USER MOD reduce.3.24.130724 H: found=0, std=0, add=1296, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1286 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: B 78 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B 82 THR OG1 : rot -40:sc= -0.263 USER MOD Set 2.1: A 74 MET CE :methyl -164:sc= -0.177 (180deg=-0.253) USER MOD Set 2.2: B 74 MET CE :methyl 155:sc= -0.141 (180deg=-0.279) USER MOD Set 3.1: B 17 TYR OH : rot 30:sc= 0.166 USER MOD Set 3.2: B 38 ASN : amide:sc= 0.0558 K(o=0.22,f=-1.8) USER MOD Set 4.1: A 78 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 82 THR OG1 : rot -45:sc= -0.292 USER MOD Set 5.1: A 17 TYR OH : rot 30:sc= 0.346 USER MOD Set 5.2: A 38 ASN : amide:sc=-0.00356! C(o=0.34!,f=-1.9!) USER MOD Single : A 1 SER N :NH3+ -119:sc= 1.28 (180deg=0.0343) USER MOD Single : A 1 SER OG : rot 180:sc= 0.00731 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 MET CE :methyl -153:sc= -0.247 (180deg=-1.37!) USER MOD Single : A 15 HIS : no HD1:sc= -0.0371 X(o=-0.037,f=-0.16) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 SER OG : rot -74:sc= 0.322 USER MOD Single : A 24 LYS NZ :NH3+ -160:sc= -0.0486 (180deg=-0.656) USER MOD Single : A 25 HIS : no HD1:sc= 0 X(o=0,f=-0.061) USER MOD Single : A 26 LYS NZ :NH3+ 160:sc= -0.0701 (180deg=-0.551) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc=-0.00891 USER MOD Single : A 33 LYS NZ :NH3+ 150:sc= 0.0885 (180deg=-0.555) USER MOD Single : A 37 ASN : amide:sc= -1.98! C(o=-2!,f=-9.1!) USER MOD Single : A 41 SER OG : rot 69:sc= -0.398! USER MOD Single : A 42 HIS : no HD1:sc= -2.38! C(o=-2.4!,f=-3.6!) USER MOD Single : A 48 LYS NZ :NH3+ 162:sc= -0.0574 (180deg=-0.535) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ -153:sc= -0.149 (180deg=-1.03) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 78:sc= 0.577 USER MOD Single : A 68 CYS SG : rot -63:sc= 0.557 USER MOD Single : A 71 GLN : amide:sc= -0.268 X(o=-0.27,f=0) USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 82:sc= 1.05 USER MOD Single : B 1 SER N :NH3+ -142:sc= 1.3 (180deg=-0.0928) USER MOD Single : B 1 SER OG : rot 180:sc= 0.00728 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 MET CE :methyl -154:sc= -0.332 (180deg=-1.28!) USER MOD Single : B 15 HIS : no HD1:sc= -0.0407 X(o=-0.041,f=-0.15) USER MOD Single : B 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 18 SER OG : rot -74:sc= 0.308 USER MOD Single : B 24 LYS NZ :NH3+ -158:sc= -0.0507 (180deg=-0.661) USER MOD Single : B 25 HIS : no HD1:sc= 0 X(o=0,f=-0.078) USER MOD Single : B 26 LYS NZ :NH3+ 162:sc= -0.0869 (180deg=-0.608) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 SER OG : rot 180:sc=-0.00657 USER MOD Single : B 33 LYS NZ :NH3+ 146:sc= 0.067 (180deg=-0.495) USER MOD Single : B 37 ASN : amide:sc= -2.12! C(o=-2.1!,f=-9!) USER MOD Single : B 41 SER OG : rot 67:sc= -0.299! USER MOD Single : B 42 HIS : no HD1:sc= -2.33! C(o=-2.3!,f=-3.9!) USER MOD Single : B 48 LYS NZ :NH3+ 162:sc= -0.0679 (180deg=-0.526) USER MOD Single : B 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 55 LYS NZ :NH3+ -144:sc= -0.218 (180deg=-1.09) USER MOD Single : B 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 59 THR OG1 : rot 81:sc= 0.519 USER MOD Single : B 68 CYS SG : rot -65:sc= 0.526 USER MOD Single : B 71 GLN : amide:sc= -0.219 X(o=-0.22,f=0) USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 81 THR OG1 : rot 83:sc= 1.05 USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 1 -10.088 4.824 12.946 1.00 0.00 N ATOM 21 CA SER A 1 -10.250 3.344 12.889 1.00 0.00 C ATOM 22 C SER A 1 -8.868 2.688 12.912 1.00 0.00 C ATOM 23 O SER A 1 -7.864 3.333 12.685 1.00 0.00 O ATOM 24 CB SER A 1 -10.976 2.957 11.600 1.00 0.00 C ATOM 25 OG SER A 1 -10.058 2.990 10.516 1.00 0.00 O ATOM 0 H1 SER A 1 -10.551 5.191 13.802 1.00 0.00 H new ATOM 0 H2 SER A 1 -9.076 5.062 12.971 1.00 0.00 H new ATOM 0 H3 SER A 1 -10.524 5.254 12.105 1.00 0.00 H new ATOM 0 HA SER A 1 -10.833 3.006 13.746 1.00 0.00 H new ATOM 0 