USER MOD reduce.3.24.130724 H: found=0, std=0, add=1043, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1043 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 79 TYR OH : rot 90:sc= -0.013 USER MOD Set 1.2: A 88 SER OG : rot 148:sc= -0.0253 USER MOD Set 2.1: A 8 GLN : amide:sc= 1.01 K(o=2.2,f=1.4) USER MOD Set 2.2: A 71 THR OG1 : rot 79:sc= 1.16 USER MOD Set 3.1: A 37 THR OG1 : rot -70:sc= -1.75! USER MOD Set 3.2: A 48 THR OG1 : rot 68:sc= 0.631 USER MOD Single : A 1 MET CE :methyl -167:sc= 0 (180deg=-0.0567) USER MOD Single : A 1 MET N :NH3+ -109:sc= 0.102 (180deg=0) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 CYS SG : rot -10:sc= 0.545 USER MOD Single : A 9 GLN : amide:sc= -0.245 X(o=-0.24,f=-0.24) USER MOD Single : A 10 GLN : amide:sc= -0.869 K(o=-0.87,f=0) USER MOD Single : A 11 LYS NZ :NH3+ 154:sc= 1.22 (180deg=1.09) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0.00272 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.0237 USER MOD Single : A 34 LYS NZ :NH3+ -147:sc= 1.19 (180deg=0.786) USER MOD Single : A 35 SER OG : rot 180:sc= -0.209 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 60:sc= -0.234 USER MOD Single : A 51 MET CE :methyl -166:sc= 0 (180deg=-0.16) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 62 MET CE :methyl 141:sc= -0.133 (180deg=-2.51!) USER MOD Single : A 64 TYR OH : rot 10:sc= 1.14 USER MOD Single : A 65 LYS NZ :NH3+ 163:sc= 0.357 (180deg=0.198) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 SER OG : rot 162:sc= 1.12 USER MOD Single : A 74 SER OG : rot -140:sc= -0.224 USER MOD Single : A 78 GLN : amide:sc= -8.65! C(o=-8.7!,f=-14!) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ -154:sc= 0.785 (180deg=0.567) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 156:sc= 1.29 (180deg=1.13) USER MOD Single : A 95 ASN : amide:sc= -1.02 K(o=-1,f=-0.0071) USER MOD Single : A 97 THR OG1 : rot -76:sc= 0.398 USER MOD Single : A 102 GLN : amide:sc= -0.63 K(o=-0.63,f=-1.8!) USER MOD Single : A 103 ASN : amide:sc= -0.234 X(o=-0.23,f=-0.59) USER MOD Single : A 105 GLN : amide:sc= -0.0143 K(o=-0.014,f=-1) USER MOD Single : A 107 LYS NZ :NH3+ 136:sc= 1.2 (180deg=0.546) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl -168:sc= -3.58! (180deg=-3.93!) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ -169:sc= -0.021 (180deg=-0.217) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0.0602 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 HIS : no HD1:sc= 0 X(o=0,f=-0.0095) USER MOD Single : A 131 HIS : no HD1:sc= 0 X(o=0,f=-0.0074) USER MOD Single : A 132 HIS : no HE2:sc= 1.22 K(o=1.2,f=-4!) USER MOD Single : A 133 HIS : no HE2:sc= 0.164 K(o=0.16,f=-3.8!) USER MOD Single : A 134 HIS : no HD1:sc= -0.0822 X(o=-0.082,f=0) USER MOD Single : A 135 HIS : no HD1:sc= -0.0968 X(o=-0.097,f=-0.04) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.136 24.405 -0.353 1.00 0.00 N ATOM 2 CA MET A 1 -13.208 22.932 -0.233 1.00 0.00 C ATOM 3 C MET A 1 -13.554 22.322 -1.587 1.00 0.00 C ATOM 4 O MET A 1 -14.134 22.996 -2.439 1.00 0.00 O ATOM 5 CB MET A 1 -14.271 22.539 0.803 1.00 0.00 C ATOM 6 CG MET A 1 -14.322 21.048 1.097 1.00 0.00 C ATOM 7 SD MET A 1 -15.739 20.577 2.105 1.00 0.00 S ATOM 8 CE MET A 1 -15.444 18.820 2.306 1.00 0.00 C ATOM 0 H1 MET A 1 -12.145 24.712 -0.274 1.00 0.00 H new ATOM 0 H2 MET A 1 -13.517 24.697 -1.276 1.00 0.00 H new ATOM 0 H3 MET A 1 -13.695 24.843 0.406 1.00 0.00 H new ATOM 0 HA MET A 1 -12.239 22.554 0.095 1.00 0.00 H new ATOM 0 HB2 MET A 1 -14.076 23.076 1.731 1.00 0.00 H new ATOM 0 HB3 MET A 1 -15.249 22.863 0.447 1.00 0.00 H new ATOM 0 HG2 MET A 1 -14.354 20.499 0.156 1.00 0.00 H new ATOM 0 HG3 MET A 1 -13.406 20.752 1.608 1.00 0.00 H new ATOM 0 HE1 MET A 1 -16.340 18.344 2.704 1.00 0.00 H new ATOM 0 HE2 MET A 1 -15.198 18.380 1.340 1.00 0.00 H new ATOM 0 HE3 MET A 1 -14.615 18.667 2.997 1.00 0.00 H new ATOM 20 N ILE A 2 -13.187 21.054 -1.773 1.00 0.00 N ATOM 21 CA ILE A 2 -13.498 20.306 -2.988 1.00 0.00 C ATOM 22 C ILE A 2 -12.776 20.888 -4.200 1.00 0.00 C ATOM 23 O ILE A 2 -13.329 21.699 -4.944 1.00 0.00 O ATOM 24 CB ILE A 2 -15.025 20.243 -3.268 1.00 0.00 C ATOM 25 CG1 ILE A 2 -15.779 19.673 -2.057 1.00 0.00 C ATOM 26 CG2 ILE A 2 -15.306 19.400 -4.509 1.00 0.00 C ATOM 27 CD1 ILE A 2 -15.377 18.257 -1.695 1.00 0.00 C ATOM 0 H ILE A 2 -12.664 20.516 -1.082 1.00 0.00 H new ATOM 0 HA ILE A 2 -13.144 19.289 -2.818 1.00 0.00 H new ATOM 0 HB ILE A 2 -15.379 21.258 -3.447 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -15.607 20.320 -1.197 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -16.849 19.695 -2.264 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -16.380 19.366 -4.690 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -14.806 19.843 -5.370 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -14.933 18.388 -4.353 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -15.953 17.925 -0.831 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -15.575 17.596 -2.539 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -14.314 18.231 -1.455 1.00 0.00 H new ATOM 39 N MET A 3 -11.521 20.508 -4.367 1.00 0.00 N ATOM 40 CA MET A 3 -10.779 20.866 -5.563 1.00 0.00 C ATOM 41 C MET A 3 -11.057 19.836 -6.644 1.00 0.00 C ATOM 42 O MET A 3 -11.129 18.637 -6.365 1.00 0.00 O ATOM 43 CB MET A 3 -9.277 20.954 -5.275 1.00 0.00 C ATOM 44 CG MET A 3 -8.894 22.100 -4.351 1.00 0.00 C ATOM 45 SD MET A 3 -7.120 22.174 -4.038 1.00 0.00 S ATOM 46 CE MET A 3 -7.034 23.580 -2.932 1.00 0.00 C ATOM 0 H MET A 3 -10.996 19.953 -3.691 1.00 0.00 H new ATOM 0 HA MET A 3 -11.104 21.849 -5.903 1.00 0.00 H new ATOM 0 HB2 MET A 3 -8.946 20.015 -4.830 1.00 0.00 H new ATOM 0 HB3 MET A 3 -8.742 21.066 -6.218 1.00 0.00 H new ATOM 0 HG2 MET A 3 -9.221 23.042 -4.791 1.00 0.00 H new ATOM 0 HG3 MET A 3 -9.422 21.990 -3.404 1.00 0.00 H new ATOM 0 HE1 MET A 3 -5.997 23.755 -2.646 1.00 0.00 H new ATOM 0 HE2 MET A 3 -7.426 24.464 -3.436 1.00 0.00 H new ATOM 0 HE3 MET A 3 -7.627 23.378 -2.040 1.00 0.00 H new ATOM 56 N VAL A 4 -11.228 20.300 -7.869 1.00 0.00 N ATOM 57 CA VAL A 4 -11.588 19.421 -8.968 1.00 0.00 C ATOM 58 C VAL A 4 -10.414 18.529 -9.346 1.00 0.00 C ATOM 59 O VAL A 4 -9.492 18.958 -10.043 1.00 0.00 O ATOM 60 CB VAL A 4 -12.060 20.211 -10.209 1.00 0.00 C ATOM 61 CG1 VAL A 4 -12.506 19.269 -11.316 1.00 0.00 C ATOM 62 CG2 VAL A 4 -13.181 21.164 -9.842 1.00 0.00 C ATOM 0 H VAL A 4 -11.123 21.281 -8.128 1.00 0.00 H new ATOM 0 HA VAL A 4 -12.418 18.804 -8.625 1.00 0.00 H new ATOM 0 HB VAL A 4 -11.216 20.794 -10.577 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -12.833 19.850 -12.178 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -11.673 18.628 -11.606 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -13.331 18.653 -10.959 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -13.499 21.711 -10.730 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -14.023 20.599 -9.443 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -12.828 21.869 -9.089 1.00 0.00 H new ATOM 72 N SER A 5 -10.435 17.304 -8.847 1.00 0.00 N ATOM 73 CA SER A 5 -9.420 16.323 -9.185 1.00 0.00 C ATOM 74 C SER A 5 -9.684 15.767 -10.581 1.00 0.00 C ATOM 75 O SER A 5 -10.653 15.034 -10.801 1.00 0.00 O ATOM 76 CB SER A 5 -9.423 15.194 -8.157 1.00 0.00 C ATOM 77 OG SER A 5 -9.363 15.713 -6.838 1.00 0.00 O ATOM 0 H SER A 5 -11.149 16.965 -8.202 1.00 0.00 H new ATOM 0 HA SER A 5 -8.441 16.802 -9.175 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.324 14.591 -8.275 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.573 14.535 -8.332 1.00 0.00 H new ATOM 0 HG SER A 5 -9.368 14.973 -6.195 1.00 0.00 H new ATOM 83 N GLY A 6 -8.835 16.134 -11.523 1.00 0.00 N ATOM 84 CA GLY A 6 -9.023 15.706 -12.890 1.00 0.00 C ATOM 85 C GLY A 6 -8.276 14.430 -13.181 1.00 0.00 C ATOM 86 O GLY A 6 -7.446 14.000 -12.381 1.00 0.00 O ATOM 0 H GLY A 6 -8.017 16.722 -11.366 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -10.086 15.558 -13.082 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -8.683 16.490 -13.567 1.00 0.00 H new ATOM 90 N CYS A 7 -8.567 13.815 -14.314 1.00 0.00 N ATOM 91 CA CYS A 7 -7.870 12.608 -14.717 1.00 0.00 C ATOM 92 C CYS A 7 -7.151 12.837 -16.041 1.00 0.00 C ATOM 93 O CYS A 7 -7.668 12.513 -17.112 1.00 0.00 O ATOM 94 CB CYS A 7 -8.844 11.428 -14.818 1.00 0.00 C ATOM 95 SG CYS A 7 -8.070 9.844 -15.222 1.00 0.00 S ATOM 0 H CYS A 7 -9.281 14.132 -14.970 1.00 0.00 H new ATOM 0 HA CYS A 7 -7.127 12.362 -13.959 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -9.372 11.328 -13.870 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -9.592 11.656 -15.577 1.00 0.00 H new ATOM 0 HG CYS A 7 -6.829 10.040 -15.555 1.00 0.00 H new ATOM 101 N GLN A 8 -5.968 13.435 -15.959 1.00 0.00 N ATOM 102 CA GLN A 8 -5.145 13.673 -17.132 1.00 0.00 C ATOM 103 C GLN A 8 -4.367 12.412 -17.476 1.00 0.00 C ATOM 104 O GLN A 8 -3.209 12.258 -17.088 1.00 0.00 O ATOM 105 CB GLN A 8 -4.172 14.836 -16.900 1.00 0.00 C ATOM 106 CG GLN A 8 -4.840 16.139 -16.483 1.00 0.00 C ATOM 107 CD GLN A 8 -3.845 17.277 -16.327 1.00 0.00 C ATOM 108 OE1 GLN A 8 -2.676 17.061 -15.998 1.00 0.00 O ATOM 109 NE2 GLN A 8 -4.302 18.501 -16.556 1.00 0.00 N ATOM 0 H GLN A 8 -5.558 13.765 -15.085 1.00 0.00 H new ATOM 0 HA GLN A 8 -5.801 13.939 -17.961 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -3.455 14.547 -16.131 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -3.606 15.008 -17.815 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -5.589 16.414 -17.226 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -5.366 15.989 -15.540 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -5.276 18.640 -16.826 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -3.680 19.304 -16.462 1.00 0.00 H new ATOM 118 N GLN A 9 -5.018 11.499 -18.178 1.00 0.00 N ATOM 119 CA GLN A 9 -4.406 10.224 -18.517 1.00 0.00 C ATOM 120 C GLN A 9 -3.754 10.309 -19.894 1.00 0.00 C ATOM 121 O GLN A 9 -4.228 9.695 -20.850 1.00 0.00 O ATOM 122 CB GLN A 9 -5.459 9.106 -18.490 1.00 0.00 C ATOM 123 CG GLN A 9 -4.922 7.740 -18.071 1.00 0.00 C ATOM 124 CD GLN A 9 -3.844 7.201 -18.992 1.00 0.00 C ATOM 125 OE1 GLN A 9 -2.656 7.442 -18.784 1.00 0.00 O ATOM 126 NE2 GLN A 9 -4.253 6.464 -20.011 1.00 0.00 N ATOM 0 H GLN A 9 -5.970 11.617 -18.524 1.00 0.00 H new ATOM 0 HA GLN A 9 -3.638 9.993 -17.779 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -6.258 9.393 -17.807 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -5.904 9.019 -19.481 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -4.521 7.811 -17.060 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -5.748 7.029 -18.037 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -5.249 6.289 -20.146 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -3.573 6.071 -20.661 1.00 0.00 H new ATOM 135 N GLN A 10 -2.689 11.103 -19.988 1.00 0.00 N ATOM 136 CA GLN A 10 -1.929 11.237 -21.229 1.00 0.00 C ATOM 137 C GLN A 10 -0.742 12.179 -21.029 1.00 0.00 C ATOM 138 O GLN A 10 -0.727 13.298 -21.551 1.00 0.00 O ATOM 139 CB GLN A 10 -2.817 11.751 -22.370 1.00 0.00 C ATOM 140 CG GLN A 10 -2.218 11.547 -23.754 1.00 0.00 C ATOM 141 CD GLN A 10 -3.131 12.029 -24.865 1.00 0.00 C ATOM 142 OE1 GLN A 10 -3.138 11.476 -25.966 1.00 0.00 O ATOM 143 NE2 GLN A 10 -3.904 13.068 -24.593 1.00 0.00 N ATOM 0 H GLN A 10 -2.332 11.666 -19.216 1.00 0.00 H new ATOM 0 HA GLN A 10 -1.559 10.249 -21.501 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -3.781 11.245 -22.324 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -3.007 12.814 -22.220 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -1.267 12.077 -23.815 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -2.003 10.488 -23.900 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -3.871 13.500 -23.670 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -4.533 13.437 -25.307 1.00 0.00 H new ATOM 152 N LYS A 11 0.229 11.735 -20.240 1.00 0.00 N ATOM 153 CA LYS A 11 1.454 12.496 -19.996 1.00 0.00 C ATOM 154 C LYS A 11 2.561 11.585 -19.490 1.00 0.00 C ATOM 155 O LYS A 11 2.305 10.456 -19.069 1.00 0.00 O ATOM 156 CB LYS A 11 1.239 13.622 -18.976 1.00 0.00 C ATOM 157 CG LYS A 11 0.956 14.979 -19.600 1.00 0.00 C ATOM 158 CD LYS A 11 1.026 16.098 -18.573 1.00 0.00 C ATOM 159 CE LYS A 11 2.421 16.226 -17.977 1.00 0.00 C ATOM 160 NZ LYS A 11 2.524 17.378 -17.043 1.00 0.00 N ATOM 0 H LYS A 11 0.192 10.840 -19.751 1.00 0.00 H new ATOM 0 HA LYS A 11 1.741 12.939 -20.950 1.00 0.00 H new ATOM 0 HB2 LYS A 11 0.408 13.353 -18.324 1.00 0.00 H new ATOM 0 HB3 LYS A 11 2.125 13.701 -18.346 1.00 0.00 H new ATOM 0 HG2 LYS A 11 1.676 15.170 -20.396 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -0.032 14.969 -20.060 1.00 0.00 H new ATOM 0 HD2 LYS A 11 0.742 17.040 -19.041 1.00 0.00 H new ATOM 0 HD3 LYS A 11 0.306 15.908 -17.777 1.00 0.00 H new ATOM 0 HE2 LYS A 11 2.675 15.307 -17.449 1.00 0.00 H new ATOM 0 HE3 LYS A 11 3.149 16.344 -18.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 3.278 17.197 -16.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 2.747 18.241 -17.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 1.619 17.503 -16.545 1.00 0.00 H new ATOM 174 N GLU A 12 3.784 12.088 -19.536 1.00 0.00 N ATOM 175 CA GLU A 12 4.934 11.389 -18.988 1.00 0.00 C ATOM 176 C GLU A 12 5.735 12.333 -18.096 1.00 0.00 C ATOM 177 O GLU A 12 6.577 13.101 -18.571 1.00 0.00 O ATOM 178 CB GLU A 12 5.818 10.835 -20.109 1.00 0.00 C ATOM 179 CG GLU A 12 7.060 10.110 -19.608 1.00 0.00 C ATOM 180 CD GLU A 12 8.017 9.756 -20.725 1.00 0.00 C ATOM 181 OE1 GLU A 12 8.704 10.670 -21.233 1.00 0.00 O ATOM 182 OE2 GLU A 12 8.090 8.567 -21.102 1.00 0.00 O ATOM 0 H GLU A 12 4.007 12.991 -19.954 1.00 0.00 H new ATOM 0 HA GLU A 12 4.580 10.549 -18.391 1.00 0.00 H new ATOM 0 HB2 GLU A 12 5.229 10.150 -20.719 1.00 0.00 H new ATOM 0 HB3 GLU A 12 6.124 11.656 -20.757 1.00 0.00 H new ATOM 0 HG2 GLU A 12 7.574 10.738 -18.880 1.00 0.00 H new ATOM 0 HG3 GLU A 12 6.760 9.200 -19.089 1.00 0.00 H new ATOM 189 N GLU A 13 5.447 12.295 -16.808 1.00 0.00 N ATOM 190 CA GLU A 13 6.145 13.128 -15.848 1.00 0.00 C ATOM 191 C GLU A 13 6.572 12.268 -14.665 1.00 0.00 C ATOM 192 O GLU A 13 6.199 11.095 -14.589 1.00 0.00 O ATOM 193 CB GLU A 13 5.249 14.296 -15.406 1.00 0.00 C ATOM 194 CG GLU A 13 6.012 15.461 -14.786 1.00 0.00 C ATOM 195 CD GLU A 13 5.147 16.688 -14.581 1.00 0.00 C ATOM 196 OE1 GLU A 13 4.770 17.329 -15.588 1.00 0.00 O ATOM 197 OE2 GLU A 13 4.843 17.021 -13.416 1.00 0.00 O ATOM 0 H GLU A 13 4.731 11.693 -16.402 1.00 0.00 H new ATOM 0 HA GLU A 13 7.036 13.559 -16.305 1.00 0.00 H new ATOM 0 HB2 GLU A 13 4.690 14.659 -16.269 1.00 0.00 H new ATOM 0 HB3 GLU A 13 4.519 13.928 -14.685 1.00 0.00 H new ATOM 0 HG2 GLU A 13 6.425 15.149 -13.827 1.00 0.00 H new ATOM 0 HG3 GLU A 13 6.855 15.719 -15.427 1.00 0.00 H new ATOM 204 N THR A 14 7.365 12.837 -13.767 1.00 0.00 N ATOM 205 CA THR A 14 7.898 12.105 -12.622 1.00 0.00 C ATOM 206 C THR A 14 6.785 11.447 -11.800 1.00 0.00 C ATOM 207 O THR A 14 5.922 12.130 -11.244 1.00 0.00 O ATOM 208 CB THR A 14 8.714 13.045 -11.718 1.00 0.00 C ATOM 209 OG1 THR A 14 9.625 13.808 -12.520 1.00 0.00 O ATOM 210 CG2 THR A 14 9.493 12.261 -10.671 1.00 0.00 C ATOM 0 H THR A 14 7.657 13.813 -13.809 1.00 0.00 H new ATOM 0 HA THR A 14 8.544 11.319 -13.013 1.00 0.00 H new ATOM 0 HB THR A 14 8.022 13.711 -11.203 1.00 0.00 H new ATOM 0 HG1 THR A 14 10.144 14.408 -11.945 1.00 0.00 H new ATOM 0 HG21 THR A 14 10.060 12.952 -10.047 1.00 0.00 H new ATOM 0 HG22 THR A 14 8.799 11.696 -10.049 1.00 0.00 H new ATOM 0 HG23 THR A 14 10.178 11.574 -11.167 1.00 0.00 H new ATOM 218 N PRO A 15 6.786 10.105 -11.728 1.00 0.00 N ATOM 219 CA PRO A 15 5.806 