USER MOD reduce.3.24.130724 H: found=0, std=0, add=893, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 889 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 16 HIS : no HD1:sc= -7.45! C(o=-9.4!,f=-13!) USER MOD Set 1.2: A 106 TYR OH : rot 180:sc= -1.97 USER MOD Set 2.1: A 79 SER OG : rot -164:sc= 0.0084 USER MOD Set 2.2: A 100 TYR OH : rot 119:sc= -0.418 USER MOD Set 3.1: A 70 ASN : amide:sc= -3.01 K(o=-4.6,f=-7.2!) USER MOD Set 3.2: A 105 SER OG : rot 90:sc= -1.59 USER MOD Single : A 1 GLY N :NH3+ 175:sc= -0.115 (180deg=-0.2) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot -105:sc=-0.00783 USER MOD Single : A 5 SER OG : rot 145:sc= 0.902 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 HIS : no HE2:sc= -0.559 X(o=-0.56,f=-0.79) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 MET CE :methyl -143:sc= -0.669 (180deg=-2.99!) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc=-0.00958 K(o=-0.0096,f=-1) USER MOD Single : A 28 MET CE :methyl -169:sc= -0.643 (180deg=-0.972) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 56:sc= 0.061 USER MOD Single : A 34 TYR OH : rot 180:sc= -1.43! USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot -121:sc= 0.57 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot -72:sc= -0.308 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 146:sc= 0.663 USER MOD Single : A 51 ASN : amide:sc= -0.139 K(o=-0.14,f=-0.68) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot -44:sc= 0.898 USER MOD Single : A 65 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 67 MET CE :methyl -170:sc= -0.724 (180deg=-1.2) USER MOD Single : A 80 MET CE :methyl -154:sc= -0.227 (180deg=-1.35) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= -1.19 K(o=-1.2,f=-4!) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.178 USER MOD Single : A 101 THR OG1 : rot 83:sc= 1.08 USER MOD Single : A 107 LYS NZ :NH3+ 162:sc=-0.00248 (180deg=-0.169) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 172:sc= 0.0737 (180deg=0.0653) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -8.894 13.553 16.004 1.00 0.00 N ATOM 2 CA GLY A 1 -10.139 14.293 16.122 1.00 0.00 C ATOM 3 C GLY A 1 -11.223 13.690 15.226 1.00 0.00 C ATOM 4 O GLY A 1 -12.272 14.298 15.020 1.00 0.00 O ATOM 0 H1 GLY A 1 -8.153 14.031 16.555 1.00 0.00 H new ATOM 0 H2 GLY A 1 -9.028 12.588 16.368 1.00 0.00 H new ATOM 0 H3 GLY A 1 -8.609 13.510 15.005 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -10.474 14.285 17.159 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.974 15.335 15.848 1.00 0.00 H new ATOM 8 N SER A 2 -10.931 12.502 14.718 1.00 0.00 N ATOM 9 CA SER A 2 -11.867 11.810 13.848 1.00 0.00 C ATOM 10 C SER A 2 -11.890 10.318 14.186 1.00 0.00 C ATOM 11 O SER A 2 -11.340 9.900 15.205 1.00 0.00 O ATOM 12 CB SER A 2 -11.507 12.015 12.376 1.00 0.00 C ATOM 13 OG SER A 2 -12.665 12.136 11.555 1.00 0.00 O ATOM 0 H SER A 2 -10.060 12.001 14.892 1.00 0.00 H new ATOM 0 HA SER A 2 -12.860 12.229 14.012 1.00 0.00 H new ATOM 0 HB2 SER A 2 -10.895 12.911 12.274 1.00 0.00 H new ATOM 0 HB3 SER A 2 -10.903 11.176 12.030 1.00 0.00 H new ATOM 0 HG SER A 2 -12.393 12.267 10.623 1.00 0.00 H new ATOM 19 N SER A 3 -12.531 9.555 13.313 1.00 0.00 N ATOM 20 CA SER A 3 -12.632 8.119 13.506 1.00 0.00 C ATOM 21 C SER A 3 -12.911 7.429 12.169 1.00 0.00 C ATOM 22 O SER A 3 -12.927 8.078 11.123 1.00 0.00 O ATOM 23 CB SER A 3 -13.726 7.775 14.519 1.00 0.00 C ATOM 24 OG SER A 3 -13.739 6.387 14.840 1.00 0.00 O ATOM 0 H SER A 3 -12.986 9.905 12.470 1.00 0.00 H new ATOM 0 HA SER A 3 -11.682 7.760 13.902 1.00 0.00 H new ATOM 0 HB2 SER A 3 -13.573 8.356 15.429 1.00 0.00 H new ATOM 0 HB3 SER A 3 -14.697 8.063 14.116 1.00 0.00 H new ATOM 0 HG SER A 3 -14.498 5.956 14.396 1.00 0.00 H new ATOM 30 N GLY A 4 -13.125 6.124 12.245 1.00 0.00 N ATOM 31 CA GLY A 4 -13.403 5.340 11.054 1.00 0.00 C ATOM 32 C GLY A 4 -12.192 4.492 10.661 1.00 0.00 C ATOM 33 O GLY A 4 -11.098 4.682 11.191 1.00 0.00 O ATOM 0 H GLY A 4 -13.111 5.589 13.114 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -14.262 4.693 11.232 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -13.669 6.004 10.231 1.00 0.00 H new ATOM 37 N SER A 5 -12.428 3.574 9.735 1.00 0.00 N ATOM 38 CA SER A 5 -11.370 2.697 9.264 1.00 0.00 C ATOM 39 C SER A 5 -10.519 2.223 10.445 1.00 0.00 C ATOM 40 O SER A 5 -9.523 2.857 10.790 1.00 0.00 O ATOM 41 CB SER A 5 -10.492 3.399 8.226 1.00 0.00 C ATOM 42 OG SER A 5 -11.255 3.889 7.127 1.00 0.00 O ATOM 0 H SER A 5 -13.337 3.419 9.298 1.00 0.00 H new ATOM 0 HA SER A 5 -11.831 1.833 8.785 1.00 0.00 H new ATOM 0 HB2 SER A 5 -9.963 4.227 8.698 1.00 0.00 H new ATOM 0 HB3 SER A 5 -9.735 2.704 7.861 1.00 0.00 H new ATOM 0 HG SER A 5 -10.865 4.729 6.807 1.00 0.00 H new ATOM 48 N SER A 6 -10.942 1.113 11.030 1.00 0.00 N ATOM 49 CA SER A 6 -10.232 0.547 12.165 1.00 0.00 C ATOM 50 C SER A 6 -9.304 -0.575 11.694 1.00 0.00 C ATOM 51 O SER A 6 -8.145 -0.638 12.101 1.00 0.00 O ATOM 52 CB SER A 6 -11.208 0.022 13.219 1.00 0.00 C ATOM 53 OG SER A 6 -10.951 0.576 14.507 1.00 0.00 O ATOM 0 H SER A 6 -11.768 0.590 10.740 1.00 0.00 H new ATOM 0 HA SER A 6 -9.635 1.335 12.623 1.00 0.00 H new ATOM 0 HB2 SER A 6 -12.228 0.260 12.919 1.00 0.00 H new ATOM 0 HB3 SER A 6 -11.136 -1.064 13.271 1.00 0.00 H new ATOM 0 HG SER A 6 -11.596 0.218 15.152 1.00 0.00 H new ATOM 59 N GLY A 7 -9.849 -1.433 10.844 1.00 0.00 N ATOM 60 CA GLY A 7 -9.084 -2.549 10.314 1.00 0.00 C ATOM 61 C GLY A 7 -7.887 -2.055 9.499 1.00 0.00 C ATOM 62 O GLY A 7 -6.775 -2.556 9.658 1.00 0.00 O ATOM 0 H GLY A 7 -10.811 -1.378 10.509 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -8.736 -3.178 11.133 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -9.725 -3.169 9.687 1.00 0.00 H new ATOM 66 N LEU A 8 -8.156 -1.080 8.643 1.00 0.00 N ATOM 67 CA LEU A 8 -7.115 -0.514 7.803 1.00 0.00 C ATOM 68 C LEU A 8 -5.998 0.043 8.688 1.00 0.00 C ATOM 69 O LEU A 8 -4.844 -0.366 8.569 1.00 0.00 O ATOM 70 CB LEU A 8 -7.706 0.516 6.838 1.00 0.00 C ATOM 71 CG LEU A 8 -8.857 0.026 5.957 1.00 0.00 C ATOM 72 CD1 LEU A 8 -9.342 1.135 5.022 1.00 0.00 C ATOM 73 CD2 LEU A 8 -8.461 -1.238 5.191 1.00 0.00 C ATOM 0 H LEU A 8 -9.080 -0.668 8.513 1.00 0.00 H new ATOM 0 HA LEU A 8 -6.670 -1.286 7.175 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -8.057 1.369 7.419 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.907 0.878 6.190 1.00 0.00 H new ATOM 0 HG LEU A 8 -9.694 -0.238 6.603 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -10.160 0.760 4.407 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -9.690 1.982 5.613 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -8.521 1.454 4.379 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -9.297 -1.565 4.573 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -7.601 -1.024 4.556 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -8.202 -2.026 5.898 1.00 0.00 H new ATOM 85 N HIS A 9 -6.380 0.969 9.555 1.00 0.00 N ATOM 86 CA HIS A 9 -5.425 1.587 10.460 1.00 0.00 C ATOM 87 C HIS A 9 -4.498 0.515 11.037 1.00 0.00 C ATOM 88 O HIS A 9 -3.306 0.756 11.223 1.00 0.00 O ATOM 89 CB HIS A 9 -6.146 2.393 11.543 1.00 0.00 C ATOM 90 CG HIS A 9 -6.327 3.853 11.204 1.00 0.00 C ATOM 91 ND1 HIS A 9 -7.420 4.590 11.624 1.00 0.00 N ATOM 92 CD2 HIS A 9 -5.543 4.704 10.482 1.00 0.00 C ATOM 93 CE1 HIS A 9 -7.290 5.828 11.169 1.00 0.00 C ATOM 94 NE2 HIS A 9 -6.126 5.896 10.461 1.00 0.00 N ATOM 0 H HIS A 9 -7.338 1.307 9.650 1.00 0.00 H new ATOM 0 HA HIS A 9 -4.806 2.297 9.912 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -7.125 1.948 11.721 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -5.585 2.314 12.474 1.00 0.00 H new ATOM 0 HD1 HIS A 9 -8.194 4.240 12.188 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -4.606 4.451 10.008 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -7.984 6.640 11.330 1.00 0.00 H new ATOM 102 N ARG A 10 -5.080 -0.644 11.304 1.00 0.00 N ATOM 103 CA ARG A 10 -4.320 -1.753 11.855 1.00 0.00 C ATOM 104 C ARG A 10 -3.381 -2.333 10.796 1.00 0.00 C ATOM 105 O ARG A 10 -2.207 -2.577 11.069 1.00 0.00 O ATOM 106 CB ARG A 10 -5.249 -2.858 12.363 1.00 0.00 C ATOM 107 CG ARG A 10 -4.608 -4.237 12.187 1.00 0.00 C ATOM 108 CD ARG A 10 -3.261 -4.311 12.907 1.00 0.00 C ATOM 109 NE ARG A 10 -3.428 -4.955 14.229 1.00 0.00 N ATOM 110 CZ ARG A 10 -2.497 -4.945 15.193 1.00 0.00 C ATOM 111 NH1 ARG A 10 -1.327 -4.324 14.987 1.00 0.00 N ATOM 112 NH2 ARG A 10 -2.735 -5.555 16.361 1.00 0.00 N ATOM 0 H ARG A 10 -6.069 -0.840 11.149 1.00 0.00 H new ATOM 0 HA ARG A 10 -3.736 -1.371 12.692 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -5.477 -2.691 13.416 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -6.194 -2.821 11.822 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -5.276 -5.005 12.577 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -4.469 -4.445 11.126 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -2.549 -4.876 12.306 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -2.850 -3.309 13.031 1.00 0.00 H new ATOM 0 HE ARG A 10 -4.307 -5.437 14.418 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -1.146 -3.860 14.097 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -0.618 -4.316 15.720 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -3.625 -6.028 16.517 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -2.026 -5.547 17.094 1.00 0.00 H new ATOM 126 N ILE A 11 -3.934 -2.536 9.609 1.00 0.00 N ATOM 127 CA ILE A 11 -3.160 -3.082 8.507 1.00 0.00 C ATOM 128 C ILE A 11 -1.977 -2.157 8.212 1.00 0.00 C ATOM 129 O ILE A 11 -0.838 -2.611 8.122 1.00 0.00 O ATOM 130 CB ILE A 11 -4.059 -3.336 7.295 1.00 0.00 C ATOM 131 CG1 ILE A 11 -4.943 -4.566 7.516 1.00 0.00 C ATOM 132 CG2 ILE A 11 -3.232 -3.448 6.013 1.00 0.00 C ATOM 133 CD1 ILE A 11 -6.346 -4.342 6.948 1.00 0.00 C ATOM 0 H ILE A 11 -4.908 -2.332 9.386 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.746 -4.053 8.777 1.00 0.00 H new ATOM 0 HB ILE A 11 -4.723 -2.479 7.176 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -4.489 -5.435 7.040 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -5.009 -4.784 8.582 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -3.895 -3.628 5.167 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -2.683 -2.520 5.852 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -2.528 -4.275 6.105 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -6.954 -5.231 7.118 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -6.807 -3.487 7.443 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -6.278 -4.148 5.877 1.00 0.00 H new ATOM 145 N VAL A 12 -2.289 -0.877 8.070 1.00 0.00 N ATOM 146 CA VAL A 12 -1.267 0.115 7.787 1.00 0.00 C ATOM 147 C VAL A 12 -0.122 -0.038 8.790 1.00 0.00 C ATOM 148 O VAL A 12 1.041 -0.132 8.401 1.00 0.00 O ATOM 149 CB VAL A 12 -1.882 1.516 7.791 1.00 0.00 C ATOM 150 CG1 VAL A 12 -0.822 2.581 7.500 1.00 0.00 C ATOM 151 CG2 VAL A 12 -3.041 1.609 6.796 1.00 0.00 C ATOM 0 H VAL A 12 -3.236 -0.505 8.146 1.00 0.00 H new ATOM 0 HA VAL A 12 -0.850 -0.040 6.792 1.00 0.00 H new ATOM 0 HB VAL A 12 -2.281 1.704 8.788 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -1.285 3.568 7.509 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -0.045 2.539 8.263 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -0.380 2.396 6.521 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -3.460 2.615 6.819 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -2.677 1.390 5.792 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -3.812 0.888 7.067 1.00 0.00 H new ATOM 161 N ASP A 13 -0.491 -0.059 10.062 1.00 0.00 N ATOM 162 CA ASP A 13 0.490 -0.199 11.125 1.00 0.00 C ATOM 163 C ASP A 13 1.424 -1.366 10.799 1.00 0.00 C ATOM 164 O ASP A 13 2.620 -1.306 11.082 1.00 0.00 O ATOM 165 CB ASP A 13 -0.187 -0.496 12.464 1.00 0.00 C ATOM 166 CG ASP A 13 -0.607 0.739 13.264 1.00 0.00 C ATOM 167 OD1 ASP A 13 0.275 1.294 13.955 1.00 0.00 O ATOM 168 OD2 ASP A 13 -1.799 1.101 13.165 1.00 0.00 O ATOM 0 H ASP A 13 -1.457 0.019 10.381 1.00 0.00 H new ATOM 0 HA ASP A 13 1.042 0.738 11.200 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -1.070 -1.109 12.280 1.00 0.00 H new ATOM 0 HB3 ASP A 13 0.493 -1.091 13.074 1.00 0.00 H new ATOM 173 N LYS A 14 0.844 -2.400 10.208 1.00 0.00 N ATOM 174 CA LYS A 14 1.610 -3.579 9.841 1.00 0.00 C ATOM 175 C LYS A 14 2.497 -3.251 8.639 1.00 0.00 C ATOM 176 O LYS A 14 3.700 -3.506 8.663 1.00 0.00 O ATOM 177 CB LYS A 14 0.680 -4.772 9.611 1.00 0.00 C ATOM 178 CG LYS A 14 1.101 -5.968 10.468 1.00 0.00 C ATOM 179 CD LYS A 14 -0.113 -6.622 11.131 1.00 0.00 C ATOM 180 CE LYS A 14 0.320 -7.603 12.222 1.00 0.00 C ATOM 181 NZ LYS A 14 -0.790 -8.519 12.567 1.00 0.00 N ATOM 0 H LYS A 14 -0.148 -2.446 9.974 1.00 0.00 H new ATOM 0 HA LYS A 14 2.272 -3.872 10.656 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -0.345 -4.490 9.852 1.00 0.00 H new ATOM 0 HB3 LYS A 14 0.695 -5.052 8.558 1.00 0.00 H new ATOM 0 HG2 LYS A 14 1.619 -6.700 9.848 1.00 0.00 H new ATOM 0 HG3 LYS A 14 1.806 -5.642 11.233 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -0.754 -5.853 11.562 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -0.704 -7.146 10.380 1.00 0.00 H new ATOM 0 HE2 LYS A 14 1.181 -8.178 11.881 1.00 0.00 H new ATOM 0 HE3 LYS A 14 0.635 -7.053 13.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -0.479 -9.178 13.