.813 1.00 0.00 H new ATOM 2052 N TYR A 120 -17.095 13.924 3.455 1.00 0.00 N ATOM 2053 CA TYR A 120 -17.593 12.669 4.037 1.00 0.00 C ATOM 2054 C TYR A 120 -18.562 13.021 5.164 1.00 0.00 C ATOM 2055 O TYR A 120 -18.183 13.098 6.336 1.00 0.00 O ATOM 2056 CB TYR A 120 -16.425 11.769 4.542 1.00 0.00 C ATOM 2057 CG TYR A 120 -15.746 10.956 3.436 1.00 0.00 C ATOM 2058 CD1 TYR A 120 -15.106 11.584 2.368 1.00 0.00 C ATOM 2059 CD2 TYR A 120 -15.768 9.558 3.450 1.00 0.00 C ATOM 2060 CE1 TYR A 120 -14.516 10.847 1.362 1.00 0.00 C ATOM 2061 CE2 TYR A 120 -15.181 8.823 2.441 1.00 0.00 C ATOM 2062 CZ TYR A 120 -14.555 9.468 1.401 1.00 0.00 C ATOM 2063 OH TYR A 120 -13.976 8.731 0.389 1.00 0.00 O ATOM 0 H TYR A 120 -16.318 14.328 3.978 1.00 0.00 H new ATOM 0 HA TYR A 120 -18.113 12.089 3.274 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -15.679 12.398 5.028 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -16.808 11.085 5.300 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -15.072 12.663 2.328 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -16.254 9.044 4.266 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -14.023 11.350 0.543 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -15.213 7.744 2.468 1.00 0.00 H new ATOM 0 HH TYR A 120 -13.128 9.146 0.126 1.00 0.00 H new ATOM 2073 N ASP A 121 -19.805 13.306 4.763 1.00 0.00 N ATOM 2074 CA ASP A 121 -20.938 13.542 5.680 1.00 0.00 C ATOM 2075 C ASP A 121 -21.290 12.232 6.411 1.00 0.00 C ATOM 2076 O ASP A 121 -21.861 12.237 7.503 1.00 0.00 O ATOM 2077 CB ASP A 121 -22.156 14.067 4.872 1.00 0.00 C ATOM 2078 CG ASP A 121 -21.806 15.274 3.974 1.00 0.00 C ATOM 2079 OD1 ASP A 121 -21.407 15.061 2.800 1.00 0.00 O ATOM 2080 OD2 ASP A 121 -21.916 16.434 4.433 1.00 0.00 O ATOM 0 H ASP A 121 -20.062 13.382 3.779 1.00 0.00 H new ATOM 0 HA ASP A 121 -20.665 14.291 6.423 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -22.549 13.261 4.252 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -22.949 14.353 5.564 1.00 0.00 H new ATOM 2085 N LYS A 122 -20.933 11.116 5.759 1.00 0.00 N ATOM 2086 CA LYS A 122 -21.015 9.767 6.314 1.00 0.00 C ATOM 2087 C LYS A 122 -19.772 9.488 7.206 1.00 0.00 C ATOM 2088 O LYS A 122 -18.651 9.890 6.856 1.00 0.00 O ATOM 2089 CB LYS A 122 -21.116 8.754 5.140 1.00 0.00 C ATOM 2090 CG LYS A 122 -19.943 8.821 4.127 1.00 0.00 C ATOM 2091 CD LYS A 122 -20.197 8.006 2.841 1.00 0.00 C ATOM 2092 CE LYS A 122 -21.373 8.542 2.006 1.00 0.00 C ATOM 2093 NZ LYS A 122 -21.556 7.784 0.738 1.00 0.00 N ATOM 0 H LYS A 122 -20.570 11.133 4.806 1.00 0.00 H new ATOM 0 HA LYS A 122 -21.899 9.664 6.943 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -21.167 7.746 5.551 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -22.050 8.928 4.606 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -19.763 9.862 3.859 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -19.036 8.454 4.608 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -19.294 8.012 2.231 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -20.394 6.968 3.109 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -22.289 8.488 2.595 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -21.204 9.594 1.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -22.359 8.181 0.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -20.693 7.857 0.