HB2 SER A 1 -11.407 1.960 11.697 1.00 0.00 H new ATOM 0 HB3 SER A 1 -11.801 3.644 11.414 1.00 0.00 H new ATOM 0 HG SER A 1 -10.520 2.741 9.688 1.00 0.00 H new ATOM 31 N GLU A 2 -8.804 1.415 13.188 1.00 0.00 N ATOM 32 CA GLU A 2 -7.481 0.734 13.228 1.00 0.00 C ATOM 33 C GLU A 2 -6.727 1.005 11.924 1.00 0.00 C ATOM 34 O GLU A 2 -5.519 1.137 11.909 1.00 0.00 O ATOM 35 CB GLU A 2 -7.689 -0.774 13.392 1.00 0.00 C ATOM 36 CG GLU A 2 -6.359 -1.438 13.753 1.00 0.00 C ATOM 37 CD GLU A 2 -6.479 -2.953 13.574 1.00 0.00 C ATOM 38 OE1 GLU A 2 -7.068 -3.369 12.590 1.00 0.00 O ATOM 39 OE2 GLU A 2 -5.979 -3.671 14.425 1.00 0.00 O ATOM 0 H GLU A 2 -9.608 0.819 13.387 1.00 0.00 H new ATOM 0 HA GLU A 2 -6.902 1.116 14.069 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -8.427 -0.967 14.171 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -8.081 -1.200 12.469 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -5.562 -1.048 13.119 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -6.091 -1.203 14.783 1.00 0.00 H new ATOM 46 N LEU A 3 -7.430 1.073 10.825 1.00 0.00 N ATOM 47 CA LEU A 3 -6.753 1.317 9.519 1.00 0.00 C ATOM 48 C LEU A 3 -6.111 2.706 9.514 1.00 0.00 C ATOM 49 O LEU A 3 -4.938 2.853 9.235 1.00 0.00 O ATOM 50 CB LEU A 3 -7.781 1.225 8.385 1.00 0.00 C ATOM 51 CG LEU A 3 -7.062 1.108 7.027 1.00 0.00 C ATOM 52 CD1 LEU A 3 -6.547 -0.326 6.805 1.00 0.00 C ATOM 53 CD2 LEU A 3 -8.042 1.471 5.905 1.00 0.00 C ATOM 0 H LEU A 3 -8.444 0.970 10.776 1.00 0.00 H new ATOM 0 HA LEU A 3 -5.978 0.565 9.373 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -8.427 0.361 8.539 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -8.421 2.107 8.392 1.00 0.00 H new ATOM 0 HG LEU A 3 -6.212 1.790 7.021 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -6.043 -0.386 5.841 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -5.846 -0.588 7.598 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -7.387 -1.021 6.819 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -7.538 1.390 4.942 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -8.892 0.788 5.929 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -8.394 2.493 6.046 1.00 0.00 H new ATOM 65 N GLU A 4 -6.863 3.730 9.816 1.00 0.00 N ATOM 66 CA GLU A 4 -6.274 5.098 9.821 1.00 0.00 C ATOM 67 C GLU A 4 -5.052 5.111 10.740 1.00 0.00 C ATOM 68 O GLU A 4 -3.994 5.593 10.392 1.00 0.00 O ATOM 69 CB GLU A 4 -7.313 6.102 10.323 1.00 0.00 C ATOM 70 CG GLU A 4 -8.524 6.091 9.388 1.00 0.00 C ATOM 71 CD GLU A 4 -9.646 6.939 9.990 1.00 0.00 C ATOM 72 OE1 GLU A 4 -10.253 6.488 10.947 1.00 0.00 O ATOM 73 OE2 GLU A 4 -9.878 8.025 9.485 1.00 0.00 O ATOM 0 H GLU A 4 -7.853 3.679 10.058 1.00 0.00 H new ATOM 0 HA GLU A 4 -5.973 5.375 8.811 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.621 5.847 11.337 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -6.880 7.101 10.363 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -8.244 6.482 8.410 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -8.869 5.068 9.236 1.00 0.00 H new ATOM 80 N LYS A 5 -5.205 4.564 11.915 1.00 0.00 N ATOM 81 CA LYS A 5 -4.078 4.508 12.888 1.00 0.00 C ATOM 82 C LYS A 5 -2.832 3.928 12.213 1.00 0.00 C ATOM 83 O LYS A 5 -1.727 4.397 12.401 1.00 0.00 O ATOM 84 CB LYS A 5 -4.477 3.578 14.041 1.00 0.00 C ATOM 85 CG LYS A 5 -5.564 4.241 14.910 1.00 0.00 C ATOM 86 CD LYS A 5 -4.931 5.188 15.941 1.00 0.00 C ATOM 87 CE LYS A 5 -5.998 5.630 16.945 1.00 0.00 C ATOM 88 NZ LYS A 5 -5.379 6.522 17.966 1.00 0.00 N ATOM 0 H LYS A 5 -6.075 4.148 12.246 1.00 0.00 H new ATOM 0 HA LYS A 5 -3.863 5.513 13.251 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -4.846 2.632 13.644 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -3.604 3.348 14.651 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -6.256 4.795 14.276 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -6.146 3.474 15.422 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -4.114 4.686 16.459 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -4.505 6.057 15.440 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -6.803 6.153 16.430 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -6.441 4.759 17.