9.353 -10.947 1.00 0.00 C ATOM 220 C PRO A 15 5.981 9.585 -9.453 1.00 0.00 C ATOM 221 O PRO A 15 6.907 9.058 -8.835 1.00 0.00 O ATOM 222 CB PRO A 15 6.086 7.884 -11.300 1.00 0.00 C ATOM 223 CG PRO A 15 6.976 7.924 -12.498 1.00 0.00 C ATOM 224 CD PRO A 15 7.736 9.216 -12.409 1.00 0.00 C ATOM 0 HA PRO A 15 4.785 9.658 -11.176 1.00 0.00 H new ATOM 0 HB2 PRO A 15 6.568 7.366 -10.471 1.00 0.00 H new ATOM 0 HB3 PRO A 15 5.161 7.349 -11.516 1.00 0.00 H new ATOM 0 HG2 PRO A 15 7.656 7.072 -12.507 1.00 0.00 H new ATOM 0 HG3 PRO A 15 6.393 7.877 -13.418 1.00 0.00 H new ATOM 0 HD2 PRO A 15 8.661 9.103 -11.844 1.00 0.00 H new ATOM 0 HD3 PRO A 15 8.009 9.594 -13.394 1.00 0.00 H new ATOM 232 N PHE A 16 5.092 10.392 -8.883 1.00 0.00 N ATOM 233 CA PHE A 16 5.165 10.757 -7.472 1.00 0.00 C ATOM 234 C PHE A 16 5.138 9.528 -6.560 1.00 0.00 C ATOM 235 O PHE A 16 5.795 9.502 -5.524 1.00 0.00 O ATOM 236 CB PHE A 16 4.021 11.720 -7.107 1.00 0.00 C ATOM 237 CG PHE A 16 2.641 11.216 -7.445 1.00 0.00 C ATOM 238 CD1 PHE A 16 2.098 11.425 -8.702 1.00 0.00 C ATOM 239 CD2 PHE A 16 1.883 10.539 -6.501 1.00 0.00 C ATOM 240 CE1 PHE A 16 0.831 10.971 -9.012 1.00 0.00 C ATOM 241 CE2 PHE A 16 0.615 10.082 -6.806 1.00 0.00 C ATOM 242 CZ PHE A 16 0.089 10.295 -8.063 1.00 0.00 C ATOM 0 H PHE A 16 4.306 10.809 -9.382 1.00 0.00 H new ATOM 0 HA PHE A 16 6.119 11.260 -7.314 1.00 0.00 H new ATOM 0 HB2 PHE A 16 4.066 11.927 -6.038 1.00 0.00 H new ATOM 0 HB3 PHE A 16 4.183 12.667 -7.622 1.00 0.00 H new ATOM 0 HD1 PHE A 16 2.673 11.950 -9.450 1.00 0.00 H new ATOM 0 HD2 PHE A 16 2.289 10.367 -5.515 1.00 0.00 H new ATOM 0 HE1 PHE A 16 0.421 11.144 -9.996 1.00 0.00 H new ATOM 0 HE2 PHE A 16 0.036 9.558 -6.060 1.00 0.00 H new ATOM 0 HZ PHE A 16 -0.900 9.934 -8.305 1.00 0.00 H new ATOM 252 N TYR A 17 4.402 8.505 -6.967 1.00 0.00 N ATOM 253 CA TYR A 17 4.204 7.325 -6.137 1.00 0.00 C ATOM 254 C TYR A 17 5.409 6.385 -6.181 1.00 0.00 C ATOM 255 O TYR A 17 5.506 5.462 -5.378 1.00 0.00 O ATOM 256 CB TYR A 17 2.941 6.586 -6.588 1.00 0.00 C ATOM 257 CG TYR A 17 2.953 6.167 -8.045 1.00 0.00 C ATOM 258 CD1 TYR A 17 2.474 7.014 -9.037 1.00 0.00 C ATOM 259 CD2 TYR A 17 3.442 4.923 -8.425 1.00 0.00 C ATOM 260 CE1 TYR A 17 2.485 6.633 -10.365 1.00 0.00 C ATOM 261 CE2 TYR A 17 3.455 4.537 -9.750 1.00 0.00 C ATOM 262 CZ TYR A 17 2.976 5.394 -10.715 1.00 0.00 C ATOM 263 OH TYR A 17 2.987 5.016 -12.035 1.00 0.00 O ATOM 0 H TYR A 17 3.930 8.468 -7.870 1.00 0.00 H new ATOM 0 HA TYR A 17 4.089 7.657 -5.105 1.00 0.00 H new ATOM 0 HB2 TYR A 17 2.811 5.699 -5.968 1.00 0.00 H new ATOM 0 HB3 TYR A 17 2.077 7.227 -6.413 1.00 0.00 H new ATOM 0 HD1 TYR A 17 2.087 7.985 -8.766 1.00 0.00 H new ATOM 0 HD2 TYR A 17 3.818 4.247 -7.671 1.00 0.00 H new ATOM 0 HE1 TYR A 17 2.111 7.303 -11.125 1.00 0.00 H new ATOM 0 HE2 TYR A 17 3.839 3.567 -10.029 1.00 0.00 H new ATOM 0 HH TYR A 17 3.365 4.115 -12.114 1.00 0.00 H new ATOM 273 N TYR A 18 6.345 6.652 -7.084 1.00 0.00 N ATOM 274 CA TYR A 18 7.461 5.739 -7.343 1.00 0.00 C ATOM 275 C TYR A 18 8.567 5.902 -6.301 1.00 0.00 C ATOM 276 O TYR A 18 9.728 5.566 -6.541 1.00 0.00 O ATOM 277 CB TYR A 18 8.017 6.011 -8.737 1.00 0.00 C ATOM 278 CG TYR A 18 8.492 4.771 -9.465 1.00 0.00 C ATOM 279 CD1 TYR A 18 7.617 4.029 -10.249 1.00 0.00 C ATOM 280 CD2 TYR A 18 9.811 4.343 -9.371 1.00 0.00 C ATOM 281 CE1 TYR A 18 8.043 2.895 -10.916 1.00 0.00 C ATOM 282 CE2 TYR A 18 10.240 3.212 -10.034 1.00 0.00 C ATOM 283 CZ TYR A 18 9.355 2.493 -10.805 1.00 0.00 C ATOM 284 OH TYR A 18 9.787 1.366 -11.464 1.00 0.00 O ATOM 0 H TYR A 18 6.356 7.498 -7.654 1.00 0.00 H new ATOM 0 HA TYR A 18 7.093 4.715 -7.281 1.00 0.00 H new ATOM 0 HB2 TYR A 18 7.247 6.498 -9.335 1.00 0.00 H new ATOM 0 HB3 TYR A 18 8.848 6.712 -8.655 1.00 0.00 H new ATOM 0 HD1 TYR A 18 6.588 4.343 -10.339 1.00 0.00 H new ATOM 0 HD2 TYR A 18 10.511 4.904 -8.770 1.00 0.00 H new ATOM 0 HE1 TYR A 18 7.350 2.328 -11.520 1.00 0.00 H new ATOM 0 HE2 TYR A 18 11.268 2.891 -9.948 1.00 0.00 H new ATOM 0 HH TYR A 18 10.739 1.224 -11.280 1.00 0.00 H new ATOM 294 N GLY A 19 8.191 6.401 -5.145 1.00 0.00 N ATOM 295 CA GLY A 19 9.148 6.630 -4.081 1.00 0.00 C ATOM 296 C GLY A 19 8.873 5.762 -2.871 1.00 0.00 C ATOM 297 O GLY A 19 7.954 4.943 -2.885 1.00 0.00 O ATOM 0 H GLY A 19 7.231 6.657 -4.916 1.00 0.00 H new ATOM 0 HA2 GLY A 19 10.154 6.429 -4.449 1.00 0.00 H new ATOM 0 HA3 GLY A 19 9.119 7.679 -3.788 1.00 0.00 H new ATOM 301 N THR A 20 9.671 5.935 -1.828 1.00 0.00 N ATOM 302 CA THR A 20 9.491 5.183 -0.598 1.00 0.00 C ATOM 303 C THR A 20 8.744 6.033 0.430 1.00 0.00 C ATOM 304 O THR A 20 9.232 7.086 0.853 1.00 0.00 O ATOM 305 CB THR A 20 10.851 4.743 -0.020 1.00 0.00 C ATOM 306 OG1 THR A 20 11.654 4.153 -1.058 1.00 0.00 O ATOM 307 CG2 THR A 20 10.667 3.739 1.110 1.00 0.00 C ATOM 0 H THR A 20 10.451 6.592 -1.810 1.00 0.00 H new ATOM 0 HA THR A 20 8.906 4.292 -0.825 1.00 0.00 H new ATOM 0 HB THR A 20 11.352 5.625 0.379 1.00 0.00 H new ATOM 0 HG1 THR A 20 12.518 3.877 -0.686 1.00 0.00 H new ATOM 0 HG21 THR A 20 11.642 3.446 1.499 1.00 0.00 H new ATOM 0 HG22 THR A 20 10.080 4.193 1.908 1.00 0.00 H new ATOM 0 HG23 THR A 20 10.147 2.858 0.733 1.00 0.00 H new ATOM 315 N TRP A 21 7.559 5.583 0.814 1.00 0.00 N ATOM 316 CA TRP A 21 6.710 6.347 1.721 1.00 0.00 C ATOM 317 C TRP A 21 6.537 5.634 3.056 1.00 0.00 C ATOM 318 O TRP A 21 6.252 4.439 3.093 1.00 0.00 O ATOM 319 CB TRP A 21 5.324 6.564 1.104 1.00 0.00 C ATOM 320 CG TRP A 21 5.342 7.168 -0.267 1.00 0.00 C ATOM 321 CD1 TRP A 21 5.543 6.511 -1.446 1.00 0.00 C ATOM 322 CD2 TRP A 21 5.131 8.543 -0.604 1.00 0.00 C ATOM 323 NE1 TRP A 21 5.483 7.394 -2.495 1.00 0.00 N ATOM 324 CE2 TRP A 21 5.228 8.650 -2.005 1.00 0.00 C ATOM 325 CE3 TRP A 21 4.870 9.696 0.140 1.00 0.00 C ATOM 326 CZ2 TRP A 21 5.077 9.864 -2.670 1.00 0.00 C ATOM 327 CZ3 TRP A 21 4.719 10.901 -0.523 1.00 0.00 C ATOM 328 CH2 TRP A 21 4.821 10.975 -1.916 1.00 0.00 C ATOM 0 H TRP A 21 7.162 4.693 0.513 1.00 0.00 H new ATOM 0 HA TRP A 21 7.201 7.306 1.888 1.00 0.00 H new ATOM 0 HB2 TRP A 21 4.806 5.606 1.058 1.00 0.00 H new ATOM 0 HB3 TRP A 21 4.743 7.209 1.764 1.00 0.00 H new ATOM 0 HD1 TRP A 21 5.723 5.450 -1.540 1.00 0.00 H new ATOM 0 HE1 TRP A 21 5.608 7.155 -3.479 1.00 0.00 H new ATOM 0 HE3 TRP A 21 4.787 9.648 1.216 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 5.159 9.926 -3.745 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 4.519 11.798 0.044 1.00 0.00 H new ATOM 0 HH2 TRP A 21 4.695 11.929 -2.406 1.00 0.00 H new ATOM 339 N ASP A 22 6.714 6.372 4.143 1.00 0.00 N ATOM 340 CA ASP A 22 6.363 5.881 5.473 1.00 0.00 C ATOM 341 C ASP A 22 5.011 6.445 5.869 1.00 0.00 C ATOM 342 O ASP A 22 4.783 7.653 5.746 1.00 0.00 O ATOM 343 CB ASP A 22 7.414 6.282 6.513 1.00 0.00 C ATOM 344 CG ASP A 22 6.960 6.009 7.942 1.00 0.00 C ATOM 345 OD1 ASP A 22 6.955 4.836 8.355 1.00 0.00 O ATOM 346 OD2 ASP A 22 6.611 6.975 8.656 1.00 0.00 O ATOM 0 H ASP A 22 7.100 7.316 4.132 1.00 0.00 H new ATOM 0 HA ASP A 22 6.323 4.792 5.440 1.00 0.00 H new ATOM 0 HB2 ASP A 22 8.338 5.737 6.319 1.00 0.00 H new ATOM 0 HB3 ASP A 22 7.641 7.343 6.404 1.00 0.00 H new ATOM 351 N GLU A 23 4.111 5.580 6.316 1.00 0.00 N ATOM 352 CA GLU A 23 2.767 6.007 6.684 1.00 0.00 C ATOM 353 C GLU A 23 2.811 6.996 7.842 1.00 0.00 C ATOM 354 O GLU A 23 2.299 8.111 7.740 1.00 0.00 O ATOM 355 CB GLU A 23 1.893 4.804 7.053 1.00 0.00 C ATOM 356 CG GLU A 23 1.646 3.848 5.898 1.00 0.00 C ATOM 357 CD GLU A 23 0.563 2.832 6.208 1.00 0.00 C ATOM 358 OE1 GLU A 23 -0.630 3.184 6.103 1.00 0.00 O ATOM 359 OE2 GLU A 23 0.897 1.684 6.560 1.00 0.00 O ATOM 0 H GLU A 23 4.286 4.582 6.433 1.00 0.00 H new ATOM 0 HA GLU A 23 2.327 6.503 5.819 1.00 0.00 H new ATOM 0 HB2 GLU A 23 2.368 4.259 7.869 1.00 0.00 H new ATOM 0 HB3 GLU A 23 0.934 5.164 7.426 1.00 0.00 H new ATOM 0 HG2 GLU A 23 1.363 4.418 5.013 1.00 0.00 H new ATOM 0 HG3 GLU A 23 2.572 3.326 5.658 1.00 0.00 H new ATOM 366 N GLY A 24 3.437 6.585 8.937 1.00 0.00 N ATOM 367 CA GLY A 24 3.506 7.430 10.111 1.00 0.00 C ATOM 368 C GLY A 24 2.144 7.646 10.739 1.00 0.00 C ATOM 369 O GLY A 24 1.898 8.671 11.381 1.00 0.00 O ATOM 0 H GLY A 24 3.898 5.680 9.032 1.00 0.00 H new ATOM 0 HA2 GLY A 24 4.175 6.978 10.843 1.00 0.00 H new ATOM 0 HA3 GLY A 24 3.936 8.394 9.839 1.00 0.00 H new ATOM 373 N ARG A 25 1.251 6.684 10.554 1.00 0.00 N ATOM 374 CA ARG A 25 -0.084 6.781 11.109 1.00 0.00 C ATOM 375 C ARG A 25 -0.672 5.397 11.309 1.00 0.00 C ATOM 376 O ARG A 25 -0.418 4.492 10.513 1.00 0.00 O ATOM 377 CB ARG A 25 -0.993 7.588 10.184 1.00 0.00 C ATOM 378 CG ARG A 25 -2.199 8.194 10.883 1.00 0.00 C ATOM 379 CD ARG A 25 -1.977 9.667 11.190 1.00 0.00 C ATOM 380 NE ARG A 25 -0.682 9.918 11.831 1.00 0.00 N ATOM 381 CZ ARG A 25 -0.452 10.924 12.673 1.00 0.00 C ATOM 382 NH1 ARG A 25 -1.432 11.761 12.997 1.00 0.00 N ATOM 383 NH2 ARG A 25 0.760 11.099 13.183 1.00 0.00 N ATOM 0 H ARG A 25 1.430 5.831 10.025 1.00 0.00 H new ATOM 0 HA ARG A 25 -0.015 7.288 12.072 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -0.411 8.388 9.725 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -1.339 6.942 9.377 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -3.082 8.080 10.254 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -2.396 7.653 11.809 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -2.038 10.241 10.265 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -2.776 10.024 11.840 1.00 0.00 H new ATOM 0 HE ARG A 25 0.089 9.284 11.619 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -2.363 11.634 12.601 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -1.253 12.531 13.642 1.00 0.00 H new ATOM 0 HH21 ARG A 25 1.516 10.463 12.930 1.00 0.00 H new ATOM 0 HH22 ARG A 25 0.936 11.870 13.828 1.00 0.00 H new ATOM 397 N ALA A 26 -1.449 5.260 12.378 1.00 0.00 N ATOM 398 CA ALA A 26 -2.144 4.012 12.711 1.00 0.00 C ATOM 399 C ALA A 26 -1.166 2.888 13.083 1.00 0.00 C ATOM 400 O ALA A 26 0.029 2.960 12.791 1.00 0.00 O ATOM 401 CB ALA A 26 -3.048 3.585 11.556 1.00 0.00 C ATOM 0 H ALA A 26 -1.618 6.013 13.045 1.00 0.00 H new ATOM 0 HA ALA A 26 -2.760 4.203 13.590 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -3.558 2.657 11.817 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -3.787 4.364 11.365 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -2.446 3.429 10.661 1.00 0.00 H new ATOM 407 N PRO A 27 -1.662 1.847 13.777 1.00 0.00 N ATOM 408 CA PRO A 27 -0.873 0.650 14.080 1.00 0.00 C ATOM 409 C PRO A 27 -0.581 -0.163 12.819 1.00 0.00 C ATOM 410 O PRO A 27 -1.340 -0.110 11.845 1.00 0.00 O ATOM 411 CB PRO A 27 -1.767 -0.149 15.040 1.00 0.00 C ATOM 412 CG PRO A 27 -2.826 0.804 15.481 1.00 0.00 C ATOM 413 CD PRO A 27 -3.015 1.757 14.342 1.00 0.00 C ATOM 0 HA PRO A 27 0.100 0.896 14.506 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -2.201 -1.016 14.542 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -1.196 -0.522 15.890 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -3.754 0.279 15.710 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -2.526 1.331 16.387 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -3.735 1.382 13.614 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -3.379 2.727 14.680 1.00 0.00 H new ATOM 421 N GLY A 28 0.513 -0.914 12.840 1.00 0.00 N ATOM 422 CA GLY A 28 0.912 -1.671 11.681 1.00 0.00 C ATOM 423 C GLY A 28 0.266 -3.040 11.618 1.00 0.00 C ATOM 424 O GLY A 28 -0.670 -3.338 12.368 1.00 0.00 O ATOM 0 H GLY A 28 1.131 -1.009 13.646 1.00 0.00 H new ATOM 0 HA2 GLY A 28 0.654 -1.112 10.782 1.00 0.00 H new ATOM 0 HA3 GLY A 28 1.996 -1.786 11.684 1.00 0.00 H new ATOM 428 N PRO A 29 0.749 -3.875 10.694 1.00 0.00 N ATOM 429 CA PRO A 29 0.296 -5.261 10.507 1.00 0.00 C ATOM 430 C PRO A 29 0.280 -6.089 11.799 1.00 0.00 C ATOM 431 O PRO A 29 0.944 -5.754 12.784 1.00 0.00 O ATOM 432 CB PRO A 29 1.323 -5.835 9.537 1.00 0.00 C ATOM 433 CG PRO A 29 1.843 -4.663 8.781 1.00 0.00 C ATOM 434 CD PRO A 29 1.780 -3.493 9.718 1.00 0.00 C ATOM 0 HA PRO A 29 -0.735 -5.289 10.154 1.00 0.00 H new ATOM 0 HB2 PRO A 29 2.124 -6.347 10.069 1.00 0.00 H new ATOM 0 HB3 PRO A 29 0.868 -6.565 8.868 1.00 0.00 H new ATOM 0 HG2 PRO A 29 2.866 -4.839 8.447 1.00 0.00 H new ATOM 0 HG3 PRO A 29 1.244 -4.479 7.889 1.00 0.00 H new ATOM 0 HD2 PRO A 29 2.741 -3.316 10.201 1.00 0.00 H new ATOM 0 HD3 PRO A 29 1.513 -2.575 9.194 1.00 0.00 H new ATOM 442 N THR A 30 -0.441 -7.205 11.751 1.00 0.00 N ATOM 443 CA THR A 30 -0.730 -8.014 12.933 1.00 0.00 C ATOM 444 C THR A 30 0.501 -8.734 13.500 1.00 0.00 C ATOM 445 O THR A 30 0.438 -9.304 14.589 1.00 0.00 O ATOM 446 CB THR A 30 -1.814 -9.061 12.610 1.00 0.00 C ATOM 447 OG1 THR A 30 -1.514 -9.695 11.358 1.00 0.00 O ATOM 448 CG2 THR A 30 -3.193 -8.421 12.538 1.00 0.00 C ATOM 0 H THR A 30 -0.843 -7.576 10.890 1.00 0.00 H new ATOM 0 HA THR A 30 -1.078 -7.316 13.695 1.00 0.00 H new ATOM 0 HB THR A 30 -1.821 -9.802 13.410 1.00 0.00 H new ATOM 0 HG1 THR A 30 -2.203 -10.361 11.155 1.00 0.00 H new ATOM 0 HG21 THR A 30 -3.937 -9.184 12.309 1.00 0.00 H new ATOM 0 HG22 THR A 30 -3.430 -7.959 13.496 1.00 0.00 H new ATOM 0 HG23 THR A 30 -3.201 -7.660 11.757 1.00 0.00 H new ATOM 456 N ASP A 31 1.615 -8.713 12.781 1.00 0.00 N ATOM 457 CA ASP A 31 2.813 -9.425 13.229 1.00 0.00 C ATOM 458 C ASP A 31 3.507 -8.674 14.366 1.00 0.00 C ATOM 459 O ASP A 31 4.407 -9.203 15.019 1.00 0.00 O ATOM 460 CB ASP A 31 3.778 -9.636 12.061 1.00 0.00 C ATOM 461 CG ASP A 31 4.922 -10.566 12.413 1.00 0.00 C ATOM 462 OD1 ASP A 31 4.666 -11.766 12.656 1.00 0.00 O ATOM 463 OD2 ASP A 31 6.085 -10.112 12.423 1.00 0.00 O ATOM 0 H ASP A 31 1.718 -8.218 11.895 1.00 0.00 H new ATOM 0 HA ASP A 31 2.504 -10.399 13.607 1.00 0.00 H new ATOM 0 HB2 ASP A 31 3.231 -10.044 11.211 1.00 0.00 H new ATOM 0 HB3 ASP A 31 4.181 -8.673 11.748 1.00 0.00 H new ATOM 468 N GLY A 32 3.064 -7.449 14.612 1.00 0.00 N ATOM 469 CA GLY A 32 3.666 -6.642 15.657 1.00 0.00 C ATOM 470 C GLY A 32 4.577 -5.582 15.084 1.00 0.00 C ATOM 471 O GLY A 32 5.530 -5.141 15.731 1.00 0.00 O ATOM 0 H GLY A 32 2.300 -6.999 14.108 1.00 0.00 H new ATOM 0 HA2 GLY A 32 2.883 -6.168 16.249 1.00 0.00 H new ATOM 0 HA3 GLY A 32 4.232 -7.283 16.332 1.00 0.00 H new ATOM 475 N VAL A 33 4.270 -5.171 13.863 1.00 0.00 N ATOM 476 CA VAL A 33 5.077 -4.200 13.147 1.00 0.00 C ATOM 477 C VAL A 33 4.862 -2.806 13.725 1.00 0.00 C ATOM 478 O VAL A 33 3.727 -2.393 13.966 1.00 0.00 O ATOM 479 CB VAL A 33 4.714 -4.203 11.652 1.00 0.00 C ATOM 480 CG1 VAL A 33 5.676 -3.348 10.859 1.00 0.00 C ATOM 481 CG2 VAL A 33 4.688 -5.628 11.112 1.00 0.00 C ATOM 0 H VAL A 33 3.457 -5.501 13.344 1.00 0.00 H new ATOM 0 HA VAL A 33 6.126 -4.474 13.259 1.00 0.00 H new ATOM 0 HB VAL A 33 3.717 -3.775 11.544 1.00 0.00 H new ATOM 0 HG11 VAL A 33 5.397 -3.368 9.806 1.00 0.00 H new ATOM 0 HG12 VAL A 33 5.638 -2.322 11.225 1.00 0.00 H new ATOM 0 HG13 VAL A 33 6.688 -3.737 10.973 1.00 0.00 H new ATOM 0 HG21 VAL A 33 4.429 -5.611 10.053 1.00 0.00 H new ATOM 0 HG22 VAL A 33 5.670 -6.083 11.239 1.00 0.00 H new ATOM 0 HG23 VAL A 33 3.945 -6.210 11.658 1.00 0.00 H new ATOM 491 N LYS A 34 5.955 -2.086 13.933 1.00 0.00 N ATOM 492 CA LYS A 34 5.903 -0.787 14.584 1.00 0.00 C ATOM 493 C LYS A 34 5.496 0.300 13.598 1.00 0.00 C ATOM 494 O LYS A 34 4.833 1.270 13.962 1.00 0.00 O ATOM 495 CB LYS A 34 7.269 -0.460 15.192 1.00 0.00 C ATOM 496 CG LYS A 34 7.867 -1.600 16.007 1.00 0.00 C ATOM 497 CD LYS A 34 6.948 -2.036 17.140 1.00 0.00 C ATOM 498 CE LYS A 34 6.853 -0.985 18.233 1.00 0.00 C ATOM 499 NZ LYS A 34 8.166 -0.742 18.883 1.00 0.00 N ATOM 0 H LYS A 34 6.892 -2.382 13.659 1.00 0.00 H new ATOM 0 HA LYS A 34 5.154 -0.825 15.375 1.00 0.00 H new ATOM 0 HB2 LYS A 34 7.960 -0.197 14.391 1.00 0.00 H new ATOM 0 HB3 LYS A 34 7.172 0.418 15.830 1.00 0.00 H new ATOM 0 HG2 LYS A 34 8.063 -2.449 15.352 1.00 0.00 H new ATOM 0 HG3 LYS A 34 8.826 -1.287 16.419 1.00 0.00 H new ATOM 0 HD2 LYS A 34 5.953 -2.237 16.743 1.00 0.00 H new ATOM 0 HD3 LYS A 34 7.315 -2.970 17.566 1.00 0.00 H new ATOM 0 HE2 LYS A 34 6.480 -0.053 17.809 1.00 0.00 H new ATOM 0 HE3 LYS A 34 6.130 -1.306 18.