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -1.601 -7.967 12.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -1.072 -9.057 11.723 1.00 0.00 H new ATOM 195 N MET A 15 1.869 -2.691 7.615 1.00 0.00 N ATOM 196 CA MET A 15 2.587 -2.325 6.406 1.00 0.00 C ATOM 197 C MET A 15 3.691 -1.310 6.709 1.00 0.00 C ATOM 198 O MET A 15 4.704 -1.262 6.013 1.00 0.00 O ATOM 199 CB MET A 15 1.609 -1.729 5.392 1.00 0.00 C ATOM 200 CG MET A 15 0.378 -2.623 5.226 1.00 0.00 C ATOM 201 SD MET A 15 0.395 -3.392 3.616 1.00 0.00 S ATOM 202 CE MET A 15 -0.360 -2.097 2.646 1.00 0.00 C ATOM 0 H MET A 15 0.871 -2.482 7.598 1.00 0.00 H new ATOM 0 HA MET A 15 3.049 -3.223 5.995 1.00 0.00 H new ATOM 0 HB2 MET A 15 1.300 -0.736 5.719 1.00 0.00 H new ATOM 0 HB3 MET A 15 2.107 -1.607 4.430 1.00 0.00 H new ATOM 0 HG2 MET A 15 0.366 -3.387 6.003 1.00 0.00 H new ATOM 0 HG3 MET A 15 -0.530 -2.032 5.346 1.00 0.00 H new ATOM 0 HE1 MET A 15 -1.003 -2.540 1.885 1.00 0.00 H new ATOM 0 HE2 MET A 15 -0.956 -1.456 3.296 1.00 0.00 H new ATOM 0 HE3 MET A 15 0.417 -1.504 2.164 1.00 0.00 H new ATOM 212 N HIS A 16 3.457 -0.523 7.750 1.00 0.00 N ATOM 213 CA HIS A 16 4.419 0.488 8.154 1.00 0.00 C ATOM 214 C HIS A 16 5.698 -0.189 8.651 1.00 0.00 C ATOM 215 O HIS A 16 6.752 0.442 8.720 1.00 0.00 O ATOM 216 CB HIS A 16 3.809 1.436 9.188 1.00 0.00 C ATOM 217 CG HIS A 16 3.225 2.697 8.597 1.00 0.00 C ATOM 218 ND1 HIS A 16 3.714 3.958 8.889 1.00 0.00 N ATOM 219 CD2 HIS A 16 2.189 2.877 7.728 1.00 0.00 C ATOM 220 CE1 HIS A 16 2.997 4.850 8.221 1.00 0.00 C ATOM 221 NE2 HIS A 16 2.052 4.178 7.503 1.00 0.00 N ATOM 0 H HIS A 16 2.616 -0.565 8.325 1.00 0.00 H new ATOM 0 HA HIS A 16 4.686 1.104 7.295 1.00 0.00 H new ATOM 0 HB2 HIS A 16 3.028 0.907 9.734 1.00 0.00 H new ATOM 0 HB3 HIS A 16 4.576 1.708 9.913 1.00 0.00 H new ATOM 0 HD2 HIS A 16 1.583 2.094 7.296 1.00 0.00 H new ATOM 0 HE1 HIS A 16 3.136 5.921 8.242 1.00 0.00 H new ATOM 0 HE2 HIS A 16 1.355 4.605 6.893 1.00 0.00 H new ATOM 229 N ASP A 17 5.563 -1.464 8.985 1.00 0.00 N ATOM 230 CA ASP A 17 6.694 -2.233 9.474 1.00 0.00 C ATOM 231 C ASP A 17 7.377 -2.931 8.297 1.00 0.00 C ATOM 232 O ASP A 17 6.779 -3.093 7.235 1.00 0.00 O ATOM 233 CB ASP A 17 6.242 -3.309 10.464 1.00 0.00 C ATOM 234 CG ASP A 17 7.319 -3.783 11.441 1.00 0.00 C ATOM 235 OD1 ASP A 17 8.464 -3.972 10.975 1.00 0.00 O ATOM 236 OD2 ASP A 17 6.975 -3.945 12.632 1.00 0.00 O ATOM 0 H ASP A 17 4.687 -1.984 8.926 1.00 0.00 H new ATOM 0 HA ASP A 17 7.377 -1.547 9.974 1.00 0.00 H new ATOM 0 HB2 ASP A 17 5.398 -2.923 11.036 1.00 0.00 H new ATOM 0 HB3 ASP A 17 5.879 -4.169 9.902 1.00 0.00 H new ATOM 241 N THR A 18 8.621 -3.326 8.526 1.00 0.00 N ATOM 242 CA THR A 18 9.393 -4.003 7.498 1.00 0.00 C ATOM 243 C THR A 18 9.617 -5.468 7.877 1.00 0.00 C ATOM 244 O THR A 18 9.937 -6.292 7.022 1.00 0.00 O ATOM 245 CB THR A 18 10.693 -3.223 7.291 1.00 0.00 C ATOM 246 OG1 THR A 18 11.305 -3.859 6.172 1.00 0.00 O ATOM 247 CG2 THR A 18 11.690 -3.434 8.432 1.00 0.00 C ATOM 0 H THR A 18 9.113 -3.190 9.409 1.00 0.00 H new ATOM 0 HA THR A 18 8.856 -4.024 6.550 1.00 0.00 H new ATOM 0 HB THR A 18 10.468 -2.161 7.198 1.00 0.00 H new ATOM 0 HG1 THR A 18 12.154 -3.415 5.967 1.00 0.00 H new ATOM 0 HG21 THR A 18 12.595 -2.859 8.236 1.00 0.00 H new ATOM 0 HG22 THR A 18 11.245 -3.102 9.370 1.00 0.00 H new ATOM 0 HG23 THR A 18 11.942 -4.492 8.504 1.00 0.00 H new ATOM 255 N SER A 19 9.441 -5.748 9.160 1.00 0.00 N ATOM 256 CA SER A 19 9.620 -7.099 9.663 1.00 0.00 C ATOM 257 C SER A 19 8.410 -7.960 9.292 1.00 0.00 C ATOM 258 O SER A 19 8.518 -8.864 8.466 1.00 0.00 O ATOM 259 CB SER A 19 9.827 -7.099 11.179 1.00 0.00 C ATOM 260 OG SER A 19 11.208 -7.066 11.529 1.00 0.00 O ATOM 0 H SER A 19 9.176 -5.062 9.867 1.00 0.00 H new ATOM 0 HA SER A 19 10.513 -7.521 9.202 1.00 0.00 H new ATOM 0 HB2 SER A 19 9.322 -6.236 11.614 1.00 0.00 H new ATOM 0 HB3 SER A 19 9.365 -7.988 11.608 1.00 0.00 H new ATOM 0 HG SER A 19 11.298 -7.065 12.505 1.00 0.00 H new ATOM 266 N THR A 20 7.287 -7.648 9.922 1.00 0.00 N ATOM 267 CA THR A 20 6.059 -8.382 9.669 1.00 0.00 C ATOM 268 C THR A 20 5.188 -7.632 8.660 1.00 0.00 C ATOM 269 O THR A 20 4.129 -8.118 8.267 1.00 0.00 O ATOM 270 CB THR A 20 5.366 -8.621 11.012 1.00 0.00 C ATOM 271 OG1 THR A 20 4.783 -7.360 11.331 1.00 0.00 O ATOM 272 CG2 THR A 20 6.360 -8.870 12.148 1.00 0.00 C ATOM 0 H THR A 20 7.202 -6.897 10.607 1.00 0.00 H new ATOM 0 HA THR A 20 6.264 -9.352 9.216 1.00 0.00 H new ATOM 0 HB THR A 20 4.692 -9.474 10.926 1.00 0.00 H new ATOM 0 HG1 THR A 20 4.311 -7.425 12.187 1.00 0.00 H new ATOM 0 HG21 THR A 20 5.816 -9.034 13.078 1.00 0.00 H new ATOM 0 HG22 THR A 20 6.961 -9.750 11.919 1.00 0.00 H new ATOM 0 HG23 THR A 20 7.013 -8.004 12.257 1.00 0.00 H new ATOM 280 N GLY A 21 5.665 -6.459 8.271 1.00 0.00 N ATOM 281 CA GLY A 21 4.943 -5.636 7.316 1.00 0.00 C ATOM 282 C GLY A 21 5.285 -6.037 5.879 1.00 0.00 C ATOM 283 O GLY A 21 5.893 -7.081 5.650 1.00 0.00 O ATOM 0 H GLY A 21 6.543 -6.059 8.600 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.870 -5.738 7.480 1.00 0.00 H new ATOM 0 HA3 GLY A 21 5.192 -4.586 7.474 1.00 0.00 H new ATOM 287 N ILE A 22 4.879 -5.185 4.949 1.00 0.00 N ATOM 288 CA ILE A 22 5.134 -5.437 3.541 1.00 0.00 C ATOM 289 C ILE A 22 6.621 -5.222 3.250 1.00 0.00 C ATOM 290 O ILE A 22 7.388 -4.873 4.146 1.00 0.00 O ATOM 291 CB ILE A 22 4.208 -4.587 2.668 1.00 0.00 C ATOM 292 CG1 ILE A 22 4.051 -5.202 1.276 1.00 0.00 C ATOM 293 CG2 ILE A 22 4.693 -3.138 2.603 1.00 0.00 C ATOM 294 CD1 ILE A 22 2.589 -5.173 0.826 1.00 0.00 C ATOM 0 H ILE A 22 4.375 -4.320 5.143 1.00 0.00 H new ATOM 0 HA ILE A 22 4.906 -6.474 3.292 1.00 0.00 H new ATOM 0 HB ILE A 22 3.220 -4.575 3.128 1.00 0.00 H new ATOM 0 HG12 ILE A 22 4.666 -4.655 0.561 1.00 0.00 H new ATOM 0 HG13 ILE A 22 4.412 -6.230 1.286 1.00 0.00 H new ATOM 0 HG21 ILE A 22 4.017 -2.556 1.976 1.00 0.00 H new ATOM 0 HG22 ILE A 22 4.711 -2.715 3.607 1.00 0.00 H new ATOM 0 HG23 ILE A 22 5.697 -3.109 2.179 1.00 0.00 H new ATOM 0 HD11 ILE A 22 2.505 -5.616 -0.166 1.00 0.00 H new ATOM 0 HD12 ILE A 22 1.980 -5.741 1.530 1.00 0.00 H new ATOM 0 HD13 ILE A 22 2.239 -4.141 0.794 1.00 0.00 H new ATOM 306 N ARG A 23 6.983 -5.439 1.994 1.00 0.00 N ATOM 307 CA ARG A 23 8.364 -5.274 1.575 1.00 0.00 C ATOM 308 C ARG A 23 8.425 -4.825 0.113 1.00 0.00 C ATOM 309 O ARG A 23 8.455 -5.655 -0.794 1.00 0.00 O ATOM 310 CB ARG A 23 9.148 -6.578 1.733 1.00 0.00 C ATOM 311 CG ARG A 23 9.179 -7.024 3.196 1.00 0.00 C ATOM 312 CD ARG A 23 10.440 -7.839 3.494 1.00 0.00 C ATOM 313 NE ARG A 23 10.129 -9.285 3.454 1.00 0.00 N ATOM 314 CZ ARG A 23 10.117 -10.021 2.334 1.00 0.00 C ATOM 315 NH1 ARG A 23 10.398 -9.450 1.155 1.00 0.00 N ATOM 316 NH2 ARG A 23 9.823 -11.327 2.393 1.00 0.00 N ATOM 0 H ARG A 23 6.344 -5.728 1.253 1.00 0.00 H new ATOM 0 HA ARG A 23 8.815 -4.513 2.212 1.00 0.00 H new ATOM 0 HB2 ARG A 23 8.693 -7.357 1.121 1.00 0.00 H new ATOM 0 HB3 ARG A 23 10.166 -6.441 1.369 1.00 0.00 H new ATOM 0 HG2 ARG A 23 9.144 -6.151 3.847 1.00 0.00 H new ATOM 0 HG3 ARG A 23 8.295 -7.622 3.417 1.00 0.00 H new ATOM 0 HD2 ARG A 23 11.215 -7.605 2.764 1.00 0.00 H new ATOM 0 HD3 ARG A 23 10.834 -7.570 4.474 1.00 0.00 H new ATOM 0 HE ARG A 23 9.910 -9.751 4.334 1.00 0.00 H new ATOM 0 HH11 ARG A 23 10.621 -8.456 1.110 1.00 0.00 H new ATOM 0 HH12 ARG A 23 10.389 -10.010 0.302 1.00 0.00 H new ATOM 0 HH21 ARG A 23 9.608 -11.761 3.291 1.00 0.00 H new ATOM 0 HH22 ARG A 23 9.814 -11.887 1.540 1.00 0.00 H new ATOM 330 N PRO A 24 8.441 -3.478 -0.074 1.00 0.00 N ATOM 331 CA PRO A 24 8.497 -2.909 -1.410 1.00 0.00 C ATOM 332 C PRO A 24 9.901 -3.043 -2.004 1.00 0.00 C ATOM 333 O PRO A 24 10.890 -2.715 -1.350 1.00 0.00 O ATOM 334 CB PRO A 24 8.060 -1.463 -1.240 1.00 0.00 C ATOM 335 CG PRO A 24 8.222 -1.149 0.238 1.00 0.00 C ATOM 336 CD PRO A 24 8.406 -2.465 0.977 1.00 0.00 C ATOM 0 HA PRO A 24 7.848 -3.427 -2.116 1.00 0.00 H new ATOM 0 HB2 PRO A 24 8.670 -0.797 -1.850 1.00 0.00 H new ATOM 0 HB3 PRO A 24 7.026 -1.328 -1.557 1.00 0.00 H new ATOM 0 HG2 PRO A 24 9.082 -0.498 0.398 1.00 0.00 H new ATOM 0 HG3 PRO A 24 7.347 -0.619 0.614 1.00 0.00 H new ATOM 0 HD2 PRO A 24 9.327 -2.467 1.560 1.00 0.00 H new ATOM 0 HD3 PRO A 24 7.588 -2.646 1.674 1.00 0.00 H new ATOM 344 N SER A 25 9.943 -3.526 -3.238 1.00 0.00 N ATOM 345 CA SER A 25 11.208 -3.707 -3.927 1.00 0.00 C ATOM 346 C SER A 25 11.298 -2.749 -5.117 1.00 0.00 C ATOM 347 O SER A 25 10.282 -2.241 -5.587 1.00 0.00 O ATOM 348 CB SER A 25 11.377 -5.154 -4.397 1.00 0.00 C ATOM 349 OG SER A 25 11.970 -5.974 -3.394 1.00 0.00 O ATOM 0 H SER A 25 9.121 -3.797 -3.777 1.00 0.00 H new ATOM 0 HA SER A 25 12.013 -3.484 -3.227 1.00 0.00 H new ATOM 0 HB2 SER A 25 10.404 -5.562 -4.671 1.00 0.00 H new ATOM 0 HB3 SER A 25 11.995 -5.174 -5.294 1.00 0.00 H new ATOM 0 HG SER A 25 12.060 -6.890 -3.731 1.00 0.00 H new ATOM 355 N PRO A 26 12.557 -2.526 -5.582 1.00 0.00 N ATOM 356 CA PRO A 26 12.792 -1.638 -6.708 1.00 0.00 C ATOM 357 C PRO A 26 12.387 -2.303 -8.025 1.00 0.00 C ATOM 358 O PRO A 26 11.622 -1.734 -8.802 1.00 0.00 O ATOM 359 CB PRO A 26 14.274 -1.305 -6.642 1.00 0.00 C ATOM 360 CG PRO A 26 14.904 -2.377 -5.768 1.00 0.00 C ATOM 361 CD PRO A 26 13.784 -3.111 -5.050 1.00 0.00 C ATOM 0 HA PRO A 26 12.190 -0.730 -6.661 1.00 0.00 H new ATOM 0 HB2 PRO A 26 14.718 -1.302 -7.637 1.00 0.00 H new ATOM 0 HB3 PRO A 26 14.433 -0.313 -6.219 1.00 0.00 H new ATOM 0 HG2 PRO A 26 15.487 -3.070 -6.375 1.00 0.00 H new ATOM 0 HG3 PRO A 26 15.589 -1.929 -5.049 1.00 0.00 H new ATOM 0 HD2 PRO A 26 13.827 -4.183 -5.241 1.00 0.00 H new ATOM 0 HD3 PRO A 26 13.851 -2.977 -3.970 1.00 0.00 H new ATOM 369 N ASN A 27 12.917 -3.499 -8.234 1.00 0.00 N ATOM 370 CA ASN A 27 12.620 -4.248 -9.444 1.00 0.00 C ATOM 371 C ASN A 27 12.667 -3.304 -10.647 1.00 0.00 C ATOM 372 O ASN A 27 11.644 -2.751 -11.047 1.00 0.00 O ATOM 373 CB ASN A 27 11.221 -4.864 -9.380 1.00 0.00 C ATOM 374 CG ASN A 27 11.225 -6.149 -8.551 1.00 0.00 C ATOM 375 OD1 ASN A 27 12.183 -6.475 -7.868 1.00 0.00 O ATOM 376 ND2 ASN A 27 10.104 -6.859 -8.647 1.00 0.00 N ATOM 0 H ASN A 27 13.550 -3.968 -7.586 1.00 0.00 H new ATOM 0 HA ASN A 27 13.360 -5.043 -9.540 1.00 0.00 H new ATOM 0 HB2 ASN A 27 10.524 -4.148 -8.944 1.00 0.00 H new ATOM 0 HB3 ASN A 27 10.868 -5.079 -10.389 1.00 0.00 H new ATOM 0 HD21 ASN A 27 10.008 -7.733 -8.131 1.00 0.00 H new ATOM 0 HD22 ASN A 27 9.340 -6.529 -9.237 1.00 0.00 H new ATOM 383 N MET A 28 13.865 -3.149 -11.191 1.00 0.00 N ATOM 384 CA MET A 28 14.059 -2.282 -12.340 1.00 0.00 C ATOM 385 C MET A 28 12.945 -2.479 -13.370 1.00 0.00 C ATOM 386 O MET A 28 12.701 -3.598 -13.818 1.00 0.00 O ATOM 387 CB MET A 28 15.412 -2.585 -12.987 1.00 0.00 C ATOM 388 CG MET A 28 15.647 -1.697 -14.210 1.00 0.00 C ATOM 389 SD MET A 28 16.711 -2.531 -15.375 1.00 0.00 S ATOM 390 CE MET A 28 15.979 -1.985 -16.909 1.00 0.00 C ATOM 0 H MET A 28 14.711 -3.610 -10.857 1.00 0.00 H new ATOM 0 HA MET A 28 14.034 -1.247 -11.998 1.00 0.00 H new ATOM 0 HB2 MET A 28 16.209 -2.428 -12.261 1.00 0.00 H new ATOM 0 HB3 MET A 28 15.451 -3.634 -13.282 1.00 0.00 H new ATOM 0 HG2 MET A 28 14.695 -1.456 -14.683 1.00 0.00 H new ATOM 0 HG3 MET A 28 16.099 -0.754 -13.903 1.00 0.00 H new ATOM 0 HE1 MET A 28 16.394 -2.562 -17.736 1.00 0.00 H new ATOM 0 HE2 MET A 28 14.900 -2.131 -16.870 1.00 0.00 H new ATOM 0 HE3 MET A 28 16.196 -0.928 -17.060 1.00 0.00 H new ATOM 400 N GLU A 29 12.299 -1.375 -13.715 1.00 0.00 N ATOM 401 CA GLU A 29 11.217 -1.413 -14.684 1.00 0.00 C ATOM 402 C GLU A 29 11.439 -0.358 -15.770 1.00 0.00 C ATOM 403 O GLU A 29 11.523 0.833 -15.475 1.00 0.00 O ATOM 404 CB GLU A 29 9.862 -1.219 -14.000 1.00 0.00 C ATOM 405 CG GLU A 29 8.884 -2.328 -14.395 1.00 0.00 C ATOM 406 CD GLU A 29 9.177 -3.616 -13.624 1.00 0.00 C ATOM 407 OE1 GLU A 29 9.209 -3.536 -12.377 1.00 0.00 O ATOM 408 OE2 GLU A 29 9.361 -4.652 -14.298 1.00 0.00 O ATOM 0 H GLU A 29 12.504 -0.449 -13.341 1.00 0.00 H new ATOM 0 HA GLU A 29 11.212 -2.396 -15.156 1.00 0.00 H new ATOM 0 HB2 GLU A 29 9.994 -1.214 -12.918 1.00 0.00 H new ATOM 0 HB3 GLU A 29 9.448 -0.249 -14.275 1.00 0.00 H new ATOM 0 HG2 GLU A 29 7.862 -2.005 -14.196 1.00 0.00 H new ATOM 0 HG3 GLU A 29 8.956 -2.517 -15.466 1.00 0.00 H new ATOM 415 N GLN A 30 11.528 -0.835 -17.003 1.00 0.00 N ATOM 416 CA GLN A 30 11.739 0.052 -18.134 1.00 0.00 C ATOM 417 C GLN A 30 12.726 1.161 -17.763 1.00 0.00 C ATOM 418 O GLN A 30 12.418 2.344 -17.900 1.00 0.00 O ATOM 419 CB GLN A 30 10.415 0.640 -18.625 1.00 0.00 C ATOM 420 CG GLN A 30 9.712 1.416 -17.509 1.00 0.00 C ATOM 421 CD GLN A 30 8.590 2.291 -18.073 1.00 0.00 C ATOM 422 OE1 GLN A 30 7.494 1.835 -18.352 1.00 0.00 O ATOM 423 NE2 GLN A 30 8.924 3.569 -18.223 1.00 0.00 N ATOM 0 H GLN A 30 11.458 -1.824 -17.243 1.00 0.00 H new ATOM 0 HA GLN A 30 12.166 -0.530 -18.951 1.00 0.00 H new ATOM 0 HB2 GLN A 30 10.598 1.301 -19.472 1.00 0.00 H new ATOM 0 HB3 GLN A 30 9.767 -0.161 -18.980 1.00 0.00 H new ATOM 0 HG2 GLN A 30 9.302 0.719 -16.779 1.00 0.00 H new ATOM 0 HG3 GLN A 30 10.435 2.040 -16.983 1.00 0.00 H new ATOM 0 HE21 GLN A 30 9.860 3.885 -17.969 1.00 0.00 H new ATOM 0 HE22 GLN A 30 8.244 4.234 -18.592 1.00 0.00 H new ATOM 432 N GLY A 31 13.894 0.739 -17.299 1.00 0.00 N ATOM 433 CA GLY A 31 14.928 1.681 -16.907 1.00 0.00 C ATOM 434 C GLY A 31 14.582 2.353 -15.577 1.00 0.00 C ATOM 435 