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -21.744 6.784 0.955 1.00 0.00 H new ATOM 2107 N PRO A 123 -19.949 8.814 8.381 1.00 0.00 N ATOM 2108 CA PRO A 123 -18.844 8.523 9.325 1.00 0.00 C ATOM 2109 C PRO A 123 -18.038 7.251 8.940 1.00 0.00 C ATOM 2110 O PRO A 123 -18.064 6.243 9.661 1.00 0.00 O ATOM 2111 CB PRO A 123 -19.611 8.366 10.664 1.00 0.00 C ATOM 2112 CG PRO A 123 -20.919 7.742 10.268 1.00 0.00 C ATOM 2113 CD PRO A 123 -21.247 8.295 8.891 1.00 0.00 C ATOM 0 HA PRO A 123 -18.074 9.295 9.348 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -19.064 7.735 11.364 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -19.761 9.329 11.153 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -20.841 6.655 10.244 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -21.702 7.989 10.985 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -21.650 7.521 8.238 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -21.996 9.085 8.948 1.00 0.00 H new ATOM 2121 N ILE A 124 -17.333 7.308 7.788 1.00 0.00 N ATOM 2122 CA ILE A 124 -16.451 6.207 7.338 1.00 0.00 C ATOM 2123 C ILE A 124 -15.137 6.230 8.133 1.00 0.00 C ATOM 2124 O ILE A 124 -14.344 7.177 8.016 1.00 0.00 O ATOM 2125 CB ILE A 124 -16.151 6.252 5.790 1.00 0.00 C ATOM 2126 CG1 ILE A 124 -17.465 6.019 4.974 1.00 0.00 C ATOM 2127 CG2 ILE A 124 -15.043 5.228 5.383 1.00 0.00 C ATOM 2128 CD1 ILE A 124 -17.267 5.931 3.470 1.00 0.00 C ATOM 0 H ILE A 124 -17.358 8.105 7.152 1.00 0.00 H new ATOM 0 HA ILE A 124 -16.984 5.275 7.527 1.00 0.00 H new ATOM 0 HB ILE A 124 -15.768 7.245 5.553 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -17.934 5.098 5.320 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -18.160 6.831 5.189 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -14.866 5.291 4.309 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -14.121 5.458 5.917 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -15.368 4.220 5.639 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -18.230 5.769 2.985 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -16.829 6.860 3.106 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -16.600 5.101 3.239 1.00 0.00 H new ATOM 2140 N LYS A 125 -14.929 5.176 8.932 1.00 0.00 N ATOM 2141 CA LYS A 125 -13.752 5.033 9.802 1.00 0.00 C ATOM 2142 C LYS A 125 -12.492 4.753 8.953 1.00 0.00 C ATOM 2143 O LYS A 125 -12.582 4.082 7.912 1.00 0.00 O ATOM 2144 CB LYS A 125 -13.956 3.905 10.873 1.00 0.00 C ATOM 2145 CG LYS A 125 -14.918 4.255 12.040 1.00 0.00 C ATOM 2146 CD LYS A 125 -16.395 4.342 11.615 1.00 0.00 C ATOM 2147 CE LYS A 125 -17.325 4.758 12.761 1.00 0.00 C ATOM 2148 NZ LYS A 125 -18.738 4.828 12.316 1.00 0.00 N ATOM 0 H LYS A 125 -15.578 4.391 8.994 1.00 0.00 H new ATOM 0 HA LYS A 125 -13.618 5.972 10.338 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -14.333 3.015 10.370 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -12.984 3.647 11.292 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -14.817 3.502 12.821 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -14.617 5.208 12.475 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -16.491 5.058 10.799 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -16.714 3.374 11.229 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -17.235 4.045 13.581 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -17.016 5.729 13.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -19.296 5.361 13.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -18.788 5.306 11.