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 8.019 -0.508 19.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 8.753 -1.597 18.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 8.646 0.050 18.410 1.00 0.00 H new ATOM 513 N SER A 35 5.898 0.120 12.352 1.00 0.00 N ATOM 514 CA SER A 35 5.618 1.080 11.288 1.00 0.00 C ATOM 515 C SER A 35 5.723 0.388 9.940 1.00 0.00 C ATOM 516 O SER A 35 6.356 -0.661 9.828 1.00 0.00 O ATOM 517 CB SER A 35 6.598 2.257 11.334 1.00 0.00 C ATOM 518 OG SER A 35 6.594 2.878 12.607 1.00 0.00 O ATOM 0 H SER A 35 6.429 -0.695 12.045 1.00 0.00 H new ATOM 0 HA SER A 35 4.609 1.466 11.432 1.00 0.00 H new ATOM 0 HB2 SER A 35 7.603 1.906 11.101 1.00 0.00 H new ATOM 0 HB3 SER A 35 6.330 2.987 10.570 1.00 0.00 H new ATOM 0 HG SER A 35 7.229 3.624 12.609 1.00 0.00 H new ATOM 524 N ALA A 36 5.127 0.976 8.921 1.00 0.00 N ATOM 525 CA ALA A 36 5.095 0.353 7.610 1.00 0.00 C ATOM 526 C ALA A 36 5.474 1.345 6.524 1.00 0.00 C ATOM 527 O ALA A 36 5.039 2.498 6.534 1.00 0.00 O ATOM 528 CB ALA A 36 3.723 -0.246 7.331 1.00 0.00 C ATOM 0 H ALA A 36 4.660 1.881 8.974 1.00 0.00 H new ATOM 0 HA ALA A 36 5.830 -0.452 7.604 1.00 0.00 H new ATOM 0 HB1 ALA A 36 3.721 -0.708 6.344 1.00 0.00 H new ATOM 0 HB2 ALA A 36 3.495 -1.000 8.084 1.00 0.00 H new ATOM 0 HB3 ALA A 36 2.969 0.540 7.365 1.00 0.00 H new ATOM 534 N THR A 37 6.292 0.886 5.595 1.00 0.00 N ATOM 535 CA THR A 37 6.703 1.697 4.467 1.00 0.00 C ATOM 536 C THR A 37 6.244 1.058 3.163 1.00 0.00 C ATOM 537 O THR A 37 6.342 -0.158 2.984 1.00 0.00 O ATOM 538 CB THR A 37 8.234 1.897 4.443 1.00 0.00 C ATOM 539 OG1 THR A 37 8.899 0.634 4.577 1.00 0.00 O ATOM 540 CG2 THR A 37 8.681 2.830 5.561 1.00 0.00 C ATOM 0 H THR A 37 6.688 -0.054 5.602 1.00 0.00 H new ATOM 0 HA THR A 37 6.235 2.676 4.574 1.00 0.00 H new ATOM 0 HB THR A 37 8.500 2.348 3.487 1.00 0.00 H new ATOM 0 HG1 THR A 37 8.774 0.293 5.487 1.00 0.00 H new ATOM 0 HG21 THR A 37 9.763 2.953 5.521 1.00 0.00 H new ATOM 0 HG22 THR A 37 8.200 3.801 5.439 1.00 0.00 H new ATOM 0 HG23 THR A 37 8.400 2.404 6.524 1.00 0.00 H new ATOM 548 N VAL A 38 5.730 1.874 2.262 1.00 0.00 N ATOM 549 CA VAL A 38 5.208 1.376 1.003 1.00 0.00 C ATOM 550 C VAL A 38 5.997 1.949 -0.172 1.00 0.00 C ATOM 551 O VAL A 38 6.317 3.138 -0.206 1.00 0.00 O ATOM 552 CB VAL A 38 3.697 1.693 0.853 1.00 0.00 C ATOM 553 CG1 VAL A 38 3.439 3.195 0.861 1.00 0.00 C ATOM 554 CG2 VAL A 38 3.124 1.039 -0.400 1.00 0.00 C ATOM 0 H VAL A 38 5.663 2.885 2.378 1.00 0.00 H new ATOM 0 HA VAL A 38 5.323 0.292 1.001 1.00 0.00 H new ATOM 0 HB VAL A 38 3.182 1.270 1.716 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.370 3.381 0.754 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.789 3.619 1.802 1.00 0.00 H new ATOM 0 HG13 VAL A 38 3.973 3.660 0.033 1.00 0.00 H new ATOM 0 HG21 VAL A 38 2.063 1.277 -0.482 1.00 0.00 H new ATOM 0 HG22 VAL A 38 3.649 1.414 -1.279 1.00 0.00 H new ATOM 0 HG23 VAL A 38 3.250 -0.042 -0.336 1.00 0.00 H new ATOM 564 N THR A 39 6.353 1.082 -1.105 1.00 0.00 N ATOM 565 CA THR A 39 7.059 1.489 -2.304 1.00 0.00 C ATOM 566 C THR A 39 6.271 1.056 -3.537 1.00 0.00 C ATOM 567 O THR A 39 5.874 -0.108 -3.652 1.00 0.00 O ATOM 568 CB THR A 39 8.471 0.873 -2.343 1.00 0.00 C ATOM 569 OG1 THR A 39 9.137 1.118 -1.096 1.00 0.00 O ATOM 570 CG2 THR A 39 9.287 1.459 -3.486 1.00 0.00 C ATOM 0 H THR A 39 6.161 0.082 -1.052 1.00 0.00 H new ATOM 0 HA THR A 39 7.157 2.575 -2.297 1.00 0.00 H new ATOM 0 HB THR A 39 8.376 -0.201 -2.504 1.00 0.00 H new ATOM 0 HG1 THR A 39 10.034 0.724 -1.121 1.00 0.00 H new ATOM 0 HG21 THR A 39 10.280 1.009 -3.493 1.00 0.00 H new ATOM 0 HG22 THR A 39 8.788 1.252 -4.433 1.00 0.00 H new ATOM 0 HG23 THR A 39 9.379 2.537 -3.352 1.00 0.00 H new ATOM 578 N PHE A 40 6.021 1.985 -4.446 1.00 0.00 N ATOM 579 CA PHE A 40 5.276 1.665 -5.652 1.00 0.00 C ATOM 580 C PHE A 40 6.218 1.513 -6.837 1.00 0.00 C ATOM 581 O PHE A 40 6.904 2.457 -7.230 1.00 0.00 O ATOM 582 CB PHE A 40 4.238 2.748 -5.942 1.00 0.00 C ATOM 583 CG PHE A 40 3.139 2.825 -4.920 1.00 0.00 C ATOM 584 CD1 PHE A 40 2.012 2.024 -5.034 1.00 0.00 C ATOM 585 CD2 PHE A 40 3.227 3.702 -3.850 1.00 0.00 C ATOM 586 CE1 PHE A 40 0.998 2.095 -4.100 1.00 0.00 C ATOM 587 CE2 PHE A 40 2.213 3.778 -2.915 1.00 0.00 C ATOM 588 CZ PHE A 40 1.098 2.973 -3.040 1.00 0.00 C ATOM 0 H PHE A 40 6.320 2.957 -4.373 1.00 0.00 H new ATOM 0 HA PHE A 40 4.759 0.718 -5.494 1.00 0.00 H new ATOM 0 HB2 PHE A 40 4.740 3.714 -5.995 1.00 0.00 H new ATOM 0 HB3 PHE A 40 3.798 2.563 -6.922 1.00 0.00 H new ATOM 0 HD1 PHE A 40 1.927 1.337 -5.863 1.00 0.00 H new ATOM 0 HD2 PHE A 40 4.098 4.333 -3.746 1.00 0.00 H new ATOM 0 HE1 PHE A 40 0.127 1.464 -4.199 1.00 0.00 H new ATOM 0 HE2 PHE A 40 2.292 4.467 -2.087 1.00 0.00 H new ATOM 0 HZ PHE A 40 0.305 3.030 -2.309 1.00 0.00 H new ATOM 598 N THR A 41 6.252 0.313 -7.386 1.00 0.00 N ATOM 599 CA THR A 41 7.076 0.011 -8.542 1.00 0.00 C ATOM 600 C THR A 41 6.227 -0.051 -9.812 1.00 0.00 C ATOM 601 O THR A 41 5.023 0.200 -9.766 1.00 0.00 O ATOM 602 CB THR A 41 7.850 -1.307 -8.342 1.00 0.00 C ATOM 603 OG1 THR A 41 7.415 -1.952 -7.139 1.00 0.00 O ATOM 604 CG2 THR A 41 9.346 -1.049 -8.261 1.00 0.00 C ATOM 0 H THR A 41 5.709 -0.480 -7.043 1.00 0.00 H new ATOM 0 HA THR A 41 7.803 0.816 -8.654 1.00 0.00 H new ATOM 0 HB THR A 41 7.650 -1.951 -9.198 1.00 0.00 H new ATOM 0 HG1 THR A 41 6.458 -2.152 -7.203 1.00 0.00 H new ATOM 0 HG21 THR A 41 9.871 -1.994 -8.120 1.00 0.00 H new ATOM 0 HG22 THR A 41 9.685 -0.580 -9.185 1.00 0.00 H new ATOM 0 HG23 THR A 41 9.556 -0.388 -7.420 1.00 0.00 H new ATOM 612 N GLU A 42 6.871 -0.360 -10.938 1.00 0.00 N ATOM 613 CA GLU A 42 6.224 -0.361 -12.256 1.00 0.00 C ATOM 614 C GLU A 42 4.862 -1.067 -12.256 1.00 0.00 C ATOM 615 O GLU A 42 3.830 -0.437 -12.492 1.00 0.00 O ATOM 616 CB GLU A 42 7.145 -1.030 -13.279 1.00 0.00 C ATOM 617 CG GLU A 42 6.594 -1.026 -14.699 1.00 0.00 C ATOM 618 CD GLU A 42 7.485 -1.768 -15.668 1.00 0.00 C ATOM 619 OE1 GLU A 42 8.539 -1.223 -16.040 1.00 0.00 O ATOM 620 OE2 GLU A 42 7.141 -2.904 -16.055 1.00 0.00 O ATOM 0 H GLU A 42 7.858 -0.617 -10.965 1.00 0.00 H new ATOM 0 HA GLU A 42 6.044 0.681 -12.522 1.00 0.00 H new ATOM 0 HB2 GLU A 42 8.109 -0.522 -13.272 1.00 0.00 H new ATOM 0 HB3 GLU A 42 7.325 -2.060 -12.972 1.00 0.00 H new ATOM 0 HG2 GLU A 42 5.603 -1.479 -14.702 1.00 0.00 H new ATOM 0 HG3 GLU A 42 6.474 0.004 -15.036 1.00 0.00 H new ATOM 627 N ASP A 43 4.863 -2.368 -11.987 1.00 0.00 N ATOM 628 CA ASP A 43 3.644 -3.168 -12.106 1.00 0.00 C ATOM 629 C ASP A 43 3.403 -3.954 -10.820 1.00 0.00 C ATOM 630 O ASP A 43 2.537 -4.827 -10.746 1.00 0.00 O ATOM 631 CB ASP A 43 3.764 -4.109 -13.317 1.00 0.00 C ATOM 632 CG ASP A 43 2.474 -4.841 -13.668 1.00 0.00 C ATOM 633 OD1 ASP A 43 1.533 -4.202 -14.182 1.00 0.00 O ATOM 634 OD2 ASP A 43 2.409 -6.074 -13.469 1.00 0.00 O ATOM 0 H ASP A 43 5.686 -2.890 -11.687 1.00 0.00 H new ATOM 0 HA ASP A 43 2.789 -2.510 -12.261 1.00 0.00 H new ATOM 0 HB2 ASP A 43 4.087 -3.530 -14.182 1.00 0.00 H new ATOM 0 HB3 ASP A 43 4.543 -4.844 -13.116 1.00 0.00 H new ATOM 639 N GLU A 44 4.171 -3.627 -9.793 1.00 0.00 N ATOM 640 CA GLU A 44 4.051 -4.297 -8.510 1.00 0.00 C ATOM 641 C GLU A 44 4.135 -3.299 -7.356 1.00 0.00 C ATOM 642 O GLU A 44 4.838 -2.293 -7.436 1.00 0.00 O ATOM 643 CB GLU A 44 5.133 -5.373 -8.352 1.00 0.00 C ATOM 644 CG GLU A 44 6.562 -4.844 -8.409 1.00 0.00 C ATOM 645 CD GLU A 44 7.065 -4.617 -9.823 1.00 0.00 C ATOM 646 OE1 GLU A 44 7.592 -5.576 -10.423 1.00 0.00 O ATOM 647 OE2 GLU A 44 6.957 -3.481 -10.334 1.00 0.00 O ATOM 0 H GLU A 44 4.886 -2.900 -9.824 1.00 0.00 H new ATOM 0 HA GLU A 44 3.073 -4.776 -8.481 1.00 0.00 H new ATOM 0 HB2 GLU A 44 4.985 -5.882 -7.400 1.00 0.00 H new ATOM 0 HB3 GLU A 44 5.003 -6.119 -9.136 1.00 0.00 H new ATOM 0 HG2 GLU A 44 6.616 -3.906 -7.857 1.00 0.00 H new ATOM 0 HG3 GLU A 44 7.223 -5.549 -7.905 1.00 0.00 H new ATOM 654 N VAL A 45 3.396 -3.580 -6.299 1.00 0.00 N ATOM 655 CA VAL A 45 3.473 -2.803 -5.072 1.00 0.00 C ATOM 656 C VAL A 45 4.313 -3.562 -4.060 1.00 0.00 C ATOM 657 O VAL A 45 4.123 -4.765 -3.868 1.00 0.00 O ATOM 658 CB VAL A 45 2.076 -2.536 -4.463 1.00 0.00 C ATOM 659 CG1 VAL A 45 2.187 -1.782 -3.142 1.00 0.00 C ATOM 660 CG2 VAL A 45 1.197 -1.766 -5.431 1.00 0.00 C ATOM 0 H VAL A 45 2.728 -4.350 -6.265 1.00 0.00 H new ATOM 0 HA VAL A 45 3.923 -1.840 -5.314 1.00 0.00 H new ATOM 0 HB VAL A 45 1.613 -3.504 -4.270 1.00 0.00 H new ATOM 0 HG11 VAL A 45 1.190 -1.608 -2.737 1.00 0.00 H new ATOM 0 HG12 VAL A 45 2.768 -2.372 -2.434 1.00 0.00 H new ATOM 0 HG13 VAL A 45 2.682 -0.826 -3.309 1.00 0.00 H new ATOM 0 HG21 VAL A 45 0.221 -1.592 -4.977 1.00 0.00 H new ATOM 0 HG22 VAL A 45 1.664 -0.809 -5.665 1.00 0.00 H new ATOM 0 HG23 VAL A 45 1.073 -2.343 -6.348 1.00 0.00 H new ATOM 670 N VAL A 46 5.252 -2.874 -3.436 1.00 0.00 N ATOM 671 CA VAL A 46 6.086 -3.494 -2.425 1.00 0.00 C ATOM 672 C VAL A 46 5.776 -2.906 -1.057 1.00 0.00 C ATOM 673 O VAL A 46 5.861 -1.693 -0.857 1.00 0.00 O ATOM 674 CB VAL A 46 7.586 -3.305 -2.736 1.00 0.00 C ATOM 675 CG1 VAL A 46 8.449 -4.031 -1.711 1.00 0.00 C ATOM 676 CG2 VAL A 46 7.909 -3.786 -4.145 1.00 0.00 C ATOM 0 H VAL A 46 5.455 -1.890 -3.611 1.00 0.00 H new ATOM 0 HA VAL A 46 5.866 -4.562 -2.426 1.00 0.00 H new ATOM 0 HB VAL A 46 7.811 -2.240 -2.677 1.00 0.00 H new ATOM 0 HG11 VAL A 46 9.502 -3.883 -1.952 1.00 0.00 H new ATOM 0 HG12 VAL A 46 8.245 -3.634 -0.717 1.00 0.00 H new ATOM 0 HG13 VAL A 46 8.219 -5.096 -1.731 1.00 0.00 H new ATOM 0 HG21 VAL A 46 8.971 -3.644 -4.343 1.00 0.00 H new ATOM 0 HG22 VAL A 46 7.662 -4.844 -4.234 1.00 0.00 H new ATOM 0 HG23 VAL A 46 7.325 -3.215 -4.867 1.00 0.00 H new ATOM 686 N GLU A 47 5.411 -3.770 -0.123 1.00 0.00 N ATOM 687 CA GLU A 47 5.196 -3.359 1.252 1.00 0.00 C ATOM 688 C GLU A 47 6.361 -3.781 2.112 1.00 0.00 C ATOM 689 O GLU A 47 6.902 -4.880 1.968 1.00 0.00 O ATOM 690 CB GLU A 47 3.896 -3.923 1.815 1.00 0.00 C ATOM 691 CG GLU A 47 2.707 -3.002 1.616 1.00 0.00 C ATOM 692 CD GLU A 47 1.399 -3.619 2.071 1.00 0.00 C ATOM 693 OE1 GLU A 47 0.766 -4.345 1.275 1.00 0.00 O ATOM 694 OE2 GLU A 47 0.997 -3.380 3.227 1.00 0.00 O ATOM 0 H GLU A 47 5.257 -4.764 -0.295 1.00 0.00 H new ATOM 0 HA GLU A 47 5.117 -2.272 1.261 1.00 0.00 H new ATOM 0 HB2 GLU A 47 3.688 -4.882 1.340 1.00 0.00 H new ATOM 0 HB3 GLU A 47 4.023 -4.116 2.880 1.00 0.00 H new ATOM 0 HG2 GLU A 47 2.876 -2.075 2.165 1.00 0.00 H new ATOM 0 HG3 GLU A 47 2.631 -2.738 0.561 1.00 0.00 H new ATOM 701 N THR A 48 6.754 -2.887 2.988 1.00 0.00 N ATOM 702 CA THR A 48 7.864 -3.133 3.879 1.00 0.00 C ATOM 703 C THR A 48 7.427 -2.950 5.325 1.00 0.00 C ATOM 704 O THR A 48 6.942 -1.885 5.713 1.00 0.00 O ATOM 705 CB THR A 48 9.041 -2.190 3.585 1.00 0.00 C ATOM 706 OG1 THR A 48 8.829 -1.508 2.341 1.00 0.00 O ATOM 707 CG2 THR A 48 10.348 -2.963 3.518 1.00 0.00 C ATOM 0 H THR A 48 6.316 -1.973 3.103 1.00 0.00 H new ATOM 0 HA THR A 48 8.193 -4.160 3.718 1.00 0.00 H new ATOM 0 HB THR A 48 9.102 -1.463 4.395 1.00 0.00 H new ATOM 0 HG1 THR A 48 8.073 -0.890 2.431 1.00 0.00 H new ATOM 0 HG21 THR A 48 11.167 -2.275 3.309 1.00 0.00 H new ATOM 0 HG22 THR A 48 10.526 -3.460 4.472 1.00 0.00 H new ATOM 0 HG23 THR A 48 10.289 -3.709 2.725 1.00 0.00 H new ATOM 715 N GLU A 49 7.592 -3.993 6.112 1.00 0.00 N ATOM 716 CA GLU A 49 7.195 -3.966 7.507 1.00 0.00 C ATOM 717 C GLU A 49 8.413 -3.735 8.384 1.00 0.00 C ATOM 718 O GLU A 49 9.357 -4.519 8.362 1.00 0.00 O ATOM 719 CB GLU A 49 6.526 -5.281 7.893 1.00 0.00 C ATOM 720 CG GLU A 49 5.391 -5.689 6.967 1.00 0.00 C ATOM 721 CD GLU A 49 4.814 -7.044 7.316 1.00 0.00 C ATOM 722 OE1 GLU A 49 5.459 -8.068 7.021 1.00 0.00 O ATOM 723 OE2 GLU A 49 3.701 -7.092 7.878 1.00 0.00 O ATOM 0 H GLU A 49 8.001 -4.876 5.808 1.00 0.00 H new ATOM 0 HA GLU A 49 6.484 -3.153 7.653 1.00 0.00 H new ATOM 0 HB2 GLU A 49 7.277 -6.071 7.901 1.00 0.00 H new ATOM 0 HB3 GLU A 49 6.141 -5.197 8.909 1.00 0.00 H new ATOM 0 HG2 GLU A 49 4.601 -4.939 7.014 1.00 0.00 H new ATOM 0 HG3 GLU A 49 5.754 -5.706 5.939 1.00 0.00 H new ATOM 730 N VAL A 50 8.396 -2.659 9.142 1.00 0.00 N ATOM 731 CA VAL A 50 9.512 -2.333 10.010 1.00 0.00 C ATOM 732 C VAL A 50 9.336 -3.010 11.361 1.00 0.00 C ATOM 733 O VAL A 50 8.431 -2.667 12.128 1.00 0.00 O ATOM 734 CB VAL A 50 9.641 -0.811 10.219 1.00 0.00 C ATOM 735 CG1 VAL A 50 10.897 -0.480 11.009 1.00 0.00 C ATOM 736 CG2 VAL A 50 9.644 -0.085 8.881 1.00 0.00 C ATOM 0 H VAL A 50 7.623 -1.994 9.176 1.00 0.00 H new ATOM 0 HA VAL A 50 10.421 -2.693 9.528 1.00 0.00 H new ATOM 0 HB VAL A 50 8.778 -0.472 10.792 1.00 0.00 H new ATOM 0 HG11 VAL A 50 10.968 0.599 11.145 1.00 0.00 H new ATOM 0 HG12 VAL A 50 10.852 -0.966 11.984 1.00 0.00 H new ATOM 0 HG13 VAL A 50 11.773 -0.836 10.466 1.00 0.00 H new ATOM 0 HG21 VAL A 50 9.736 0.988 9.049 1.00 0.00 H new ATOM 0 HG22 VAL A 50 10.485 -0.431 8.281 1.00 0.00 H new ATOM 0 HG23 VAL A 50 8.713 -0.291 8.353 1.00 0.00 H new ATOM 746 N MET A 51 10.203 -3.962 11.657 1.00 0.00 N ATOM 747 CA MET A 51 10.122 -4.694 12.907 1.00 0.00 C ATOM 748 C MET A 51 11.353 -4.411 13.743 1.00 0.00 C ATOM 749 O MET A 51 12.481 -4.555 13.262 1.00 0.00 O ATOM 750 CB MET A 51 9.999 -6.196 12.641 1.00 0.00 C ATOM 751 CG MET A 51 9.029 -6.904 13.573 1.00 0.00 C ATOM 752 SD MET A 51 9.457 -6.702 15.311 1.00 0.00 S ATOM 753 CE MET A 51 8.053 -7.489 16.095 1.00 0.00 C ATOM 0 H MET A 51 10.971 -4.246 11.049 1.00 0.00 H new ATOM 0 HA MET A 51 9.235 -4.368 13.451 1.00 0.00 H new ATOM 0 HB2 MET A 51 9.676 -6.348 11.611 1.00 0.00 H new ATOM 0 HB3 MET A 51 10.983 -6.655 12.738 1.00 0.00 H new ATOM 0 HG2 MET A 51 8.023 -6.519 13.404 1.00 0.00 H new ATOM 0 HG3 MET A 51 9.008 -7.966 13.330 1.00 0.00 H new ATOM 0 HE1 MET A 51 8.038 -7.234 17.155 1.00 0.00 H new ATOM 0 HE2 MET A 51 7.132 -7.143 15.625 1.00 0.00 H new ATOM 0 HE3 MET A 51 8.133 -8.570 15.983 1.00 0.00 H new ATOM 763 N GLU A 52 11.130 -4.007 14.986 1.00 0.00 N ATOM 764 CA GLU A 52 12.204 -3.643 15.893 1.00 0.00 C ATOM 765 C GLU A 52 13.214 -4.782 16.053 1.00 0.00 C ATOM 766 O GLU A 52 12.837 -5.935 16.265 1.00 0.00 O ATOM 767 CB GLU A 52 11.616 -3.258 17.249 1.00 0.00 C ATOM 768 CG GLU A 52 10.627 -4.275 17.798 1.00 0.00 C ATOM 769 CD GLU A 52 10.195 -3.962 19.214 1.00 0.00 C ATOM 770 OE1 GLU A 52 9.410 -3.013 19.407 1.00 0.00 O ATOM 771 OE2 GLU A 52 10.643 -4.667 20.144 1.00 0.00 O ATOM 0 H GLU A 52 10.198 -3.923 15.392 1.00 0.00 H new ATOM 0 HA GLU A 52 12.737 -2.791 15.471 1.00 0.00 H new ATOM 0 HB2 GLU A 52 12.428 -3.132 17.965 1.00 0.00 H new ATOM 0 HB3 GLU A 52 11.118 -2.293 17.158 1.00 0.00 H new ATOM 0 HG2 GLU A 52 9.749 -4.307 17.153 1.00 0.00 H new ATOM 0 HG3 GLU A 52 11.079 -5.267 17.771 1.00 0.00 H new ATOM 778 N GLY A 53 14.493 -4.450 15.938 1.00 0.00 N ATOM 779 CA GLY A 53 15.541 -5.446 16.068 1.00 0.00 C ATOM 780 C GLY A 53 16.016 -5.951 14.722 1.00 0.00 C ATOM 781 O GLY A 53 17.210 -6.183 14.517 1.00 0.00 O ATOM 0 H GLY A 53 14.826 -3.503 15.756 1.00 0.00 H new ATOM 0 HA2 GLY A 53 16.383 -5.017 16.612 1.00 0.00 H new ATOM 0 HA3 GLY A 53 15.173 -6.284 16.660 1.00 0.00 H new ATOM 785 N ARG A 54 15.080 -6.115 13.799 1.00 0.00 N ATOM 786 CA ARG A 54 15.388 -6.610 12.466 1.00 0.00 C ATOM 787 C ARG A 54 15.612 -5.448 11.517 1.00 0.00 C ATOM 788 O ARG A 54 16.705 -5.245 10.984 1.00 0.00 O ATOM 789 CB ARG A 54 14.222 -7.437 11.937 1.00 0.00 C ATOM 790 CG ARG A 54 