O GLY A 31 15.221 2.091 -14.560 1.00 0.00 O ATOM 0 H GLY A 31 14.146 -0.243 -17.186 1.00 0.00 H new ATOM 0 HA2 GLY A 31 15.883 1.163 -16.819 1.00 0.00 H new ATOM 0 HA3 GLY A 31 15.047 2.439 -17.681 1.00 0.00 H new ATOM 439 N SER A 32 13.570 3.207 -15.628 1.00 0.00 N ATOM 440 CA SER A 32 13.131 3.919 -14.439 1.00 0.00 C ATOM 441 C SER A 32 12.822 2.924 -13.318 1.00 0.00 C ATOM 442 O SER A 32 11.768 2.290 -13.320 1.00 0.00 O ATOM 443 CB SER A 32 11.903 4.782 -14.737 1.00 0.00 C ATOM 444 OG SER A 32 12.152 6.165 -14.498 1.00 0.00 O ATOM 0 H SER A 32 13.042 3.422 -16.474 1.00 0.00 H new ATOM 0 HA SER A 32 13.936 4.579 -14.118 1.00 0.00 H new ATOM 0 HB2 SER A 32 11.605 4.642 -15.776 1.00 0.00 H new ATOM 0 HB3 SER A 32 11.069 4.452 -14.118 1.00 0.00 H new ATOM 0 HG SER A 32 11.345 6.683 -14.701 1.00 0.00 H new ATOM 450 N THR A 33 13.760 2.820 -12.389 1.00 0.00 N ATOM 451 CA THR A 33 13.601 1.913 -11.264 1.00 0.00 C ATOM 452 C THR A 33 12.671 2.524 -10.214 1.00 0.00 C ATOM 453 O THR A 33 12.992 3.552 -9.619 1.00 0.00 O ATOM 454 CB THR A 33 14.993 1.581 -10.724 1.00 0.00 C ATOM 455 OG1 THR A 33 15.578 0.776 -11.744 1.00 0.00 O ATOM 456 CG2 THR A 33 14.943 0.659 -9.504 1.00 0.00 C ATOM 0 H THR A 33 14.633 3.348 -12.391 1.00 0.00 H new ATOM 0 HA THR A 33 13.125 0.981 -11.571 1.00 0.00 H new ATOM 0 HB THR A 33 15.510 2.504 -10.460 1.00 0.00 H new ATOM 0 HG1 THR A 33 15.565 1.264 -12.594 1.00 0.00 H new ATOM 0 HG21 THR A 33 15.957 0.455 -9.161 1.00 0.00 H new ATOM 0 HG22 THR A 33 14.380 1.142 -8.706 1.00 0.00 H new ATOM 0 HG23 THR A 33 14.456 -0.278 -9.776 1.00 0.00 H new ATOM 464 N TYR A 34 11.538 1.866 -10.017 1.00 0.00 N ATOM 465 CA TYR A 34 10.560 2.332 -9.049 1.00 0.00 C ATOM 466 C TYR A 34 10.914 1.854 -7.639 1.00 0.00 C ATOM 467 O TYR A 34 10.564 0.740 -7.252 1.00 0.00 O ATOM 468 CB TYR A 34 9.226 1.711 -9.466 1.00 0.00 C ATOM 469 CG TYR A 34 8.652 2.282 -10.764 1.00 0.00 C ATOM 470 CD1 TYR A 34 9.186 1.903 -11.979 1.00 0.00 C ATOM 471 CD2 TYR A 34 7.601 3.175 -10.720 1.00 0.00 C ATOM 472 CE1 TYR A 34 8.646 2.441 -13.201 1.00 0.00 C ATOM 473 CE2 TYR A 34 7.061 3.712 -11.942 1.00 0.00 C ATOM 474 CZ TYR A 34 7.611 3.318 -13.123 1.00 0.00 C ATOM 475 OH TYR A 34 7.101 3.826 -14.277 1.00 0.00 O ATOM 0 H TYR A 34 11.275 1.013 -10.512 1.00 0.00 H new ATOM 0 HA TYR A 34 10.526 3.421 -9.031 1.00 0.00 H new ATOM 0 HB2 TYR A 34 9.358 0.635 -9.582 1.00 0.00 H new ATOM 0 HB3 TYR A 34 8.502 1.859 -8.665 1.00 0.00 H new ATOM 0 HD1 TYR A 34 10.008 1.204 -12.013 1.00 0.00 H new ATOM 0 HD2 TYR A 34 7.183 3.471 -9.769 1.00 0.00 H new ATOM 0 HE1 TYR A 34 9.055 2.154 -14.158 1.00 0.00 H new ATOM 0 HE2 TYR A 34 6.238 4.411 -11.922 1.00 0.00 H new ATOM 0 HH TYR A 34 6.365 4.438 -14.068 1.00 0.00 H new ATOM 485 N LYS A 35 11.602 2.720 -6.910 1.00 0.00 N ATOM 486 CA LYS A 35 12.007 2.400 -5.552 1.00 0.00 C ATOM 487 C LYS A 35 10.845 2.684 -4.598 1.00 0.00 C ATOM 488 O LYS A 35 10.046 3.588 -4.839 1.00 0.00 O ATOM 489 CB LYS A 35 13.296 3.139 -5.189 1.00 0.00 C ATOM 490 CG LYS A 35 14.473 2.168 -5.076 1.00 0.00 C ATOM 491 CD LYS A 35 15.612 2.779 -4.258 1.00 0.00 C ATOM 492 CE LYS A 35 16.772 1.792 -4.111 1.00 0.00 C ATOM 493 NZ LYS A 35 17.088 1.572 -2.682 1.00 0.00 N ATOM 0 H LYS A 35 11.889 3.643 -7.234 1.00 0.00 H new ATOM 0 HA LYS A 35 12.240 1.339 -5.464 1.00 0.00 H new ATOM 0 HB2 LYS A 35 13.513 3.892 -5.947 1.00 0.00 H new ATOM 0 HB3 LYS A 35 13.163 3.666 -4.244 1.00 0.00 H new ATOM 0 HG2 LYS A 35 14.141 1.241 -4.608 1.00 0.00 H new ATOM 0 HG3 LYS A 35 14.833 1.911 -6.072 1.00 0.00 H new ATOM 0 HD2 LYS A 35 15.964 3.690 -4.742 1.00 0.00 H new ATOM 0 HD3 LYS A 35 15.245 3.063 -3.272 1.00 0.00 H new ATOM 0 HE2 LYS A 35 16.512 0.844 -4.582 1.00 0.00 H new ATOM 0 HE3 LYS A 35 17.651 2.175 -4.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 17.877 0.900 -2.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 17.356 2.476 -2.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 16.253 1.186 -2.197 1.00 0.00 H new ATOM 507 N LYS A 36 10.787 1.895 -3.535 1.00 0.00 N ATOM 508 CA LYS A 36 9.737 2.051 -2.544 1.00 0.00 C ATOM 509 C LYS A 36 8.390 1.687 -3.173 1.00 0.00 C ATOM 510 O LYS A 36 7.454 2.484 -3.149 1.00 0.00 O ATOM 511 CB LYS A 36 9.773 3.456 -1.940 1.00 0.00 C ATOM 512 CG LYS A 36 10.567 3.471 -0.632 1.00 0.00 C ATOM 513 CD LYS A 36 10.575 4.869 -0.011 1.00 0.00 C ATOM 514 CE LYS A 36 11.873 5.609 -0.342 1.00 0.00 C ATOM 515 NZ LYS A 36 11.918 6.913 0.356 1.00 0.00 N ATOM 0 H LYS A 36 11.451 1.146 -3.339 1.00 0.00 H new ATOM 0 HA LYS A 36 9.896 1.367 -1.710 1.00 0.00 H new ATOM 0 HB2 LYS A 36 10.223 4.150 -2.650 1.00 0.00 H new ATOM 0 HB3 LYS A 36 8.756 3.803 -1.756 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.131 2.760 0.070 1.00 0.00 H new ATOM 0 HG3 LYS A 36 11.591 3.147 -0.820 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.723 5.440 -0.380 1.00 0.00 H new ATOM 0 HD3 LYS A 36 10.462 4.791 1.070 1.00 0.00 H new ATOM 0 HE2 LYS A 36 12.730 5.003 -0.048 1.00 0.00 H new ATOM 0 HE3 LYS A 36 11.946 5.763 -1.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 12.805 7.402 0.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 11.111 7.496 0.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 11.870 6.759 1.383 1.00 0.00 H new ATOM 529 N THR A 37 8.336 0.482 -3.721 1.00 0.00 N ATOM 530 CA THR A 37 7.120 0.002 -4.355 1.00 0.00 C ATOM 531 C THR A 37 7.001 -1.515 -4.202 1.00 0.00 C ATOM 532 O THR A 37 8.010 -2.214 -4.108 1.00 0.00 O ATOM 533 CB THR A 37 7.131 0.468 -5.812 1.00 0.00 C ATOM 534 OG1 THR A 37 8.425 0.101 -6.283 1.00 0.00 O ATOM 535 CG2 THR A 37 7.107 1.992 -5.940 1.00 0.00 C ATOM 0 H THR A 37 9.115 -0.176 -3.739 1.00 0.00 H new ATOM 0 HA THR A 37 6.233 0.415 -3.874 1.00 0.00 H new ATOM 0 HB THR A 37 6.272 0.047 -6.334 1.00 0.00 H new ATOM 0 HG1 THR A 37 8.897 0.900 -6.598 1.00 0.00 H new ATOM 0 HG21 THR A 37 7.116 2.269 -6.994 1.00 0.00 H new ATOM 0 HG22 THR A 37 6.204 2.382 -5.470 1.00 0.00 H new ATOM 0 HG23 THR A 37 7.984 2.412 -5.447 1.00 0.00 H new ATOM 543 N PHE A 38 5.761 -1.981 -4.183 1.00 0.00 N ATOM 544 CA PHE A 38 5.498 -3.403 -4.044 1.00 0.00 C ATOM 545 C PHE A 38 4.474 -3.876 -5.078 1.00 0.00 C ATOM 546 O PHE A 38 3.441 -3.236 -5.271 1.00 0.00 O ATOM 547 CB PHE A 38 4.924 -3.617 -2.641 1.00 0.00 C ATOM 548 CG PHE A 38 3.680 -2.777 -2.343 1.00 0.00 C ATOM 549 CD1 PHE A 38 2.448 -3.247 -2.675 1.00 0.00 C ATOM 550 CD2 PHE A 38 3.807 -1.562 -1.747 1.00 0.00 C ATOM 551 CE1 PHE A 38 1.293 -2.467 -2.399 1.00 0.00 C ATOM 552 CE2 PHE A 38 2.653 -0.783 -1.471 1.00 0.00 C ATOM 553 CZ PHE A 38 1.420 -1.252 -1.802 1.00 0.00 C ATOM 0 H PHE A 38 4.927 -1.399 -4.262 1.00 0.00 H new ATOM 0 HA PHE A 38 6.418 -3.968 -4.199 1.00 0.00 H new ATOM 0 HB2 PHE A 38 4.676 -4.671 -2.518 1.00 0.00 H new ATOM 0 HB3 PHE A 38 5.693 -3.382 -1.905 1.00 0.00 H new ATOM 0 HD1 PHE A 38 2.348 -4.213 -3.148 1.00 0.00 H new ATOM 0 HD2 PHE A 38 4.786 -1.189 -1.483 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.314 -2.839 -2.663 1.00 0.00 H new ATOM 0 HE2 PHE A 38 2.754 0.183 -0.998 1.00 0.00 H new ATOM 0 HZ PHE A 38 0.542 -0.660 -1.591 1.00 0.00 H new ATOM 563 N LEU A 39 4.796 -4.991 -5.716 1.00 0.00 N ATOM 564 CA LEU A 39 3.918 -5.556 -6.726 1.00 0.00 C ATOM 565 C LEU A 39 2.500 -5.660 -6.161 1.00 0.00 C ATOM 566 O LEU A 39 2.318 -5.817 -4.955 1.00 0.00 O ATOM 567 CB LEU A 39 4.475 -6.886 -7.237 1.00 0.00 C ATOM 568 CG LEU A 39 5.953 -6.887 -7.632 1.00 0.00 C ATOM 569 CD1 LEU A 39 6.355 -8.227 -8.251 1.00 0.00 C ATOM 570 CD2 LEU A 39 6.274 -5.709 -8.555 1.00 0.00 C ATOM 0 H LEU A 39 5.653 -5.519 -5.553 1.00 0.00 H new ATOM 0 HA LEU A 39 3.868 -4.902 -7.597 1.00 0.00 H new ATOM 0 HB2 LEU A 39 4.325 -7.640 -6.465 1.00 0.00 H new ATOM 0 HB3 LEU A 39 3.888 -7.195 -8.102 1.00 0.00 H new ATOM 0 HG LEU A 39 6.548 -6.760 -6.728 1.00 0.00 H new ATOM 0 HD11 LEU A 39 7.410 -8.200 -8.523 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.186 -9.026 -7.529 1.00 0.00 H new ATOM 0 HD13 LEU A 39 5.755 -8.410 -9.143 1.00 0.00 H new ATOM 0 HD21 LEU A 39 7.331 -5.733 -8.821 1.00 0.00 H new ATOM 0 HD22 LEU A 39 5.670 -5.781 -9.460 1.00 0.00 H new ATOM 0 HD23 LEU A 39 6.050 -4.774 -8.042 1.00 0.00 H new ATOM 582 N GLY A 40 1.531 -5.569 -7.060 1.00 0.00 N ATOM 583 CA GLY A 40 0.134 -5.651 -6.667 1.00 0.00 C ATOM 584 C GLY A 40 -0.163 -6.982 -5.974 1.00 0.00 C ATOM 585 O GLY A 40 -0.887 -7.021 -4.980 1.00 0.00 O ATOM 0 H GLY A 40 1.686 -5.439 -8.060 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.108 -4.826 -5.997 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -0.502 -5.545 -7.546 1.00 0.00 H new ATOM 589 N SER A 41 0.412 -8.041 -6.526 1.00 0.00 N ATOM 590 CA SER A 41 0.217 -9.371 -5.973 1.00 0.00 C ATOM 591 C SER A 41 0.851 -9.458 -4.583 1.00 0.00 C ATOM 592 O SER A 41 0.296 -10.085 -3.682 1.00 0.00 O ATOM 593 CB SER A 41 0.807 -10.441 -6.893 1.00 0.00 C ATOM 594 OG SER A 41 0.502 -11.759 -6.444 1.00 0.00 O ATOM 0 H SER A 41 1.012 -8.005 -7.350 1.00 0.00 H new ATOM 0 HA SER A 41 -0.854 -9.553 -5.889 1.00 0.00 H new ATOM 0 HB2 SER A 41 0.421 -10.304 -7.903 1.00 0.00 H new ATOM 0 HB3 SER A 41 1.889 -10.317 -6.946 1.00 0.00 H new ATOM 0 HG SER A 41 0.895 -12.413 -7.059 1.00 0.00 H new ATOM 600 N SER A 42 2.004 -8.819 -4.452 1.00 0.00 N ATOM 601 CA SER A 42 2.719 -8.816 -3.187 1.00 0.00 C ATOM 602 C SER A 42 1.783 -8.383 -2.058 1.00 0.00 C ATOM 603 O SER A 42 1.734 -9.022 -1.008 1.00 0.00 O ATOM 604 CB SER A 42 3.940 -7.896 -3.247 1.00 0.00 C ATOM 605 OG SER A 42 3.630 -6.570 -2.828 1.00 0.00 O ATOM 0 H SER A 42 2.461 -8.299 -5.201 1.00 0.00 H new ATOM 0 HA SER A 42 3.070 -9.829 -2.990 1.00 0.00 H new ATOM 0 HB2 SER A 42 4.730 -8.301 -2.615 1.00 0.00 H new ATOM 0 HB3 SER A 42 4.327 -7.873 -4.266 1.00 0.00 H new ATOM 0 HG SER A 42 3.092 -6.127 -3.517 1.00 0.00 H new ATOM 611 N LEU A 43 1.062 -7.300 -2.312 1.00 0.00 N ATOM 612 CA LEU A 43 0.130 -6.774 -1.330 1.00 0.00 C ATOM 613 C LEU A 43 -0.952 -7.819 -1.050 1.00 0.00 C ATOM 614 O LEU A 43 -1.131 -8.241 0.092 1.00 0.00 O ATOM 615 CB LEU A 43 -0.423 -5.422 -1.786 1.00 0.00 C ATOM 616 CG LEU A 43 -1.512 -4.811 -0.902 1.00 0.00 C ATOM 617 CD1 LEU A 43 -1.230 -5.075 0.578 1.00 0.00 C ATOM 618 CD2 LEU A 43 -1.682 -3.319 -1.196 1.00 0.00 C ATOM 0 H LEU A 43 1.105 -6.773 -3.184 1.00 0.00 H new ATOM 0 HA LEU A 43 0.639 -6.581 -0.386 1.00 0.00 H new ATOM 0 HB2 LEU A 43 0.405 -4.716 -1.849 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.822 -5.536 -2.794 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.458 -5.297 -1.140 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.019 -4.630 1.184 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.198 -6.150 0.756 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -0.271 -4.634 0.850 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.462 -2.908 -0.555 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -0.743 -2.801 -1.003 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.963 -3.184 -2.241 1.00 0.00 H new ATOM 630 N VAL A 44 -1.646 -8.205 -2.110 1.00 0.00 N ATOM 631 CA VAL A 44 -2.706 -9.192 -1.993 1.00 0.00 C ATOM 632 C VAL A 44 -2.212 -10.365 -1.144 1.00 0.00 C ATOM 633 O VAL A 44 -2.769 -10.645 -0.083 1.00 0.00 O ATOM 634 CB VAL A 44 -3.180 -9.618 -3.384 1.00 0.00 C ATOM 635 CG1 VAL A 44 -4.259 -10.698 -3.288 1.00 0.00 C ATOM 636 CG2 VAL A 44 -3.679 -8.414 -4.186 1.00 0.00 C ATOM 0 H VAL A 44 -1.495 -7.852 -3.055 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.572 -8.765 -1.486 1.00 0.00 H new ATOM 0 HB VAL A 44 -2.327 -10.043 -3.913 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -4.579 -10.983 -4.290 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -3.856 -11.570 -2.774 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -5.113 -10.311 -2.731 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -4.010 -8.745 -5.171 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -4.512 -7.947 -3.661 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -2.871 -7.692 -4.299 1.00 0.00 H new ATOM 646 N ASP A 45 -1.173 -11.019 -1.642 1.00 0.00 N ATOM 647 CA ASP A 45 -0.599 -12.155 -0.943 1.00 0.00 C ATOM 648 C ASP A 45 -0.331 -11.770 0.514 1.00 0.00 C ATOM 649 O ASP A 45 -0.713 -12.494 1.431 1.00 0.00 O ATOM 650 CB ASP A 45 0.731 -12.575 -1.573 1.00 0.00 C ATOM 651 CG ASP A 45 1.125 -14.035 -1.338 1.00 0.00 C ATOM 652 OD1 ASP A 45 0.271 -14.905 -1.613 1.00 0.00 O ATOM 653 OD2 ASP A 45 2.272 -14.247 -0.889 1.00 0.00 O ATOM 0 H ASP A 45 -0.714 -10.783 -2.522 1.00 0.00 H new ATOM 0 HA ASP A 45 -1.306 -12.982 -1.007 1.00 0.00 H new ATOM 0 HB2 ASP A 45 0.680 -12.397 -2.647 1.00 0.00 H new ATOM 0 HB3 ASP A 45 1.520 -11.934 -1.181 1.00 0.00 H new ATOM 658 N TRP A 46 0.323 -10.630 0.680 1.00 0.00 N ATOM 659 CA TRP A 46 0.647 -10.140 2.009 1.00 0.00 C ATOM 660 C TRP A 46 -0.652 -10.066 2.814 1.00 0.00 C ATOM 661 O TRP A 46 -0.819 -10.786 3.798 1.00 0.00 O ATOM 662 CB TRP A 46 1.382 -8.800 1.935 1.00 0.00 C ATOM 663 CG TRP A 46 1.764 -8.224 3.300 1.00 0.00 C ATOM 664 CD1 TRP A 46 2.890 -8.431 3.997 1.00 0.00 C ATOM 665 CD2 TRP A 46 0.970 -7.332 4.111 1.00 0.00 C ATOM 666 NE1 TRP A 46 2.880 -7.741 5.192 1.00 0.00 N ATOM 667 CE2 TRP A 46 1.675 -7.052 5.263 1.00 0.00 C ATOM 668 CE3 TRP A 46 -0.303 -6.781 3.877 1.00 0.00 C ATOM 669 CZ2 TRP A 46 1.189 -6.212 6.273 1.00 0.00 C ATOM 670 CZ3 TRP A 46 -0.773 -5.945 4.896 1.00 0.00 C ATOM 671 CH2 TRP A 46 -0.076 -5.652 6.062 1.00 0.00 C ATOM 0 H TRP A 46 0.637 -10.031 -0.084 1.00 0.00 H new ATOM 0 HA TRP A 46 1.332 -10.820 2.515 1.00 0.00 H new ATOM 0 HB2 TRP A 46 2.286 -8.925 1.339 1.00 0.00 H new ATOM 0 HB3 TRP A 46 0.753 -8.080 1.412 1.00 0.00 H new ATOM 0 HD1 TRP A 46 3.703 -9.059 3.665 1.00 0.00 H new ATOM 0 HE1 TRP A 46 3.620 -7.737 5.894 1.00 0.00 H new ATOM 0 HE3 TRP A 46 -0.872 -6.987 2.982 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 1.760 -6.007 7.167 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 -1.747 -5.496 4.767 1.00 0.00 H new ATOM 0 HH2 TRP A 46 -0.509 -4.995 6.802 1.00 0.00 H new ATOM 682 N LEU A 47 -1.539 -9.188 2.368 1.00 0.00 N ATOM 683 CA LEU A 47 -2.817 -9.011 3.035 1.00 0.00 C ATOM 684 C LEU A 47 -3.341 -10.373 3.495 1.00 0.00 C ATOM 685 O LEU A 47 -3.751 -10.528 4.644 1.00 0.00 O ATOM 686 CB LEU A 47 -3.791 -8.250 2.133 1.00 0.00 C ATOM 687 CG LEU A 47 -3.685 -6.724 2.167 1.00 0.00 C ATOM 688 CD1 LEU A 47 -4.279 -6.105 0.901 1.00 0.00 C ATOM 689 CD2 LEU A 47 -4.325 -6.159 3.437 1.00 0.00 C ATOM 0 H LEU A 47 -1.397 -8.592 1.553 1.00 0.00 H new ATOM 0 HA LEU A 47 -2.699 -8.397 3.928 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.639 -8.582 1.106 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.807 -8.530 2.411 1.00 0.00 H new ATOM 0 HG LEU A 47 -2.629 -6.455 2.191 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -4.191 -5.020 0.951 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -3.740 -6.473 0.028 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -5.331 -6.380 0.820 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.236 -5.073 3.437 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -5.378 -6.437 3.468 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -3.817 -6.564 4.312 1.00 0.00 H new ATOM 701 N ILE A 48 -3.309 -11.325 2.575 1.00 0.00 N ATOM 702 CA ILE A 48 -3.776 -12.669 2.871 1.00 0.00 C ATOM 703 C ILE A 48 -2.898 -13.278 3.967 1.00 0.00 C ATOM 704 O ILE A 48 -3.398 -13.681 5.016 1.00 0.00 O ATOM 705 CB ILE A 48 -3.837 -13.509 1.594 1.00 0.00 C ATOM 706 CG1 ILE A 48 -4.741 -12.852 0.549 1.00 0.00 C ATOM 707 CG2 ILE A 48 -4.267 -14.945 1.903 1.00 0.00 C ATOM 708 CD1 ILE A 48 -4.495 -13.446 -0.839 1.00 0.00 C ATOM 0 H ILE A 48 -2.967 -11.193 1.623 1.00 0.00 H new ATOM 0 HA ILE A 48 -4.796 -12.643 3.255 1.00 0.00 H new ATOM 0 HB ILE A 48 -2.835 -13.558 1.168 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -5.786 -12.990 0.828 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -4.557 -11.778 0.527 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -4.302 -15.521 0.978 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -3.551 -15.400 2.587 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -5.255 -14.938 2.364 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -5.150 -12.962 -1.563 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -3.456 -13.284 -1.125 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -4.704 -14.516 -0.819 1.00 0.00 H new ATOM 720 N SER A 49 -1.604 -13.326 3.686 1.00 0.00 N ATOM 721 CA SER A 49 -0.652 -13.879 4.634 1.00 0.00 C ATOM 722 C SER A 49 -0.804 -13.189 5.991 1.00 0.00 C ATOM 723 O SER A 49 -0.529 -13.787 7.030 1.00 0.00 O ATOM 724 CB SER A 49 0.782 -13.735 4.122 1.00 0.00 C ATOM 725 OG SER A 49 1.742 -14.080 5.117 1.00 0.00 O ATOM 0 H SER A 49 -1.193 -12.991 2.815 1.00 0.00 H new ATOM 0 HA SER A 49 -0.862 -14.942 4.749 1.00 0.00 H new ATOM 0 HB2 SER A 49 0.921 -14.372 3.248 1.00 0.00 H new ATOM 0 HB3 SER A 49 0.950 -12.708 3.797 1.00 0.00 H new ATOM 0 HG SER A 49 2.645 -13.976 4.750 1.00 0.00 H new ATOM 731 N SER A 50 -1.241 -11.939 5.937 1.00 0.00 N ATOM 732 CA SER A 50 -1.432 -11.161 7.149 1.00 0.00 C ATOM 733 C SER A 50 -2.717 -11.600 7.856 1.00 0.00 C ATOM 734 O SER A 50 -2.949 -11.241 9.009 1.00 0.00 O ATOM 735 CB SER A 50 -1.481 -9.663 6.840 1.00 0.00 C ATOM 736 OG SER A 50 -0.248 -9.188 6.309 1.00 0.00 O ATOM 0 H SER A 50 -1.468 -11.446 5.073 1.00 0.00 H new ATOM 0 HA SER A 50 -0.583 -11.341 7.808 1.00 0.00 H new ATOM 0 HB2 SER A 50 -2.282 -9.466 6.128 1.00 0.00 H new ATOM 0 HB3 SER A 50 -1.720 -9.113 7.750 1.00 0.00 H new ATOM 0 HG SER A 50 -0.424 -8.474 5.661 1.00 0.00 H new ATOM 742 N ASN A 51 -3.518 -12.369 7.133 1.00 0.00 N ATOM 743 CA ASN A 51 -4.773 -12.860 7.676 1.00 0.00 C ATOM 744 C ASN A 51 -5.836 -11.765 7.564 1.00 0.00 C ATOM 745 O ASN A 51 -6.848 -11.803 8.262 1.00 0.00 O ATOM 746 CB ASN A 51 -4.628 -13.228 9.154 1.00 0.00 C ATOM 747 CG ASN A 51 -5.716 -14.213 9.584 1.00 0.00 C ATOM 748 OD1 ASN A 51 -6.046 -15.157 8.885 1.00 0.00 O ATOM 749 ND2 ASN A 51 -6.254 -13.942 10.770 1.00 0.00 N ATOM 0 H ASN A 51 -3.322 -12.664 6.176 1.00 0.00 H new ATOM 0 HA ASN A 51 -5.061 -13.746 7.110 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -3.646 -13.667 9.328 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -4.687 -12.327 9.764 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -6.989 -14.541 11.145 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -5.931 -13.135 11.304 1.00 0.00 H new ATOM 756 N PHE A 52 -5.569 -10.815 6.680 1.00 0.00 N ATOM 757 CA PHE A 52 -6.490 -9.711 6.468 1.00 0.00 C ATOM 758 C PHE A 52 -7.514 -10.052 5.384 1.00 0.00 C ATOM 759 O PHE A 52 -8.588 -9.455 5.329 1.00 0.00 O ATOM 760 CB PHE A 52 -5.655 -8.515 6.006 1.00 0.00 C ATOM 761 CG PHE A 52 -4.760 -7.922 7.096 1.00 0.00 C ATOM 762 CD1 PHE A 52 -5.234 -7.781 8.363 1.00 0.00 C ATOM 763 CD2 PHE A 52 -3.490 -7.536 6.798 1.00 0.00 C ATOM 764 CE1 PHE A 52 -4.404 -7.230 9.375 1.00 0.00 C ATOM 765 CE2 PHE A 52 -2.660 -6.986 7.810 1.00 0.00 C ATOM 766 CZ PHE A 52 -3.134 -6.844 9.077 1.00 0.00 C ATOM 0 H PHE A 52 -4.729 -10.787 6.103 1.00 0.00 H new ATOM 0 HA PHE A 52 -7.033 -9.497 7.389 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -5.032 -8.823 5.166 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -6.325 -7.738 5.638 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -6.242 -8.088 8.600 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -3.113 -7.648 5.792 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -4.781 -7.117 10.381 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -1.652 -6.680 7.574 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.502 -6.425 9.846 1.00 0.00 H new ATOM 776 N ALA A 53 -7.145 -11.011 4.547 1.00 0.00 N ATOM 777 CA ALA A 53 -8.019 -11.439 3.468 1.00 0.00 C ATOM 778 C ALA A 53 -8.055 -12.968 3.422 1.00 0.00 C ATOM 779 O ALA A 53 -7.168 -13.630 3.959 1.00 0.00 O ATOM 780 CB ALA A 53 -7.539 -10.828 2.150 1.00 0.00 C ATOM 0 H ALA A 53 -6.253 -11.503 4.594 1.00 0.00 H new ATOM 0 HA ALA A 53 -9.038 -11.090 3.638 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -8.194 -11.149 1.340 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -7.559 -9.741 2.224 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -6.521 -11.159 1.945 1.00 0.00 H new ATOM 786 N ALA A 54 -9.090 -13.484 2.777 1.00 0.00 N ATOM 787 CA ALA A 54 -9.254 -14.923 2.654 1.00 0.00 C ATOM 788 C ALA A 54 -8.833 -15.362 1.250 1.00 0.00 C ATOM 789 O ALA A 54 -8.278 -16.446 1.075 1.00 0.00 O ATOM 790 CB ALA A 54 -10.701 -15.302 2.974 1.00 0.00 C ATOM 0 H ALA A 54 -9.824 -12.932 2.334 1.00 0.00 H new ATOM 0 HA ALA A 54 -8.616 -15.444 3.368 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -10.823 -16.381 2.882 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.941 -14.995 3.992 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -11.371 -14.800 2.277 1.00 0.00 H new ATOM 796 N SER A 55 -9.113 -14.498 0.286 1.00 0.00 N ATOM 797 CA SER A 55 -8.770 -14.783 -1.097 1.00 0.00 C ATOM 798 C SER A 55 -8.241 -13.518 -1.777 1.00 0.00 C ATOM 799 O SER A 55 -8.543 -12.406 -1.347 1.00 0.00 O ATOM 800 CB SER A 55 -9.976 -15.332 -1.861 1.00 0.00 C ATOM 801 OG SER A 55 -11.139 -15.406 -1.041 1.00 0.00 O ATOM 0 H SER A 55 -9.574 -13.600 0.435 1.00 0.00 H new ATOM 0 HA SER A 55 -7.991 -15.545 -1.106 1.00 0.00 H new ATOM 0 HB2 SER A 55 -10.180 -14.696 -2.722 1.00 0.00 H new ATOM 0 HB3 SER A 55 -9.740 -16.324 -2.246 1.00 0.00 H new ATOM 0 HG SER A 55 -11.887 -15.760 -1.566 1.00 0.00 H new ATOM 807 N ARG A 56 -7.462 -13.731 -2.827 1.00 0.00 N ATOM 808 CA ARG A 56 -6.889 -12.622 -3.570 1.00 0.00 C ATOM 809 C ARG A 56 -7.898 -11.476 -3.677 1.00 0.00 C ATOM 810 O ARG A 56 -7.514 -10.309 -3.735 1.00 0.00 O ATOM 811 CB ARG A 56 -6.473 -13.058 -4.977 1.00 0.00 C ATOM 812 CG ARG A 56 -5.092 -13.715 -4.960 1.00 0.00 C ATOM 813 CD ARG A 56 -5.206 -15.234 -5.107 1.00 0.00 C ATOM 814 NE ARG A 56 -4.936 -15.890 -3.808 1.00 0.00 N ATOM 815 CZ ARG A 56 -4.711 -17.203 -3.662 1.00 0.00 C ATOM 816 NH1 ARG A 56 -4.721 -18.008 -4.733 1.00 0.00 N ATOM 817 NH2 ARG A 56 -4.475 -17.711 -2.445 1.00 0.00 N ATOM 0 H ARG A 56 -7.214 -14.655 -3.181 1.00 0.00 H new ATOM 0 HA ARG A 56 -6.005 -12.283 -3.030 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -7.207 -13.757 -5.377 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -6.461 -12.194 -5.641 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -4.484 -13.312 -5.770 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -4.582 -13.473 -4.028 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -6.203 -15.500 -5.458 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -4.499 -15.589 -5.857 1.00 0.00 H new ATOM 0 HE ARG A 56 -4.920 -15.306 -2.972 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -4.900 -17.622 -5.660 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -4.550 -19.007 -4.621 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -4.467 -17.098 -1.629 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -4.304 -18.710 -2.334 1.00 0.00 H new ATOM 831 N LEU A 57 -9.169 -11.850 -3.698 1.00 0.00 N ATOM 832 CA LEU A 57 -10.236 -10.869 -3.797 1.00 0.00 C ATOM 833 C LEU A 57 -10.239 -9.997 -2.539 1.00 0.00 C ATOM 834 O LEU A 57 -9.947 -8.804 -2.606 1.00 0.00 O ATOM 835 CB LEU A 57 -11.575 -11.558 -4.070 1.00 0.00 C ATOM 836 CG LEU A 57 -12.530 -10.819 -5.009 1.00 0.00 C ATOM 837 CD1 LEU A 57 -13.272 -9.704 -4.270 1.00 0.00 C ATOM 838 CD2 LEU A 57 -11.791 -10.295 -6.242 1.00 0.00 C ATOM 0 H LEU A 57 -9.484 -12.819 -3.648 1.00 0.00 H new ATOM 0 HA LEU A 57 -10.066 -10.206 -4.646 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -11.375 -12.544 -4.490 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -12.082 -11.714 -3.118 1.00 0.00 H new ATOM 0 HG LEU A 57 -13.280 -11.528 -5.360 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -13.944 -9.195 -4.960 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -13.850 -10.132 -3.451 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -12.552 -8.990 -3.872 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -12.493 -9.774 -6.893 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -11.006 -9.607 -5.930 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -11.347 -11.131 -6.783 1.00 0.00 H new ATOM 850 N GLU A 58 -10.572 -10.627 -1.422 1.00 0.00 N ATOM 851 CA GLU A 58 -10.617 -9.924 -0.151 1.00 0.00 C ATOM 852 C GLU A 58 -9.412 -8.989 -0.019 1.00 0.00 C ATOM 853 O GLU A 58 -9.541 -7.871 0.478 1.00 0.00 O ATOM 854 CB GLU A 58 -10.678 -10.908 1.018 1.00 0.00 C ATOM 855 CG GLU A 58 -12.105 -11.419 1.231 1.00 0.00 C ATOM 856 CD GLU A 58 -12.124 -12.608 2.194 1.00 0.00 C ATOM 857 OE1 GLU A 58 -11.860 -12.371 3.393 1.00 0.00 O ATOM 858 OE2 GLU A 58 -12.401 -13.726 1.710 1.00 0.00 O ATOM 0 H GLU A 58 -10.813 -11.617 -1.371 1.00 0.00 H new ATOM 0 HA GLU A 58 -11.525 -9.321 -0.123 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -10.012 -11.749 0.825 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -10.323 -10.422 1.926 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -12.727 -10.616 1.627 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -12.536 -11.714 0.274 1.00 0.00 H new ATOM 865 N ALA A 59 -8.269 -9.482 -0.472 1.00 0.00 N ATOM 866 CA ALA A 59 -7.043 -8.705 -0.411 1.00 0.00 C ATOM 867 C ALA A 59 -7.130 -7.543 -1.402 1.00 0.00 C ATOM 868 O ALA A 59 -6.795 -6.409 -1.065 1.00 0.00 O ATOM 869 CB ALA A 59 -5.846 -9.618 -0.686 1.00 0.00 C ATOM 0 H ALA A 59 -8.166 -10.410 -0.883 1.00 0.00 H new ATOM 0 HA ALA A 59 -6.907 -8.280 0.583 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -4.926 -9.035 -0.640 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -5.812 -10.409 0.063 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -5.946 -10.061 -1.677 1.00 0.00 H new ATOM 875 N VAL A 60 -7.581 -7.866 -2.605 1.00 0.00 N ATOM 876 CA VAL A 60 -7.717 -6.863 -3.647 1.00 0.00 C ATOM 877 C VAL A 60 -8.548 -5.693 -3.118 1.00 0.00 C ATOM 878 O VAL A 60 -8.184 -4.533 -3.306 1.00 0.00 O ATOM 879 CB VAL A 60 -8.309 -7.495 -4.908 1.00 0.00 C ATOM 880 CG1 VAL A 60 -8.768 -6.421 -5.897 1.00 0.00 C ATOM 881 CG2 VAL A 60 -7.311 -8.452 -5.563 1.00 0.00 C ATOM 0 H VAL A 60 -7.857 -8.808 -2.881 1.00 0.00 H new ATOM 0 HA VAL A 60 -6.740 -6.468 -3.926 1.00 0.00 H new ATOM 0 HB VAL A 60 -9.184 -8.074 -4.612 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -9.185 -6.898 -6.784 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -9.529 -5.797 -5.429 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -7.917 -5.802 -6.183 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -7.757 -8.887 -6.457 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -6.409 -7.905 -5.837 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -7.055 -9.246 -4.862 1.00 0.00 H new ATOM 891 N THR A 61 -9.650 -6.038 -2.467 1.00 0.00 N ATOM 892 CA THR A 61 -10.536 -5.030 -1.909 1.00 0.00 C ATOM 893 C THR A 61 -9.837 -4.273 -0.779 1.00 0.00 C ATOM 894 O THR A 61 -9.946 -3.051 -0.686 1.00 0.00 O ATOM 895 CB THR A 61 -11.825 -5.726 -1.469 1.00 0.00 C ATOM 896 OG1 THR A 61 -12.719 -5.525 -2.560 1.00 0.00 O ATOM 897 CG2 THR A 61 -12.503 -5.016 -0.295 1.00 0.00 C ATOM 0 H THR A 61 -9.949 -7.001 -2.314 1.00 0.00 H new ATOM 0 HA THR A 61 -10.795 -4.275 -2.651 1.00 0.00 H new ATOM 0 HB THR A 61 -11.604 -6.756 -1.191 1.00 0.00 H new ATOM 0 HG1 THR A 61 -13.581 -5.947 -2.359 1.00 0.00 H new ATOM 0 HG21 THR A 61 -13.413 -5.551 -0.023 1.00 0.00 H new ATOM 0 HG22 THR A 61 -11.825 -4.995 0.558 1.00 0.00 H new ATOM 0 HG23 THR A 61 -12.755 -3.995 -0.583 1.00 0.00 H new ATOM 905 N LEU A 62 -9.136 -5.029 0.052 1.00 0.00 N ATOM 906 CA LEU A 62 -8.419 -4.444 1.173 1.00 0.00 C ATOM 907 C LEU A 62 -7.362 -3.473 0.646 1.00 0.00 C ATOM 908 O LEU A 62 -7.127 -2.422 1.241 1.00 0.00 O ATOM 909 CB LEU A 62 -7.852 -5.540 2.077 1.00 0.00 C ATOM 910 CG LEU A 62 -8.721 -5.943 3.270 1.00 0.00 C ATOM 911 CD1 LEU A 62 -9.196 -7.392 3.138 1.00 0.00 C ATOM 912 CD2 LEU A 62 -7.987 -5.698 4.590 1.00 0.00 C ATOM 0 H LEU A 62 -9.049 -6.042 -0.028 1.00 0.00 H new ATOM 0 HA LEU A 62 -9.098 -3.866 1.800 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -7.671 -6.427 1.469 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -6.884 -5.208 2.454 1.00 0.00 H new ATOM 0 HG LEU A 62 -9.610 -5.312 3.274 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -9.812 -7.653 3.999 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -9.783 -7.501 2.226 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -8.332 -8.056 3.095 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -8.627 -5.993 5.422 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -7.070 -6.287 4.611 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -7.741 -4.640 4.679 1.00 0.00 H new ATOM 924 N ALA A 63 -6.751 -3.859 -0.465 1.00 0.00 N ATOM 925 CA ALA A 63 -5.724 -3.035 -1.079 1.00 0.00 C ATOM 926 C ALA A 63 -6.326 -1.685 -1.473 1.00 0.00 C ATOM 927 O ALA A 63 -5.892 -0.642 -0.987 1.00 0.00 O ATOM 928 CB ALA A 63 -5.122 -3.776 -2.275 1.00 0.00 C ATOM 0 H ALA A 63 -6.948 -4.731 -0.956 1.00 0.00 H new ATOM 0 HA ALA A 63 -4.915 -2.842 -0.374 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -4.351 -3.158 -2.736 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -4.681 -4.714 -1.937 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -5.904 -3.985 -3.005 1.00 0.00 H new ATOM 934 N SER A 64 -7.318 -1.749 -2.350 1.00 0.00 N ATOM 935 CA SER A 64 -7.984 -0.545 -2.815 1.00 0.00 C ATOM 936 C SER A 64 -8.383 0.326 -1.622 1.00 0.00 C ATOM 937 O SER A 64 -8.244 1.548 -1.667 1.00 0.00 O ATOM 938 CB SER A 64 -9.215 -0.886 -3.658 1.00 0.00 C ATOM 939 OG SER A 64 -10.308 -1.321 -2.854 1.00 0.00 O ATOM 0 H SER A 64 -7.676 -2.616 -2.750 1.00 0.00 H new ATOM 0 HA SER A 64 -7.288 0.009 -3.445 1.00 0.00 H new ATOM 0 HB2 SER A 64 -9.514 -0.010 -4.234 1.00 0.00 H new ATOM 0 HB3 SER A 64 -8.959 -1.666 -4.375 1.00 0.00 H new ATOM 0 HG SER A 64 -9.986 -1.957 -2.181 1.00 0.00 H new ATOM 945 N MET A 65 -8.871 -0.336 -0.583 1.00 0.00 N ATOM 946 CA MET A 65 -9.291 0.363 0.619 1.00 0.00 C ATOM 947 C MET A 65 -8.148 1.205 1.192 1.00 0.00 C ATOM 948 O MET A 65 -8.336 2.378 1.508 1.00 0.00 O ATOM 949 CB MET A 65 -9.750 -0.654 1.666 1.00 0.00 C ATOM 950 CG MET A 65 -11.131 -1.214 1.318 1.00 0.00 C ATOM 951 SD MET A 65 -12.227 -1.047 2.717 1.00 0.00 S ATOM 952 CE MET A 65 -12.187 -2.718 3.343 1.00 0.00 C ATOM 0 H MET A 65 -8.985 -1.349 -0.549 1.00 0.00 H new ATOM 0 HA MET A 65 -10.114 1.029 0.361 1.00 0.00 H new ATOM 0 HB2 MET A 65 -9.028 -1.469 1.728 1.00 0.00 H new ATOM 0 HB3 MET A 65 -9.782 -0.181 2.648 1.00 0.00 H new ATOM 0 HG2 MET A 65 -11.542 -0.684 0.459 1.00 0.00 H new ATOM 0 HG3 MET A 65 -11.046 -2.263 1.035 1.00 0.00 H new ATOM 0 HE1 MET A 65 -12.823 -2.792 4.225 1.00 0.00 H new ATOM 0 HE2 MET A 65 -12.549 -3.403 2.576 1.00 0.00 H new ATOM 0 HE3 MET A 65 -11.164 -2.982 3.611 1.00 0.00 H new ATOM 962 N LEU A 66 -6.990 0.572 1.307 1.00 0.00 N ATOM 963 CA LEU A 66 -5.818 1.248 1.836 1.00 0.00 C ATOM 964 C LEU A 66 -5.484 2.449 0.949 1.00 0.00 C ATOM 965 O LEU A 66 -5.222 3.541 1.450 1.00 0.00 O ATOM 966 CB LEU A 66 -4.659 0.262 1.999 1.00 0.00 C ATOM 967 CG LEU A 66 -4.945 -0.974 2.854 1.00 0.00 C ATOM 968 CD1 LEU A 66 -4.072 -2.154 2.421 1.00 0.00 C ATOM 969 CD2 LEU A 66 -4.786 -0.660 4.342 1.00 0.00 C ATOM 0 H LEU A 66 -6.838 -0.401 1.043 1.00 0.00 H new ATOM 0 HA LEU A 66 -6.019 1.635 2.835 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -4.348 -0.070 1.008 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.814 0.794 2.436 1.00 0.00 H new ATOM 0 HG LEU A 66 -5.983 -1.266 2.696 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.295 -3.020 3.045 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.278 -2.395 1.378 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -3.021 -1.889 2.531 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -4.995 -1.556 4.927 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -3.766 -0.329 4.537 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.484 0.129 4.624 1.00 0.00 H new ATOM 981 N MET A 67 -5.503 2.206 -0.353 1.00 0.00 N ATOM 982 CA MET A 67 -5.205 3.254 -1.315 1.00 0.00 C ATOM 983 C MET A 67 -6.146 4.447 -1.134 1.00 0.00 C ATOM 984 O MET A 67 -5.718 5.597 -1.215 1.00 0.00 O ATOM 985 CB MET A 67 -5.349 2.701 -2.734 1.00 0.00 C ATOM 986 CG MET A 67 -4.118 1.885 -3.132 1.00 0.00 C ATOM 987 SD MET A 67 -3.842 2.014 -4.890 1.00 0.00 S ATOM 988 CE MET A 67 -5.441 1.500 -5.494 1.00 0.00 C ATOM 0 H MET A 67 -5.720 1.298 -0.765 1.00 0.00 H new ATOM 0 HA MET A 67 -4.182 3.593 -1.150 1.00 0.00 H new ATOM 0 HB2 MET A 67 -6.240 2.076 -2.796 1.00 0.00 H new ATOM 0 HB3 MET A 67 -5.487 3.523 -3.436 1.00 0.00 H new ATOM 0 HG2 MET A 67 -3.243 2.245 -2.591 1.00 0.00 H new ATOM 0 HG3 MET A 67 -4.258 0.841 -2.853 1.00 0.00 H new ATOM 0 HE1 MET A 67 -5.392 1.351 -6.573 1.00 0.00 H new ATOM 0 HE2 MET A 67 -5.729 0.566 -5.012 1.00 0.00 H new ATOM 0 HE3 MET A 67 -6.180 2.268 -5.267 1.00 0.00 H new ATOM 998 N GLU A 68 -7.410 4.132 -0.891 1.00 0.00 N ATOM 999 CA GLU A 68 -8.414 5.164 -0.698 1.00 0.00 C ATOM 1000 C GLU A 68 -8.115 5.966 0.570 1.00 0.00 C ATOM 1001 O GLU A 68 -8.190 7.193 0.565 1.00 0.00 O ATOM 1002 CB GLU A 68 -9.819 4.559 -0.646 1.00 0.00 C ATOM 1003 CG GLU A 68 -10.536 4.719 -1.988 1.00 0.00 C ATOM 1004 CD GLU A 68 -11.779 5.599 -1.844 1.00 0.00 C ATOM 1005 OE1 GLU A 68 -11.594 6.832 -1.751 1.00 0.00 O ATOM 1006 OE2 GLU A 68 -12.886 5.019 -1.830 1.00 0.00 O ATOM 0 H GLU A 68 -7.761 3.177 -0.823 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.377 5.843 -1.550 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -9.754 3.502 -0.388 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -10.398 5.044 0.140 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -9.856 5.160 -2.717 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -10.822 3.739 -2.371 1.00 0.00 H new ATOM 1013 N GLU A 69 -7.782 5.238 1.626 1.00 0.00 N ATOM 1014 CA GLU A 69 -7.471 5.867 2.899 1.00 0.00 C ATOM 1015 C GLU A 69 -6.252 6.780 2.756 1.00 0.00 C ATOM 1016 O GLU A 69 -5.948 7.562 3.656 1.00 0.00 O ATOM 1017 CB GLU A 69 -7.244 4.816 3.988 1.00 0.00 C ATOM 1018 CG GLU A 69 -8.528 4.564 4.783 1.00 0.00 C ATOM 1019 CD GLU A 69 -8.505 5.317 6.114 1.00 0.00 C ATOM 1020 OE1 GLU A 69 -7.462 5.229 6.798 1.00 0.00 O ATOM 1021 OE2 GLU A 69 -9.530 5.964 6.418 1.00 0.00 O ATOM 0 H GLU A 69 -7.721 4.220 1.626 1.00 0.00 H new ATOM 0 HA GLU A 69 -8.323 6.476 3.199 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -6.904 3.885 3.535 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -6.454 5.150 4.661 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -9.391 4.880 4.197 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -8.642 3.496 4.967 1.00 0.00 H new ATOM 1028 N ASN A 70 -5.585 6.650 1.619 1.00 0.00 N ATOM 1029 CA ASN A 70 -4.406 7.454 1.346 1.00 0.00 C ATOM 1030 C ASN A 70 -3.174 6.757 1.927 1.00 0.00 C ATOM 1031 O ASN A 70 -2.164 7.403 2.204 1.00 0.00 O ATOM 1032 CB ASN A 70 -4.518 8.835 1.996 1.00 0.00 C ATOM 1033 CG ASN A 70 -3.824 9.900 1.145 1.00 0.00 C ATOM 1034 OD1 ASN A 70 -3.245 9.622 0.108 1.00 0.00 O ATOM 1035 ND2 ASN A 70 -3.913 11.131 1.640 1.00 0.00 N ATOM 0 H ASN A 70 -5.839 5.999 0.876 1.00 0.00 H new ATOM 0 HA ASN A 70 -4.319 7.570 0.266 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -5.568 9.096 2.125 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -4.071 8.810 2.990 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -3.481 11.912 1.146 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -4.413 11.294 2.514 1.00 0.00 H new ATOM 1042 N PHE A 71 -3.297 5.449 2.094 1.00 0.00 N ATOM 1043 CA PHE A 71 -2.206 4.657 2.637 1.00 0.00 C ATOM 1044 C PHE A 71 -1.313 4.116 1.519 1.00 0.00 C ATOM 1045 O PHE A 71 -0.165 3.747 1.761 1.00 0.00 O ATOM 1046 CB PHE A 71 -2.836 3.481 3.385 1.00 0.00 C ATOM 1047 CG PHE A 71 -3.572 3.880 4.666 1.00 0.00 C ATOM 1048 CD1 PHE A 71 -3.019 4.790 5.512 1.00 0.00 C ATOM 1049 CD2 PHE A 71 -4.778 3.325 4.959 1.00 0.00 C ATOM 1050 CE1 PHE A 71 -3.701 5.161 6.701 1.00 0.00 C ATOM 1051 CE2 PHE A 71 -5.460 3.695 6.148 1.00 0.00 C ATOM 1052 CZ PHE A 71 -4.907 4.605 6.994 1.00 0.00 C ATOM 0 H PHE A 71 -4.136 4.917 1.863 1.00 0.00 H new ATOM 0 HA PHE A 71 -1.590 5.272 3.292 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -3.535 2.973 2.720 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -2.055 2.763 3.636 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.061 5.231 5.279 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -5.217 2.603 4.287 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -3.262 5.884 7.372 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -6.418 3.254 6.381 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.426 4.886 7.899 1.00 0.00 H new ATOM 1062 N LEU A 72 -1.874 4.085 0.319 1.00 0.00 N ATOM 1063 CA LEU A 72 -1.143 3.595 -0.837 1.00 0.00 C ATOM 1064 C LEU A 72 -1.727 4.217 -2.106 1.00 0.00 C ATOM 1065 O LEU A 72 -2.739 4.915 -2.051 1.00 0.00 O ATOM 1066 CB LEU A 72 -1.129 2.065 -0.852 1.00 0.00 C ATOM 1067 CG LEU A 72 -2.248 1.376 -0.069 1.00 0.00 C ATOM 1068 CD1 LEU A 72 -2.904 0.274 -0.904 1.00 0.00 C ATOM 1069 CD2 LEU A 72 -1.734 0.849 1.272 1.00 0.00 C ATOM 0 H LEU A 72 -2.827 4.391 0.122 1.00 0.00 H new ATOM 0 HA LEU A 72 -0.098 3.900 -0.785 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -1.179 1.731 -1.888 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -0.172 1.726 -0.454 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.018 2.116 0.149 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -3.696 -0.200 -0.324 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -3.328 0.707 -1.810 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -2.156 -0.472 -1.174 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.549 0.364 1.809 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -0.935 0.129 1.098 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.351 1.679 1.866 1.00 0.00 H new ATOM 1081 N ARG A 73 -1.065 3.943 -3.220 1.00 0.00 N ATOM 1082 CA ARG A 73 -1.505 4.468 -4.502 1.00 0.00 C ATOM 1083 C ARG A 73 -1.054 3.546 -5.636 1.00 0.00 C ATOM 1084 O ARG A 73 -0.046 2.853 -5.514 1.00 0.00 O ATOM 1085 CB ARG A 73 -0.949 5.872 -4.743 1.00 0.00 C ATOM 1086 CG ARG A 73 0.550 5.927 -4.440 1.00 0.00 C ATOM 1087 CD ARG A 73 0.804 6.424 -3.015 1.00 0.00 C ATOM 1088 NE ARG A 73 2.031 7.249 -2.978 1.00 0.00 N ATOM 1089 CZ ARG A 73 2.146 8.452 -3.558 1.00 0.00 C ATOM 1090 NH1 ARG A 73 1.108 8.976 -4.224 1.00 0.00 N ATOM 1091 NH2 ARG A 73 3.299 9.130 -3.473 1.00 0.00 N ATOM 0 H ARG A 73 -0.226 3.364 -3.262 1.00 0.00 H new ATOM 0 HA ARG A 73 -2.594 4.520 -4.483 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -1.125 6.164 -5.778 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -1.477 6.589 -4.115 1.00 0.00 H new ATOM 0 HG2 ARG A 73 0.987 4.936 -4.567 1.00 0.00 H new ATOM 0 HG3 ARG A 73 1.045 6.587 -5.153 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -0.048 7.009 -2.668 1.00 0.00 H new ATOM 0 HD3 ARG A 73 0.906 5.576 -2.338 1.00 0.00 H new ATOM 0 HE ARG A 73 2.841 6.879 -2.480 1.00 0.00 H new ATOM 0 HH11 ARG A 73 0.231 8.460 -4.289 1.00 0.00 H new ATOM 0 HH12 ARG A 73 1.195 9.891 -4.665 1.00 0.00 H new ATOM 0 HH21 ARG A 73 4.089 8.731 -2.967 1.00 0.00 H new ATOM 0 HH22 ARG A 73 3.386 10.045 -3.914 1.00 0.00 H new ATOM 1105 N PRO A 74 -1.844 3.568 -6.744 1.00 0.00 N ATOM 1106 CA PRO A 74 -1.536 2.743 -7.899 1.00 0.00 C ATOM 1107 C PRO A 74 -0.356 3.320 -8.686 1.00 0.00 C ATOM 1108 O PRO A 74 -0.490 4.348 -9.347 1.00 0.00 O ATOM 1109 CB PRO A 74 -2.823 2.700 -8.706 1.00 0.00 C ATOM 1110 CG PRO A 74 -3.660 3.872 -8.220 1.00 0.00 C ATOM 1111 CD PRO A 74 -3.046 4.377 -6.924 1.00 0.00 C ATOM 0 HA PRO A 74 -1.219 1.737 -7.625 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -2.618 2.783 -9.773 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -3.347 1.756 -8.555 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -3.678 