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -19.122 3.866 12.228 1.00 0.00 H new ATOM 2162 N PRO A 126 -11.297 5.271 9.373 1.00 0.00 N ATOM 2163 CA PRO A 126 -10.018 4.981 8.689 1.00 0.00 C ATOM 2164 C PRO A 126 -9.599 3.503 8.855 1.00 0.00 C ATOM 2165 O PRO A 126 -10.010 2.831 9.815 1.00 0.00 O ATOM 2166 CB PRO A 126 -9.020 5.938 9.386 1.00 0.00 C ATOM 2167 CG PRO A 126 -9.604 6.152 10.746 1.00 0.00 C ATOM 2168 CD PRO A 126 -11.099 6.176 10.540 1.00 0.00 C ATOM 0 HA PRO A 126 -10.072 5.132 7.611 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -8.024 5.500 9.445 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -8.923 6.878 8.842 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -9.314 5.353 11.428 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -9.252 7.087 11.182 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -11.633 5.819 11.421 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -11.461 7.183 10.334 1.00 0.00 H new ATOM 2176 N LYS A 127 -8.790 3.013 7.900 1.00 0.00 N ATOM 2177 CA LYS A 127 -8.236 1.640 7.920 1.00 0.00 C ATOM 2178 C LYS A 127 -7.216 1.510 9.084 1.00 0.00 C ATOM 2179 O LYS A 127 -7.076 0.443 9.694 1.00 0.00 O ATOM 2180 CB LYS A 127 -7.576 1.307 6.531 1.00 0.00 C ATOM 2181 CG LYS A 127 -7.736 -0.157 6.029 1.00 0.00 C ATOM 2182 CD LYS A 127 -7.105 -1.221 6.955 1.00 0.00 C ATOM 2183 CE LYS A 127 -7.261 -2.650 6.412 1.00 0.00 C ATOM 2184 NZ LYS A 127 -6.716 -3.662 7.350 1.00 0.00 N ATOM 0 H LYS A 127 -8.498 3.557 7.088 1.00 0.00 H new ATOM 0 HA LYS A 127 -9.037 0.919 8.087 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -8.000 1.975 5.781 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -6.512 1.533 6.594 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -8.798 -0.375 5.915 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -7.286 -0.240 5.040 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -6.046 -1.000 7.086 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -7.567 -1.159 7.940 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -8.316 -2.856 6.229 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -6.749 -2.732 5.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -6.841 -4.612 6.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -5.704 -3.482 7.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -7.221 -3.602 8.257 1.00 0.00 H new ATOM 2198 N ARG A 128 -6.546 2.633 9.395 1.00 0.00 N ATOM 2199 CA ARG A 128 -5.499 2.712 10.429 1.00 0.00 C ATOM 2200 C ARG A 128 -5.799 3.872 11.385 1.00 0.00 C ATOM 2201 O ARG A 128 -6.571 4.778 11.054 1.00 0.00 O ATOM 2202 CB ARG A 128 -4.116 2.891 9.736 1.00 0.00 C ATOM 2203 CG ARG A 128 -3.898 4.270 9.044 1.00 0.00 C ATOM 2204 CD ARG A 128 -2.944 4.205 7.830 1.00 0.00 C ATOM 2205 NE ARG A 128 -3.567 3.494 6.686 1.00 0.00 N ATOM 2206 CZ ARG A 128 -3.131 2.351 6.129 1.00 0.00 C ATOM 2207 NH1 ARG A 128 -2.032 1.747 6.564 1.00 0.00 N ATOM 2208 NH2 ARG A 128 -3.813 1.815 5.123 1.00 0.00 N ATOM 0 H ARG A 128 -6.719 3.524 8.929 1.00 0.00 H new ATOM 0 HA ARG A 128 -5.479 1.794 11.016 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -3.333 2.747 10.480 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -3.996 2.105 8.991 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -4.862 4.661 8.718 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -3.498 4.975 9.773 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -2.671 5.216 7.526 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -2.023 3.698 8.117 1.00 0.00 H new ATOM 0 HE ARG A 128 -4.406 3.913 6.284 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -1.500 2.150 7.336 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -1.719 0.880 6.127 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -4.659 2.271 4.780 