13.585 -8.336 12.974 1.00 0.00 C ATOM 791 CD ARG A 54 14.454 -9.538 13.300 1.00 0.00 C ATOM 792 NE ARG A 54 13.788 -10.451 14.225 1.00 0.00 N ATOM 793 CZ ARG A 54 14.397 -11.451 14.859 1.00 0.00 C ATOM 794 NH1 ARG A 54 15.696 -11.664 14.680 1.00 0.00 N ATOM 795 NH2 ARG A 54 13.702 -12.239 15.669 1.00 0.00 N ATOM 0 H ARG A 54 14.092 -5.910 13.951 1.00 0.00 H new ATOM 0 HA ARG A 54 16.288 -7.222 12.527 1.00 0.00 H new ATOM 0 HB2 ARG A 54 13.463 -6.763 11.539 1.00 0.00 H new ATOM 0 HB3 ARG A 54 14.572 -8.049 11.106 1.00 0.00 H new ATOM 0 HG2 ARG A 54 13.401 -7.765 13.884 1.00 0.00 H new ATOM 0 HG3 ARG A 54 12.616 -8.678 12.611 1.00 0.00 H new ATOM 0 HD2 ARG A 54 14.702 -10.068 12.380 1.00 0.00 H new ATOM 0 HD3 ARG A 54 15.394 -9.200 13.736 1.00 0.00 H new ATOM 0 HE ARG A 54 12.792 -10.314 14.396 1.00 0.00 H new ATOM 0 HH11 ARG A 54 16.230 -11.060 14.055 1.00 0.00 H new ATOM 0 HH12 ARG A 54 16.159 -12.431 15.167 1.00 0.00 H new ATOM 0 HH21 ARG A 54 12.704 -12.078 15.805 1.00 0.00 H new ATOM 0 HH22 ARG A 54 14.166 -13.006 16.156 1.00 0.00 H new ATOM 809 N GLY A 55 14.548 -4.690 11.328 1.00 0.00 N ATOM 810 CA GLY A 55 14.543 -3.613 10.368 1.00 0.00 C ATOM 811 C GLY A 55 13.355 -3.736 9.447 1.00 0.00 C ATOM 812 O GLY A 55 12.352 -4.357 9.808 1.00 0.00 O ATOM 0 H GLY A 55 13.670 -4.806 11.834 1.00 0.00 H new ATOM 0 HA2 GLY A 55 14.511 -2.655 10.887 1.00 0.00 H new ATOM 0 HA3 GLY A 55 15.465 -3.631 9.787 1.00 0.00 H new ATOM 816 N GLU A 56 13.447 -3.145 8.270 1.00 0.00 N ATOM 817 CA GLU A 56 12.394 -3.257 7.284 1.00 0.00 C ATOM 818 C GLU A 56 12.408 -4.626 6.633 1.00 0.00 C ATOM 819 O GLU A 56 13.443 -5.102 6.161 1.00 0.00 O ATOM 820 CB GLU A 56 12.544 -2.186 6.214 1.00 0.00 C ATOM 821 CG GLU A 56 12.744 -0.791 6.768 1.00 0.00 C ATOM 822 CD GLU A 56 14.201 -0.460 7.008 1.00 0.00 C ATOM 823 OE1 GLU A 56 14.867 0.018 6.067 1.00 0.00 O ATOM 824 OE2 GLU A 56 14.693 -0.687 8.133 1.00 0.00 O ATOM 0 H GLU A 56 14.244 -2.581 7.975 1.00 0.00 H new ATOM 0 HA GLU A 56 11.443 -3.118 7.798 1.00 0.00 H new ATOM 0 HB2 GLU A 56 13.392 -2.439 5.577 1.00 0.00 H new ATOM 0 HB3 GLU A 56 11.657 -2.191 5.581 1.00 0.00 H new ATOM 0 HG2 GLU A 56 12.321 -0.065 6.074 1.00 0.00 H new ATOM 0 HG3 GLU A 56 12.195 -0.695 7.705 1.00 0.00 H new ATOM 831 N VAL A 57 11.248 -5.240 6.612 1.00 0.00 N ATOM 832 CA VAL A 57 11.073 -6.561 6.041 1.00 0.00 C ATOM 833 C VAL A 57 10.224 -6.467 4.779 1.00 0.00 C ATOM 834 O VAL A 57 9.104 -5.956 4.813 1.00 0.00 O ATOM 835 CB VAL A 57 10.404 -7.511 7.056 1.00 0.00 C ATOM 836 CG1 VAL A 57 10.132 -8.876 6.435 1.00 0.00 C ATOM 837 CG2 VAL A 57 11.264 -7.651 8.306 1.00 0.00 C ATOM 0 H VAL A 57 10.392 -4.837 6.992 1.00 0.00 H new ATOM 0 HA VAL A 57 12.054 -6.964 5.789 1.00 0.00 H new ATOM 0 HB VAL A 57 9.446 -7.077 7.342 1.00 0.00 H new ATOM 0 HG11 VAL A 57 9.660 -9.524 7.174 1.00 0.00 H new ATOM 0 HG12 VAL A 57 9.469 -8.760 5.578 1.00 0.00 H new ATOM 0 HG13 VAL A 57 11.072 -9.321 6.109 1.00 0.00 H new ATOM 0 HG21 VAL A 57 10.776 -8.325 9.010 1.00 0.00 H new ATOM 0 HG22 VAL A 57 12.239 -8.055 8.034 1.00 0.00 H new ATOM 0 HG23 VAL A 57 11.394 -6.673 8.770 1.00 0.00 H new ATOM 847 N GLN A 58 10.768 -6.936 3.667 1.00 0.00 N ATOM 848 CA GLN A 58 10.104 -6.835 2.385 1.00 0.00 C ATOM 849 C GLN A 58 9.125 -7.980 2.160 1.00 0.00 C ATOM 850 O GLN A 58 9.458 -9.147 2.371 1.00 0.00 O ATOM 851 CB GLN A 58 11.147 -6.822 1.278 1.00 0.00 C ATOM 852 CG GLN A 58 12.115 -5.658 1.384 1.00 0.00 C ATOM 853 CD GLN A 58 13.073 -5.577 0.212 1.00 0.00 C ATOM 854 OE1 GLN A 58 13.447 -6.590 -0.379 1.00 0.00 O ATOM 855 NE2 GLN A 58 13.471 -4.364 -0.133 1.00 0.00 N ATOM 0 H GLN A 58 11.678 -7.395 3.632 1.00 0.00 H new ATOM 0 HA GLN A 58 9.532 -5.908 2.373 1.00 0.00 H new ATOM 0 HB2 GLN A 58 11.708 -7.756 1.305 1.00 0.00 H new ATOM 0 HB3 GLN A 58 10.643 -6.780 0.313 1.00 0.00 H new ATOM 0 HG2 GLN A 58 11.551 -4.728 1.450 1.00 0.00 H new ATOM 0 HG3 GLN A 58 12.686 -5.750 2.308 1.00 0.00 H new ATOM 0 HE21 GLN A 58 13.136 -3.551 0.384 1.00 0.00 H new ATOM 0 HE22 GLN A 58 14.113 -4.241 -0.916 1.00 0.00 H new ATOM 864 N LEU A 59 7.918 -7.631 1.740 1.00 0.00 N ATOM 865 CA LEU A 59 6.901 -8.615 1.392 1.00 0.00 C ATOM 866 C LEU A 59 7.016 -9.007 -0.079 1.00 0.00 C ATOM 867 O LEU A 59 7.707 -8.338 -0.847 1.00 0.00 O ATOM 868 CB LEU A 59 5.504 -8.051 1.677 1.00 0.00 C ATOM 869 CG LEU A 59 5.148 -7.911 3.157 1.00 0.00 C ATOM 870 CD1 LEU A 59 3.780 -7.265 3.317 1.00 0.00 C ATOM 871 CD2 LEU A 59 5.174 -9.272 3.838 1.00 0.00 C ATOM 0 H LEU A 59 7.616 -6.663 1.631 1.00 0.00 H new ATOM 0 HA LEU A 59 7.057 -9.505 2.002 1.00 0.00 H new ATOM 0 HB2 LEU A 59 5.422 -7.071 1.206 1.00 0.00 H new ATOM 0 HB3 LEU A 59 4.765 -8.696 1.202 1.00 0.00 H new ATOM 0 HG LEU A 59 5.890 -7.270 3.632 1.00 0.00 H new ATOM 0 HD11 LEU A 59 3.543 -7.173 4.377 1.00 0.00 H new ATOM 0 HD12 LEU A 59 3.789 -6.275 2.860 1.00 0.00 H new ATOM 0 HD13 LEU A 59 3.026 -7.883 2.829 1.00 0.00 H new ATOM 0 HD21 LEU A 59 4.919 -9.157 4.891 1.00 0.00 H new ATOM 0 HD22 LEU A 59 4.451 -9.932 3.359 1.00 0.00 H new ATOM 0 HD23 LEU A 59 6.171 -9.703 3.752 1.00 0.00 H new ATOM 883 N PRO A 60 6.366 -10.118 -0.479 1.00 0.00 N ATOM 884 CA PRO A 60 6.320 -10.554 -1.882 1.00 0.00 C ATOM 885 C PRO A 60 5.769 -9.473 -2.811 1.00 0.00 C ATOM 886 O PRO A 60 4.974 -8.629 -2.391 1.00 0.00 O ATOM 887 CB PRO A 60 5.373 -11.758 -1.853 1.00 0.00 C ATOM 888 CG PRO A 60 5.432 -12.258 -0.452 1.00 0.00 C ATOM 889 CD PRO A 60 5.646 -11.046 0.410 1.00 0.00 C ATOM 0 HA PRO A 60 7.314 -10.783 -2.266 1.00 0.00 H new ATOM 0 HB2 PRO A 60 4.358 -11.469 -2.127 1.00 0.00 H new ATOM 0 HB3 PRO A 60 5.688 -12.525 -2.560 1.00 0.00 H new ATOM 0 HG2 PRO A 60 4.509 -12.772 -0.182 1.00 0.00 H new ATOM 0 HG3 PRO A 60 6.244 -12.974 -0.327 1.00 0.00 H new ATOM 0 HD2 PRO A 60 4.701 -10.624 0.751 1.00 0.00 H new ATOM 0 HD3 PRO A 60 6.229 -11.284 1.300 1.00 0.00 H new ATOM 897 N PHE A 61 6.187 -9.505 -4.070 1.00 0.00 N ATOM 898 CA PHE A 61 5.755 -8.506 -5.037 1.00 0.00 C ATOM 899 C PHE A 61 4.296 -8.715 -5.410 1.00 0.00 C ATOM 900 O PHE A 61 3.924 -9.721 -6.018 1.00 0.00 O ATOM 901 CB PHE A 61 6.611 -8.549 -6.296 1.00 0.00 C ATOM 902 CG PHE A 61 8.083 -8.363 -6.046 1.00 0.00 C ATOM 903 CD1 PHE A 61 8.600 -7.104 -5.782 1.00 0.00 C ATOM 904 CD2 PHE A 61 8.949 -9.443 -6.079 1.00 0.00 C ATOM 905 CE1 PHE A 61 9.950 -6.925 -5.555 1.00 0.00 C ATOM 906 CE2 PHE A 61 10.303 -9.270 -5.853 1.00 0.00 C ATOM 907 CZ PHE A 61 10.804 -8.009 -5.591 1.00 0.00 C ATOM 0 H PHE A 61 6.823 -10.210 -4.444 1.00 0.00 H new ATOM 0 HA PHE A 61 5.871 -7.528 -4.569 1.00 0.00 H new ATOM 0 HB2 PHE A 61 6.456 -9.506 -6.795 1.00 0.00 H new ATOM 0 HB3 PHE A 61 6.269 -7.773 -6.981 1.00 0.00 H new ATOM 0 HD1 PHE A 61 7.938 -6.252 -5.754 1.00 0.00 H new ATOM 0 HD2 PHE A 61 8.563 -10.431 -6.283 1.00 0.00 H new ATOM 0 HE1 PHE A 61 10.337 -5.938 -5.350 1.00 0.00 H new ATOM 0 HE2 PHE A 61 10.968 -10.120 -5.881 1.00 0.00 H new ATOM 0 HZ PHE A 61 11.861 -7.872 -5.415 1.00 0.00 H new ATOM 917 N MET A 62 3.486 -7.748 -5.044 1.00 0.00 N ATOM 918 CA MET A 62 2.057 -7.789 -5.310 1.00 0.00 C ATOM 919 C MET A 62 1.753 -7.006 -6.576 1.00 0.00 C ATOM 920 O MET A 62 2.000 -5.807 -6.635 1.00 0.00 O ATOM 921 CB MET A 62 1.294 -7.193 -4.128 1.00 0.00 C ATOM 922 CG MET A 62 1.453 -7.981 -2.838 1.00 0.00 C ATOM 923 SD MET A 62 0.897 -7.071 -1.383 1.00 0.00 S ATOM 924 CE MET A 62 -0.786 -6.667 -1.844 1.00 0.00 C ATOM 0 H MET A 62 3.794 -6.909 -4.553 1.00 0.00 H new ATOM 0 HA MET A 62 1.743 -8.824 -5.447 1.00 0.00 H new ATOM 0 HB2 MET A 62 1.637 -6.171 -3.964 1.00 0.00 H new ATOM 0 HB3 MET A 62 0.235 -7.137 -4.381 1.00 0.00 H new ATOM 0 HG2 MET A 62 0.890 -8.911 -2.915 1.00 0.00 H new ATOM 0 HG3 MET A 62 2.501 -8.252 -2.711 1.00 0.00 H new ATOM 0 HE1 MET A 62 -1.435 -6.762 -0.973 1.00 0.00 H new ATOM 0 HE2 MET A 62 -0.826 -5.643 -2.216 1.00 0.00 H new ATOM 0 HE3 MET A 62 -1.123 -7.350 -2.624 1.00 0.00 H new ATOM 934 N ALA A 63 1.219 -7.677 -7.580 1.00 0.00 N ATOM 935 CA ALA A 63 0.985 -7.050 -8.873 1.00 0.00 C ATOM 936 C ALA A 63 -0.230 -6.132 -8.841 1.00 0.00 C ATOM 937 O ALA A 63 -1.245 -6.443 -8.210 1.00 0.00 O ATOM 938 CB ALA A 63 0.818 -8.109 -9.946 1.00 0.00 C ATOM 0 H ALA A 63 0.938 -8.656 -7.528 1.00 0.00 H new ATOM 0 HA ALA A 63 1.855 -6.437 -9.108 1.00 0.00 H new ATOM 0 HB1 ALA A 63 0.644 -7.628 -10.908 1.00 0.00 H new ATOM 0 HB2 ALA A 63 1.722 -8.716 -10.002 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -0.032 -8.746 -9.700 1.00 0.00 H new ATOM 944 N TYR A 64 -0.120 -5.000 -9.519 1.00 0.00 N ATOM 945 CA TYR A 64 -1.222 -4.057 -9.616 1.00 0.00 C ATOM 946 C TYR A 64 -1.194 -3.382 -10.978 1.00 0.00 C ATOM 947 O TYR A 64 -0.127 -3.212 -11.567 1.00 0.00 O ATOM 948 CB TYR A 64 -1.140 -2.998 -8.506 1.00 0.00 C ATOM 949 CG TYR A 64 -0.176 -1.863 -8.797 1.00 0.00 C ATOM 950 CD1 TYR A 64 1.198 -2.047 -8.726 1.00 0.00 C ATOM 951 CD2 TYR A 64 -0.648 -0.602 -9.140 1.00 0.00 C ATOM 952 CE1 TYR A 64 2.073 -1.010 -8.992 1.00 0.00 C ATOM 953 CE2 TYR A 64 0.222 0.440 -9.409 1.00 0.00 C ATOM 954 CZ TYR A 64 1.580 0.230 -9.330 1.00 0.00 C ATOM 955 OH TYR A 64 2.450 1.263 -9.590 1.00 0.00 O ATOM 0 H TYR A 64 0.725 -4.712 -10.012 1.00 0.00 H new ATOM 0 HA TYR A 64 -2.158 -4.603 -9.496 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -2.134 -2.582 -8.342 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -0.841 -3.484 -7.577 1.00 0.00 H new ATOM 0 HD1 TYR A 64 1.590 -3.017 -8.458 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -1.713 -0.432 -9.198 1.00 0.00 H new ATOM 0 HE1 TYR A 64 3.139 -1.172 -8.935 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -0.162 1.412 -9.679 1.00 0.00 H new ATOM 0 HH TYR A 64 3.364 0.914 -9.647 1.00 0.00 H new ATOM 965 N LYS A 65 -2.355 -2.998 -11.479 1.00 0.00 N ATOM 966 CA LYS A 65 -2.427 -2.313 -12.756 1.00 0.00 C ATOM 967 C LYS A 65 -3.316 -1.094 -12.674 1.00 0.00 C ATOM 968 O LYS A 65 -4.244 -1.027 -11.865 1.00 0.00 O ATOM 969 CB LYS A 65 -2.879 -3.259 -13.868 1.00 0.00 C ATOM 970 CG LYS A 65 -1.769 -4.192 -14.301 1.00 0.00 C ATOM 971 CD LYS A 65 -2.150 -5.032 -15.502 1.00 0.00 C ATOM 972 CE LYS A 65 -0.919 -5.656 -16.144 1.00 0.00 C ATOM 973 NZ LYS A 65 -0.083 -6.395 -15.156 1.00 0.00 N ATOM 0 H LYS A 65 -3.255 -3.148 -11.024 1.00 0.00 H new ATOM 0 HA LYS A 65 -1.423 -1.971 -13.005 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -3.731 -3.844 -13.523 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -3.218 -2.677 -14.724 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -0.880 -3.608 -14.538 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -1.507 -4.849 -13.471 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -2.842 -5.816 -15.197 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -2.671 -4.413 -16.232 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -1.230 -6.337 -16.936 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.320 -4.875 -16.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 0.567 -7.032 -15.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 0.466 -5.717 -14.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -0.698 -6.953 -14.529 1.00 0.00 H new ATOM 987 N VAL A 66 -3.001 -0.131 -13.517 1.00 0.00 N ATOM 988 CA VAL A 66 -3.637 1.175 -13.490 1.00 0.00 C ATOM 989 C VAL A 66 -4.978 1.168 -14.215 1.00 0.00 C ATOM 990 O VAL A 66 -5.086 0.717 -15.355 1.00 0.00 O ATOM 991 CB VAL A 66 -2.706 2.234 -14.118 1.00 0.00 C ATOM 992 CG1 VAL A 66 -3.381 3.597 -14.191 1.00 0.00 C ATOM 993 CG2 VAL A 66 -1.404 2.325 -13.338 1.00 0.00 C ATOM 0 H VAL A 66 -2.293 -0.231 -14.245 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.824 1.427 -12.446 1.00 0.00 H new ATOM 0 HB VAL A 66 -2.484 1.920 -15.138 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.697 4.318 -14.638 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -4.282 3.525 -14.801 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.648 3.925 -13.186 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.759 3.076 -13.794 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -1.617 2.607 -12.307 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -0.902 1.358 -13.354 1.00 0.00 H new ATOM 1003 N ILE A 67 -5.994 1.670 -13.531 1.00 0.00 N ATOM 1004 CA ILE A 67 -7.319 1.826 -14.110 1.00 0.00 C ATOM 1005 C ILE A 67 -7.431 3.204 -14.734 1.00 0.00 C ATOM 1006 O ILE A 67 -7.794 3.358 -15.900 1.00 0.00 O ATOM 1007 CB ILE A 67 -8.421 1.679 -13.043 1.00 0.00 C ATOM 1008 CG1 ILE A 67 -8.195 0.411 -12.222 1.00 0.00 C ATOM 1009 CG2 ILE A 67 -9.797 1.663 -13.694 1.00 0.00 C ATOM 1010 CD1 ILE A 67 -9.183 0.239 -11.090 1.00 0.00 C ATOM 0 H ILE A 67 -5.924 1.980 -12.562 1.00 0.00 H new ATOM 0 HA ILE A 67 -7.454 1.047 -14.860 1.00 0.00 H new ATOM 0 HB ILE A 67 -8.374 2.537 -12.372 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -8.256 -0.455 -12.882 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -7.185 0.429 -11.812 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -10.562 1.559 -12.925 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -9.953 2.595 -14.237 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -9.862 0.824 -14.387 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -8.962 -0.682 -10.551 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -9.106 1.086 -10.408 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -10.194 0.189 -11.494 1.00 0.00 H new ATOM 1022 N SER A 68 -7.107 4.202 -13.931 1.00 0.00 N ATOM 1023 CA SER A 68 -7.104 5.585 -14.375 1.00 0.00 C ATOM 1024 C SER A 68 -5.880 6.290 -13.808 1.00 0.00 C ATOM 1025 O SER A 68 -5.336 5.874 -12.787 1.00 0.00 O ATOM 1026 CB SER A 68 -8.375 6.305 -13.922 1.00 0.00 C ATOM 1027 OG SER A 68 -9.539 5.554 -14.242 1.00 0.00 O ATOM 0 H SER A 68 -6.839 4.077 -12.955 1.00 0.00 H new ATOM 0 HA SER A 68 -7.072 5.605 -15.464 1.00 0.00 H new ATOM 0 HB2 SER A 68 -8.335 6.475 -12.846 1.00 0.00 H new ATOM 0 HB3 SER A 68 -8.430 7.284 -14.398 1.00 0.00 H new ATOM 0 HG SER A 68 -10.335 6.039 -13.939 1.00 0.00 H new ATOM 1033 N GLN A 69 -5.465 7.361 -14.454 1.00 0.00 N ATOM 1034 CA GLN A 69 -4.233 8.050 -14.086 1.00 0.00 C ATOM 1035 C GLN A 69 -4.373 9.541 -14.354 1.00 0.00 C ATOM 1036 O GLN A 69 -5.148 9.949 -15.221 1.00 0.00 O ATOM 1037 CB GLN A 69 -3.051 7.482 -14.881 1.00 0.00 C ATOM 1038 CG GLN A 69 -1.704 8.073 -14.494 1.00 0.00 C ATOM 1039 CD GLN A 69 -0.581 7.609 -15.400 1.00 0.00 C ATOM 1040 OE1 GLN A 69 -0.293 8.233 -16.421 1.00 0.00 O ATOM 1041 NE2 GLN A 69 0.066 6.513 -15.034 1.00 0.00 N ATOM 0 H GLN A 69 -5.962 7.779 -15.241 1.00 0.00 H new ATOM 0 HA GLN A 69 -4.047 7.896 -13.023 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -3.017 6.402 -14.739 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -3.222 7.659 -15.943 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -1.766 9.161 -14.527 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -1.473 7.798 -13.465 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -0.202 6.023 -14.180 1.00 0.00 H new ATOM 0 HE22 GLN A 69 0.833 6.158 -15.606 1.00 0.00 H new ATOM 1050 N SER A 70 -3.638 10.349 -13.610 1.00 0.00 N ATOM 1051 CA SER A 70 -3.681 11.782 -13.792 1.00 0.00 C ATOM 1052 C SER A 70 -2.424 12.441 -13.252 1.00 0.00 C ATOM 1053 O SER A 70 -1.962 12.117 -12.156 1.00 0.00 O ATOM 1054 CB SER A 70 -4.900 12.362 -13.085 1.00 0.00 C ATOM 1055 OG SER A 70 -5.011 13.755 -13.320 1.00 0.00 O ATOM 0 H SER A 70 -3.005 10.033 -12.875 1.00 0.00 H new ATOM 0 HA SER A 70 -3.746 11.982 -14.861 1.00 0.00 H new ATOM 0 HB2 SER A 70 -5.801 11.858 -13.435 1.00 0.00 H new ATOM 0 HB3 SER A 70 -4.826 12.176 -12.014 1.00 0.00 H new ATOM 0 HG SER A 70 -5.923 14.049 -13.117 1.00 0.00 H new ATOM 1061 N THR A 71 -1.880 13.368 -14.024 1.00 