4.664 -8.968 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -4.693 3.563 -8.058 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.804 5.438 -6.988 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.733 4.257 -6.087 1.00 0.00 H new ATOM 1119 N VAL A 75 0.772 2.632 -8.587 1.00 0.00 N ATOM 1120 CA VAL A 75 1.973 3.063 -9.281 1.00 0.00 C ATOM 1121 C VAL A 75 1.774 2.895 -10.789 1.00 0.00 C ATOM 1122 O VAL A 75 1.206 1.901 -11.237 1.00 0.00 O ATOM 1123 CB VAL A 75 3.187 2.297 -8.750 1.00 0.00 C ATOM 1124 CG1 VAL A 75 4.378 2.428 -9.703 1.00 0.00 C ATOM 1125 CG2 VAL A 75 3.557 2.765 -7.342 1.00 0.00 C ATOM 0 H VAL A 75 0.879 1.780 -8.037 1.00 0.00 H new ATOM 0 HA VAL A 75 2.164 4.120 -9.094 1.00 0.00 H new ATOM 0 HB VAL A 75 2.919 1.242 -8.692 1.00 0.00 H new ATOM 0 HG11 VAL A 75 5.227 1.875 -9.302 1.00 0.00 H new ATOM 0 HG12 VAL A 75 4.109 2.024 -10.679 1.00 0.00 H new ATOM 0 HG13 VAL A 75 4.647 3.479 -9.807 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.423 2.205 -6.988 1.00 0.00 H new ATOM 0 HG22 VAL A 75 3.797 3.828 -7.363 1.00 0.00 H new ATOM 0 HG23 VAL A 75 2.716 2.596 -6.670 1.00 0.00 H new ATOM 1135 N GLY A 76 2.253 3.884 -11.530 1.00 0.00 N ATOM 1136 CA GLY A 76 2.135 3.859 -12.978 1.00 0.00 C ATOM 1137 C GLY A 76 2.857 2.645 -13.567 1.00 0.00 C ATOM 1138 O GLY A 76 3.102 1.664 -12.866 1.00 0.00 O ATOM 0 H GLY A 76 2.723 4.707 -11.155 1.00 0.00 H new ATOM 0 HA2 GLY A 76 1.082 3.833 -13.260 1.00 0.00 H new ATOM 0 HA3 GLY A 76 2.554 4.774 -13.396 1.00 0.00 H new ATOM 1142 N VAL A 77 3.179 2.752 -14.847 1.00 0.00 N ATOM 1143 CA VAL A 77 3.869 1.676 -15.538 1.00 0.00 C ATOM 1144 C VAL A 77 2.857 0.600 -15.936 1.00 0.00 C ATOM 1145 O VAL A 77 2.777 0.219 -17.103 1.00 0.00 O ATOM 1146 CB VAL A 77 5.003 1.135 -14.664 1.00 0.00 C ATOM 1147 CG1 VAL A 77 4.706 -0.293 -14.202 1.00 0.00 C ATOM 1148 CG2 VAL A 77 6.343 1.206 -15.399 1.00 0.00 C ATOM 0 H VAL A 77 2.975 3.568 -15.424 1.00 0.00 H new ATOM 0 HA VAL A 77 4.330 2.045 -16.454 1.00 0.00 H new ATOM 0 HB VAL A 77 5.073 1.766 -13.778 1.00 0.00 H new ATOM 0 HG11 VAL A 77 5.527 -0.653 -13.583 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.783 -0.303 -13.622 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.596 -0.941 -15.071 1.00 0.00 H new ATOM 0 HG21 VAL A 77 7.132 0.816 -14.756 1.00 0.00 H new ATOM 0 HG22 VAL A 77 6.290 0.611 -16.311 1.00 0.00 H new ATOM 0 HG23 VAL A 77 6.563 2.242 -15.655 1.00 0.00 H new ATOM 1158 N ARG A 78 2.109 0.140 -14.944 1.00 0.00 N ATOM 1159 CA ARG A 78 1.106 -0.885 -15.177 1.00 0.00 C ATOM 1160 C ARG A 78 -0.289 -0.346 -14.850 1.00 0.00 C ATOM 1161 O ARG A 78 -1.063 -0.029 -15.752 1.00 0.00 O ATOM 1162 CB ARG A 78 1.378 -2.126 -14.324 1.00 0.00 C ATOM 1163 CG ARG A 78 0.171 -3.066 -14.324 1.00 0.00 C ATOM 1164 CD ARG A 78 -0.109 -3.600 -15.731 1.00 0.00 C ATOM 1165 NE ARG A 78 -1.451 -4.221 -15.779 1.00 0.00 N ATOM 1166 CZ ARG A 78 -2.064 -4.598 -16.909 1.00 0.00 C ATOM 1167 NH1 ARG A 78 -1.459 -4.420 -18.091 1.00 0.00 N ATOM 1168 NH2 ARG A 78 -3.283 -5.154 -16.857 1.00 0.00 N ATOM 0 H ARG A 78 2.177 0.458 -13.977 1.00 0.00 H new ATOM 0 HA ARG A 78 1.155 -1.164 -16.230 1.00 0.00 H new ATOM 0 HB2 ARG A 78 2.253 -2.651 -14.708 1.00 0.00 H new ATOM 0 HB3 ARG A 78 1.610 -1.826 -13.302 1.00 0.00 H new ATOM 0 HG2 ARG A 78 0.354 -3.899 -13.645 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -0.706 -2.537 -13.951 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -0.049 -2.788 -16.456 1.00 0.00 H new ATOM 0 HD3 ARG A 78 0.650 -4.332 -16.009 1.00 0.00 H new ATOM 0 HE ARG A 78 -1.940 -4.372 -14.897 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -0.532 -3.997 -18.131 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -1.926 -4.707 -18.951 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -3.744 -5.290 -15.957 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -3.750 -5.441 -17.717 1.00 0.00 H new ATOM 1182 N SER A 79 -0.567 -0.259 -13.558 1.00 0.00 N ATOM 1183 CA SER A 79 -1.854 0.236 -13.101 1.00 0.00 C ATOM 1184 C SER A 79 -2.062 1.674 -13.580 1.00 0.00 C ATOM 1185 O SER A 79 -1.606 2.044 -14.661 1.00 0.00 O ATOM 1186 CB SER A 79 -1.963 0.164 -11.576 1.00 0.00 C ATOM 1187 OG SER A 79 -1.464 -1.068 -11.063 1.00 0.00 O ATOM 0 H SER A 79 0.077 -0.523 -12.813 1.00 0.00 H new ATOM 0 HA SER A 79 -2.633 -0.398 -13.524 1.00 0.00 H new ATOM 0 HB2 SER A 79 -1.409 0.992 -11.133 1.00 0.00 H new ATOM 0 HB3 SER A 79 -3.005 0.284 -11.281 1.00 0.00 H new ATOM 0 HG SER A 79 -1.776 -1.189 -10.142 1.00 0.00 H new ATOM 1193 N MET A 80 -2.751 2.446 -12.753 1.00 0.00 N ATOM 1194 CA MET A 80 -3.025 3.835 -13.079 1.00 0.00 C ATOM 1195 C MET A 80 -3.843 3.945 -14.368 1.00 0.00 C ATOM 1196 O MET A 80 -4.129 2.938 -15.014 1.00 0.00 O ATOM 1197 CB MET A 80 -1.705 4.590 -13.246 1.00 0.00 C ATOM 1198 CG MET A 80 -1.058 4.871 -11.889 1.00 0.00 C ATOM 1199 SD MET A 80 -0.363 6.514 -11.871 1.00 0.00 S ATOM 1200 CE MET A 80 -1.067 7.133 -10.352 1.00 0.00 C ATOM 0 H MET A 80 -3.128 2.136 -11.857 1.00 0.00 H new ATOM 0 HA MET A 80 -3.604 4.272 -12.265 1.00 0.00 H new ATOM 0 HB2 MET A 80 -1.023 4.005 -13.864 1.00 0.00 H new ATOM 0 HB3 MET A 80 -1.883 5.529 -13.769 1.00 0.00 H new ATOM 0 HG2 MET A 80 -1.800 4.773 -11.096 1.00 0.00 H new ATOM 0 HG3 MET A 80 -0.279 4.136 -11.690 1.00 0.00 H new ATOM 0 HE1 MET A 80 -1.138 8.220 -10.400 1.00 0.00 H new ATOM 0 HE2 MET A 80 -2.062 6.710 -10.213 1.00 0.00 H new ATOM 0 HE3 MET A 80 -0.432 6.847 -9.514 1.00 0.00 H new ATOM 1210 N GLY A 81 -4.196 5.177 -14.703 1.00 0.00 N ATOM 1211 CA GLY A 81 -4.976 5.432 -15.903 1.00 0.00 C ATOM 1212 C GLY A 81 -6.083 6.452 -15.632 1.00 0.00 C ATOM 1213 O GLY A 81 -5.895 7.649 -15.843 1.00 0.00 O ATOM 0 H GLY A 81 -3.957 6.010 -14.165 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -4.323 5.801 -16.694 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -5.415 4.500 -16.260 1.00 0.00 H new ATOM 1217 N ALA A 82 -7.214 5.940 -15.167 1.00 0.00 N ATOM 1218 CA ALA A 82 -8.351 6.792 -14.865 1.00 0.00 C ATOM 1219 C ALA A 82 -8.446 6.991 -13.351 1.00 0.00 C ATOM 1220 O ALA A 82 -8.970 8.001 -12.885 1.00 0.00 O ATOM 1221 CB ALA A 82 -9.622 6.175 -15.452 1.00 0.00 C ATOM 0 H ALA A 82 -7.367 4.947 -14.992 1.00 0.00 H new ATOM 0 HA ALA A 82 -8.225 7.775 -15.320 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -10.475 6.814 -15.225 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -9.516 6.082 -16.533 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -9.782 5.189 -15.017 1.00 0.00 H new ATOM 1227 N ILE A 83 -7.930 6.010 -12.624 1.00 0.00 N ATOM 1228 CA ILE A 83 -7.949 6.064 -11.172 1.00 0.00 C ATOM 1229 C ILE A 83 -9.397 6.179 -10.690 1.00 0.00 C ATOM 1230 O ILE A 83 -10.261 6.665 -11.418 1.00 0.00 O ATOM 1231 CB ILE A 83 -7.042 7.187 -10.666 1.00 0.00 C ATOM 1232 CG1 ILE A 83 -5.736 7.239 -11.462 1.00 0.00 C ATOM 1233 CG2 ILE A 83 -6.791 7.054 -9.162 1.00 0.00 C ATOM 1234 CD1 ILE A 83 -4.845 6.040 -11.132 1.00 0.00 C ATOM 0 H ILE A 83 -7.496 5.173 -13.014 1.00 0.00 H new ATOM 0 HA ILE A 83 -7.544 5.144 -10.751 1.00 0.00 H new ATOM 0 HB ILE A 83 -7.554 8.136 -10.825 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -5.957 7.250 -12.529 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -5.205 8.164 -11.237 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -6.143 7.865 -8.828 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -7.740 7.105 -8.629 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -6.310 6.098 -8.957 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -3.924 6.101 -11.711 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -4.606 6.046 -10.068 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -5.369 5.117 -11.381 1.00 0.00 H new ATOM 1246 N ARG A 84 -9.617 5.722 -9.466 1.00 0.00 N ATOM 1247 CA ARG A 84 -10.945 5.767 -8.878 1.00 0.00 C ATOM 1248 C ARG A 84 -10.849 5.777 -7.351 1.00 0.00 C ATOM 1249 O ARG A 84 -11.632 5.114 -6.672 1.00 0.00 O ATOM 1250 CB ARG A 84 -11.785 4.568 -9.322 1.00 0.00 C ATOM 1251 CG ARG A 84 -12.158 4.678 -10.801 1.00 0.00 C ATOM 1252 CD ARG A 84 -11.128 3.968 -11.681 1.00 0.00 C ATOM 1253 NE ARG A 84 -11.795 2.938 -12.509 1.00 0.00 N ATOM 1254 CZ ARG A 84 -12.487 3.203 -13.625 1.00 0.00 C ATOM 1255 NH1 ARG A 84 -12.608 4.467 -14.054 1.00 0.00 N ATOM 1256 NH2 ARG A 84 -13.058 2.205 -14.313 1.00 0.00 N ATOM 0 H ARG A 84 -8.898 5.319 -8.865 1.00 0.00 H new ATOM 0 HA ARG A 84 -11.429 6.682 -9.221 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -11.229 3.646 -9.151 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -12.691 4.510 -8.718 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -13.143 4.242 -10.964 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -12.223 5.728 -11.086 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -10.624 4.692 -12.322 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -10.362 3.506 -11.058 1.00 0.00 H new ATOM 0 HE ARG A 84 -11.723 1.965 -12.211 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -12.173 5.227 -13.531 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -13.135 4.669 -14.904 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -12.966 1.243 -13.987 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -13.585 2.407 -15.163 1.00 0.00 H new ATOM 1270 N SER A 85 -9.883 6.536 -6.855 1.00 0.00 N ATOM 1271 CA SER A 85 -9.674 6.640 -5.421 1.00 0.00 C ATOM 1272 C SER A 85 -10.656 7.649 -4.821 1.00 0.00 C ATOM 1273 O SER A 85 -10.288 8.791 -4.548 1.00 0.00 O ATOM 1274 CB SER A 85 -8.234 7.046 -5.101 1.00 0.00 C ATOM 1275 OG SER A 85 -7.397 5.914 -4.878 1.00 0.00 O ATOM 0 H SER A 85 -9.236 7.085 -7.421 1.00 0.00 H new ATOM 0 HA SER A 85 -9.853 5.660 -4.978 1.00 0.00 H new ATOM 0 HB2 SER A 85 -7.833 7.637 -5.924 1.00 0.00 H new ATOM 0 HB3 SER A 85 -8.225 7.683 -4.217 1.00 0.00 H new ATOM 0 HG SER A 85 -6.486 6.215 -4.679 1.00 0.00 H new ATOM 1281 N GLY A 86 -11.885 7.192 -4.635 1.00 0.00 N ATOM 1282 CA GLY A 86 -12.922 8.041 -4.074 1.00 0.00 C ATOM 1283 C GLY A 86 -14.205 7.246 -3.823 1.00 0.00 C ATOM 1284 O GLY A 86 -14.723 7.232 -2.707 1.00 0.00 O ATOM 0 H GLY A 86 -12.186 6.245 -4.863 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -12.572 8.479 -3.139 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -13.129 8.867 -4.755 1.00 0.00 H new ATOM 1288 N ASP A 87 -14.681 6.604 -4.879 1.00 0.00 N ATOM 1289 CA ASP A 87 -15.894 5.809 -4.787 1.00 0.00 C ATOM 1290 C ASP A 87 -15.560 4.445 -4.180 1.00 0.00 C ATOM 1291 O ASP A 87 -14.412 4.186 -3.819 1.00 0.00 O ATOM 1292 CB ASP A 87 -16.505 5.574 -6.170 1.00 0.00 C ATOM 1293 CG ASP A 87 -17.317 6.746 -6.725 1.00 0.00 C ATOM 1294 OD1 ASP A 87 -17.846 7.514 -5.894 1.00 0.00 O ATOM 1295 OD2 ASP A 87 -17.391 6.846 -7.969 1.00 0.00 O ATOM 0 H ASP A 87 -14.249 6.618 -5.803 1.00 0.00 H new ATOM 0 HA ASP A 87 -16.606 6.352 -4.166 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -15.703 5.343 -6.871 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -17.149 4.696 -6.122 1.00 0.00 H new ATOM 1300 N LEU A 88 -16.582 3.608 -4.086 1.00 0.00 N ATOM 1301 CA LEU A 88 -16.411 2.276 -3.530 1.00 0.00 C ATOM 1302 C LEU A 88 -15.507 1.455 -4.451 1.00 0.00 C ATOM 1303 O LEU A 88 -15.055 0.373 -4.079 1.00 0.00 O ATOM 1304 CB LEU A 88 -17.771 1.627 -3.265 1.00 0.00 C ATOM 1305 CG LEU A 88 -17.741 0.163 -2.822 1.00 0.00 C ATOM 1306 CD1 LEU A 88 -17.580 -0.770 -4.023 1.00 0.00 C ATOM 1307 CD2 LEU A 88 -16.657 -0.068 -1.767 1.00 0.00 C ATOM 0 H LEU A 88 -17.532 3.826 -4.386 1.00 0.00 H new ATOM 0 HA LEU A 88 -15.915 2.329 -2.561 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -18.285 2.207 -2.499 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -18.369 1.699 -4.174 1.00 0.00 H new ATOM 0 HG LEU A 88 -18.698 -0.073 -2.357 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -17.562 -1.805 -3.680 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -18.416 -0.629 -4.708 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -16.647 -0.542 -4.538 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -16.657 -1.116 -1.469 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -15.683 0.191 -2.183 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -16.858 0.556 -0.896 1.00 0.00 H new ATOM 1319 N ALA A 89 -15.270 2.001 -5.635 1.00 0.00 N ATOM 1320 CA ALA A 89 -14.428 1.332 -6.612 1.00 0.00 C ATOM 1321 C ALA A 89 -13.256 0.659 -5.894 1.00 0.00 C ATOM 1322 O ALA A 89 -12.787 1.151 -4.868 1.00 0.00 O ATOM 1323 CB ALA A 89 -13.964 2.343 -7.663 1.00 0.00 C ATOM 0 H ALA A 89 -15.646 2.899 -5.940 1.00 0.00 H new ATOM 0 HA ALA A 89 -14.987 0.554 -7.132 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -13.332 1.842 -8.396 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -14.832 2.771 -8.164 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -13.397 3.137 -7.178 1.00 0.00 H new ATOM 1329 N GLU A 90 -12.818 -0.455 -6.460 1.00 0.00 N ATOM 1330 CA GLU A 90 -11.710 -1.201 -5.887 1.00 0.00 C ATOM 1331 C GLU A 90 -10.567 -1.313 -6.897 1.00 0.00 C ATOM 1332 O GLU A 90 -10.010 -2.393 -7.093 1.00 0.00 O ATOM 1333 CB GLU A 90 -12.165 -2.584 -5.417 1.00 0.00 C ATOM 1334 CG GLU A 90 -13.347 -2.474 -4.452 1.00 0.00 C ATOM 1335 CD GLU A 90 -14.481 -3.415 -4.864 1.00 0.00 C ATOM 1336 OE1 GLU A 90 -14.683 -3.558 -6.089 1.00 0.00 O ATOM 1337 OE2 GLU A 90 -15.119 -3.971 -3.944 1.00 0.00 O ATOM 0 H