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -6.103 6.823 18.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -4.625 6.008 18.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -4.976 7.359 17.498 1.00 0.00 H new ATOM 102 N ALA A 6 -3.015 2.886 11.448 1.00 0.00 N ATOM 103 CA ALA A 6 -1.869 2.218 10.763 1.00 0.00 C ATOM 104 C ALA A 6 -1.408 3.009 9.530 1.00 0.00 C ATOM 105 O ALA A 6 -0.227 3.061 9.248 1.00 0.00 O ATOM 106 CB ALA A 6 -2.294 0.800 10.354 1.00 0.00 C ATOM 0 H ALA A 6 -3.925 2.462 11.265 1.00 0.00 H new ATOM 0 HA ALA A 6 -1.027 2.174 11.454 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -1.464 0.302 9.852 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -2.574 0.234 11.242 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.146 0.857 9.677 1.00 0.00 H new ATOM 112 N MET A 7 -2.283 3.630 8.792 1.00 0.00 N ATOM 113 CA MET A 7 -1.786 4.394 7.611 1.00 0.00 C ATOM 114 C MET A 7 -0.815 5.460 8.119 1.00 0.00 C ATOM 115 O MET A 7 0.296 5.591 7.637 1.00 0.00 O ATOM 116 CB MET A 7 -2.951 5.063 6.872 1.00 0.00 C ATOM 117 CG MET A 7 -3.844 3.999 6.219 1.00 0.00 C ATOM 118 SD MET A 7 -2.906 3.066 4.976 1.00 0.00 S ATOM 119 CE MET A 7 -2.562 4.434 3.840 1.00 0.00 C ATOM 0 H MET A 7 -3.291 3.645 8.946 1.00 0.00 H new ATOM 0 HA MET A 7 -1.289 3.719 6.914 1.00 0.00 H new ATOM 0 HB2 MET A 7 -3.537 5.663 7.569 1.00 0.00 H new ATOM 0 HB3 MET A 7 -2.567 5.743 6.111 1.00 0.00 H new ATOM 0 HG2 MET A 7 -4.228 3.320 6.980 1.00 0.00 H new ATOM 0 HG3 MET A 7 -4.706 4.475 5.752 1.00 0.00 H new ATOM 0 HE1 MET A 7 -2.435 4.045 2.830 1.00 0.00 H new ATOM 0 HE2 MET A 7 -3.394 5.138 3.856 1.00 0.00 H new ATOM 0 HE3 MET A 7 -1.649 4.943 4.150 1.00 0.00 H new ATOM 129 N VAL A 8 -1.213 6.205 9.113 1.00 0.00 N ATOM 130 CA VAL A 8 -0.306 7.241 9.672 1.00 0.00 C ATOM 131 C VAL A 8 0.936 6.552 10.237 1.00 0.00 C ATOM 132 O VAL A 8 2.033 7.066 10.160 1.00 0.00 O ATOM 133 CB VAL A 8 -1.025 8.003 10.787 1.00 0.00 C ATOM 134 CG1 VAL A 8 -0.175 9.201 11.215 1.00 0.00 C ATOM 135 CG2 VAL A 8 -2.377 8.499 10.271 1.00 0.00 C ATOM 0 H VAL A 8 -2.127 6.140 9.561 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.016 7.944 8.891 1.00 0.00 H new ATOM 0 HB VAL A 8 -1.179 7.342 11.640 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -0.686 9.745 12.009 1.00 0.00 H new ATOM 0 HG12 VAL A 8 0.791 8.850 11.579 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.023 9.863 10.362 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -2.892 9.042 11.063 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -2.221 9.161 9.419 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -2.983 7.647 9.962 1.00 0.00 H new ATOM 145 N ALA A 9 0.773 5.383 10.797 1.00 0.00 N ATOM 146 CA ALA A 9 1.945 4.653 11.354 1.00 0.00 C ATOM 147 C ALA A 9 2.949 4.390 10.229 1.00 0.00 C ATOM 148 O ALA A 9 4.128 4.631 10.373 1.00 0.00 O ATOM 149 CB ALA A 9 1.478 3.318 11.942 1.00 0.00 C ATOM 0 H ALA A 9 -0.122 4.903 10.892 1.00 0.00 H new ATOM 0 HA ALA A 9 2.415 5.249 12.136 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.334 2.781 12.351 1.00 0.00 H new ATOM 0 HB2 ALA A 9 0.754 3.503 12.735 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.014 2.718 11.159 1.00 0.00 H new ATOM 155 N LEU A 10 2.492 3.882 9.116 1.00 0.00 N ATOM 156 CA LEU A 10 3.431 3.587 7.989 1.00 0.00 C ATOM 157 C LEU A 10 4.384 4.774 7.807 1.00 0.00 C ATOM 158 O LEU A 10 5.560 4.604 7.555 1.00 0.00 O ATOM 159 CB LEU A 10 2.612 3.374 6.689 1.00 0.00 C ATOM 160 CG LEU A 10 2.314 1.879 6.470 1.00 0.00 C ATOM 161 CD1 LEU A 10 1.336 1.385 7.537 1.00 0.00 C ATOM 162 CD2 LEU A 10 1.693 1.679 5.084 1.00 0.00 C ATOM 0 H LEU A 10 1.513 3.658 8.936 1.00 0.00 H new ATOM 0 HA LEU A 10 4.007 2.688 8.208 1.00 0.00 H new ATOM 0 HB2 LEU A 10 1.677 3.931 6.747 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.165 3.768 5.836 