0.00 N ATOM 1062 CA THR A 71 -0.775 14.187 -13.569 1.00 0.00 C ATOM 1063 C THR A 71 -1.280 15.315 -12.672 1.00 0.00 C ATOM 1064 O THR A 71 -0.496 15.989 -12.001 1.00 0.00 O ATOM 1065 CB THR A 71 -0.003 14.767 -14.765 1.00 0.00 C ATOM 1066 OG1 THR A 71 -0.908 15.000 -15.853 1.00 0.00 O ATOM 1067 CG2 THR A 71 1.108 13.818 -15.200 1.00 0.00 C ATOM 0 H THR A 71 -2.190 13.571 -14.974 1.00 0.00 H new ATOM 0 HA THR A 71 -0.099 13.557 -12.991 1.00 0.00 H new ATOM 0 HB THR A 71 0.453 15.711 -14.465 1.00 0.00 H new ATOM 0 HG1 THR A 71 -1.407 15.828 -15.692 1.00 0.00 H new ATOM 0 HG21 THR A 71 1.642 14.247 -16.048 1.00 0.00 H new ATOM 0 HG22 THR A 71 1.802 13.667 -14.373 1.00 0.00 H new ATOM 0 HG23 THR A 71 0.676 12.861 -15.491 1.00 0.00 H new ATOM 1075 N ASP A 72 -2.603 15.507 -12.665 1.00 0.00 N ATOM 1076 CA ASP A 72 -3.241 16.495 -11.798 1.00 0.00 C ATOM 1077 C ASP A 72 -3.077 16.093 -10.339 1.00 0.00 C ATOM 1078 O ASP A 72 -2.833 16.935 -9.474 1.00 0.00 O ATOM 1079 CB ASP A 72 -4.727 16.652 -12.151 1.00 0.00 C ATOM 1080 CG ASP A 72 -5.472 17.576 -11.198 1.00 0.00 C ATOM 1081 OD1 ASP A 72 -5.168 18.788 -11.167 1.00 0.00 O ATOM 1082 OD2 ASP A 72 -6.373 17.097 -10.487 1.00 0.00 O ATOM 0 H ASP A 72 -3.253 14.987 -13.254 1.00 0.00 H new ATOM 0 HA ASP A 72 -2.754 17.458 -11.953 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -4.814 17.040 -13.166 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -5.202 15.671 -12.142 1.00 0.00 H new ATOM 1087 N GLY A 73 -3.192 14.798 -10.069 1.00 0.00 N ATOM 1088 CA GLY A 73 -2.914 14.307 -8.734 1.00 0.00 C ATOM 1089 C GLY A 73 -3.898 13.265 -8.237 1.00 0.00 C ATOM 1090 O GLY A 73 -4.248 13.262 -7.056 1.00 0.00 O ATOM 0 H GLY A 73 -3.470 14.086 -10.744 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -1.911 13.880 -8.718 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -2.914 15.149 -8.042 1.00 0.00 H new ATOM 1094 N SER A 74 -4.366 12.393 -9.119 1.00 0.00 N ATOM 1095 CA SER A 74 -5.181 11.271 -8.711 1.00 0.00 C ATOM 1096 C SER A 74 -4.981 10.089 -9.651 1.00 0.00 C ATOM 1097 O SER A 74 -4.926 10.245 -10.871 1.00 0.00 O ATOM 1098 CB SER A 74 -6.646 11.657 -8.687 1.00 0.00 C ATOM 1099 OG SER A 74 -6.860 12.835 -7.928 1.00 0.00 O ATOM 0 H SER A 74 -4.192 12.446 -10.123 1.00 0.00 H new ATOM 0 HA SER A 74 -4.872 10.981 -7.707 1.00 0.00 H new ATOM 0 HB2 SER A 74 -7.000 11.810 -9.707 1.00 0.00 H new ATOM 0 HB3 SER A 74 -7.232 10.840 -8.266 1.00 0.00 H new ATOM 0 HG SER A 74 -7.682 12.741 -7.403 1.00 0.00 H new ATOM 1105 N ILE A 75 -4.859 8.918 -9.063 1.00 0.00 N ATOM 1106 CA ILE A 75 -4.672 7.676 -9.801 1.00 0.00 C ATOM 1107 C ILE A 75 -5.563 6.579 -9.213 1.00 0.00 C ATOM 1108 O ILE A 75 -5.682 6.465 -7.992 1.00 0.00 O ATOM 1109 CB ILE A 75 -3.195 7.206 -9.755 1.00 0.00 C ATOM 1110 CG1 ILE A 75 -2.253 8.317 -10.236 1.00 0.00 C ATOM 1111 CG2 ILE A 75 -3.004 5.943 -10.585 1.00 0.00 C ATOM 1112 CD1 ILE A 75 -0.814 7.875 -10.388 1.00 0.00 C ATOM 0 H ILE A 75 -4.886 8.795 -8.051 1.00 0.00 H new ATOM 0 HA ILE A 75 -4.945 7.865 -10.839 1.00 0.00 H new ATOM 0 HB ILE A 75 -2.947 6.975 -8.719 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -2.611 8.694 -11.194 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -2.296 9.147 -9.531 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -1.961 5.631 -10.538 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -3.638 5.149 -10.190 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -3.277 6.144 -11.621 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -0.210 8.715 -10.731 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -0.437 7.526 -9.427 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.757 7.066 -11.116 1.00 0.00 H new ATOM 1124 N GLU A 76 -6.199 5.790 -10.070 1.00 0.00 N ATOM 1125 CA GLU A 76 -6.975 4.648 -9.609 1.00 0.00 C ATOM 1126 C GLU A 76 -6.316 3.366 -10.096 1.00 0.00 C ATOM 1127 O GLU A 76 -6.011 3.232 -11.285 1.00 0.00 O ATOM 1128 CB GLU A 76 -8.425 4.715 -10.104 1.00 0.00 C ATOM 1129 CG GLU A 76 -9.370 3.862 -9.266 1.00 0.00 C ATOM 1130 CD GLU A 76 -10.783 3.812 -9.809 1.00 0.00 C ATOM 1131 OE1 GLU A 76 -11.400 4.881 -9.993 1.00 0.00 O ATOM 1132 OE2 GLU A 76 -11.290 2.697 -10.040 1.00 0.00 O ATOM 0 H GLU A 76 -6.193 5.919 -11.082 1.00 0.00 H new ATOM 0 HA GLU A 76 -6.999 4.664 -8.519 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -8.764 5.751 -10.086 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -8.466 4.384 -11.142 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -8.976 2.847 -9.208 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -9.394 4.253 -8.249 1.00 0.00 H new ATOM 1139 N ILE A 77 -6.088 2.432 -9.185 1.00 0.00 N ATOM 1140 CA ILE A 77 -5.387 1.197 -9.514 1.00 0.00 C ATOM 1141 C ILE A 77 -6.145 -0.014 -8.986 1.00 0.00 C ATOM 1142 O ILE A 77 -6.941 0.103 -8.055 1.00 0.00 O ATOM 1143 CB ILE A 77 -3.957 1.183 -8.927 1.00 0.00 C ATOM 1144 CG1 ILE A 77 -4.001 1.410 -7.411 1.00 0.00 C ATOM 1145 CG2 ILE A 77 -3.095 2.238 -9.603 1.00 0.00 C ATOM 1146 CD1 ILE A 77 -2.649 1.319 -6.736 1.00 0.00 C ATOM 0 H ILE A 77 -6.378 2.505 -8.210 1.00 0.00 H new ATOM 0 HA ILE A 77 -5.326 1.148 -10.601 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.513 0.206 -9.116 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -4.429 2.393 -7.213 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.670 0.675 -6.963 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -2.091 2.215 -9.178 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -3.041 2.033 -10.672 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -3.534 3.223 -9.444 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.764 1.491 -5.666 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.226 0.328 -6.901 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -1.982 2.072 -7.155 1.00 0.00 H new ATOM 1158 N GLN A 78 -5.896 -1.169 -9.584 1.00 0.00 N ATOM 1159 CA GLN A 78 -6.476 -2.416 -9.111 1.00 0.00 C ATOM 1160 C GLN A 78 -5.369 -3.419 -8.827 1.00 0.00 C ATOM 1161 O GLN A 78 -4.336 -3.421 -9.501 1.00 0.00 O ATOM 1162 CB GLN A 78 -7.459 -2.996 -10.137 1.00 0.00 C ATOM 1163 CG GLN A 78 -8.142 -4.270 -9.660 1.00 0.00 C ATOM 1164 CD GLN A 78 -8.902 -4.060 -8.366 1.00 0.00 C ATOM 1165 OE1 GLN A 78 -8.338 -4.181 -7.284 1.00 0.00 O ATOM 1166 NE2 GLN A 78 -10.194 -3.784 -8.460 1.00 0.00 N ATOM 0 H GLN A 78 -5.294 -1.268 -10.401 1.00 0.00 H new ATOM 0 HA GLN A 78 -7.029 -2.211 -8.194 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -8.218 -2.248 -10.366 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -6.926 -3.203 -11.065 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -8.828 -4.623 -10.430 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -7.394 -5.050 -9.518 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -10.630 -3.690 -9.377 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -10.753 -3.665 -7.615 1.00 0.00 H new ATOM 1175 N TYR A 79 -5.586 -4.262 -7.834 1.00 0.00 N ATOM 1176 CA TYR A 79 -4.603 -5.255 -7.449 1.00 0.00 C ATOM 1177 C TYR A 79 -4.926 -6.587 -8.105 1.00 0.00 C ATOM 1178 O TYR A 79 -6.085 -6.887 -8.386 1.00 0.00 O ATOM 1179 CB TYR A 79 -4.572 -5.422 -5.930 1.00 0.00 C ATOM 1180 CG TYR A 79 -4.252 -4.149 -5.173 1.00 0.00 C ATOM 1181 CD1 TYR A 79 -2.937 -3.747 -4.964 1.00 0.00 C ATOM 1182 CD2 TYR A 79 -5.269 -3.354 -4.660 1.00 0.00 C ATOM 1183 CE1 TYR A 79 -2.646 -2.589 -4.264 1.00 0.00 C ATOM 1184 CE2 TYR A 79 -4.987 -2.195 -3.963 1.00 0.00 C ATOM 1185 CZ TYR A 79 -3.675 -1.817 -3.766 1.00 0.00 C ATOM 1186 OH TYR A 79 -3.393 -0.665 -3.068 1.00 0.00 O ATOM 0 H TYR A 79 -6.440 -4.277 -7.277 1.00 0.00 H new ATOM 0 HA TYR A 79 -3.622 -4.916 -7.783 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -5.540 -5.796 -5.597 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -3.832 -6.180 -5.674 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -2.129 -4.349 -5.354 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -6.298 -3.647 -4.809 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -1.619 -2.292 -4.109 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -5.791 -1.587 -3.574 1.00 0.00 H new ATOM 0 HH TYR A 79 -3.345 0.091 -3.690 1.00 0.00 H new ATOM 1196 N LEU A 80 -3.899 -7.378 -8.352 1.00 0.00 N ATOM 1197 CA LEU A 80 -4.070 -8.670 -8.990 1.00 0.00 C ATOM 1198 C LEU A 80 -3.857 -9.788 -7.977 1.00 0.00 C ATOM 1199 O LEU A 80 -3.178 -9.602 -6.962 1.00 0.00 O ATOM 1200 CB LEU A 80 -3.089 -8.800 -10.157 1.00 0.00 C ATOM 1201 CG LEU A 80 -3.165 -7.668 -11.187 1.00 0.00 C ATOM 1202 CD1 LEU A 80 -1.990 -7.739 -12.143 1.00 0.00 C ATOM 1203 CD2 LEU A 80 -4.473 -7.725 -11.961 1.00 0.00 C ATOM 0 H LEU A 80 -2.933 -7.147 -8.119 1.00 0.00 H new ATOM 0 HA LEU A 80 -5.086 -8.751 -9.376 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -2.075 -8.843 -9.759 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -3.272 -9.747 -10.664 1.00 0.00 H new ATOM 0 HG LEU A 80 -3.124 -6.721 -10.649 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -2.061 -6.928 -12.867 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -1.059 -7.646 -11.583 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -2.004 -8.695 -12.667 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -4.503 -6.911 -12.686 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -4.545 -8.679 -12.483 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -5.310 -7.626 -11.269 1.00 0.00 H new ATOM 1215 N GLY A 81 -4.433 -10.949 -8.248 1.00 0.00 N ATOM 1216 CA GLY A 81 -4.397 -12.030 -7.287 1.00 0.00 C ATOM 1217 C GLY A 81 -5.635 -12.010 -6.419 1.00 0.00 C ATOM 1218 O GLY A 81 -6.663 -11.494 -6.842 1.00 0.00 O ATOM 0 H GLY A 81 -4.925 -11.162 -9.116 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -4.327 -12.985 -7.808 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -3.507 -11.940 -6.664 1.00 0.00 H new ATOM 1222 N PRO A 82 -5.577 -12.549 -5.193 1.00 0.00 N ATOM 1223 CA PRO A 82 -6.721 -12.544 -4.265 1.00 0.00 C ATOM 1224 C PRO A 82 -7.145 -11.127 -3.859 1.00 0.00 C ATOM 1225 O PRO A 82 -8.140 -10.938 -3.156 1.00 0.00 O ATOM 1226 CB PRO A 82 -6.199 -13.311 -3.043 1.00 0.00 C ATOM 1227 CG PRO A 82 -5.018 -14.070 -3.535 1.00 0.00 C ATOM 1228 CD PRO A 82 -4.408 -13.223 -4.614 1.00 0.00 C ATOM 0 HA PRO A 82 -7.607 -12.987 -4.720 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -5.922 -12.629 -2.239 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -6.960 -13.982 -2.644 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -4.306 -14.250 -2.730 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -5.314 -15.045 -3.923 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -3.688 -12.511 -4.211 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -3.881 -13.826 -5.353 1.00 0.00 H new ATOM 1236 N TYR A 83 -6.382 -10.136 -4.307 1.00 0.00 N ATOM 1237 CA TYR A 83 -6.656 -8.743 -3.981 1.00 0.00 C ATOM 1238 C TYR A 83 -7.422 -8.062 -5.110 1.00 0.00 C ATOM 1239 O TYR A 83 -7.572 -6.846 -5.116 1.00 0.00 O ATOM 1240 CB TYR A 83 -5.350 -7.991 -3.714 1.00 0.00 C ATOM 1241 CG TYR A 83 -4.523 -8.581 -2.598 1.00 0.00 C ATOM 1242 CD1 TYR A 83 -4.942 -8.494 -1.279 1.00 0.00 C ATOM 1243 CD2 TYR A 83 -3.311 -9.208 -2.861 1.00 0.00 C ATOM 1244 CE1 TYR A 83 -4.184 -9.023 -0.252 1.00 0.00 C ATOM 1245 CE2 TYR A 83 -2.550 -9.741 -1.840 1.00 0.00 C ATOM 1246 CZ TYR A 83 -2.989 -9.642 -0.538 1.00 0.00 C ATOM 1247 OH TYR A 83 -2.226 -10.164 0.482 1.00 0.00 O ATOM 0 H TYR A 83 -5.564 -10.274 -4.901 1.00 0.00 H new ATOM 0 HA TYR A 83 -7.270 -8.722 -3.081 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -4.755 -7.980 -4.627 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -5.582 -6.954 -3.472 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -5.877 -8.004 -1.050 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -2.959 -9.279 -3.880 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -4.528 -8.951 0.769 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -1.615 -10.233 -2.061 1.00 0.00 H new ATOM 0 HH TYR A 83 -1.414 -10.567 0.110 1.00 0.00 H new ATOM 1257 N TYR A 84 -7.911 -8.859 -6.055 1.00 0.00 N ATOM 1258 CA TYR A 84 -8.675 -8.342 -7.184 1.00 0.00 C ATOM 1259 C TYR A 84 -10.006 -7.724 -6.712 1.00 0.00 C ATOM 1260 O TYR A 84 -10.373 -7.898 -5.548 1.00 0.00 O ATOM 1261 CB TYR A 84 -8.843 -9.448 -8.252 1.00 0.00 C ATOM 1262 CG TYR A 84 -9.469 -10.746 -7.774 1.00 0.00 C ATOM 1263 CD1 TYR A 84 -10.382 -10.783 -6.728 1.00 0.00 C ATOM 1264 CD2 TYR A 84 -9.135 -11.947 -8.390 1.00 0.00 C ATOM 1265 CE1 TYR A 84 -10.933 -11.973 -6.303 1.00 0.00 C ATOM 1266 CE2 TYR A 84 -9.685 -13.141 -7.972 1.00 0.00 C ATOM 1267 CZ TYR A 84 -10.584 -13.149 -6.931 1.00 0.00 C ATOM 1268 OH TYR A 84 -11.124 -14.341 -6.507 1.00 0.00 O ATOM 0 H TYR A 84 -7.790 -9.872 -6.060 1.00 0.00 H new ATOM 0 HA TYR A 84 -8.129 -7.527 -7.659 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -9.452 -9.051 -9.064 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -7.862 -9.673 -8.670 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -10.665 -9.863 -6.239 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -8.432 -11.945 -9.210 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -11.635 -11.984 -5.482 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -9.411 -14.065 -8.460 1.00 0.00 H new ATOM 0 HH TYR A 84 -10.774 -15.073 -7.057 1.00 0.00 H new ATOM 1278 N PRO A 85 -10.799 -7.137 -7.647 1.00 0.00 N ATOM 1279 CA PRO A 85 -11.706 -6.001 -7.486 1.00 0.00 C ATOM 1280 C PRO A 85 -11.796 -5.207 -6.157 1.00 0.00 C ATOM 1281 O PRO A 85 -12.556 -4.238 -6.092 1.00 0.00 O ATOM 1282 CB PRO A 85 -13.014 -6.621 -7.920 1.00 0.00 C ATOM 1283 CG PRO A 85 -12.603 -7.559 -9.031 1.00 0.00 C ATOM 1284 CD PRO A 85 -11.082 -7.646 -8.990 1.00 0.00 C ATOM 0 HA PRO A 85 -11.326 -5.157 -8.061 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -13.497 -7.154 -7.102 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -13.720 -5.868 -8.270 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -13.051 -8.543 -8.892 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -12.944 -7.187 -9.997 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -10.725 -8.667 -9.126 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -10.615 -7.039 -9.766 1.00 0.00 H new ATOM 1292 N LEU A 86 -11.063 -5.560 -5.121 1.00 0.00 N ATOM 1293 CA LEU A 86 -10.943 -4.680 -3.968 1.00 0.00 C ATOM 1294 C LEU A 86 -9.747 -3.767 -4.194 1.00 0.00 C ATOM 1295 O LEU A 86 -8.598 -4.176 -4.033 1.00 0.00 O ATOM 1296 CB LEU A 86 -10.780 -5.479 -2.669 1.00 0.00 C ATOM 1297 CG LEU A 86 -10.738 -4.637 -1.391 1.00 0.00 C ATOM 1298 CD1 LEU A 86 -12.034 -3.861 -1.217 1.00 0.00 C ATOM 1299 CD2 LEU A 86 -10.482 -5.516 -0.178 1.00 0.00 C ATOM 0 H LEU A 86 -10.546 -6.437 -5.049 1.00 0.00 H new ATOM 0 HA LEU A 86 -11.853 -4.089 -3.863 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -11.604 -6.189 -2.591 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -9.861 -6.062 -2.732 1.00 0.00 H new ATOM 0 HG LEU A 86 -9.918 -3.925 -1.481 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -11.984 -3.269 -0.303 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -12.179 -3.199 -2.071 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -12.870 -4.558 -1.152 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -10.456 -4.898 0.720 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -11.280 -6.253 -0.088 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -9.527 -6.028 -0.294 1.00 0.00 H new ATOM 1311 N LYS A 87 -10.027 -2.529 -4.564 1.00 0.00 N ATOM 1312 CA LYS A 87 -8.996 -1.645 -5.087 1.00 0.00 C ATOM 1313 C LYS A 87 -8.748 -0.449 -4.184 1.00 0.00 C ATOM 1314 O LYS A 87 -9.405 -0.274 -3.153 1.00 0.00 O ATOM 1315 CB LYS A 87 -9.378 -1.173 -6.492 1.00 0.00 C ATOM 1316 CG LYS A 87 -10.729 -0.482 -6.561 1.00 0.00 C ATOM 1317 CD LYS A 87 -11.195 -0.315 -7.996 1.00 0.00 C ATOM 1318 CE LYS A 87 -12.567 0.332 -8.065 1.00 0.00 C ATOM 1319 NZ LYS A 87 -12.526 1.775 -7.712 1.00 0.00 N ATOM 0 H LYS A 87 -10.957 -2.113 -4.513 1.00 0.00 H new ATOM 0 HA LYS A 87 -8.068 -2.215 -5.129 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -8.612 -0.489 -6.856 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -9.385 -2.031 -7.164 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -11.465 -1.062 -6.004 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -10.664 0.495 -6.082 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -10.476 0.294 -8.544 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -11.226 -1.289 -8.485 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.971 0.217 -9.071 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -13.246 -0.187 -7.