GLU A 90 -13.210 -0.860 -7.310 1.00 0.00 H new ATOM 0 HA GLU A 90 -11.345 -0.659 -5.014 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -12.449 -3.189 -6.278 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -11.337 -3.096 -4.927 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -13.019 -2.715 -3.441 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -13.711 -1.447 -4.433 1.00 0.00 H new ATOM 1344 N GLN A 91 -10.250 -0.183 -7.512 1.00 0.00 N ATOM 1345 CA GLN A 91 -9.182 -0.141 -8.497 1.00 0.00 C ATOM 1346 C GLN A 91 -7.905 -0.757 -7.922 1.00 0.00 C ATOM 1347 O GLN A 91 -7.204 -0.122 -7.136 1.00 0.00 O ATOM 1348 CB GLN A 91 -8.933 1.290 -8.975 1.00 0.00 C ATOM 1349 CG GLN A 91 -8.961 1.371 -10.503 1.00 0.00 C ATOM 1350 CD GLN A 91 -7.993 0.362 -11.123 1.00 0.00 C ATOM 1351 OE1 GLN A 91 -8.222 -0.837 -11.124 1.00 0.00 O ATOM 1352 NE2 GLN A 91 -6.902 0.911 -11.648 1.00 0.00 N ATOM 0 H GLN A 91 -10.714 0.710 -7.347 1.00 0.00 H new ATOM 0 HA GLN A 91 -9.489 -0.730 -9.362 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -9.691 1.953 -8.558 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -7.968 1.637 -8.607 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -9.972 1.179 -10.862 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -8.695 2.379 -10.822 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -6.773 1.922 -11.613 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -6.194 0.321 -12.086 1.00 0.00 H new ATOM 1361 N PHE A 92 -7.641 -1.988 -8.337 1.00 0.00 N ATOM 1362 CA PHE A 92 -6.460 -2.697 -7.874 1.00 0.00 C ATOM 1363 C PHE A 92 -6.337 -4.061 -8.556 1.00 0.00 C ATOM 1364 O PHE A 92 -7.315 -4.800 -8.654 1.00 0.00 O ATOM 1365 CB PHE A 92 -6.627 -2.906 -6.367 1.00 0.00 C ATOM 1366 CG PHE A 92 -5.344 -3.335 -5.653 1.00 0.00 C ATOM 1367 CD1 PHE A 92 -4.997 -4.649 -5.607 1.00 0.00 C ATOM 1368 CD2 PHE A 92 -4.550 -2.401 -5.062 1.00 0.00 C ATOM 1369 CE1 PHE A 92 -3.806 -5.047 -4.944 1.00 0.00 C ATOM 1370 CE2 PHE A 92 -3.359 -2.799 -4.399 1.00 0.00 C ATOM 1371 CZ PHE A 92 -3.013 -4.113 -4.354 1.00 0.00 C ATOM 0 H PHE A 92 -8.225 -2.512 -8.989 1.00 0.00 H new ATOM 0 HA PHE A 92 -5.564 -2.122 -8.108 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -6.987 -1.980 -5.920 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -7.395 -3.661 -6.198 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -5.628 -5.390 -6.075 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -4.826 -1.357 -5.097 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -3.530 -6.091 -4.908 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -2.728 -2.058 -3.931 1.00 0.00 H new ATOM 0 HZ PHE A 92 -2.107 -4.415 -3.849 1.00 0.00 H new ATOM 1381 N LEU A 93 -5.127 -4.352 -9.009 1.00 0.00 N ATOM 1382 CA LEU A 93 -4.862 -5.614 -9.679 1.00 0.00 C ATOM 1383 C LEU A 93 -4.088 -6.536 -8.734 1.00 0.00 C ATOM 1384 O LEU A 93 -3.584 -6.093 -7.703 1.00 0.00 O ATOM 1385 CB LEU A 93 -4.160 -5.374 -11.016 1.00 0.00 C ATOM 1386 CG LEU A 93 -4.748 -4.268 -11.894 1.00 0.00 C ATOM 1387 CD1 LEU A 93 -3.662 -3.608 -12.746 1.00 0.00 C ATOM 1388 CD2 LEU A 93 -5.901 -4.800 -12.747 1.00 0.00 C ATOM 0 H LEU A 93 -4.319 -3.736 -8.925 1.00 0.00 H new ATOM 0 HA LEU A 93 -5.797 -6.119 -9.923 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -3.115 -5.136 -10.817 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -4.172 -6.305 -11.582 1.00 0.00 H new ATOM 0 HG LEU A 93 -5.159 -3.497 -11.242 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -4.107 -2.826 -13.361 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -2.904 -3.171 -12.095 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -3.200 -4.356 -13.390 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -6.301 -3.994 -13.362 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -5.538 -5.601 -13.391 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -6.687 -5.185 -12.097 1.00 0.00 H new ATOM 1400 N ASP A 94 -4.018 -7.802 -9.120 1.00 0.00 N ATOM 1401 CA ASP A 94 -3.314 -8.789 -8.320 1.00 0.00 C ATOM 1402 C ASP A 94 -2.310 -9.533 -9.203 1.00 0.00 C ATOM 1403 O ASP A 94 -2.465 -10.727 -9.456 1.00 0.00 O ATOM 1404 CB ASP A 94 -4.284 -9.819 -7.737 1.00 0.00 C ATOM 1405 CG ASP A 94 -3.625 -11.075 -7.163 1.00 0.00 C ATOM 1406 OD1 ASP A 94 -2.837 -10.916 -6.205 1.00 0.00 O ATOM 1407 OD2 ASP A 94 -3.924 -12.166 -7.694 1.00 0.00 O ATOM 0 H ASP A 94 -4.437 -8.166 -9.976 1.00 0.00 H new ATOM 0 HA ASP A 94 -2.810 -8.266 -7.507 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -4.868 -9.341 -6.950 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -4.984 -10.118 -8.517 1.00 0.00 H new ATOM 1412 N ASP A 95 -1.303 -8.796 -9.649 1.00 0.00 N ATOM 1413 CA ASP A 95 -0.274 -9.371 -10.499 1.00 0.00 C ATOM 1414 C ASP A 95 1.071 -8.717 -10.177 1.00 0.00 C ATOM 1415 O ASP A 95 1.120 -7.681 -9.515 1.00 0.00 O ATOM 1416 CB ASP A 95 -0.578 -9.121 -11.978 1.00 0.00 C ATOM 1417 CG ASP A 95 -0.488 -10.358 -12.874 1.00 0.00 C ATOM 1418 OD1 ASP A 95 -0.014 -11.396 -12.363 1.00 0.00 O ATOM 1419 OD2 ASP A 95 -0.896 -10.238 -14.049 1.00 0.00 O ATOM 0 H ASP A 95 -1.178 -7.806 -9.438 1.00 0.00 H new ATOM 0 HA ASP A 95 -0.244 -10.445 -10.313 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -1.581 -8.702 -12.062 1.00 0.00 H new ATOM 0 HB3 ASP A 95 0.114 -8.368 -12.354 1.00 0.00 H new ATOM 1424 N SER A 96 2.131 -9.350 -10.659 1.00 0.00 N ATOM 1425 CA SER A 96 3.473 -8.843 -10.430 1.00 0.00 C ATOM 1426 C SER A 96 3.619 -7.450 -11.046 1.00 0.00 C ATOM 1427 O SER A 96 3.932 -6.487 -10.347 1.00 0.00 O ATOM 1428 CB SER A 96 4.526 -9.791 -11.008 1.00 0.00 C ATOM 1429 OG SER A 96 4.541 -11.046 -10.334 1.00 0.00 O ATOM 0 H SER A 96 2.087 -10.209 -11.207 1.00 0.00 H new ATOM 0 HA SER A 96 3.634 -8.776 -9.354 1.00 0.00 H new ATOM 0 HB2 SER A 96 4.327 -9.951 -12.068 1.00 0.00 H new ATOM 0 HB3 SER A 96 5.510 -9.328 -10.934 1.00 0.00 H new ATOM 0 HG SER A 96 5.225 -11.623 -10.733 1.00 0.00 H new ATOM 1435 N THR A 97 3.384 -7.386 -12.349 1.00 0.00 N ATOM 1436 CA THR A 97 3.485 -6.127 -13.067 1.00 0.00 C ATOM 1437 C THR A 97 2.933 -4.982 -12.215 1.00 0.00 C ATOM 1438 O THR A 97 3.690 -4.145 -11.727 1.00 0.00 O ATOM 1439 CB THR A 97 2.767 -6.288 -14.408 1.00 0.00 C ATOM 1440 OG1 THR A 97 1.419 -6.577 -14.047 1.00 0.00 O ATOM 1441 CG2 THR A 97 3.223 -7.534 -15.170 1.00 0.00 C ATOM 0 H THR A 97 3.124 -8.186 -12.926 1.00 0.00 H new ATOM 0 HA THR A 97 4.525 -5.869 -13.268 1.00 0.00 H new ATOM 0 HB THR A 97 2.940 -5.403 -15.021 1.00 0.00 H new ATOM 0 HG1 THR A 97 0.881 -6.695 -14.858 1.00 0.00 H new ATOM 0 HG21 THR A 97 2.683 -7.601 -16.114 1.00 0.00 H new ATOM 0 HG22 THR A 97 4.293 -7.468 -15.368 1.00 0.00 H new ATOM 0 HG23 THR A 97 3.019 -8.422 -14.571 1.00 0.00 H new ATOM 1449 N ALA A 98 1.616 -4.982 -12.064 1.00 0.00 N ATOM 1450 CA ALA A 98 0.953 -3.953 -11.280 1.00 0.00 C ATOM 1451 C ALA A 98 1.772 -3.674 -10.018 1.00 0.00 C ATOM 1452 O ALA A 98 2.137 -4.598 -9.293 1.00 0.00 O ATOM 1453 CB ALA A 98 -0.476 -4.396 -10.962 1.00 0.00 C ATOM 0 H ALA A 98 0.991 -5.678 -12.471 1.00 0.00 H new ATOM 0 HA ALA A 98 0.888 -3.022 -11.843 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -0.974 -3.625 -10.374 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -1.023 -4.554 -11.891 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -0.451 -5.326 -10.394 1.00 0.00 H new ATOM 1459 N LEU A 99 2.035 -2.395 -9.793 1.00 0.00 N ATOM 1460 CA LEU A 99 2.803 -1.982 -8.631 1.00 0.00 C ATOM 1461 C LEU A 99 1.954 -1.044 -7.771 1.00 0.00 C ATOM 1462 O LEU A 99 0.865 -0.640 -8.176 1.00 0.00 O ATOM 1463 CB LEU A 99 4.142 -1.379 -9.061 1.00 0.00 C ATOM 1464 CG LEU A 99 5.271 -2.375 -9.330 1.00 0.00 C ATOM 1465 CD1 LEU A 99 6.000 -2.040 -10.633 1.00 0.00 C ATOM 1466 CD2 LEU A 99 6.230 -2.452 -8.140 1.00 0.00 C ATOM 0 H LEU A 99 1.730 -1.631 -10.396 1.00 0.00 H new ATOM 0 HA LEU A 99 3.052 -2.844 -8.012 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.980 -0.792 -9.965 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.472 -0.687 -8.286 1.00 0.00 H new ATOM 0 HG LEU A 99 4.831 -3.364 -9.453 1.00 0.00 H new ATOM 0 HD11 LEU A 99 6.798 -2.764 -10.800 1.00 0.00 H new ATOM 0 HD12 LEU A 99 5.296 -2.078 -11.464 1.00 0.00 H new ATOM 0 HD13 LEU A 99 6.427 -1.039 -10.564 1.00 0.00 H new ATOM 0 HD21 LEU A 99 7.023 -3.167 -8.358 1.00 0.00 H new ATOM 0 HD22 LEU A 99 6.667 -1.470 -7.960 1.00 0.00 H new ATOM 0 HD23 LEU A 99 5.684 -2.774 -7.253 1.00 0.00 H new ATOM 1478 N TYR A 100 2.485 -0.724 -6.600 1.00 0.00 N ATOM 1479 CA TYR A 100 1.789 0.159 -5.679 1.00 0.00 C ATOM 1480 C TYR A 100 2.743 0.701 -4.612 1.00 0.00 C ATOM 1481 O TYR A 100 3.596 -0.029 -4.109 1.00 0.00 O ATOM 1482 CB TYR A 100 0.718 -0.697 -5.001 1.00 0.00 C ATOM 1483 CG TYR A 100 -0.403 -1.149 -5.939 1.00 0.00 C ATOM 1484 CD1 TYR A 100 -1.509 -0.345 -6.128 1.00 0.00 C ATOM 1485 CD2 TYR A 100 -0.309 -2.359 -6.595 1.00 0.00 C ATOM 1486 CE1 TYR A 100 -2.565 -0.769 -7.011 1.00 0.00 C ATOM 1487 CE2 TYR A 100 -1.365 -2.784 -7.477 1.00 0.00 C ATOM 1488 CZ TYR A 100 -2.441 -1.968 -7.642 1.00 0.00 C ATOM 1489 OH TYR A 100 -3.438 -2.369 -8.475 1.00 0.00 O ATOM 0 H TYR A 100 3.389 -1.060 -6.268 1.00 0.00 H new ATOM 0 HA TYR A 100 1.367 1.012 -6.211 1.00 0.00 H new ATOM 0 HB2 TYR A 100 1.192 -1.577 -4.567 1.00 0.00 H new ATOM 0 HB3 TYR A 100 0.283 -0.131 -4.177 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -1.583 0.602 -5.614 1.00 0.00 H new ATOM 0 HD2 TYR A 100 0.557 -2.988 -6.447 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -3.435 -0.149 -7.169 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -1.304 -3.729 -7.996 1.00 0.00 H new ATOM 0 HH TYR A 100 -3.083 -2.478 -9.382 1.00 0.00 H new ATOM 1499 N THR A 101 2.567 1.976 -4.299 1.00 0.00 N ATOM 1500 CA THR A 101 3.401 2.624 -3.301 1.00 0.00 C ATOM 1501 C THR A 101 2.538 3.202 -2.178 1.00 0.00 C ATOM 1502 O THR A 101 1.311 3.176 -2.257 1.00 0.00 O ATOM 1503 CB THR A 101 4.258 3.674 -4.011 1.00 0.00 C ATOM 1504 OG1 THR A 101 5.203 4.077 -3.023 1.00 0.00 O ATOM 1505 CG2 THR A 101 3.478 4.952 -4.323 1.00 0.00 C ATOM 0 H THR A 101 1.859 2.578 -4.719 1.00 0.00 H new ATOM 0 HA THR A 101 4.069 1.910 -2.819 1.00 0.00 H new ATOM 0 HB THR A 101 4.653 3.255 -4.936 1.00 0.00 H new ATOM 0 HG1 THR A 101 5.945 3.438 -3.000 1.00 0.00 H new ATOM 0 HG21 THR A 101 4.132 5.664 -4.826 1.00 0.00 H new ATOM 0 HG22 THR A 101 2.634 4.714 -4.970 1.00 0.00 H new ATOM 0 HG23 THR A 101 3.111 5.390 -3.395 1.00 0.00 H new ATOM 1513 N PHE A 102 3.214 3.710 -1.158 1.00 0.00 N ATOM 1514 CA PHE A 102 2.524 4.294 -0.020 1.00 0.00 C ATOM 1515 C PHE A 102 2.156 5.754 -0.292 1.00 0.00 C ATOM 1516 O PHE A 102 2.976 6.521 -0.794 1.00 0.00 O ATOM 1517 CB PHE A 102 3.489 4.235 1.166 1.00 0.00 C ATOM 1518 CG PHE A 102 3.644 2.840 1.775 1.00 0.00 C ATOM 1519 CD1 PHE A 102 2.552 2.048 1.944 1.00 0.00 C ATOM 1520 CD2 PHE A 102 4.873 2.393 2.147 1.00 0.00 C ATOM 1521 CE1 PHE A 102 2.695 0.753 2.509 1.00 0.00 C ATOM 1522 CE2 PHE A 102 5.017 1.098 2.712 1.00 0.00 C ATOM 1523 CZ PHE A 102 3.925 0.305 2.881 1.00 0.00 C ATOM 0 H PHE A 102 4.232 3.729 -1.096 1.00 0.00 H new ATOM 0 HA PHE A 102 1.602 3.747 0.178 1.00 0.00 H new ATOM 0 HB2 PHE A 102 4.468 4.590 0.843 1.00 0.00 H new ATOM 0 HB3 PHE A 102 3.141 4.921 1.939 1.00 0.00 H new ATOM 0 HD1 PHE A 102 1.576 2.404 1.649 1.00 0.00 H new ATOM 0 HD2 PHE A 102 5.740 3.023 2.013 1.00 0.00 H new ATOM 0 HE1 PHE A 102 1.828 0.124 2.643 1.00 0.00 H new ATOM 0 HE2 PHE A 102 5.993 0.743 3.007 1.00 0.00 H new ATOM 0 HZ PHE A 102 4.034 -0.680 3.310 1.00 0.00 H new ATOM 1533 N ALA A 103 0.923 6.093 0.053 1.00 0.00 N ATOM 1534 CA ALA A 103 0.436 7.448 -0.148 1.00 0.00 C ATOM 1535 C ALA A 103 0.958 8.344 0.977 1.00 0.00 C ATOM 1536 O ALA A 103 0.565 8.190 2.132 1.00 0.00 O ATOM 1537 CB ALA A 103 -1.092 7.435 -0.222 1.00 0.00 C ATOM 0 H ALA A 103 0.246 5.454 0.470 1.00 0.00 H new ATOM 0 HA ALA A 103 0.804 7.853 -1.090 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -1.458 8.451 -0.373 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -1.411 6.807 -1.054 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.498 7.038 0.708 1.00 0.00 H new ATOM 1543 N GLU A 104 1.836 9.262 0.599 1.00 0.00 N ATOM 1544 CA GLU A 104 2.416 10.183 1.561 1.00 0.00 C ATOM 1545 C GLU A 104 1.331 11.084 2.155 1.00 0.00 C ATOM 1546 O GLU A 104 0.810 11.966 1.474 1.00 0.00 O ATOM 1547 CB GLU A 104 3.529 11.015 0.921 1.00 0.00 C ATOM 1548 CG GLU A 104 2.989 11.856 -0.237 1.00 0.00 C ATOM 1549 CD GLU A 104 4.124 12.336 -1.143 1.00 0.00 C ATOM 1550 OE1 GLU A 104 5.011 13.042 -0.616 1.00 0.00 O ATOM 1551 OE2 GLU A 104 4.080 11.985 -2.342 1.00 0.00 O ATOM 0 H GLU A 104 2.159 9.387 -0.360 1.00 0.00 H new ATOM 0 HA GLU A 104 2.860 9.601 2.369 1.00 0.00 H new ATOM 0 HB2 GLU A 104 3.977 11.667 1.671 1.00 0.00 H new ATOM 0 HB3 GLU A 104 4.318 10.356 0.559 1.00 0.00 H new ATOM 0 HG2 GLU A 104 2.279 11.267 -0.818 1.00 0.00 H new ATOM 0 HG3 GLU A 104 2.445 12.715 0.156 1.00 0.00 H new ATOM 1558 N SER A 105 1.021 10.830 3.418 1.00 0.00 N ATOM 1559 CA SER A 105 0.007 11.607 4.110 1.00 0.00 C ATOM 1560 C SER A 105 -0.211 11.046 5.517 1.00 0.00 C ATOM 1561 O SER A 105 -1.146 10.280 5.745 1.00 0.00 O ATOM 1562 CB SER A 105 -1.309 11.613 3.331 1.00 0.00 C ATOM 1563 OG SER A 105 -1.587 10.346 2.742 1.00 0.00 O ATOM 0 H SER A 105 1.454 10.097 3.980 1.00 0.00 H new