1.00 0.00 H new ATOM 0 HG LEU A 10 3.244 1.314 6.541 1.00 0.00 H new ATOM 0 HD11 LEU A 10 1.128 0.327 7.378 1.00 0.00 H new ATOM 0 HD12 LEU A 10 1.775 1.524 8.525 1.00 0.00 H new ATOM 0 HD13 LEU A 10 0.407 1.951 7.469 1.00 0.00 H new ATOM 0 HD21 LEU A 10 1.482 0.621 4.929 1.00 0.00 H new ATOM 0 HD22 LEU A 10 0.766 2.248 5.015 1.00 0.00 H new ATOM 0 HD23 LEU A 10 2.389 2.026 4.320 1.00 0.00 H new ATOM 174 N ILE A 11 3.889 5.975 7.959 1.00 0.00 N ATOM 175 CA ILE A 11 4.789 7.154 7.818 1.00 0.00 C ATOM 176 C ILE A 11 5.782 7.122 8.985 1.00 0.00 C ATOM 177 O ILE A 11 6.952 7.415 8.836 1.00 0.00 O ATOM 178 CB ILE A 11 3.967 8.455 7.856 1.00 0.00 C ATOM 179 CG1 ILE A 11 3.249 8.652 6.513 1.00 0.00 C ATOM 180 CG2 ILE A 11 4.893 9.653 8.103 1.00 0.00 C ATOM 181 CD1 ILE A 11 2.154 7.596 6.341 1.00 0.00 C ATOM 0 H ILE A 11 2.914 6.187 8.172 1.00 0.00 H new ATOM 0 HA ILE A 11 5.319 7.118 6.866 1.00 0.00 H new ATOM 0 HB ILE A 11 3.236 8.385 8.662 1.00 0.00 H new ATOM 0 HG12 ILE A 11 2.813 9.650 6.468 1.00 0.00 H new ATOM 0 HG13 ILE A 11 3.966 8.580 5.695 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.303 10.569 8.128 1.00 0.00 H new ATOM 0 HG22 ILE A 11 5.407 9.525 9.056 1.00 0.00 H new ATOM 0 HG23 ILE A 11 5.628 9.716 7.300 1.00 0.00 H new ATOM 0 HD11 ILE A 11 1.651 7.745 5.385 1.00 0.00 H new ATOM 0 HD12 ILE A 11 2.600 6.602 6.365 1.00 0.00 H new ATOM 0 HD13 ILE A 11 1.429 7.688 7.150 1.00 0.00 H new ATOM 193 N ASP A 12 5.312 6.749 10.146 1.00 0.00 N ATOM 194 CA ASP A 12 6.201 6.670 11.337 1.00 0.00 C ATOM 195 C ASP A 12 7.454 5.878 10.982 1.00 0.00 C ATOM 196 O ASP A 12 8.568 6.328 11.166 1.00 0.00 O ATOM 197 CB ASP A 12 5.462 5.932 12.464 1.00 0.00 C ATOM 198 CG ASP A 12 6.180 6.176 13.795 1.00 0.00 C ATOM 199 OD1 ASP A 12 6.115 7.291 14.285 1.00 0.00 O ATOM 200 OD2 ASP A 12 6.782 5.243 14.301 1.00 0.00 O ATOM 0 H ASP A 12 4.340 6.494 10.319 1.00 0.00 H new ATOM 0 HA ASP A 12 6.473 7.676 11.655 1.00 0.00 H new ATOM 0 HB2 ASP A 12 4.431 6.281 12.526 1.00 0.00 H new ATOM 0 HB3 ASP A 12 5.425 4.864 12.250 1.00 0.00 H new ATOM 205 N VAL A 13 7.270 4.681 10.490 1.00 0.00 N ATOM 206 CA VAL A 13 8.435 3.826 10.136 1.00 0.00 C ATOM 207 C VAL A 13 9.066 4.288 8.819 1.00 0.00 C ATOM 208 O VAL A 13 10.269 4.225 8.659 1.00 0.00 O ATOM 209 CB VAL A 13 7.981 2.365 10.031 1.00 0.00 C ATOM 210 CG1 VAL A 13 9.115 1.507 9.464 1.00 0.00 C ATOM 211 CG2 VAL A 13 7.599 1.850 11.424 1.00 0.00 C ATOM 0 H VAL A 13 6.357 4.259 10.318 1.00 0.00 H new ATOM 0 HA VAL A 13 9.190 3.912 10.917 1.00 0.00 H new ATOM 0 HB VAL A 13 7.119 2.303 9.367 1.00 0.00 H new ATOM 0 HG11 VAL A 13 8.786 0.470 9.392 1.00 0.00 H new ATOM 0 HG12 VAL A 13 9.386 1.871 8.473 1.00 0.00 H new ATOM 0 HG13 VAL A 13 9.981 1.568 10.123 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.276 0.811 11.352 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.463 1.916 12.086 1.00 0.00 H new ATOM 0 HG23 VAL A 13 6.787 2.456 11.826 1.00 0.00 H new ATOM 221 N PHE A 14 8.298 4.741 7.868 1.00 0.00 N ATOM 222 CA PHE A 14 8.937 5.174 6.595 1.00 0.00 C ATOM 223 C PHE A 14 9.822 6.388 6.876 1.00 0.00 C ATOM 224 O PHE A 14 10.876 6.555 6.294 1.00 0.00 O ATOM 225 CB PHE A 14 7.876 5.544 5.557 1.00 0.00 C ATOM 226 CG PHE A 14 8.562 5.850 4.245 1.00 0.00 C ATOM 227 CD1 PHE A 14 9.033 7.143 3.985 1.00 0.00 C ATOM 228 CD2 PHE A 14 8.734 4.838 3.293 1.00 0.00 C ATOM 229 CE1 PHE A 14 9.675 7.424 2.772 1.00 0.00 C ATOM 230 CE2 PHE A 14 9.378 5.119 2.081 1.00 0.00 C ATOM 231 CZ PHE A 14 9.849 6.412 1.820 1.00 0.00 C ATOM 0 H PHE A 14 7.283 4.829 7.913 1.00 0.00 H new ATOM 0 HA PHE A 14 9.535 4.354 6.198 1.00 0.00 H new ATOM 0 HB2 PHE A 14 7.170 4.724 5.431 1.00 0.00 H new ATOM 0 HB3 PHE A 14 7.304 6.408 5.894 1.00 0.00 H new ATOM 0 HD1 PHE A 14 8.901 7.924 4.720 1.00 0.00 H new ATOM 0 HD2 PHE A 14 8.370 3.841 3.493 1.00 0.00 H new ATOM 0 HE1 PHE A 14 10.036 8.422 2.571 1.00 0.00 H new ATOM 0 HE2 PHE A 14 9.511 4.338 1.347 1.00 0.00 H new ATOM 0 HZ PHE A 14 10.346 6.628 0.886 1.00 0.00 