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.454 2.069 -7.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -11.800 1.934 -6.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -12.296 2.333 -8.559 1.00 0.00 H new ATOM 1333 N SER A 88 -7.799 0.375 -4.598 1.00 0.00 N ATOM 1334 CA SER A 88 -7.381 1.521 -3.835 1.00 0.00 C ATOM 1335 C SER A 88 -7.285 2.760 -4.715 1.00 0.00 C ATOM 1336 O SER A 88 -7.285 2.670 -5.946 1.00 0.00 O ATOM 1337 CB SER A 88 -6.030 1.235 -3.198 1.00 0.00 C ATOM 1338 OG SER A 88 -6.171 0.606 -1.944 1.00 0.00 O ATOM 0 H SER A 88 -7.299 0.260 -5.480 1.00 0.00 H new ATOM 0 HA SER A 88 -8.124 1.713 -3.060 1.00 0.00 H new ATOM 0 HB2 SER A 88 -5.442 0.600 -3.860 1.00 0.00 H new ATOM 0 HB3 SER A 88 -5.479 2.168 -3.078 1.00 0.00 H new ATOM 0 HG SER A 88 -5.417 -0.003 -1.797 1.00 0.00 H new ATOM 1344 N THR A 89 -7.201 3.911 -4.076 1.00 0.00 N ATOM 1345 CA THR A 89 -7.085 5.170 -4.781 1.00 0.00 C ATOM 1346 C THR A 89 -5.840 5.923 -4.325 1.00 0.00 C ATOM 1347 O THR A 89 -5.482 5.899 -3.150 1.00 0.00 O ATOM 1348 CB THR A 89 -8.317 6.057 -4.551 1.00 0.00 C ATOM 1349 OG1 THR A 89 -9.519 5.274 -4.664 1.00 0.00 O ATOM 1350 CG2 THR A 89 -8.361 7.199 -5.556 1.00 0.00 C ATOM 0 H THR A 89 -7.211 3.998 -3.060 1.00 0.00 H new ATOM 0 HA THR A 89 -7.010 4.941 -5.844 1.00 0.00 H new ATOM 0 HB THR A 89 -8.247 6.476 -3.547 1.00 0.00 H new ATOM 0 HG1 THR A 89 -10.299 5.848 -4.514 1.00 0.00 H new ATOM 0 HG21 THR A 89 -9.243 7.812 -5.372 1.00 0.00 H new ATOM 0 HG22 THR A 89 -7.465 7.811 -5.451 1.00 0.00 H new ATOM 0 HG23 THR A 89 -8.406 6.793 -6.566 1.00 0.00 H new ATOM 1358 N LEU A 90 -5.190 6.574 -5.264 1.00 0.00 N ATOM 1359 CA LEU A 90 -3.990 7.354 -4.992 1.00 0.00 C ATOM 1360 C LEU A 90 -4.249 8.812 -5.332 1.00 0.00 C ATOM 1361 O LEU A 90 -4.658 9.129 -6.444 1.00 0.00 O ATOM 1362 CB LEU A 90 -2.809 6.831 -5.819 1.00 0.00 C ATOM 1363 CG LEU A 90 -2.400 5.383 -5.541 1.00 0.00 C ATOM 1364 CD1 LEU A 90 -1.296 4.953 -6.497 1.00 0.00 C ATOM 1365 CD2 LEU A 90 -1.948 5.226 -4.094 1.00 0.00 C ATOM 0 H LEU A 90 -5.475 6.581 -6.243 1.00 0.00 H new ATOM 0 HA LEU A 90 -3.741 7.261 -3.935 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -3.059 6.923 -6.876 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -1.948 7.475 -5.638 1.00 0.00 H new ATOM 0 HG LEU A 90 -3.265 4.740 -5.701 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -1.015 3.921 -6.288 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -1.653 5.031 -7.524 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -0.428 5.599 -6.365 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -1.661 4.190 -3.913 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -1.094 5.877 -3.907 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.765 5.498 -3.426 1.00 0.00 H new ATOM 1377 N LYS A 91 -4.036 9.698 -4.380 1.00 0.00 N ATOM 1378 CA LYS A 91 -4.296 11.110 -4.598 1.00 0.00 C ATOM 1379 C LYS A 91 -3.184 11.965 -4.013 1.00 0.00 C ATOM 1380 O LYS A 91 -2.478 11.545 -3.094 1.00 0.00 O ATOM 1381 CB LYS A 91 -5.648 11.492 -4.000 1.00 0.00 C ATOM 1382 CG LYS A 91 -6.831 10.923 -4.771 1.00 0.00 C ATOM 1383 CD LYS A 91 -8.043 10.711 -3.880 1.00 0.00 C ATOM 1384 CE LYS A 91 -8.489 11.994 -3.206 1.00 0.00 C ATOM 1385 NZ LYS A 91 -9.676 11.767 -2.346 1.00 0.00 N ATOM 0 H LYS A 91 -3.685 9.468 -3.450 1.00 0.00 H new ATOM 0 HA LYS A 91 -4.325 11.295 -5.672 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -5.693 11.142 -2.969 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -5.731 12.578 -3.971 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -7.093 11.600 -5.584 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -6.545 9.974 -5.225 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -8.864 10.311 -4.475 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -7.807 9.966 -3.120 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -7.673 12.394 -2.605 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -8.724 12.742 -3.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -9.718 12.502 -1.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -10.538 11.808 -2.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -9.606 10.832 -1.897 1.00 0.00 H new ATOM 1399 N ARG A 92 -3.029 13.159 -4.567 1.00 0.00 N ATOM 1400 CA ARG A 92 -1.971 14.070 -4.164 1.00 0.00 C ATOM 1401 C ARG A 92 -2.157 14.530 -2.721 1.00 0.00 C ATOM 1402 O ARG A 92 -3.283 14.728 -2.259 1.00 0.00 O ATOM 1403 CB ARG A 92 -1.954 15.284 -5.096 1.00 0.00 C ATOM 1404 CG ARG A 92 -3.189 16.154 -4.969 1.00 0.00 C ATOM 1405 CD ARG A 92 -3.212 17.269 -6.004 1.00 0.00 C ATOM 1406 NE ARG A 92 -4.382 18.140 -5.846 1.00 0.00 N ATOM 1407 CZ ARG A 92 -5.115 18.599 -6.862 1.00 0.00 C ATOM 1408 NH1 ARG A 92 -4.827 18.243 -8.105 1.00 0.00 N ATOM 1409 NH2 ARG A 92 -6.142 19.412 -6.637 1.00 0.00 N ATOM 0 H ARG A 92 -3.632 13.521 -5.306 1.00 0.00 H new ATOM 0 HA ARG A 92 -1.021 13.540 -4.231 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -1.071 15.886 -4.882 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -1.864 14.941 -6.127 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -4.080 15.537 -5.082 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -3.226 16.587 -3.969 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -2.303 17.864 -5.917 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -3.215 16.836 -7.004 1.00 0.00 H new ATOM 0 HE ARG A 92 -4.652 18.412 -4.901 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -4.043 17.616 -8.287 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -5.389 18.595 -8.880 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -6.374 19.689 -5.683 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -6.698 19.759 -7.418 1.00 0.00 H new ATOM 1423 N GLY A 93 -1.049 14.692 -2.016 1.00 0.00 N ATOM 1424 CA GLY A 93 -1.087 15.265 -0.697 1.00 0.00 C ATOM 1425 C GLY A 93 -0.296 16.550 -0.657 1.00 0.00 C ATOM 1426 O GLY A 93 0.825 16.618 -1.171 1.00 0.00 O ATOM 0 H GLY A 93 -0.118 14.433 -2.342 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -2.120 15.458 -0.407 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -0.680 14.558 0.025 1.00 0.00 H new ATOM 1430 N GLU A 94 -0.879 17.576 -0.076 1.00 0.00 N ATOM 1431 CA GLU A 94 -0.241 18.873 0.005 1.00 0.00 C ATOM 1432 C GLU A 94 0.964 18.821 0.944 1.00 0.00 C ATOM 1433 O GLU A 94 1.073 17.912 1.771 1.00 0.00 O ATOM 1434 CB GLU A 94 -1.272 19.903 0.453 1.00 0.00 C ATOM 1435 CG GLU A 94 -2.404 20.065 -0.553 1.00 0.00 C ATOM 1436 CD GLU A 94 -3.510 20.970 -0.063 1.00 0.00 C ATOM 1437 OE1 GLU A 94 -3.291 22.196 0.016 1.00 0.00 O ATOM 1438 OE2 GLU A 94 -4.609 20.461 0.243 1.00 0.00 O ATOM 0 H GLU A 94 -1.804 17.536 0.352 1.00 0.00 H new ATOM 0 HA GLU A 94 0.137 19.165 -0.975 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -1.685 19.604 1.416 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -0.781 20.865 0.601 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -2.001 20.466 -1.483 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -2.821 19.084 -0.783 1.00 0.00 H new ATOM 1445 N ASN A 95 1.878 19.780 0.768 1.00 0.00 N ATOM 1446 CA ASN A 95 3.160 19.829 1.488 1.00 0.00 C ATOM 1447 C ASN A 95 4.139 18.798 0.924 1.00 0.00 C ATOM 1448 O ASN A 95 5.318 18.783 1.284 1.00 0.00 O ATOM 1449 CB ASN A 95 2.993 19.624 3.002 1.00 0.00 C ATOM 1450 CG ASN A 95 2.150 20.696 3.677 1.00 0.00 C ATOM 1451 OD1 ASN A 95 1.504 20.435 4.693 1.00 0.00 O ATOM 1452 ND2 ASN A 95 2.149 21.905 3.131 1.00 0.00 N ATOM 0 H ASN A 95 1.750 20.553 0.115 1.00 0.00 H new ATOM 0 HA ASN A 95 3.565 20.830 1.337 1.00 0.00 H new ATOM 0 HB2 ASN A 95 2.536 18.650 3.179 1.00 0.00 H new ATOM 0 HB3 ASN A 95 3.978 19.603 3.467 1.00 0.00 H new ATOM 0 HD21 ASN A 95 1.601 22.655 3.553 1.00 0.00 H new ATOM 0 HD22 ASN A 95 2.696 22.085 2.289 1.00 0.00 H new ATOM 1459 N GLY A 96 3.653 17.953 0.025 1.00 0.00 N ATOM 1460 CA GLY A 96 4.496 16.937 -0.567 1.00 0.00 C ATOM 1461 C GLY A 96 4.252 15.577 0.044 1.00 0.00 C ATOM 1462 O GLY A 96 5.180 14.926 0.522 1.00 0.00 O ATOM 0 H GLY A 96 2.688 17.954 -0.305 1.00 0.00 H new ATOM 0 HA2 GLY A 96 4.311 16.891 -1.640 1.00 0.00 H new ATOM 0 HA3 GLY A 96 5.543 17.212 -0.436 1.00 0.00 H new ATOM 1466 N THR A 97 3.003 15.148 0.031 1.00 0.00 N ATOM 1467 CA THR A 97 2.633 13.869 0.603 1.00 0.00 C ATOM 1468 C THR A 97 1.773 13.061 -0.360 1.00 0.00 C ATOM 1469 O THR A 97 1.409 13.542 -1.436 1.00 0.00 O ATOM 1470 CB THR A 97 1.886 14.044 1.941 1.00 0.00 C ATOM 1471 OG1 THR A 97 0.883 15.062 1.818 1.00 0.00 O ATOM 1472 CG2 THR A 97 2.844 14.406 3.066 1.00 0.00 C ATOM 0 H THR A 97 2.225 15.671 -0.372 1.00 0.00 H new ATOM 0 HA THR A 97 3.559 13.326 0.789 1.00 0.00 H new ATOM 0 HB THR A 97 1.413 13.093 2.185 1.00 0.00 H new ATOM 0 HG1 THR A 97 1.310 15.944 1.825 1.00 0.00 H new ATOM 0 HG21 THR A 97 2.286 14.522 3.995 1.00 0.00 H new ATOM 0 HG22 THR A 97 3.583 13.614 3.183 1.00 0.00 H new ATOM 0 HG23 THR A 97 3.349 15.342 2.827 1.00 0.00 H new ATOM 1480 N LEU A 98 1.479 11.828 0.018 1.00 0.00 N ATOM 1481 CA LEU A 98 0.622 10.970 -0.778 1.00 0.00 C ATOM 1482 C LEU A 98 -0.577 10.529 0.046 1.00 0.00 C ATOM 1483 O LEU A 98 -0.438 10.135 1.207 1.00 0.00 O ATOM 1484 CB LEU A 98 1.394 9.743 -1.281 1.00 0.00 C ATOM 1485 CG LEU A 98 0.585 8.755 -2.131 1.00 0.00 C ATOM 1486 CD1 LEU A 98 0.104 9.423 -3.415 1.00 0.00 C ATOM 1487 CD2 LEU A 98 1.422 7.520 -2.445 1.00 0.00 C ATOM 0 H LEU A 98 1.824 11.398 0.876 1.00 0.00 H new ATOM 0 HA LEU A 98 0.276 11.535 -1.643 1.00 0.00 H new ATOM 0 HB2 LEU A 98 2.246 10.087 -1.868 1.00 0.00 H new ATOM 0 HB3 LEU A 98 1.795 9.210 -0.419 1.00 0.00 H new ATOM 0 HG LEU A 98 -0.291 8.442 -1.563 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -0.468 8.707 -4.005 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -0.528 10.276 -3.167 1.00 0.00 H new ATOM 0 HD13 LEU A 98 0.964 9.764 -3.992 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.836 6.827 -3.049 1.00 0.00 H new ATOM 0 HD22 LEU A 98 2.315 7.816 -2.996 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.715 7.033 -1.515 1.00 0.00 H new ATOM 1499 N ILE A 99 -1.754 10.628 -0.544 1.00 0.00 N ATOM 1500 CA ILE A 99 -2.964 10.158 0.099 1.00 0.00 C ATOM 1501 C ILE A 99 -3.415 8.852 -0.539 1.00 0.00 C ATOM 1502 O ILE A 99 -3.853 8.821 -1.693 1.00 0.00 O ATOM 1503 CB ILE A 99 -4.098 11.205 0.031 1.00 0.00 C ATOM 1504 CG1 ILE A 99 -3.654 12.499 0.724 1.00 0.00 C ATOM 1505 CG2 ILE A 99 -5.367 10.659 0.673 1.00 0.00 C ATOM 1506 CD1 ILE A 99 -4.695 13.596 0.713 1.00 0.00 C ATOM 0 H ILE A 99 -1.896 11.031 -1.470 1.00 0.00 H new ATOM 0 HA ILE A 99 -2.738 9.991 1.152 1.00 0.00 H new ATOM 0 HB ILE A 99 -4.315 11.424 -1.014 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -3.391 12.273 1.757 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -2.750 12.866 0.238 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -6.155 11.410 0.616 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -5.684 9.759 0.145 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -5.171 10.417 1.718 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -4.302 14.476 1.223 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -4.942 13.853 -0.317 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -5.593 13.251 1.226 1.00 0.00 H new ATOM 1518 N TRP A 100 -3.290 7.779 0.217 1.00 0.00 N ATOM 1519 CA TRP A 100 -3.652 6.460 -0.256 1.00 0.00 C ATOM 1520 C TRP A 100 -4.965 6.031 0.373 1.00 0.00 C ATOM 1521 O TRP A 100 -5.057 5.842 1.583 1.00 0.00 O ATOM 1522 CB TRP A 100 -2.539 5.458 0.077 1.00 0.00 C ATOM 1523 CG TRP A 100 -2.863 4.032 -0.270 1.00 0.00 C ATOM 1524 CD1 TRP A 100 -3.583 3.582 -1.340 1.00 0.00 C ATOM 1525 CD2 TRP A 100 -2.461 2.863 0.459 1.00 0.00 C ATOM 1526 NE1 TRP A 100 -3.657 2.212 -1.317 1.00 0.00 N ATOM 1527 CE2 TRP A 100 -2.977 1.748 -0.223 1.00 0.00 C ATOM 1528 CE3 TRP A 100 -1.719 2.654 1.626 1.00 0.00 C ATOM 1529 CZ2 TRP A 100 -2.770 0.441 0.219 1.00 0.00 C ATOM 1530 CZ3 TRP A 100 -1.515 1.359 2.063 1.00 0.00 C ATOM 1531 CH2 TRP A 100 -2.039 0.268 1.361 1.00 0.00 C ATOM 0 H TRP A 100 -2.936 7.798 1.173 1.00 0.00 H new ATOM 0 HA TRP A 100 -3.777 6.488 -1.338 1.00 0.00 H new ATOM 0 HB2 TRP A 100 -1.633 5.751 -0.453 1.00 0.00 H new ATOM 0 HB3 TRP A 100 -2.319 5.519 1.143 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -4.029 4.213 -2.095 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -4.140 1.633 -2.004 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -1.313 3.490 2.176 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -3.173 -0.403 -0.321 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -0.941 1.186 2.962 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -1.862 -0.732 1.729 1.00 0.00 H new ATOM 1542 N GLU A 101 -5.981 5.892 -0.451 1.00 0.00 N ATOM 1543 CA GLU A 101 -7.278 5.449 0.016 1.00 0.00 C ATOM 1544 C GLU A 101 -7.460 3.986 -0.302 1.00 0.00 C ATOM 1545 O GLU A 101 -7.155 3.530 -1.400 1.00 0.00 O ATOM 1546 CB GLU A 101 -8.391 6.288 -0.602 1.00 0.00 C ATOM 1547 CG GLU A 101 -8.681 7.550 0.190 1.00 0.00 C ATOM 1548 CD GLU A 101 -9.665 8.476 -0.496 1.00 0.00 C ATOM 1549 OE1 GLU A 101 -10.861 8.135 -0.563 1.00 0.00 O ATOM 1550 OE2 GLU A 101 -9.248 9.565 -0.945 1.00 0.00 O ATOM 0 H GLU A 101 -5.934 6.080 -1.452 1.00 0.00 H new ATOM 0 HA GLU A 101 -7.330 5.580 1.097 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -8.113 6.559 -1.621 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -9.299 5.688 -0.668 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -9.074 7.274 1.169 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -7.747 8.086 0.361 1.00 0.00 H new ATOM 1557 N GLN A 102 -7.946 3.257 0.669 1.00 0.00 N ATOM 1558 CA GLN A 102 -8.051 1.815 0.556 1.00 0.00 C ATOM 1559 C GLN A 102 -9.233 1.302 1.341 1.00 0.00 C ATOM 1560 O GLN A 102 -9.247 1.392 2.567 1.00 0.00 O ATOM 1561 CB GLN A 102 -6.755 1.153 1.056 1.00 0.00 C ATOM 1562 CG GLN A 102 -6.802 -0.373 1.126 1.00 0.00 C ATOM 1563 CD GLN A 102 -7.120 -0.895 2.517 1.00 0.00 C ATOM 1564 OE1 GLN A 102 -6.821 -0.245 3.522 1.00 0.00 O ATOM 1565 NE2 GLN A 102 -7.692 -2.085 2.588 1.00 0.00 N ATOM 0 H GLN A 102 -8.279 3.636 1.555 1.00 0.00 H new ATOM 0 HA GLN A 102 -8.200 1.560 -0.493 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -5.936 1.448 0.400 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -6.524 1.542 2.048 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -7.553 -0.740 0.426 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -5.842 -0.776 0.804 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -7.924 -2.591 1.733 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -7.901 -2.497 3.497 1.00 0.00 H new ATOM 1574 N ASN A 103 -10.242 0.805 0.631 1.00 0.00 N ATOM 1575 CA ASN A 103 -11.303 0.028 1.264 1.00 0.00 C ATOM 1576 