ATOM 0 HA SER A 105 0.357 12.637 4.186 1.00 0.00 H new ATOM 0 HB2 SER A 105 -2.125 11.889 4.000 1.00 0.00 H new ATOM 0 HB3 SER A 105 -1.265 12.373 2.551 1.00 0.00 H new ATOM 0 HG SER A 105 -2.103 9.799 3.371 1.00 0.00 H new ATOM 1569 N TYR A 106 0.667 11.449 6.423 1.00 0.00 N ATOM 1570 CA TYR A 106 0.582 10.996 7.801 1.00 0.00 C ATOM 1571 C TYR A 106 0.819 12.153 8.774 1.00 0.00 C ATOM 1572 O TYR A 106 1.328 13.203 8.384 1.00 0.00 O ATOM 1573 CB TYR A 106 1.696 9.962 7.975 1.00 0.00 C ATOM 1574 CG TYR A 106 1.193 8.551 8.282 1.00 0.00 C ATOM 1575 CD1 TYR A 106 0.776 7.728 7.254 1.00 0.00 C ATOM 1576 CD2 TYR A 106 1.155 8.099 9.585 1.00 0.00 C ATOM 1577 CE1 TYR A 106 0.303 6.399 7.543 1.00 0.00 C ATOM 1578 CE2 TYR A 106 0.681 6.770 9.874 1.00 0.00 C ATOM 1579 CZ TYR A 106 0.279 5.986 8.838 1.00 0.00 C ATOM 1580 OH TYR A 106 -0.169 4.731 9.111 1.00 0.00 O ATOM 0 H TYR A 106 1.441 12.084 6.230 1.00 0.00 H new ATOM 0 HA TYR A 106 -0.406 10.585 8.010 1.00 0.00 H new ATOM 0 HB2 TYR A 106 2.296 9.933 7.065 1.00 0.00 H new ATOM 0 HB3 TYR A 106 2.355 10.285 8.781 1.00 0.00 H new ATOM 0 HD1 TYR A 106 0.805 8.081 6.234 1.00 0.00 H new ATOM 0 HD2 TYR A 106 1.481 8.742 10.389 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -0.025 5.745 6.749 1.00 0.00 H new ATOM 0 HE2 TYR A 106 0.646 6.405 10.890 1.00 0.00 H new ATOM 0 HH TYR A 106 -0.129 4.572 10.077 1.00 0.00 H new ATOM 1590 N LYS A 107 0.440 11.922 10.023 1.00 0.00 N ATOM 1591 CA LYS A 107 0.605 12.931 11.054 1.00 0.00 C ATOM 1592 C LYS A 107 0.991 12.252 12.370 1.00 0.00 C ATOM 1593 O LYS A 107 0.666 12.748 13.447 1.00 0.00 O ATOM 1594 CB LYS A 107 -0.648 13.803 11.157 1.00 0.00 C ATOM 1595 CG LYS A 107 -1.873 13.069 10.607 1.00 0.00 C ATOM 1596 CD LYS A 107 -2.117 13.432 9.140 1.00 0.00 C ATOM 1597 CE LYS A 107 -3.575 13.185 8.750 1.00 0.00 C ATOM 1598 NZ LYS A 107 -4.452 14.224 9.334 1.00 0.00 N ATOM 0 H LYS A 107 0.019 11.050 10.343 1.00 0.00 H new ATOM 0 HA LYS A 107 1.417 13.610 10.795 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -0.820 14.077 12.198 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.497 14.730 10.604 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -1.728 11.993 10.700 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -2.751 13.325 11.200 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -1.865 14.479 8.974 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -1.461 12.841 8.501 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -3.672 13.187 7.664 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -3.888 12.200 9.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -5.363 14.232 8.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -4.614 14.017 10.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -3.997 15.155 9.241 1.00 0.00 H new ATOM 1612 N LYS A 108 1.678 11.127 12.238 1.00 0.00 N ATOM 1613 CA LYS A 108 2.112 10.374 13.403 1.00 0.00 C ATOM 1614 C LYS A 108 0.916 9.624 13.994 1.00 0.00 C ATOM 1615 O LYS A 108 0.590 9.794 15.168 1.00 0.00 O ATOM 1616 CB LYS A 108 2.816 11.293 14.403 1.00 0.00 C ATOM 1617 CG LYS A 108 3.498 10.482 15.507 1.00 0.00 C ATOM 1618 CD LYS A 108 5.021 10.572 15.393 1.00 0.00 C ATOM 1619 CE LYS A 108 5.697 10.066 16.669 1.00 0.00 C ATOM 1620 NZ LYS A 108 7.170 10.100 16.523 1.00 0.00 N ATOM 0 H LYS A 108 1.945 10.718 11.342 1.00 0.00 H new ATOM 0 HA LYS A 108 2.851 9.625 13.119 1.00 0.00 H new ATOM 0 HB2 LYS A 108 3.556 11.902 13.884 1.00 0.00 H new ATOM 0 HB3 LYS A 108 2.092 11.978 14.844 1.00 0.00 H new ATOM 0 HG2 LYS A 108 3.180 10.850 16.483 1.00 0.00 H new ATOM 0 HG3 LYS A 108 3.186 9.440 15.443 1.00 0.00 H new ATOM 0 HD2 LYS A 108 5.361 9.985 14.540 1.00 0.00 H new ATOM 0 HD3 LYS A 108 5.315 11.605 15.206 1.00 0.00 H new ATOM 0 HE2 LYS A 108 5.395 10.682 17.516 1.00 0.00 H new ATOM 0 HE3 LYS A 108 5.370 9.048 16.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 7.614 9.754 17.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 7.454 9.494 15.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 7.478 11.077 16.342 1.00 0.00 H new ATOM 1634 N LYS A 109 0.296 8.809 13.153 1.00 0.00 N ATOM 1635 CA LYS A 109 -0.857 8.032 13.577 1.00 0.00 C ATOM 1636 C LYS A 109 -1.722 8.879 14.512 1.00 0.00 C ATOM 1637 O LYS A 109 -1.593 8.791 15.733 1.00 0.00 O ATOM 1638 CB LYS A 109 -0.411 6.702 14.189 1.00 0.00 C ATOM 1639 CG LYS A 109 0.648 6.025 13.316 1.00 0.00 C ATOM 1640 CD LYS A 109 1.602 5.183 14.165 1.00 0.00 C ATOM 1641 CE LYS A 109 1.340 3.689 13.967 1.00 0.00 C ATOM 1642 NZ LYS A 109 2.616 2.952 13.831 1.00 0.00 N ATOM 0 H LYS A 109 0.570 8.670 12.180 1.00 0.00 H new ATOM 0 HA LYS A 109 -1.476 7.770 12.719 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -0.009 6.874 15.188 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -1.271 6.042 14.301 1.00 0.00 H new ATOM 0 HG2 LYS A 109 0.162 5.392 12.573 1.00 0.00 H new ATOM 0 HG3 LYS A 109 1.212 6.781 12.770 1.00 0.00 H new ATOM 0 HD2 LYS A 109 2.633 5.414 13.897 1.00 0.00 H new ATOM 0 HD3 LYS A 109 1.481 5.441 15.217 1.00 0.00 H new ATOM 0 HE2 LYS A 109 0.776 3.298 14.813 1.00 0.00 H new ATOM 0 HE3 LYS A 109 0.728 3.536 13.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 2.428 1.929 13.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 3.077 3.217 12.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 3.241 3.191 14.627 1.00 0.00 H new ATOM 1656 N VAL A 110 -2.583 9.682 13.905 1.00 0.00 N ATOM 1657 CA VAL A 110 -3.469 10.544 14.668 1.00 0.00 C ATOM 1658 C VAL A 110 -4.565 9.697 15.316 1.00 0.00 C ATOM 1659 O VAL A 110 -5.724 9.757 14.910 1.00 0.00 O ATOM 1660 CB VAL A 110 -4.023 11.652 13.769 1.00 0.00 C ATOM 1661 CG1 VAL A 110 -4.686 11.065 12.521 1.00 0.00 C ATOM 1662 CG2 VAL A 110 -4.997 12.546 14.539 1.00 0.00 C ATOM 0 H VAL A 110 -2.686 9.754 12.893 1.00 0.00 H new ATOM 0 HA VAL A 110 -2.922 11.038 15.471 1.00 0.00 H new ATOM 0 HB VAL A 110 -3.186 12.270 13.444 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -5.071 11.873 11.899 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -3.952 10.490 11.956 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -5.507 10.413 12.818 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -5.376 13.325 13.878 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -5.829 11.945 14.907 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -4.481 13.005 15.382 1.00 0.00 H new ATOM 1672 N SER A 111 -4.160 8.926 16.315 1.00 0.00 N ATOM 1673 CA SER A 111 -5.093 8.067 17.024 1.00 0.00 C ATOM 1674 C SER A 111 -4.773 8.069 18.520 1.00 0.00 C ATOM 1675 O SER A 111 -3.637 7.815 18.916 1.00 0.00 O ATOM 1676 CB SER A 111 -5.054 6.639 16.475 1.00 0.00 C ATOM 1677 OG SER A 111 -6.204 5.889 16.855 1.00 0.00 O ATOM 0 H SER A 111 -3.198 8.878 16.650 1.00 0.00 H new ATOM 0 HA SER A 111 -6.099 8.458 16.873 1.00 0.00 H new ATOM 0 HB2 SER A 111 -4.985 6.671 15.388 1.00 0.00 H new ATOM 0 HB3 SER A 111 -4.157 6.136 16.837 1.00 0.00 H new ATOM 0 HG SER A 111 -6.142 4.984 16.484 1.00 0.00 H new ATOM 1683 N SER A 112 -5.796 8.359 19.311 1.00 0.00 N ATOM 1684 CA SER A 112 -5.638 8.398 20.755 1.00 0.00 C ATOM 1685 C SER A 112 -4.870 7.163 21.230 1.00 0.00 C ATOM 1686 O SER A 112 -5.334 6.036 21.061 1.00 0.00 O ATOM 1687 CB SER A 112 -6.996 8.481 21.455 1.00 0.00 C ATOM 1688 OG SER A 112 -6.990 9.428 22.520 1.00 0.00 O ATOM 0 H SER A 112 -6.737 8.569 18.979 1.00 0.00 H new ATOM 0 HA SER A 112 -5.071 9.292 21.014 1.00 0.00 H new ATOM 0 HB2 SER A 112 -7.762 8.756 20.730 1.00 0.00 H new ATOM 0 HB3 SER A 112 -7.264 7.499 21.845 1.00 0.00 H new ATOM 0 HG SER A 112 -7.875 9.453 22.941 1.00 0.00 H new ATOM 1694 N LYS A 113 -3.709 7.417 21.816 1.00 0.00 N ATOM 1695 CA LYS A 113 -2.873 6.339 22.317 1.00 0.00 C ATOM 1696 C LYS A 113 -2.366 5.503 21.141 1.00 0.00 C ATOM 1697 O LYS A 113 -2.504 5.903 19.985 1.00 0.00 O ATOM 1698 CB LYS A 113 -3.623 5.525 23.373 1.00 0.00 C ATOM 1699 CG LYS A 113 -2.753 5.295 24.610 1.00 0.00 C ATOM 1700 CD LYS A 113 -3.251 4.093 25.415 1.00 0.00 C ATOM 1701 CE LYS A 113 -2.132 3.070 25.622 1.00 0.00 C ATOM 1702 NZ LYS A 113 -2.545 2.043 26.605 1.00 0.00 N ATOM 0 H LYS A 113 -3.328 8.353 21.955 1.00 0.00 H new ATOM 0 HA LYS A 113 -1.996 6.742 22.823 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -4.536 6.047 23.659 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -3.923 4.565 22.952 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -1.719 5.131 24.306 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -2.763 6.187 25.237 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -3.625 4.428 26.382 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -4.086 3.624 24.895 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -1.885 2.595 24.673 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -1.230 3.574 25.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -1.775 1.356 26.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -2.758 2.499 27.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -3.393 1.551 26.257 1.00 0.00 H new ATOM 1716 N GLU A 114 -1.790 4.358 21.475 1.00 0.00 N ATOM 1717 CA GLU A 114 -1.262 3.462 20.460 1.00 0.00 C ATOM 1718 C GLU A 114 -0.347 4.226 19.501 1.00 0.00 C ATOM 1719 O GLU A 114 -0.817 4.832 18.540 1.00 0.00 O ATOM 1720 CB GLU A 114 -2.393 2.766 19.700 1.00 0.00 C ATOM 1721 CG GLU A 114 -2.012 1.327 19.347 1.00 0.00 C ATOM 1722 CD GLU A 114 -3.238 0.532 18.892 1.00 0.00 C ATOM 1723 OE1 GLU A 114 -3.969 1.060 18.027 1.00 0.00 O ATOM 1724 OE2 GLU A 114 -3.416 -0.587 19.421 1.00 0.00 O ATOM 0 H GLU A 114 -1.677 4.030 22.434 1.00 0.00 H new ATOM 0 HA GLU A 114 -0.673 2.690 20.956 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -3.299 2.768 20.307 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -2.619 3.320 18.789 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -1.261 1.329 18.557 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -1.561 0.843 20.213 1.00 0.00 H new ATOM 1731 N SER A 115 0.944 4.172 19.797 1.00 0.00 N ATOM 1732 CA SER A 115 1.929 4.851 18.973 1.00 0.00 C ATOM 1733 C SER A 115 3.333 4.348 19.314 1.00 0.00 C ATOM 1734 O SER A 115 3.989 4.885 20.206 1.00 0.00 O ATOM 1735 CB SER A 115 1.849 6.368 19.157 1.00 0.00 C ATOM 1736 OG SER A 115 2.889 7.046 18.457 1.00 0.00 O ATOM 0 H SER A 115 1.330 3.669 20.596 1.00 0.00 H new ATOM 0 HA SER A 115 1.714 4.627 17.928 1.00 0.00 H new ATOM 0 HB2 SER A 115 0.882 6.726 18.804 1.00 0.00 H new ATOM 0 HB3 SER A 115 1.910 6.608 20.218 1.00 0.00 H new ATOM 0 HG SER A 115 2.803 8.012 18.598 1.00 0.00 H new ATOM 1742 N GLY A 116 3.753 3.323 18.587 1.00 0.00 N ATOM 1743 CA GLY A 116 5.067 2.742 18.801 1.00 0.00 C ATOM 1744 C GLY A 116 5.174 1.369 18.135 1.00 0.00 C ATOM 1745 O GLY A 116 4.397 0.465 18.439 1.00 0.00 O ATOM 0 H GLY A 116 3.206 2.880 17.849 1.00 0.00 H new ATOM 0 HA2 GLY A 116 5.832 3.406 18.399 1.00 0.00 H new ATOM 0 HA3 GLY A 116 5.257 2.647 19.870 1.00 0.00 H new ATOM 1749 N PRO A 117 6.170 1.252 17.216 1.00 0.00 N ATOM 1750 CA PRO A 117 6.389 0.004 16.505 1.00 0.00 C ATOM 1751 C PRO A 117 7.056 -1.034 17.410 1.00 0.00 C ATOM 1752 O PRO A 117 6.666 -2.200 17.415 1.00 0.00 O ATOM 1753 CB PRO A 117 7.242 0.380 15.304 1.00 0.00 C ATOM 1754 CG PRO A 117 7.855 1.731 15.635 1.00 0.00 C ATOM 1755 CD PRO A 117 7.110 2.301 16.832 1.00 0.00 C ATOM 0 HA PRO A 117 5.459 -0.466 16.185 1.00 0.00 H new ATOM 0 HB2 PRO A 117 8.016 -0.367 15.125 1.00 0.00 H new ATOM 0 HB3 PRO A 117 6.638 0.436 14.398 1.00 0.00 H new ATOM 0 HG2 PRO A 117 8.916 1.624 15.862 1.00 0.00 H new ATOM 0 HG3 PRO A 117 7.778 2.404 14.781 1.00 0.00 H new ATOM 0 HD2 PRO A 117 7.793 2.539 17.647 1.00 0.00 H new ATOM 0 HD3 PRO A 117 6.590 3.223 16.573 1.00 0.00 H new ATOM 1763 N SER A 118 8.050 -0.571 18.154 1.00 0.00 N ATOM 1764 CA SER A 118 8.775 -1.445 19.061 1.00 0.00 C ATOM 1765 C SER A 118 9.485 -2.546 18.272 1.00 0.00 C ATOM 1766 O SER A 118 8.884 -3.181 17.406 1.00 0.00 O ATOM 1767 CB SER A 118 7.837 -2.059 20.102 1.00 0.00 C ATOM 1768 OG SER A 118 8.451 -3.135 20.806 1.00 0.00 O ATOM 0 H SER A 118 8.370 0.397 18.147 1.00 0.00 H new ATOM 0 HA SER A 118 9.519 -0.848 19.589 1.00 0.00 H new ATOM 0 HB2 SER A 118 7.530 -1.290 20.811 1.00 0.00 H new ATOM 0 HB3 SER A 118 6.933 -2.417 19.609 1.00 0.00 H new ATOM 0 HG SER A 118 7.821 -3.499 21.462 1.00 0.00 H new ATOM 1774 N SER A 119 10.755 -2.739 18.598 1.00 0.00 N ATOM 1775 CA SER A 119 11.553 -3.753 17.930 1.00 0.00 C ATOM 1776 C SER A 119 11.668 -4.996 18.815 1.00 0.00 C ATOM 1777 O SER A 119 11.902 -4.886 20.017 1.00 0.00 O ATOM 1778 CB SER A 119 12.944 -3.218 17.583 1.00 0.00 C ATOM 1779 OG SER A 119 13.163 -3.172 16.176 1.00 0.00 O ATOM 0 H SER A 119 11.251 -2.210 19.316 1.00 0.00 H new ATOM 0 HA SER A 119 11.054 -4.023 16.999 1.00 0.00 H new ATOM 0 HB2 SER A 119 13.063 -2.218 18.001 1.00 0.00 H new ATOM 0 HB3 SER A 119 13.701 -3.850 18.047 1.00 0.00 H new ATOM 0 HG SER A 119 14.061 -2.823 15.996 1.00 0.00 H new ATOM 1785 N GLY A 120 11.497 -6.149 18.185 1.00 0.00 N ATOM 1786 CA GLY A 120 11.579 -7.411 18.901 1.00 0.00 C ATOM 1787 C GLY A 120 12.373 -8.445 18.100 1.00 0.00 C ATOM 1788 O GLY A 120 11.869 -9.000 17.124 1.00 0.00 O ATOM 0 H GLY A 120 11.302 -6.236 17.188 1.00 0.00 H new ATOM 0 HA2 GLY A 120 12.053 -7.254 19.870 1.00 0.00 H new ATOM 0 HA3 GLY A 120 10.575 -7.789 19.095 1.00 0.00 H new TER 1792 GLY A 120