H new ATOM 241 N HIS A 15 9.395 7.238 7.771 1.00 0.00 N ATOM 242 CA HIS A 15 10.199 8.447 8.102 1.00 0.00 C ATOM 243 C HIS A 15 11.330 8.068 9.060 1.00 0.00 C ATOM 244 O HIS A 15 12.382 8.675 9.070 1.00 0.00 O ATOM 245 CB HIS A 15 9.299 9.491 8.765 1.00 0.00 C ATOM 246 CG HIS A 15 10.018 10.811 8.823 1.00 0.00 C ATOM 247 ND1 HIS A 15 10.493 11.446 7.686 1.00 0.00 N ATOM 248 CD2 HIS A 15 10.350 11.629 9.875 1.00 0.00 C ATOM 249 CE1 HIS A 15 11.079 12.592 8.076 1.00 0.00 C ATOM 250 NE2 HIS A 15 11.020 12.753 9.401 1.00 0.00 N ATOM 0 H HIS A 15 8.521 7.146 8.288 1.00 0.00 H new ATOM 0 HA HIS A 15 10.624 8.859 7.187 1.00 0.00 H new ATOM 0 HB2 HIS A 15 8.371 9.595 8.203 1.00 0.00 H new ATOM 0 HB3 HIS A 15 9.029 9.168 9.770 1.00 0.00 H new ATOM 0 HD2 HIS A 15 10.125 11.430 10.913 1.00 0.00 H new ATOM 0 HE1 HIS A 15 11.541 13.296 7.400 1.00 0.00 H new ATOM 0 HE2 HIS A 15 11.387 13.532 9.948 1.00 0.00 H new ATOM 258 N GLN A 16 11.108 7.075 9.882 1.00 0.00 N ATOM 259 CA GLN A 16 12.155 6.663 10.859 1.00 0.00 C ATOM 260 C GLN A 16 13.462 6.363 10.124 1.00 0.00 C ATOM 261 O GLN A 16 14.523 6.791 10.532 1.00 0.00 O ATOM 262 CB GLN A 16 11.687 5.415 11.613 1.00 0.00 C ATOM 263 CG GLN A 16 12.643 5.118 12.772 1.00 0.00 C ATOM 264 CD GLN A 16 11.992 4.112 13.724 1.00 0.00 C ATOM 265 OE1 GLN A 16 11.528 4.476 14.786 1.00 0.00 O ATOM 266 NE2 GLN A 16 11.939 2.853 13.386 1.00 0.00 N ATOM 0 H GLN A 16 10.245 6.532 9.917 1.00 0.00 H new ATOM 0 HA GLN A 16 12.324 7.473 11.569 1.00 0.00 H new ATOM 0 HB2 GLN A 16 10.677 5.566 11.993 1.00 0.00 H new ATOM 0 HB3 GLN A 16 11.648 4.563 10.935 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.582 4.718 12.390 1.00 0.00 H new ATOM 0 HG3 GLN A 16 12.882 6.038 13.306 1.00 0.00 H new ATOM 0 HE21 GLN A 16 12.329 2.548 12.494 1.00 0.00 H new ATOM 0 HE22 GLN A 16 11.508 2.174 14.014 1.00 0.00 H new ATOM 275 N TYR A 17 13.401 5.635 9.041 1.00 0.00 N ATOM 276 CA TYR A 17 14.646 5.319 8.290 1.00 0.00 C ATOM 277 C TYR A 17 15.136 6.583 7.585 1.00 0.00 C ATOM 278 O TYR A 17 16.302 6.924 7.639 1.00 0.00 O ATOM 279 CB TYR A 17 14.353 4.231 7.249 1.00 0.00 C ATOM 280 CG TYR A 17 14.281 2.881 7.929 1.00 0.00 C ATOM 281 CD1 TYR A 17 13.212 2.585 8.783 1.00 0.00 C ATOM 282 CD2 TYR A 17 15.283 1.926 7.705 1.00 0.00 C ATOM 283 CE1 TYR A 17 13.145 1.337 9.414 1.00 0.00 C ATOM 284 CE2 TYR A 17 15.215 0.679 8.336 1.00 0.00 C ATOM 285 CZ TYR A 17 14.146 0.384 9.190 1.00 0.00 C ATOM 286 OH TYR A 17 14.079 -0.845 9.811 1.00 0.00 O ATOM 0 H TYR A 17 12.544 5.247 8.646 1.00 0.00 H new ATOM 0 HA TYR A 17 15.412 4.961 8.978 1.00 0.00 H new ATOM 0 HB2 TYR A 17 13.412 4.444 6.741 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.132 4.224 6.487 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.439 3.319 8.955 1.00 0.00 H new ATOM 0 HD2 TYR A 17 16.107 2.153 7.045 1.00 0.00 H new ATOM 0 HE1 TYR A 17 12.321 1.109 10.074 1.00 0.00 H new ATOM 0 HE2 TYR A 17 15.987 -0.056 8.164 1.00 0.00 H new ATOM 0 HH TYR A 17 13.141 -1.087 9.957 1.00 0.00 H new ATOM 296 N SER A 18 14.253 7.278 6.920 1.00 0.00 N ATOM 297 CA SER A 18 14.656 8.523 6.202 1.00 0.00 C ATOM 298 C SER A 18 14.330 9.747 7.062 1.00 0.00 C ATOM 299 O SER A 18 13.578 10.610 6.653 1.00 0.00 O ATOM 300 CB SER A 18 13.886 8.616 4.884 1.00 0.00 C ATOM 301 OG SER A 18 12.512 8.343 5.123 1.00 0.00 O ATOM 0 H SER A 18 13.265 7.036 6.842 1.00 0.00 H new ATOM 0 HA SER A 18 15.728 8.495 6.005 1.00 0.00 H new ATOM 0 HB2 SER A 18 14.001 9.610 4.451 1.00 0.00 H new ATOM 0 HB3 SER A 18 14.290 7.906 4.163 1.00 0.00 H new ATOM 0 HG SER A 18 12.390 7.382 5.271 1.00 0.00 H new ATOM 307 N GLY A 19 14.906 9.845 8.240 1.00 0.00 N ATOM 308 CA GLY A 19 14.656 11.031 9.125 1.00 0.00 C ATOM 309 C GLY A 19 15.997 11.721 9.376 1.00 0.00 C ATOM 310 O GLY A 19 16.054 12.852 9.816 1.00 0.00 O ATOM 0 H GLY A 19 15.543 9.149 8.628 1.00 0.00 H new ATOM 0 HA2 GLY A 19 13.956 11.719 8.652 1.00 0.00 H new ATOM 0 HA3 GLY A 19 14.207 10.716 10.067 1.00 0.00 H new ATOM 314 N ARG A 20 