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -3.491 0.948 4.693 1.00 0.00 H new ATOM 2222 N LEU A 129 -5.166 3.846 12.560 1.00 0.00 N ATOM 2223 CA LEU A 129 -5.383 4.849 13.612 1.00 0.00 C ATOM 2224 C LEU A 129 -4.625 6.125 13.229 1.00 0.00 C ATOM 2225 O LEU A 129 -3.412 6.075 13.022 1.00 0.00 O ATOM 2226 CB LEU A 129 -4.919 4.280 14.997 1.00 0.00 C ATOM 2227 CG LEU A 129 -5.503 4.953 16.289 1.00 0.00 C ATOM 2228 CD1 LEU A 129 -4.926 6.361 16.557 1.00 0.00 C ATOM 2229 CD2 LEU A 129 -7.044 4.972 16.231 1.00 0.00 C ATOM 0 H LEU A 129 -4.486 3.128 12.812 1.00 0.00 H new ATOM 0 HA LEU A 129 -6.442 5.089 13.705 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -5.171 3.220 15.027 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -3.832 4.351 15.043 1.00 0.00 H new ATOM 0 HG LEU A 129 -5.190 4.343 17.136 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -5.371 6.770 17.464 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -3.845 6.294 16.682 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -5.154 7.014 15.715 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -7.436 5.441 17.133 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -7.368 5.537 15.357 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -7.418 3.951 16.161 1.00 0.00 H new ATOM 2241 N VAL A 130 -5.349 7.253 13.113 1.00 0.00 N ATOM 2242 CA VAL A 130 -4.752 8.554 12.745 1.00 0.00 C ATOM 2243 C VAL A 130 -4.715 9.494 13.978 1.00 0.00 C ATOM 2244 O VAL A 130 -5.744 10.074 14.349 1.00 0.00 O ATOM 2245 CB VAL A 130 -5.512 9.247 11.537 1.00 0.00 C ATOM 2246 CG1 VAL A 130 -4.733 10.490 11.012 1.00 0.00 C ATOM 2247 CG2 VAL A 130 -5.805 8.236 10.396 1.00 0.00 C ATOM 0 H VAL A 130 -6.356 7.291 13.270 1.00 0.00 H new ATOM 0 HA VAL A 130 -3.733 8.361 12.410 1.00 0.00 H new ATOM 0 HB VAL A 130 -6.472 9.600 11.914 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -5.282 10.941 10.185 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -4.626 11.218 11.816 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -3.746 10.182 10.668 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -6.326 8.744 9.585 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -4.866 7.826 10.023 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -6.428 7.427 10.778 1.00 0.00 H new ATOM 2257 N PRO A 131 -3.530 9.627 14.665 1.00 0.00 N ATOM 2258 CA PRO A 131 -3.332 10.617 15.746 1.00 0.00 C ATOM 2259 C PRO A 131 -3.025 12.025 15.183 1.00 0.00 C ATOM 2260 O PRO A 131 -3.009 12.220 13.961 1.00 0.00 O ATOM 2261 CB PRO A 131 -2.137 10.017 16.523 1.00 0.00 C ATOM 2262 CG PRO A 131 -1.307 9.363 15.466 1.00 0.00 C ATOM 2263 CD PRO A 131 -2.296 8.811 14.455 1.00 0.00 C ATOM 0 HA PRO A 131 -4.213 10.772 16.369 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -1.576 10.789 17.050 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -2.469 9.297 17.271 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -0.629 10.079 15.001 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -0.691 8.568 15.887 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -1.921 8.911 13.436 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -2.486 7.751 14.622 1.00 0.00 H new ATOM 2271 N VAL A 132 -2.766 12.982 16.091 1.00 0.00 N ATOM 2272 CA VAL A 132 -2.525 14.409 15.758 1.00 0.00 C ATOM 2273 C VAL A 132 -1.334 14.605 14.779 1.00 0.00 C ATOM 2274 O VAL A 132 -1.345 15.527 13.950 1.00 0.00 O ATOM 2275 CB VAL A 132 -2.301 15.253 17.077 1.00 0.00 C ATOM 2276 CG1 VAL A 132 -1.090 14.732 17.894 1.00 0.00 C ATOM 2277 CG2 VAL A 132 -2.176 16.773 16.778 1.00 0.00 C