C ASN A 103 -12.036 0.869 2.319 1.00 0.00 C ATOM 1577 O ASN A 103 -12.528 0.361 3.327 1.00 0.00 O ATOM 1578 CB ASN A 103 -10.641 -1.219 1.868 1.00 0.00 C ATOM 1579 CG ASN A 103 -11.586 -2.246 2.449 1.00 0.00 C ATOM 1580 OD1 ASN A 103 -12.761 -2.334 2.091 1.00 0.00 O ATOM 1581 ND2 ASN A 103 -11.040 -3.065 3.329 1.00 0.00 N ATOM 0 H ASN A 103 -10.347 0.925 -0.376 1.00 0.00 H new ATOM 0 HA ASN A 103 -12.063 -0.271 0.542 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -10.041 -1.700 1.095 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -9.954 -0.900 2.652 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -11.597 -3.812 3.745 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -10.061 -2.951 3.593 1.00 0.00 H new ATOM 1588 N GLY A 104 -12.107 2.173 2.064 1.00 0.00 N ATOM 1589 CA GLY A 104 -12.785 3.077 2.971 1.00 0.00 C ATOM 1590 C GLY A 104 -11.827 3.857 3.856 1.00 0.00 C ATOM 1591 O GLY A 104 -12.206 4.880 4.431 1.00 0.00 O ATOM 0 H GLY A 104 -11.704 2.619 1.240 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -13.390 3.777 2.394 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -13.470 2.507 3.599 1.00 0.00 H new ATOM 1595 N GLN A 105 -10.588 3.393 3.957 1.00 0.00 N ATOM 1596 CA GLN A 105 -9.614 4.023 4.838 1.00 0.00 C ATOM 1597 C GLN A 105 -8.812 5.076 4.092 1.00 0.00 C ATOM 1598 O GLN A 105 -8.388 4.857 2.958 1.00 0.00 O ATOM 1599 CB GLN A 105 -8.652 2.982 5.416 1.00 0.00 C ATOM 1600 CG GLN A 105 -9.341 1.860 6.167 1.00 0.00 C ATOM 1601 CD GLN A 105 -8.357 0.959 6.894 1.00 0.00 C ATOM 1602 OE1 GLN A 105 -7.285 1.398 7.312 1.00 0.00 O ATOM 1603 NE2 GLN A 105 -8.716 -0.304 7.057 1.00 0.00 N ATOM 0 H GLN A 105 -10.235 2.586 3.442 1.00 0.00 H new ATOM 0 HA GLN A 105 -10.165 4.497 5.650 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -8.064 2.555 4.604 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -7.953 3.481 6.088 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -10.041 2.285 6.887 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -9.926 1.264 5.467 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -9.613 -0.630 6.696 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -8.096 -0.952 7.543 1.00 0.00 H new ATOM 1612 N ARG A 106 -8.620 6.218 4.733 1.00 0.00 N ATOM 1613 CA ARG A 106 -7.789 7.273 4.186 1.00 0.00 C ATOM 1614 C ARG A 106 -6.413 7.225 4.846 1.00 0.00 C ATOM 1615 O ARG A 106 -6.284 7.440 6.051 1.00 0.00 O ATOM 1616 CB ARG A 106 -8.447 8.633 4.436 1.00 0.00 C ATOM 1617 CG ARG A 106 -7.861 9.777 3.624 1.00 0.00 C ATOM 1618 CD ARG A 106 -8.453 11.108 4.053 1.00 0.00 C ATOM 1619 NE ARG A 106 -8.271 12.149 3.040 1.00 0.00 N ATOM 1620 CZ ARG A 106 -7.869 13.392 3.304 1.00 0.00 C ATOM 1621 NH1 ARG A 106 -7.467 13.723 4.521 1.00 0.00 N ATOM 1622 NH2 ARG A 106 -7.838 14.304 2.340 1.00 0.00 N ATOM 0 H ARG A 106 -9.033 6.437 5.640 1.00 0.00 H new ATOM 0 HA ARG A 106 -7.677 7.130 3.111 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -9.511 8.554 4.213 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -8.361 8.875 5.495 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -6.778 9.799 3.749 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -8.056 9.613 2.564 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -9.517 10.982 4.254 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -7.988 11.426 4.986 1.00 0.00 H new ATOM 0 HE ARG A 106 -8.465 11.907 2.068 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -7.463 13.025 5.264 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -7.161 14.676 4.715 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -8.123 14.055 1.393 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -7.530 15.254 2.547 1.00 0.00 H new ATOM 1636 N LYS A 107 -5.392 6.930 4.064 1.00 0.00 N ATOM 1637 CA LYS A 107 -4.033 6.878 4.575 1.00 0.00 C ATOM 1638 C LYS A 107 -3.218 8.040 4.042 1.00 0.00 C ATOM 1639 O LYS A 107 -3.307 8.388 2.869 1.00 0.00 O ATOM 1640 CB LYS A 107 -3.361 5.558 4.199 1.00 0.00 C ATOM 1641 CG LYS A 107 -3.764 4.396 5.089 1.00 0.00 C ATOM 1642 CD LYS A 107 -3.404 4.665 6.535 1.00 0.00 C ATOM 1643 CE LYS A 107 -3.693 3.464 7.412 1.00 0.00 C ATOM 1644 NZ LYS A 107 -2.920 2.265 6.987 1.00 0.00 N ATOM 0 H LYS A 107 -5.477 6.722 3.069 1.00 0.00 H new ATOM 0 HA LYS A 107 -4.081 6.948 5.662 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -3.608 5.316 3.165 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -2.279 5.684 4.247 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -4.837 4.224 5.004 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -3.268 3.486 4.751 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -2.347 4.923 6.606 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -3.967 5.525 6.897 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -3.450 3.704 8.447 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -4.759 3.239 7.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -2.524 1.792 7.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -3.549 1.607 6.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -2.147 2.556 6.356 1.00 0.00 H new ATOM 1658 N THR A 108 -2.452 8.656 4.914 1.00 0.00 N ATOM 1659 CA THR A 108 -1.575 9.742 4.521 1.00 0.00 C ATOM 1660 C THR A 108 -0.133 9.389 4.856 1.00 0.00 C ATOM 1661 O THR A 108 0.216 9.248 6.026 1.00 0.00 O ATOM 1662 CB THR A 108 -1.970 11.050 5.227 1.00 0.00 C ATOM 1663 OG1 THR A 108 -3.380 11.262 5.087 1.00 0.00 O ATOM 1664 CG2 THR A 108 -1.217 12.235 4.644 1.00 0.00 C ATOM 0 H THR A 108 -2.417 8.423 5.907 1.00 0.00 H new ATOM 0 HA THR A 108 -1.672 9.890 3.445 1.00 0.00 H new ATOM 0 HB THR A 108 -1.710 10.964 6.282 1.00 0.00 H new ATOM 0 HG1 THR A 108 -3.632 12.095 5.538 1.00 0.00 H new ATOM 0 HG21 THR A 108 -1.516 13.146 5.162 1.00 0.00 H new ATOM 0 HG22 THR A 108 -0.145 12.082 4.768 1.00 0.00 H new ATOM 0 HG23 THR A 108 -1.450 12.328 3.583 1.00 0.00 H new ATOM 1672 N MET A 109 0.693 9.229 3.839 1.00 0.00 N ATOM 1673 CA MET A 109 2.082 8.864 4.048 1.00 0.00 C ATOM 1674 C MET A 109 3.018 9.942 3.525 1.00 0.00 C ATOM 1675 O MET A 109 2.685 10.674 2.590 1.00 0.00 O ATOM 1676 CB MET A 109 2.410 7.515 3.393 1.00 0.00 C ATOM 1677 CG MET A 109 1.998 7.405 1.933 1.00 0.00 C ATOM 1678 SD MET A 109 0.235 7.083 1.726 1.00 0.00 S ATOM 1679 CE MET A 109 0.063 5.557 2.650 1.00 0.00 C ATOM 0 H MET A 109 0.427 9.346 2.861 1.00 0.00 H new ATOM 0 HA MET A 109 2.232 8.768 5.123 1.00 0.00 H new ATOM 0 HB2 MET A 109 3.483 7.340 3.468 1.00 0.00 H new ATOM 0 HB3 MET A 109 1.918 6.723 3.957 1.00 0.00 H new ATOM 0 HG2 MET A 109 2.257 8.329 1.417 1.00 0.00 H new ATOM 0 HG3 MET A 109 2.567 6.605 1.459 1.00 0.00 H new ATOM 0 HE1 MET A 109 -0.912 5.115 2.445 1.00 0.00 H new ATOM 0 HE2 MET A 109 0.847 4.861 2.352 1.00 0.00 H new ATOM 0 HE3 MET A 109 0.149 5.766 3.716 1.00 0.00 H new ATOM 1689 N THR A 110 4.187 10.033 4.138 1.00 0.00 N ATOM 1690 CA THR A 110 5.187 11.010 3.745 1.00 0.00 C ATOM 1691 C THR A 110 6.362 10.308 3.072 1.00 0.00 C ATOM 1692 O THR A 110 6.644 9.143 3.359 1.00 0.00 O ATOM 1693 CB THR A 110 5.696 11.799 4.963 1.00 0.00 C ATOM 1694 OG1 THR A 110 4.619 12.013 5.887 1.00 0.00 O ATOM 1695 CG2 THR A 110 6.274 13.144 4.543 1.00 0.00 C ATOM 0 H THR A 110 4.467 9.436 4.916 1.00 0.00 H new ATOM 0 HA THR A 110 4.723 11.707 3.047 1.00 0.00 H new ATOM 0 HB THR A 110 6.484 11.216 5.439 1.00 0.00 H new ATOM 0 HG1 THR A 110 4.948 12.514 6.662 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.626 13.680 5.424 1.00 0.00 H new ATOM 0 HG22 THR A 110 7.107 12.984 3.859 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.503 13.732 4.045 1.00 0.00 H new ATOM 1703 N ARG A 111 7.041 11.007 2.180 1.00 0.00 N ATOM 1704 CA ARG A 111 8.135 10.408 1.434 1.00 0.00 C ATOM 1705 C ARG A 111 9.436 10.552 2.201 1.00 0.00 C ATOM 1706 O ARG A 111 9.733 11.615 2.750 1.00 0.00 O ATOM 1707 CB ARG A 111 8.275 11.041 0.050 1.00 0.00 C ATOM 1708 CG ARG A 111 9.356 10.388 -0.798 1.00 0.00 C ATOM 1709 CD ARG A 111 9.460 11.015 -2.178 1.00 0.00 C ATOM 1710 NE ARG A 111 10.516 10.386 -2.972 1.00 0.00 N ATOM 1711 CZ ARG A 111 10.774 10.678 -4.246 1.00 0.00 C ATOM 1712 NH1 ARG A 111 10.065 11.610 -4.879 1.00 0.00 N ATOM 1713 NH2 ARG A 111 11.752 10.046 -4.881 1.00 0.00 N ATOM 0 H ARG A 111 6.856 11.985 1.955 1.00 0.00 H new ATOM 0 HA ARG A 111 7.909 9.350 1.304 1.00 0.00 H new ATOM 0 HB2 ARG A 111 7.321 10.973 -0.472 1.00 0.00 H new ATOM 0 HB3 ARG A 111 8.501 12.101 0.163 1.00 0.00 H new ATOM 0 HG2 ARG A 111 10.316 10.473 -0.289 1.00 0.00 H new ATOM 0 HG3 ARG A 111 9.143 9.324 -0.899 1.00 0.00 H new ATOM 0 HD2 ARG A 111 8.506 10.918 -2.696 1.00 0.00 H new ATOM 0 HD3 ARG A 111 9.662 12.082 -2.080 1.00 0.00 H new ATOM 0 HE ARG A 111 11.093 9.677 -2.520 1.00 0.00 H new ATOM 0 HH11 ARG A 111 9.320 12.105 -4.389 1.00 0.00 H new ATOM 0 HH12 ARG A 111 10.267 11.830 -5.854 1.00 0.00 H new ATOM 0 HH21 ARG A 111 12.303 9.339 -4.394 1.00 0.00 H new ATOM 0 HH22 ARG A 111 11.953 10.267 -5.856 1.00 0.00 H new ATOM 1727 N ILE A 112 10.200 9.477 2.242 1.00 0.00 N ATOM 1728 CA ILE A 112 11.489 9.489 2.905 1.00 0.00 C ATOM 1729 C ILE A 112 12.497 10.239 2.048 1.00 0.00 C ATOM 1730 O ILE A 112 12.415 10.221 0.816 1.00 0.00 O ATOM 1731 CB ILE A 112 11.989 8.059 3.171 1.00 0.00 C ATOM 1732 CG1 ILE A 112 10.882 7.231 3.825 1.00 0.00 C ATOM 1733 CG2 ILE A 112 13.233 8.068 4.050 1.00 0.00 C ATOM 1734 CD1 ILE A 112 10.434 7.747 5.178 1.00 0.00 C ATOM 0 H ILE A 112 9.949 8.582 1.822 1.00 0.00 H new ATOM 0 HA ILE A 112 11.377 9.993 3.865 1.00 0.00 H new ATOM 0 HB ILE A 112 12.256 7.606 2.216 1.00 0.00 H new ATOM 0 HG12 ILE A 112 10.022 7.204 3.156 1.00 0.00 H new ATOM 0 HG13 ILE A 112 11.231 6.204 3.938 1.00 0.00 H new ATOM 0 HG21 ILE A 112 13.565 7.044 4.222 1.00 0.00 H new ATOM 0 HG22 ILE A 112 14.026 8.627 3.553 1.00 0.00 H new ATOM 0 HG23 ILE A 112 13.000 8.539 5.005 1.00 0.00 H new ATOM 0 HD11 ILE A 112 9.648 7.103 5.571 1.00 0.00 H new ATOM 0 HD12 ILE A 112 11.280 7.748 5.865 1.00 0.00 H new ATOM 0 HD13 ILE A 112 10.052 8.762 5.072 1.00 0.00 H new ATOM 1746 N GLU A 113 13.435 10.901 2.696 1.00 0.00 N ATOM 1747 CA GLU A 113 14.382 11.743 1.988 1.00 0.00 C ATOM 1748 C GLU A 113 15.595 10.933 1.551 1.00 0.00 C ATOM 1749 O GLU A 113 15.952 9.937 2.183 1.00 0.00 O ATOM 1750 CB GLU A 113 14.806 12.934 2.853 1.00 0.00 C ATOM 1751 CG GLU A 113 15.566 14.001 2.076 1.00 0.00 C ATOM 1752 CD GLU A 113 14.834 14.428 0.818 1.00 0.00 C ATOM 1753 OE1 GLU A 113 15.026 13.779 -0.233 1.00 0.00 O ATOM 1754 OE2 GLU A 113 14.058 15.401 0.877 1.00 0.00 O ATOM 0 H GLU A 113 13.563 10.873 3.708 1.00 0.00 H new ATOM 0 HA GLU A 113 13.891 12.133 1.096 1.00 0.00 H new ATOM 0 HB2 GLU A 113 13.920 13.383 3.301 1.00 0.00 H new ATOM 0 HB3 GLU A 113 15.431 12.576 3.671 1.00 0.00 H new ATOM 0 HG2 GLU A 113 15.723 14.870 2.715 1.00 0.00 H new ATOM 0 HG3 GLU A 113 16.552 13.620 1.809 1.00 0.00 H new ATOM 1761 N SER A 114 16.224 11.373 0.471 1.00 0.00 N ATOM 1762 CA SER A 114 17.326 10.643 -0.123 1.00 0.00 C ATOM 1763 C SER A 114 18.619 10.825 0.670 1.00 0.00 C ATOM 1764 O SER A 114 19.497 11.601 0.295 1.00 0.00 O ATOM 1765 CB SER A 114 17.520 11.073 -1.577 1.00 0.00 C ATOM 1766 OG SER A 114 16.323 10.892 -2.317 1.00 0.00 O ATOM 0 H SER A 114 15.985 12.239 -0.012 1.00 0.00 H new ATOM 0 HA SER A 114 17.076 9.582 -0.097 1.00 0.00 H new ATOM 0 HB2 SER A 114 17.822 12.120 -1.615 1.00 0.00 H new ATOM 0 HB3 SER A 114 18.324 10.493 -2.029 1.00 0.00 H new ATOM 0 HG SER A 114 16.466 11.174 -3.245 1.00 0.00 H new ATOM 1772 N LYS A 115 18.701 10.134 1.798 1.00 0.00 N ATOM 1773 CA LYS A 115 19.945 10.012 2.539 1.00 0.00 C ATOM 1774 C LYS A 115 20.412 8.568 2.465 1.00 0.00 C ATOM 1775 O LYS A 115 20.475 7.860 3.475 1.00 0.00 O ATOM 1776 CB LYS A 115 19.769 10.428 4.003 1.00 0.00 C ATOM 1777 CG LYS A 115 19.418 11.892 4.199 1.00 0.00 C ATOM 1778 CD LYS A 115 19.415 12.260 5.675 1.00 0.00 C ATOM 1779 CE LYS A 115 19.068 13.725 5.897 1.00 0.00 C ATOM 1780 NZ LYS A 115 20.007 14.641 5.196 1.00 0.00 N ATOM 0 H LYS A 115 17.912 9.646 2.222 1.00 0.00 H new ATOM 0 HA LYS A 115 20.686 10.677 2.096 1.00 0.00 H new ATOM 0 HB2 LYS A 115 18.986 9.816 4.451 1.00 0.00 H new ATOM 0 HB3 LYS A 115 20.691 10.212 4.543 1.00 0.00 H new ATOM 0 HG2 LYS A 115 20.136 12.516 3.667 1.00 0.00 H new ATOM 0 HG3 LYS A 115 18.438 12.095 3.768 1.00 0.00 H new ATOM 0 HD2 LYS A 115 18.697 11.633 6.203 1.00 0.00 H new ATOM 0 HD3 LYS A 115 20.396 12.051 6.103 1.00 0.00 H new ATOM 0 HE2 LYS A 115 18.053 13.912 5.548 1.00 0.00 H new ATOM 0 HE3 LYS A 115 19.083 13.942 6.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 19.849 15.616 5.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 20.986 14.360 5.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 19.843 14.588 4.170 1.00 0.00 H new ATOM 1794 N THR A 116 20.720 8.135 1.255 1.00 0.00 N ATOM 1795 CA THR A 116 21.028 6.745 0.992 1.00 0.00 C ATOM 1796 C THR A 116 22.454 6.383 1.394 1.00 0.00 C ATOM 1797 O THR A 116 23.414 6.706 0.695 1.00 0.00 O ATOM 1798 CB THR A 116 20.805 6.423 -0.496 1.00 0.00 C ATOM 1799 OG1 THR A 116 21.235 7.532 -1.299 1.00 0.00 O ATOM 1800 CG2 THR A 116 19.337 6.126 -0.771 1.00 0.00 C ATOM 0 H THR A 116 20.763 8.736 0.432 1.00 0.00 H new ATOM 0 HA THR A 116 20.353 6.145 1.602 1.00 0.00 H new ATOM 0 HB THR A 116 21.389 5.539 -0.751 1.00 0.00 H new ATOM 0 HG1 THR A 116 21.094 7.324 -2.246 1.00 0.00 H new ATOM 0 HG21 THR A 116 19.203 5.901 -1.829 1.00 0.00 H new ATOM 0 HG22 THR A 116 19.021 5.270 -0.175 1.00 0.00 H new ATOM 0 HG23 THR A 116 18.734 6.994 -0.506 1.00 0.00 H new ATOM 1808 N GLY A 117 22.581 5.718 2.533 1.00 0.00 N ATOM 1809 CA GLY A 117 23.871 5.216 2.961 1.00 0.00 C ATOM 1810 C GLY A 117 24.186 3.888 2.305 1.00 0.00 C ATOM 1811 O GLY A 117 24.232 2.850 2.970 1.00 0.00 O ATOM 0 H GLY A 117 21.811 5.516 3.171 1.00 0.00 H new ATOM 0 HA2 GLY A 117 24.647 5.940 2.713 1.00 0.00 H new ATOM 0 HA3 GLY A 117 23.878 5.100 4.045 1.00 0.00 H new ATOM 1815 N ARG A 118 24.373 3.919 0.992 1.00 0.00 N ATOM 1816 CA ARG A 118 24.639 2.717 0.224 1.00 0.00 C ATOM 1817 C ARG A 118 26.133 2.560 -0.038 1.00 0.00 C ATOM 1818 O ARG A 118 26.651 2.957 -1.083 1.00 0.00 O ATOM 1819 CB ARG A 118 23.860 2.745 -1.092 1.00 0.00 C ATOM 1820 CG ARG A 118 23.954 4.066 -1.839 1.00 0.00 C ATOM 1821 CD ARG A 118 23.214 4.016 -3.167 1.00 0.00 C ATOM 1822 NE ARG A 118 21.794 3.693 -3.002 1.00 0.00 N ATOM 1823 CZ ARG A 118 20.815 4.230 -3.730 1.00 0.00 C ATOM 1824 NH1 ARG A 118 21.090 5.121 -4.675 1.00 0.00 N ATOM 1825 NH2 ARG A 118 19.555 3.870 -3.511 1.00 0.00 N ATOM 0 H ARG A 118 24.344 4.773 0.436 1.00 0.00 H new ATOM 0 HA ARG A 118 24.307 1.857 0.806 1.00 0.00 H new ATOM 0 HB2 ARG A 118 24.228 1.948 -1.737 1.00 0.00 H new ATOM 0 HB3 ARG A 118 22.811 2.530 -0.886 1.00 0.00 H new ATOM 0 HG2 ARG A 118 23.540 4.863 -1.222 1.00 0.00 H new ATOM 0 HG3 ARG A 118 25.001 4.311 -2.015 1.00 0.00 H new ATOM 0 HD2 ARG A 118 23.309 4.979 -3.670 1.00 0.00 H new ATOM 0 HD3 ARG A 118 23.681 3.272 -3.812 1.00 0.00 H new ATOM 0 HE ARG A 118 21.539 3.014 -2.285 1.00 0.00 H new ATOM 0 HH11 ARG A 118 22.056 5.399 -4.848 1.00 0.00 H new ATOM 0 HH12 ARG A 118 20.335 5.527 -5.228 1.00 0.00 H new ATOM 0 HH21 ARG A 118 19.339 3.184 -2.787 1.00 0.00 H new ATOM 0 HH22 ARG A 118 18.804 4.279 -4.066 1.00 0.00 H new ATOM 1839 N GLU A 119 26.819 1.999 0.939 1.00 0.00 N ATOM 1840 CA GLU A 119 28.240 1.714 0.824 1.00 0.00 C ATOM 1841 C GLU A 119 28.491 0.294 1.298 1.00 0.00 C ATOM 1842 O GLU A 119 27.658 -0.281 2.005 1.00 0.00 O ATOM 1843 CB GLU A 119 29.085 2.688 1.667 1.00 0.00 C ATOM 1844 CG GLU A 119 28.980 4.158 1.269 1.00 0.00 C ATOM 1845 CD GLU A 119 27.717 4.829 1.778 1.00 0.00 C ATOM 1846 OE1 GLU A 119 27.464 4.774 3.002 1.00 0.00 O ATOM 1847 OE2 GLU A 119 26.980 5.411 0.959 1.00 0.00 O ATOM 0 H GLU A 119 26.410 1.728 1.833 1.00 0.00 H new ATOM 0 HA GLU A 119 28.533 1.833 -0.219 1.00 0.00 H new ATOM 0 HB2 GLU A 119 28.788 2.590 2.711 1.00 0.00 H new ATOM 0 HB3 GLU A 119 30.130 2.385 1.603 1.00 0.00 H new ATOM 0 HG2 GLU A 119 29.848 4.694 1.653 1.00 0.00 H new ATOM 0 HG3 GLU A 119 29.012 4.236 0.182 1.00 0.00 H new ATOM 1854 N GLU A 120 29.622 -0.278 0.915 1.00 0.00 N ATOM 1855 CA GLU A 120 29.991 -1.593 1.411 1.00 0.00 C ATOM 1856 C GLU A 120 30.453 -1.467 2.849 1.00 0.00 C ATOM 1857 O GLU A 120 31.559 -0.997 3.119 1.00 0.00 O ATOM 1858 CB GLU A 120 31.096 -2.242 0.574 1.00 0.00 C ATOM 1859 CG GLU A 120 30.731 -2.478 -0.884 1.00 0.00 C ATOM 1860 CD GLU A 120 30.694 -1.201 -1.692 1.00 0.00 C ATOM 1861 OE1 GLU A 120 31.745 -0.531 -1.789 1.00 0.00 O ATOM 1862 OE2 GLU A 120 29.621 -0.852 -2.225 1.00 0.00 O ATOM 0 H GLU A 120 30.292 0.142 0.271 1.00 0.00 H new ATOM 0 HA GLU A 120 29.112 -2.234 1.342 1.00 0.00 H new ATOM 0 HB2 GLU A 120 31.983 -1.610 0.615 1.00 0.00 H new ATOM 0 HB3 GLU A 120 31.363 -3.197 1.027 1.00 0.00 H new ATOM 0 HG2 GLU A 120 31.453 -3.163 -1.328 1.00 0.00 H new ATOM 0 HG3 GLU A 120 29.757 -2.964 -0.936 1.00 0.00 H new ATOM 1869 N LYS A 121 29.589 -1.849 3.767 1.00 0.00 N ATOM 1870 CA LYS A 121 29.890 -1.749 5.181 1.00 0.00 C ATOM 1871 C LYS A 121 30.681 -2.956 5.646 1.00 0.00 C ATOM 1872 O LYS A 121 30.406 -4.084 5.236 1.00 0.00 O ATOM 1873 CB LYS A 121 28.606 -1.646 6.004 1.00 0.00 C ATOM 1874 CG LYS A 121 27.759 -0.427 5.691 1.00 0.00 C ATOM 1875 CD LYS A 121 26.566 -0.341 6.626 1.00 0.00 C ATOM 1876 CE LYS A 121 25.730 0.896 6.358 1.00 0.00 C ATOM 1877 NZ LYS A 121 24.643 1.046 7.359 1.00 0.00 N ATOM 0 H LYS A 121 28.668 -2.234 3.558 1.00 0.00 H new ATOM 0 HA LYS A 121 30.484 -0.847 5.329 1.00 0.00 H new ATOM 0 HB2 LYS A 121 28.008 -2.542 5.836 1.00 0.00 H new ATOM 0 HB3 LYS A 121 28.867 -1.630 7.062 1.00 0.00 H new ATOM 0 HG2 LYS A 121 28.364 0.475 5.784 1.00 0.00 H new ATOM 0 HG3 LYS A 121 27.414 -0.475 4.658 1.00 0.00 H new ATOM 0 HD2 LYS A 121 25.947 -1.231 6.509 1.00 0.00 H new ATOM 0 HD3 LYS A 121 26.914 -0.328 7.659 1.00 0.00 H new ATOM 0 HE2 LYS A 121 26.369 1.779 6.378 1.00 0.00 H new ATOM 0 HE3 LYS A 121 25.300 0.836 5.