17.075 11.059 9.059 1.00 0.00 N ATOM 315 CA ARG A 20 18.419 11.679 9.230 1.00 0.00 C ATOM 316 C ARG A 20 18.521 12.884 8.300 1.00 0.00 C ATOM 317 O ARG A 20 19.179 13.854 8.620 1.00 0.00 O ATOM 318 CB ARG A 20 19.513 10.666 8.887 1.00 0.00 C ATOM 319 CG ARG A 20 19.387 9.443 9.797 1.00 0.00 C ATOM 320 CD ARG A 20 20.291 8.325 9.274 1.00 0.00 C ATOM 321 NE ARG A 20 20.243 7.165 10.208 1.00 0.00 N ATOM 322 CZ ARG A 20 21.071 6.169 10.053 1.00 0.00 C ATOM 323 NH1 ARG A 20 21.366 5.747 8.853 1.00 0.00 N ATOM 324 NH2 ARG A 20 21.604 5.594 11.096 1.00 0.00 N ATOM 0 H ARG A 20 17.083 10.109 8.687 1.00 0.00 H new ATOM 0 HA ARG A 20 18.550 11.994 10.265 1.00 0.00 H new ATOM 0 HB2 ARG A 20 19.429 10.365 7.843 1.00 0.00 H new ATOM 0 HB3 ARG A 20 20.495 11.122 9.009 1.00 0.00 H new ATOM 0 HG2 ARG A 20 19.667 9.705 10.817 1.00 0.00 H new ATOM 0 HG3 ARG A 20 18.352 9.104 9.828 1.00 0.00 H new ATOM 0 HD2 ARG A 20 19.968 8.018 8.279 1.00 0.00 H new ATOM 0 HD3 ARG A 20 21.315 8.686 9.179 1.00 0.00 H new ATOM 0 HE ARG A 20 19.563 7.150 10.968 1.00 0.00 H new ATOM 0 HH11 ARG A 20 20.949 6.196 8.038 1.00 0.00 H new ATOM 0 HH12 ARG A 20 22.013 4.968 8.731 1.00 0.00 H new ATOM 0 HH21 ARG A 20 21.373 5.923 12.033 1.00 0.00 H new ATOM 0 HH22 ARG A 20 22.251 4.815 10.974 1.00 0.00 H new ATOM 338 N GLU A 21 17.861 12.869 7.172 1.00 0.00 N ATOM 339 CA GLU A 21 17.924 14.064 6.276 1.00 0.00 C ATOM 340 C GLU A 21 16.609 14.207 5.513 1.00 0.00 C ATOM 341 O GLU A 21 16.064 15.288 5.406 1.00 0.00 O ATOM 342 CB GLU A 21 19.081 13.912 5.286 1.00 0.00 C ATOM 343 CG GLU A 21 20.414 14.040 6.026 1.00 0.00 C ATOM 344 CD GLU A 21 21.560 14.072 5.013 1.00 0.00 C ATOM 345 OE1 GLU A 21 21.450 13.396 4.003 1.00 0.00 O ATOM 346 OE2 GLU A 21 22.528 14.771 5.264 1.00 0.00 O ATOM 0 H GLU A 21 17.289 12.095 6.835 1.00 0.00 H new ATOM 0 HA GLU A 21 18.087 14.955 6.882 1.00 0.00 H new ATOM 0 HB2 GLU A 21 19.022 12.944 4.789 1.00 0.00 H new ATOM 0 HB3 GLU A 21 19.010 14.674 4.510 1.00 0.00 H new ATOM 0 HG2 GLU A 21 20.422 14.948 6.628 1.00 0.00 H new ATOM 0 HG3 GLU A 21 20.544 13.202 6.711 1.00 0.00 H new ATOM 353 N GLY A 22 16.086 13.132 4.982 1.00 0.00 N ATOM 354 CA GLY A 22 14.800 13.223 4.229 1.00 0.00 C ATOM 355 C GLY A 22 14.856 14.413 3.269 1.00 0.00 C ATOM 356 O GLY A 22 13.846 14.859 2.763 1.00 0.00 O ATOM 0 H GLY A 22 16.492 12.198 5.037 1.00 0.00 H new ATOM 0 HA2 GLY A 22 14.625 12.302 3.674 1.00 0.00 H new ATOM 0 HA3 GLY A 22 13.967 13.340 4.923 1.00 0.00 H new ATOM 360 N ASP A 23 16.031 14.924 3.005 1.00 0.00 N ATOM 361 CA ASP A 23 16.143 16.078 2.066 1.00 0.00 C ATOM 362 C ASP A 23 15.338 15.751 0.808 1.00 0.00 C ATOM 363 O ASP A 23 14.400 16.441 0.462 1.00 0.00 O ATOM 364 CB ASP A 23 17.611 16.298 1.694 1.00 0.00 C ATOM 365 CG ASP A 23 17.746 17.590 0.887 1.00 0.00 C ATOM 366 OD1 ASP A 23 16.917 17.812 0.019 1.00 0.00 O ATOM 367 OD2 ASP A 23 18.676 18.334 1.148 1.00 0.00 O ATOM 0 H ASP A 23 16.913 14.594 3.397 1.00 0.00 H new ATOM 0 HA ASP A 23 15.759 16.984 2.535 1.00 0.00 H new ATOM 0 HB2 ASP A 23 18.221 16.355 2.596 1.00 0.00 H new ATOM 0 HB3 ASP A 23 17.980 15.453 1.112 1.00 0.00 H new ATOM 372 N LYS A 24 15.675 14.680 0.142 1.00 0.00 N ATOM 373 CA LYS A 24 14.907 14.280 -1.070 1.00 0.00 C ATOM 374 C LYS A 24 13.769 13.356 -0.624 1.00 0.00 C ATOM 375 O LYS A 24 13.825 12.757 0.432 1.00 0.00 O ATOM 376 CB LYS A 24 15.829 13.540 -2.045 1.00 0.00 C ATOM 377 CG LYS A 24 17.184 14.249 -2.102 1.00 0.00 C ATOM 378 CD LYS A 24 18.034 13.636 -3.218 1.00 0.00 C ATOM 379 CE LYS A 24 19.469 14.157 -3.112 1.00 0.00 C ATOM 380 NZ LYS A 24 19.448 15.634 -2.917 1.00 0.00 N ATOM 0 H LYS A 24 16.451 14.064 0.386 1.00 0.00 H new ATOM 0 HA LYS A 24 14.504 15.159 -1.574 1.00 0.00 H new ATOM 0 HB2 LYS A 24 15.960 12.506 -1.725 1.00 0.00 H new ATOM 0 HB3 LYS A 24 15.379 13.512 -3.037 1.00 0.00 H new ATOM 0 HG2 LYS A 24 17.042 15.315 -2.282 1.00 0.00 H new ATOM 0 HG3 LYS A 24 17.697 14.153 -1.145 1.00 0.00 H new ATOM 0 HD2 LYS A 24 18.024 12.549 -3.142 1.00 0.00 H new ATOM 0 HD3 LYS A 24 17.614 13.891 -4.191 1.00 0.00 H new ATOM 0 HE2 LYS A 24 19.981 13.677 -2.278 1.00 0.00 H new ATOM 0 HE3 LYS A 24 20.026 13.907 -4.