ATOM 0 H VAL A 132 -2.716 12.790 17.092 1.00 0.00 H new ATOM 0 HA VAL A 132 -3.417 14.769 15.246 1.00 0.00 H new ATOM 0 HB VAL A 132 -3.190 15.119 17.694 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -0.969 15.338 18.792 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -1.262 13.694 18.177 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -0.187 14.798 17.288 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -2.023 17.316 17.711 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -1.328 16.945 16.115 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -3.089 17.126 16.298 1.00 0.00 H new ATOM 2287 N GLY A 133 -0.334 13.701 14.871 1.00 0.00 N ATOM 2288 CA GLY A 133 0.856 13.735 14.011 1.00 0.00 C ATOM 2289 C GLY A 133 0.564 13.413 12.543 1.00 0.00 C ATOM 2290 O GLY A 133 1.372 13.741 11.662 1.00 0.00 O ATOM 0 H GLY A 133 -0.334 12.933 15.542 1.00 0.00 H new ATOM 0 HA2 GLY A 133 1.310 14.724 14.073 1.00 0.00 H new ATOM 0 HA3 GLY A 133 1.589 13.023 14.391 1.00 0.00 H new ATOM 2294 N GLY A 134 -0.594 12.765 12.292 1.00 0.00 N ATOM 2295 CA GLY A 134 -1.042 12.428 10.939 1.00 0.00 C ATOM 2296 C GLY A 134 -0.375 11.167 10.384 1.00 0.00 C ATOM 2297 O GLY A 134 0.810 10.917 10.635 1.00 0.00 O ATOM 0 H GLY A 134 -1.237 12.465 13.025 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -2.123 12.288 10.945 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -0.833 13.266 10.274 1.00 0.00 H new ATOM 2301 N GLN A 135 -1.147 10.356 9.641 1.00 0.00 N ATOM 2302 CA GLN A 135 -0.650 9.115 9.003 1.00 0.00 C ATOM 2303 C GLN A 135 -0.588 9.300 7.488 1.00 0.00 C ATOM 2304 O GLN A 135 -1.275 10.148 6.946 1.00 0.00 O ATOM 2305 CB GLN A 135 -1.570 7.904 9.334 1.00 0.00 C ATOM 2306 CG GLN A 135 -1.726 7.598 10.828 1.00 0.00 C ATOM 2307 CD GLN A 135 -0.403 7.342 11.552 1.00 0.00 C ATOM 2308 OE1 GLN A 135 0.086 6.219 11.595 1.00 0.00 O ATOM 2309 NE2 GLN A 135 0.181 8.382 12.134 1.00 0.00 N ATOM 0 H GLN A 135 -2.135 10.538 9.463 1.00 0.00 H new ATOM 0 HA GLN A 135 0.347 8.912 9.395 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -2.557 8.091 8.912 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -1.173 7.019 8.837 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -2.235 8.433 11.308 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -2.367 6.724 10.944 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -0.250 9.305 12.081 1.00 0.00 H new ATOM 0 HE22 GLN A 135 1.061 8.259 12.634 1.00 0.00 H new ATOM 2318 N TYR A 136 0.238 8.496 6.813 1.00 0.00 N ATOM 2319 CA TYR A 136 0.251 8.429 5.348 1.00 0.00 C ATOM 2320 C TYR A 136 -0.778 7.406 4.867 1.00 0.00 C ATOM 2321 O TYR A 136 -0.805 6.262 5.346 1.00 0.00 O ATOM 2322 CB TYR A 136 1.660 8.086 4.795 1.00 0.00 C ATOM 2323 CG TYR A 136 2.596 9.297 4.715 1.00 0.00 C ATOM 2324 CD1 TYR A 136 2.388 10.279 3.744 1.00 0.00 C ATOM 2325 CD2 TYR A 136 3.666 9.474 5.597 1.00 0.00 C ATOM 2326 CE1 TYR A 136 3.205 11.385 3.655 1.00 0.00 C ATOM 2327 CE2 TYR A 136 4.490 10.584 5.508 1.00 0.00 C ATOM 2328 CZ TYR A 136 4.253 11.535 4.537 1.00 0.00 C ATOM 2329 OH TYR A 136 5.076 12.635 4.434 1.00 0.00 O ATOM 0 H TYR A 136 0.913 7.877 7.262 1.00 0.00 H new ATOM 0 HA TYR A 136 -0.013 9.415 4.965 1.00 0.00 H new ATOM 0 HB2 TYR A 136 2.116 7.326 5.429 1.00 0.00 H new ATOM 0 HB3 TYR A 136 1.556 7.651 3.801 1.00 0.00 H new ATOM 0 HD1 TYR A 136 1.569 10.169 3.048 1.00 0.00 H new ATOM 0 HD2 TYR A 136 3.853 8.733 6.360 1.00 0.00 H new ATOM 0 HE1 TYR A 136 3.025 12.132 2.896 1.00 0.00 H new ATOM 0 HE2 TYR A 136 5.314 10.704 6.196 1.00 0.00 H