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 24.091 1.901 7.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 24.020 0.214 7.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 25.056 1.128 8.310 1.00 0.00 H new ATOM 1891 N ASP A 122 31.671 -2.714 6.483 1.00 0.00 N ATOM 1892 CA ASP A 122 32.376 -3.792 7.143 1.00 0.00 C ATOM 1893 C ASP A 122 31.687 -4.074 8.472 1.00 0.00 C ATOM 1894 O ASP A 122 30.953 -3.221 8.981 1.00 0.00 O ATOM 1895 CB ASP A 122 33.845 -3.423 7.361 1.00 0.00 C ATOM 1896 CG ASP A 122 34.715 -4.645 7.563 1.00 0.00 C ATOM 1897 OD1 ASP A 122 35.092 -5.281 6.550 1.00 0.00 O ATOM 1898 OD2 ASP A 122 35.029 -4.976 8.719 1.00 0.00 O ATOM 0 H ASP A 122 32.004 -1.780 6.721 1.00 0.00 H new ATOM 0 HA ASP A 122 32.353 -4.686 6.519 1.00 0.00 H new ATOM 0 HB2 ASP A 122 34.208 -2.858 6.502 1.00 0.00 H new ATOM 0 HB3 ASP A 122 33.929 -2.771 8.230 1.00 0.00 H new ATOM 1903 N GLU A 123 31.897 -5.255 9.024 1.00 0.00 N ATOM 1904 CA GLU A 123 31.206 -5.647 10.244 1.00 0.00 C ATOM 1905 C GLU A 123 31.671 -4.814 11.433 1.00 0.00 C ATOM 1906 O GLU A 123 32.873 -4.627 11.648 1.00 0.00 O ATOM 1907 CB GLU A 123 31.403 -7.136 10.510 1.00 0.00 C ATOM 1908 CG GLU A 123 30.801 -8.016 9.430 1.00 0.00 C ATOM 1909 CD GLU A 123 30.769 -9.472 9.827 1.00 0.00 C ATOM 1910 OE1 GLU A 123 29.863 -9.858 10.595 1.00 0.00 O ATOM 1911 OE2 GLU A 123 31.644 -10.242 9.378 1.00 0.00 O ATOM 0 H GLU A 123 32.536 -5.957 8.652 1.00 0.00 H new ATOM 0 HA GLU A 123 30.141 -5.459 10.108 1.00 0.00 H new ATOM 0 HB2 GLU A 123 32.469 -7.347 10.590 1.00 0.00 H new ATOM 0 HB3 GLU A 123 30.954 -7.390 11.470 1.00 0.00 H new ATOM 0 HG2 GLU A 123 29.787 -7.679 9.213 1.00 0.00 H new ATOM 0 HG3 GLU A 123 31.377 -7.905 8.511 1.00 0.00 H new ATOM 1918 N LYS A 124 30.702 -4.308 12.192 1.00 0.00 N ATOM 1919 CA LYS A 124 30.976 -3.417 13.309 1.00 0.00 C ATOM 1920 C LYS A 124 31.773 -4.116 14.404 1.00 0.00 C ATOM 1921 O LYS A 124 31.252 -4.940 15.160 1.00 0.00 O ATOM 1922 CB LYS A 124 29.673 -2.829 13.871 1.00 0.00 C ATOM 1923 CG LYS A 124 28.619 -3.862 14.252 1.00 0.00 C ATOM 1924 CD LYS A 124 27.385 -3.198 14.844 1.00 0.00 C ATOM 1925 CE LYS A 124 26.343 -4.222 15.274 1.00 0.00 C ATOM 1926 NZ LYS A 124 25.160 -3.579 15.910 1.00 0.00 N ATOM 0 H LYS A 124 29.711 -4.504 12.049 1.00 0.00 H new ATOM 0 HA LYS A 124 31.588 -2.597 12.932 1.00 0.00 H new ATOM 0 HB2 LYS A 124 29.910 -2.231 14.751 1.00 0.00 H new ATOM 0 HB3 LYS A 124 29.247 -2.152 13.131 1.00 0.00 H new ATOM 0 HG2 LYS A 124 28.337 -4.439 13.371 1.00 0.00 H new ATOM 0 HG3 LYS A 124 29.038 -4.564 14.973 1.00 0.00 H new ATOM 0 HD2 LYS A 124 27.675 -2.592 15.702 1.00 0.00 H new ATOM 0 HD3 LYS A 124 26.948 -2.522 14.109 1.00 0.00 H new ATOM 0 HE2 LYS A 124 26.020 -4.798 14.406 1.00 0.00 H new ATOM 0 HE3 LYS A 124 26.793 -4.926 15.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 24.475 -4.310 16.188 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 25.463 -3.051 16.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 24.714 -2.926 15.234 1.00 0.00 H new ATOM 1940 N SER A 125 33.050 -3.790 14.459 1.00 0.00 N ATOM 1941 CA SER A 125 33.940 -4.328 15.468 1.00 0.00 C ATOM 1942 C SER A 125 33.907 -3.455 16.722 1.00 0.00 C ATOM 1943 O SER A 125 34.462 -2.353 16.731 1.00 0.00 O ATOM 1944 CB SER A 125 35.367 -4.418 14.915 1.00 0.00 C ATOM 1945 OG SER A 125 36.254 -4.992 15.859 1.00 0.00 O ATOM 0 H SER A 125 33.498 -3.146 13.807 1.00 0.00 H new ATOM 0 HA SER A 125 33.605 -5.330 15.736 1.00 0.00 H new ATOM 0 HB2 SER A 125 35.368 -5.015 14.003 1.00 0.00 H new ATOM 0 HB3 SER A 125 35.717 -3.422 14.644 1.00 0.00 H new ATOM 0 HG SER A 125 37.155 -5.037 15.476 1.00 0.00 H new ATOM 1951 N LYS A 126 33.223 -3.951 17.757 1.00 0.00 N ATOM 1952 CA LYS A 126 33.103 -3.264 19.049 1.00 0.00 C ATOM 1953 C LYS A 126 32.221 -2.015 18.941 1.00 0.00 C ATOM 1954 O LYS A 126 31.071 -2.017 19.380 1.00 0.00 O ATOM 1955 CB LYS A 126 34.490 -2.898 19.606 1.00 0.00 C ATOM 1956 CG LYS A 126 34.451 -2.251 20.985 1.00 0.00 C ATOM 1957 CD LYS A 126 35.837 -1.818 21.444 1.00 0.00 C ATOM 1958 CE LYS A 126 36.389 -0.692 20.580 1.00 0.00 C ATOM 1959 NZ LYS A 126 37.742 -0.264 21.026 1.00 0.00 N ATOM 0 H LYS A 126 32.734 -4.845 17.723 1.00 0.00 H new ATOM 0 HA LYS A 126 32.622 -3.954 19.743 1.00 0.00 H new ATOM 0 HB2 LYS A 126 35.100 -3.800 19.656 1.00 0.00 H new ATOM 0 HB3 LYS A 126 34.982 -2.218 18.910 1.00 0.00 H new ATOM 0 HG2 LYS A 126 33.788 -1.386 20.962 1.00 0.00 H new ATOM 0 HG3 LYS A 126 34.032 -2.954 21.705 1.00 0.00 H new ATOM 0 HD2 LYS A 126 35.791 -1.491 22.483 1.00 0.00 H new ATOM 0 HD3 LYS A 126 36.515 -2.670 21.408 1.00 0.00 H new ATOM 0 HE2 LYS A 126 36.436 -1.020 19.542 1.00 0.00 H new ATOM 0 HE3 LYS A 126 35.709 0.159 20.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 38.083 0.504 20.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 37.693 0.073 22.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 38.397 -1.070 20.969 1.00 0.00 H new ATOM 1973 N SER A 127 32.764 -0.966 18.343 1.00 0.00 N ATOM 1974 CA SER A 127 32.077 0.309 18.221 1.00 0.00 C ATOM 1975 C SER A 127 32.788 1.158 17.171 1.00 0.00 C ATOM 1976 O SER A 127 34.018 1.258 17.178 1.00 0.00 O ATOM 1977 CB SER A 127 32.059 1.026 19.577 1.00 0.00 C ATOM 1978 OG SER A 127 31.288 2.216 19.529 1.00 0.00 O ATOM 0 H SER A 127 33.696 -0.976 17.928 1.00 0.00 H new ATOM 0 HA SER A 127 31.045 0.146 17.909 1.00 0.00 H new ATOM 0 HB2 SER A 127 31.652 0.359 20.337 1.00 0.00 H new ATOM 0 HB3 SER A 127 33.079 1.265 19.876 1.00 0.00 H new ATOM 0 HG SER A 127 31.296 2.647 20.409 1.00 0.00 H new ATOM 1984 N LEU A 128 32.024 1.754 16.269 1.00 0.00 N ATOM 1985 CA LEU A 128 32.604 2.489 15.156 1.00 0.00 C ATOM 1986 C LEU A 128 32.299 3.978 15.284 1.00 0.00 C ATOM 1987 O LEU A 128 31.161 4.410 15.085 1.00 0.00 O ATOM 1988 CB LEU A 128 32.068 1.936 13.824 1.00 0.00 C ATOM 1989 CG LEU A 128 32.925 2.219 12.575 1.00 0.00 C ATOM 1990 CD1 LEU A 128 32.912 3.695 12.205 1.00 0.00 C ATOM 1991 CD2 LEU A 128 34.354 1.740 12.793 1.00 0.00 C ATOM 0 H LEU A 128 31.004 1.743 16.285 1.00 0.00 H new ATOM 0 HA LEU A 128 33.686 2.362 15.175 1.00 0.00 H new ATOM 0 HB2 LEU A 128 31.953 0.857 13.923 1.00 0.00 H new ATOM 0 HB3 LEU A 128 31.073 2.349 13.657 1.00 0.00 H new ATOM 0 HG LEU A 128 32.488 1.667 11.743 1.00 0.00 H new ATOM 0 HD11 LEU A 128 33.528 3.854 11.320 1.00 0.00 H new ATOM 0 HD12 LEU A 128 31.889 4.009 11.997 1.00 0.00 H new ATOM 0 HD13 LEU A 128 33.310 4.281 13.033 1.00 0.00 H new ATOM 0 HD21 LEU A 128 34.947 1.947 11.902 1.00 0.00 H new ATOM 0 HD22 LEU A 128 34.787 2.262 13.646 1.00 0.00 H new ATOM 0 HD23 LEU A 128 34.353 0.667 12.987 1.00 0.00 H new ATOM 2003 N GLU A 129 33.323 4.751 15.628 1.00 0.00 N ATOM 2004 CA GLU A 129 33.215 6.202 15.694 1.00 0.00 C ATOM 2005 C GLU A 129 34.605 6.810 15.782 1.00 0.00 C ATOM 2006 O GLU A 129 35.542 6.166 16.254 1.00 0.00 O ATOM 2007 CB GLU A 129 32.386 6.644 16.910 1.00 0.00 C ATOM 2008 CG GLU A 129 33.026 6.295 18.245 1.00 0.00 C ATOM 2009 CD GLU A 129 32.273 6.867 19.426 1.00 0.00 C ATOM 2010 OE1 GLU A 129 31.339 6.196 19.916 1.00 0.00 O ATOM 2011 OE2 GLU A 129 32.621 7.980 19.881 1.00 0.00 O ATOM 0 H GLU A 129 34.247 4.391 15.868 1.00 0.00 H new ATOM 0 HA GLU A 129 32.711 6.548 14.792 1.00 0.00 H new ATOM 0 HB2 GLU A 129 32.232 7.722 16.861 1.00 0.00 H new ATOM 0 HB3 GLU A 129 31.402 6.179 16.856 1.00 0.00 H new ATOM 0 HG2 GLU A 129 33.079 5.211 18.345 1.00 0.00 H new ATOM 0 HG3 GLU A 129 34.051 6.667 18.259 1.00 0.00 H new ATOM 2018 N HIS A 130 34.746 8.027 15.291 1.00 0.00 N ATOM 2019 CA HIS A 130 35.962 8.788 15.510 1.00 0.00 C ATOM 2020 C HIS A 130 35.791 9.627 16.765 1.00 0.00 C ATOM 2021 O HIS A 130 35.028 10.599 16.770 1.00 0.00 O ATOM 2022 CB HIS A 130 36.290 9.682 14.307 1.00 0.00 C ATOM 2023 CG HIS A 130 36.763 8.927 13.100 1.00 0.00 C ATOM 2024 ND1 HIS A 130 38.002 9.122 12.528 1.00 0.00 N ATOM 2025 CD2 HIS A 130 36.152 7.983 12.348 1.00 0.00 C ATOM 2026 CE1 HIS A 130 38.129 8.331 11.480 1.00 0.00 C ATOM 2027 NE2 HIS A 130 37.021 7.628 11.349 1.00 0.00 N ATOM 0 H HIS A 130 34.036 8.509 14.739 1.00 0.00 H new ATOM 0 HA HIS A 130 36.796 8.097 15.633 1.00 0.00 H new ATOM 0 HB2 HIS A 130 35.402 10.255 14.040 1.00 0.00 H new ATOM 0 HB3 HIS A 130 37.057 10.399 14.598 1.00 0.00 H new ATOM 0 HD2 HIS A 130 35.161 7.583 12.506 1.00 0.00 H new ATOM 0 HE1 HIS A 130 38.995 8.269 10.837 1.00 0.00 H new ATOM 0 HE2 HIS A 130 36.840 6.934 10.624 1.00 0.00 H new ATOM 2036 N HIS A 131 36.467 9.223 17.836 1.00 0.00 N ATOM 2037 CA HIS A 131 36.324 9.882 19.128 1.00 0.00 C ATOM 2038 C HIS A 131 36.787 11.328 19.034 1.00 0.00 C ATOM 2039 O HIS A 131 37.979 11.606 18.932 1.00 0.00 O ATOM 2040 CB HIS A 131 37.110 9.137 20.211 1.00 0.00 C ATOM 2041 CG HIS A 131 36.785 9.585 21.604 1.00 0.00 C ATOM 2042 ND1 HIS A 131 37.686 10.227 22.428 1.00 0.00 N ATOM 2043 CD2 HIS A 131 35.641 9.476 22.319 1.00 0.00 C ATOM 2044 CE1 HIS A 131 37.111 10.490 23.587 1.00 0.00 C ATOM 2045 NE2 HIS A 131 35.871 10.046 23.544 1.00 0.00 N ATOM 0 H HIS A 131 37.121 8.440 17.834 1.00 0.00 H new ATOM 0 HA HIS A 131 35.270 9.868 19.406 1.00 0.00 H new ATOM 0 HB2 HIS A 131 36.908 8.069 20.125 1.00 0.00 H new ATOM 0 HB3 HIS A 131 38.177 9.275 20.034 1.00 0.00 H new ATOM 0 HD2 HIS A 131 34.718 9.024 21.986 1.00 0.00 H new ATOM 0 HE1 HIS A 131 37.577 10.984 24.427 1.00 0.00 H new ATOM 0 HE2 HIS A 131 35.191 10.115 24.301 1.00 0.00 H new ATOM 2054 N HIS A 132 35.832 12.242 19.070 1.00 0.00 N ATOM 2055 CA HIS A 132 36.122 13.649 18.836 1.00 0.00 C ATOM 2056 C HIS A 132 35.819 14.500 20.062 1.00 0.00 C ATOM 2057 O HIS A 132 34.748 14.394 20.666 1.00 0.00 O ATOM 2058 CB HIS A 132 35.351 14.164 17.610 1.00 0.00 C ATOM 2059 CG HIS A 132 33.870 13.920 17.657 1.00 0.00 C ATOM 2060 ND1 HIS A 132 33.296 12.706 17.344 1.00 0.00 N ATOM 2061 CD2 HIS A 132 32.845 14.746 17.976 1.00 0.00 C ATOM 2062 CE1 HIS A 132 31.985 12.797 17.469 1.00 0.00 C ATOM 2063 NE2 HIS A 132 31.683 14.022 17.851 1.00 0.00 N ATOM 0 H HIS A 132 34.851 12.037 19.258 1.00 0.00 H new ATOM 0 HA HIS A 132 37.190 13.735 18.636 1.00 0.00 H new ATOM 0 HB2 HIS A 132 35.527 15.235 17.510 1.00 0.00 H new ATOM 0 HB3 HIS A 132 35.756 13.690 16.716 1.00 0.00 H new ATOM 0 HD1 HIS A 132 33.805 11.869 17.060 1.00 0.00 H new ATOM 0 HD2 HIS A 132 32.926 15.781 18.273 1.00 0.00 H new ATOM 0 HE1 HIS A 132 31.278 12.001 17.288 1.00 0.00 H new ATOM 2072 N HIS A 133 36.780 15.334 20.427 1.00 0.00 N ATOM 2073 CA HIS A 133 36.634 16.252 21.546 1.00 0.00 C ATOM 2074 C HIS A 133 36.412 17.656 20.998 1.00 0.00 C ATOM 2075 O HIS A 133 37.275 18.194 20.315 1.00 0.00 O ATOM 2076 CB HIS A 133 37.897 16.208 22.414 1.00 0.00 C ATOM 2077 CG HIS A 133 37.693 16.647 23.837 1.00 0.00 C ATOM 2078 ND1 HIS A 133 38.145 17.851 24.336 1.00 0.00 N ATOM 2079 CD2 HIS A 133 37.107 16.010 24.882 1.00 0.00 C ATOM 2080 CE1 HIS A 133 37.849 17.931 25.622 1.00 0.00 C ATOM 2081 NE2 HIS A 133 37.220 16.829 25.977 1.00 0.00 N ATOM 0 H HIS A 133 37.683 15.394 19.956 1.00 0.00 H new ATOM 0 HA HIS A 133 35.782 15.965 22.162 1.00 0.00 H new ATOM 0 HB2 HIS A 133 38.287 15.190 22.414 1.00 0.00 H new ATOM 0 HB3 HIS A 133 38.658 16.841 21.958 1.00 0.00 H new ATOM 0 HD1 HIS A 133 38.631 18.567 23.797 1.00 0.00 H new ATOM 0 HD2 HIS A 133 36.638 15.037 24.857 1.00 0.00 H new ATOM 0 HE1 HIS A 133 38.083 18.761 26.273 1.00 0.00 H new ATOM 2090 N HIS A 134 35.258 18.247 21.282 1.00 0.00 N ATOM 2091 CA HIS A 134 34.887 19.516 20.653 1.00 0.00 C ATOM 2092 C HIS A 134 35.526 20.708 21.376 1.00 0.00 C ATOM 2093 O HIS A 134 35.421 21.849 20.928 1.00 0.00 O ATOM 2094 CB HIS A 134 33.361 19.666 20.612 1.00 0.00 C ATOM 2095 CG HIS A 134 32.873 20.682 19.618 1.00 0.00 C ATOM 2096 ND1 HIS A 134 31.569 21.125 19.573 1.00 0.00 N ATOM 2097 CD2 HIS A 134 33.521 21.328 18.617 1.00 0.00 C ATOM 2098 CE1 HIS A 134 31.435 21.998 18.589 1.00 0.00 C ATOM 2099 NE2 HIS A 134 32.604 22.136 17.995 1.00 0.00 N ATOM 0 H HIS A 134 34.568 17.876 21.935 1.00 0.00 H new ATOM 0 HA HIS A 134 35.267 19.506 19.631 1.00 0.00 H new ATOM 0 HB2 HIS A 134 32.917 18.699 20.375 1.00 0.00 H new ATOM 0 HB3 HIS A 134 33.007 19.945 21.604 1.00 0.00 H new ATOM 0 HD2 HIS A 134 34.564 21.225 18.358 1.00 0.00 H new ATOM 0 HE1 HIS A 134 30.524 22.510 18.318 1.00 0.00 H new ATOM 0 HE2 HIS A 134 32.796 22.746 17.200 1.00 0.00 H new ATOM 2108 N HIS A 135 36.189 20.439 22.487 1.00 0.00 N ATOM 2109 CA HIS A 135 36.891 21.479 23.227 1.00 0.00 C ATOM 2110 C HIS A 135 38.162 20.891 23.821 1.00 0.00 C ATOM 2111 O HIS A 135 38.357 20.991 25.043 1.00 0.00 O ATOM 2112 CB HIS A 135 35.986 22.051 24.326 1.00 0.00 C ATOM 2113 CG HIS A 135 36.477 23.336 24.931 1.00 0.00 C ATOM 2114 ND1 HIS A 135 36.239 24.567 24.360 1.00 0.00 N ATOM 2115 CD2 HIS A 135 37.170 23.583 26.071 1.00 0.00 C ATOM 2116 CE1 HIS A 135 36.760 25.511 25.117 1.00 0.00 C ATOM 2117 NE2 HIS A 135 37.330 24.944 26.161 1.00 0.00 N ATOM 2118 OXT HIS A 135 38.926 20.263 23.061 1.00 0.00 O ATOM 0 H HIS A 135 36.257 19.508 22.899 1.00 0.00 H new ATOM 0 HA HIS A 135 37.156 22.295 22.555 1.00 0.00 H new ATOM 0 HB2 HIS A 135 34.992 22.216 23.911 1.00 0.00 H new ATOM 0 HB3 HIS A 135 35.882 21.308 25.117 1.00 0.00 H new ATOM 0 HD2 HIS A 135 37.529 22.847 26.776 1.00 0.00 H new ATOM 0 HE1 HIS A 135 36.726 26.572 24.916 1.00 0.00 H new ATOM 0 HE2 HIS A 135 37.812 25.436 26.914 1.00 0.00 H new TER 2127 HIS A 135