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 20.372 16.032 -3.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 18.708 16.053 -3.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 19.248 15.850 -1.919 1.00 0.00 H new ATOM 394 N HIS A 25 12.752 13.215 -1.434 1.00 0.00 N ATOM 395 CA HIS A 25 11.611 12.306 -1.091 1.00 0.00 C ATOM 396 C HIS A 25 11.655 11.132 -2.065 1.00 0.00 C ATOM 397 O HIS A 25 10.655 10.737 -2.631 1.00 0.00 O ATOM 398 CB HIS A 25 10.290 13.061 -1.252 1.00 0.00 C ATOM 399 CG HIS A 25 10.388 14.392 -0.560 1.00 0.00 C ATOM 400 ND1 HIS A 25 10.687 15.560 -1.244 1.00 0.00 N ATOM 401 CD2 HIS A 25 10.231 14.758 0.755 1.00 0.00 C ATOM 402 CE1 HIS A 25 10.700 16.563 -0.347 1.00 0.00 C ATOM 403 NE2 HIS A 25 10.428 16.129 0.886 1.00 0.00 N ATOM 0 H HIS A 25 12.660 13.695 -2.329 1.00 0.00 H new ATOM 0 HA HIS A 25 11.688 11.956 -0.062 1.00 0.00 H new ATOM 0 HB2 HIS A 25 10.067 13.204 -2.309 1.00 0.00 H new ATOM 0 HB3 HIS A 25 9.472 12.478 -0.829 1.00 0.00 H new ATOM 0 HD2 HIS A 25 9.991 14.084 1.564 1.00 0.00 H new ATOM 0 HE1 HIS A 25 10.906 17.594 -0.594 1.00 0.00 H new ATOM 0 HE2 HIS A 25 10.376 16.684 1.741 1.00 0.00 H new ATOM 411 N LYS A 26 12.822 10.576 -2.256 1.00 0.00 N ATOM 412 CA LYS A 26 12.982 9.420 -3.187 1.00 0.00 C ATOM 413 C LYS A 26 13.806 8.323 -2.505 1.00 0.00 C ATOM 414 O LYS A 26 14.681 8.601 -1.710 1.00 0.00 O ATOM 415 CB LYS A 26 13.708 9.891 -4.448 1.00 0.00 C ATOM 416 CG LYS A 26 12.939 11.057 -5.071 1.00 0.00 C ATOM 417 CD LYS A 26 13.714 11.597 -6.275 1.00 0.00 C ATOM 418 CE LYS A 26 12.919 12.729 -6.928 1.00 0.00 C ATOM 419 NZ LYS A 26 12.733 13.835 -5.947 1.00 0.00 N ATOM 0 H LYS A 26 13.683 10.878 -1.800 1.00 0.00 H new ATOM 0 HA LYS A 26 12.002 9.023 -3.451 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.724 10.201 -4.202 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.789 9.071 -5.162 1.00 0.00 H new ATOM 0 HG2 LYS A 26 11.948 10.727 -5.382 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.796 11.847 -4.334 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.692 11.961 -5.958 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.889 10.798 -6.996 1.00 0.00 H new ATOM 0 HE2 LYS A 26 13.445 13.095 -7.810 1.00 0.00 H new ATOM 0 HE3 LYS A 26 11.950 12.360 -7.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 12.508 14.715 -6.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 11.953 13.599 -5.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 13.608 13.965 -5.400 1.00 0.00 H new ATOM 433 N LEU A 27 13.533 7.080 -2.816 1.00 0.00 N ATOM 434 CA LEU A 27 14.293 5.942 -2.199 1.00 0.00 C ATOM 435 C LEU A 27 14.951 5.131 -3.320 1.00 0.00 C ATOM 436 O LEU A 27 14.383 4.951 -4.378 1.00 0.00 O ATOM 437 CB LEU A 27 13.317 5.055 -1.415 1.00 0.00 C ATOM 438 CG LEU A 27 14.084 4.135 -0.447 1.00 0.00 C ATOM 439 CD1 LEU A 27 14.616 4.932 0.761 1.00 0.00 C ATOM 440 CD2 LEU A 27 13.138 3.033 0.048 1.00 0.00 C ATOM 0 H LEU A 27 12.809 6.800 -3.478 1.00 0.00 H new ATOM 0 HA LEU A 27 15.059 6.317 -1.520 1.00 0.00 H new ATOM 0 HB2 LEU A 27 12.618 5.678 -0.857 1.00 0.00 H new ATOM 0 HB3 LEU A 27 12.727 4.454 -2.107 1.00 0.00 H new ATOM 0 HG LEU A 27 14.933 3.698 -0.974 1.00 0.00 H new ATOM 0 HD11 LEU A 27 15.154 4.261 1.431 1.00 0.00 H new ATOM 0 HD12 LEU A 27 15.290 5.714 0.412 1.00 0.00 H new ATOM 0 HD13 LEU A 27 13.780 5.384 1.295 1.00 0.00 H new ATOM 0 HD21 LEU A 27 13.672 2.376 0.734 1.00 0.00 H new ATOM 0 HD22 LEU A 27 12.291 3.485 0.564 1.00 0.00 H new ATOM 0 HD23 LEU A 27 12.778 2.454 -0.802 1.00 0.00 H new ATOM 452 N LYS A 28 16.151 4.647 -3.108 1.00 0.00 N ATOM 453 CA LYS A 28 16.841 3.858 -4.176 1.00 0.00 C ATOM 454 C LYS A 28 16.579 2.363 -3.974 1.00 0.00 C ATOM 455 O LYS A 28 16.324 1.911 -2.875 1.00 0.00 O ATOM 456 CB LYS A 28 18.348 4.115 -4.109 1.00 0.00 C ATOM 457 CG LYS A 28 18.613 