new ATOM 0 HH TYR A 136 5.119 12.925 3.499 1.00 0.00 H new ATOM 2339 N LEU A 137 -1.629 7.837 3.925 1.00 0.00 N ATOM 2340 CA LEU A 137 -2.570 6.956 3.240 1.00 0.00 C ATOM 2341 C LEU A 137 -1.846 6.436 1.996 1.00 0.00 C ATOM 2342 O LEU A 137 -1.348 7.221 1.187 1.00 0.00 O ATOM 2343 CB LEU A 137 -3.893 7.705 2.866 1.00 0.00 C ATOM 2344 CG LEU A 137 -5.197 6.825 2.842 1.00 0.00 C ATOM 2345 CD1 LEU A 137 -6.453 7.688 2.648 1.00 0.00 C ATOM 2346 CD2 LEU A 137 -5.144 5.710 1.771 1.00 0.00 C ATOM 0 H LEU A 137 -1.680 8.809 3.620 1.00 0.00 H new ATOM 0 HA LEU A 137 -2.873 6.132 3.887 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -4.040 8.519 3.576 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -3.766 8.158 1.883 1.00 0.00 H new ATOM 0 HG LEU A 137 -5.252 6.339 3.816 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -7.336 7.048 2.636 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -6.534 8.403 3.467 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -6.382 8.226 1.703 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -6.069 5.134 1.799 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -5.026 6.158 0.785 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -4.300 5.051 1.974 1.00 0.00 H new ATOM 2358 N ARG A 138 -1.785 5.119 1.855 1.00 0.00 N ATOM 2359 CA ARG A 138 -1.107 4.467 0.732 1.00 0.00 C ATOM 2360 C ARG A 138 -1.997 3.358 0.175 1.00 0.00 C ATOM 2361 O ARG A 138 -2.720 2.703 0.936 1.00 0.00 O ATOM 2362 CB ARG A 138 0.286 3.915 1.149 1.00 0.00 C ATOM 2363 CG ARG A 138 0.307 2.794 2.211 1.00 0.00 C ATOM 2364 CD ARG A 138 0.080 3.277 3.650 1.00 0.00 C ATOM 2365 NE ARG A 138 0.285 2.172 4.605 1.00 0.00 N ATOM 2366 CZ ARG A 138 1.331 2.038 5.433 1.00 0.00 C ATOM 2367 NH1 ARG A 138 2.263 2.983 5.533 1.00 0.00 N ATOM 2368 NH2 ARG A 138 1.433 0.947 6.173 1.00 0.00 N ATOM 0 H ARG A 138 -2.205 4.466 2.517 1.00 0.00 H new ATOM 0 HA ARG A 138 -0.932 5.208 -0.048 1.00 0.00 H new ATOM 0 HB2 ARG A 138 0.785 3.543 0.254 1.00 0.00 H new ATOM 0 HB3 ARG A 138 0.882 4.747 1.523 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -0.460 2.060 1.962 1.00 0.00 H new ATOM 0 HG3 ARG A 138 1.267 2.281 2.161 1.00 0.00 H new ATOM 0 HD2 ARG A 138 0.765 4.094 3.878 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -0.931 3.671 3.752 1.00 0.00 H new ATOM 0 HE ARG A 138 -0.431 1.447 4.638 1.00 0.00 H new ATOM 0 HH11 ARG A 138 2.191 3.832 4.972 1.00 0.00 H new ATOM 0 HH12 ARG A 138 3.050 2.858 6.170 1.00 0.00 H new ATOM 0 HH21 ARG A 138 0.721 0.220 6.110 1.00 0.00 H new ATOM 0 HH22 ARG A 138 2.224 0.833 6.807 1.00 0.00 H new ATOM 2382 N GLU A 139 -1.966 3.163 -1.156 1.00 0.00 N ATOM 2383 CA GLU A 139 -2.747 2.093 -1.811 1.00 0.00 C ATOM 2384 C GLU A 139 -1.774 0.959 -2.224 1.00 0.00 C ATOM 2385 O GLU A 139 -1.423 0.843 -3.408 1.00 0.00 O ATOM 2386 CB GLU A 139 -3.570 2.677 -3.015 1.00 0.00 C ATOM 2387 CG GLU A 139 -4.970 2.056 -3.223 1.00 0.00 C ATOM 2388 CD GLU A 139 -4.955 0.540 -3.490 1.00 0.00 C ATOM 2389 OE1 GLU A 139 -4.849 0.130 -4.666 1.00 0.00 O ATOM 2390 OE2 GLU A 139 -5.046 -0.254 -2.526 1.00 0.00 O ATOM 2391 OXT GLU A 139 -1.324 0.215 -1.334 1.00 0.00 O ATOM 0 H GLU A 139 -1.411 3.729 -1.798 1.00 0.00 H new ATOM 0 HA GLU A 139 -3.482 1.670 -1.126 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -3.686 3.751 -2.867 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -2.991 2.541 -3.929 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -5.577 2.252 -2.339 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -5.456 2.556 -4.061 1.00 0.00 H new