5.618 -3.974 1.00 0.00 C ATOM 458 CD LYS A 28 20.071 5.917 -4.337 1.00 0.00 C ATOM 459 CE LYS A 28 21.003 5.180 -3.373 1.00 0.00 C ATOM 460 NZ LYS A 28 22.382 5.728 -3.501 1.00 0.00 N ATOM 0 H LYS A 28 16.681 4.764 -2.244 1.00 0.00 H new ATOM 0 HA LYS A 28 16.456 4.165 -5.148 1.00 0.00 H new ATOM 0 HB2 LYS A 28 18.780 3.583 -3.261 1.00 0.00 H new ATOM 0 HB3 LYS A 28 18.832 3.730 -5.007 1.00 0.00 H new ATOM 0 HG2 LYS A 28 17.943 6.176 -4.628 1.00 0.00 H new ATOM 0 HG3 LYS A 28 18.407 5.944 -2.954 1.00 0.00 H new ATOM 0 HD2 LYS A 28 20.272 5.606 -5.362 1.00 0.00 H new ATOM 0 HD3 LYS A 28 20.256 6.990 -4.288 1.00 0.00 H new ATOM 0 HE2 LYS A 28 20.648 5.294 -2.349 1.00 0.00 H new ATOM 0 HE3 LYS A 28 21.002 4.113 -3.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 23.017 5.228 -2.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 22.718 5.597 -4.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 22.375 6.742 -3.270 1.00 0.00 H new ATOM 474 N LYS A 29 16.653 1.589 -5.023 1.00 0.00 N ATOM 475 CA LYS A 29 16.424 0.123 -4.890 1.00 0.00 C ATOM 476 C LYS A 29 17.435 -0.476 -3.901 1.00 0.00 C ATOM 477 O LYS A 29 17.118 -1.357 -3.127 1.00 0.00 O ATOM 478 CB LYS A 29 16.563 -0.553 -6.272 1.00 0.00 C ATOM 479 CG LYS A 29 18.002 -0.474 -6.818 1.00 0.00 C ATOM 480 CD LYS A 29 18.396 0.985 -7.098 1.00 0.00 C ATOM 481 CE LYS A 29 19.540 1.026 -8.117 1.00 0.00 C ATOM 482 NZ LYS A 29 19.893 2.443 -8.412 1.00 0.00 N ATOM 0 H LYS A 29 16.863 1.910 -5.968 1.00 0.00 H new ATOM 0 HA LYS A 29 15.417 -0.052 -4.510 1.00 0.00 H new ATOM 0 HB2 LYS A 29 16.263 -1.598 -6.195 1.00 0.00 H new ATOM 0 HB3 LYS A 29 15.882 -0.077 -6.977 1.00 0.00 H new ATOM 0 HG2 LYS A 29 18.694 -0.911 -6.098 1.00 0.00 H new ATOM 0 HG3 LYS A 29 18.082 -1.060 -7.734 1.00 0.00 H new ATOM 0 HD2 LYS A 29 17.537 1.537 -7.479 1.00 0.00 H new ATOM 0 HD3 LYS A 29 18.703 1.473 -6.173 1.00 0.00 H new ATOM 0 HE2 LYS A 29 20.409 0.498 -7.725 1.00 0.00 H new ATOM 0 HE3 LYS A 29 19.243 0.516 -9.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.669 2.471 -9.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 19.063 2.933 -8.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.193 2.916 -7.536 1.00 0.00 H new ATOM 496 N SER A 30 18.654 -0.013 -3.939 1.00 0.00 N ATOM 497 CA SER A 30 19.704 -0.554 -3.028 1.00 0.00 C ATOM 498 C SER A 30 19.332 -0.314 -1.562 1.00 0.00 C ATOM 499 O SER A 30 19.497 -1.177 -0.714 1.00 0.00 O ATOM 500 CB SER A 30 21.028 0.150 -3.323 1.00 0.00 C ATOM 501 OG SER A 30 20.835 1.557 -3.261 1.00 0.00 O ATOM 0 H SER A 30 18.971 0.724 -4.568 1.00 0.00 H new ATOM 0 HA SER A 30 19.792 -1.627 -3.196 1.00 0.00 H new ATOM 0 HB2 SER A 30 21.785 -0.157 -2.602 1.00 0.00 H new ATOM 0 HB3 SER A 30 21.393 -0.136 -4.309 1.00 0.00 H new ATOM 0 HG SER A 30 21.683 2.012 -3.448 1.00 0.00 H new ATOM 507 N GLU A 31 18.835 0.853 -1.251 1.00 0.00 N ATOM 508 CA GLU A 31 18.474 1.137 0.165 1.00 0.00 C ATOM 509 C GLU A 31 17.188 0.390 0.507 1.00 0.00 C ATOM 510 O GLU A 31 16.989 -0.071 1.614 1.00 0.00 O ATOM 511 CB GLU A 31 18.272 2.642 0.359 1.00 0.00 C ATOM 512 CG GLU A 31 18.302 2.973 1.853 1.00 0.00 C ATOM 513 CD GLU A 31 18.124 4.480 2.048 1.00 0.00 C ATOM 514 OE1 GLU A 31 18.833 5.229 1.396 1.00 0.00 O ATOM 515 OE2 GLU A 31 17.283 4.859 2.846 1.00 0.00 O ATOM 0 H GLU A 31 18.665 1.614 -1.909 1.00 0.00 H new ATOM 0 HA GLU A 31 19.277 0.805 0.823 1.00 0.00 H new ATOM 0 HB2 GLU A 31 19.053 3.195 -0.162 1.00 0.00 H new ATOM 0 HB3 GLU A 31 17.320 2.951 -0.074 1.00 0.00 H new ATOM 0 HG2 GLU A 31 17.510 2.433 2.371 1.00 0.00 H new ATOM 0 HG3 GLU A 31 19.247 2.649 2.289 1.00 0.00 H new ATOM 522 N LEU A 32 16.319 0.263 -0.459 1.00 0.00 N ATOM 523 CA LEU A 32 15.038 -0.460 -0.239 1.00 0.00 C ATOM 524 C LEU A 32 15.342 -1.924 0.076 1.00 0.00 C ATOM 525 O LEU A 32 14.721 -2.516 0.936 1.00 0.00 O ATOM 526 CB LEU A 32 14.182 -0.357 -1.509 1.00 0.00 C ATOM 527 CG LEU A 32 12.971 -1.299 -1.440 1.00 0.00 C ATOM 528 CD1 LEU A 32 12.159 -1.021 -0.173 1.00 0.00 C ATOM 529 CD2 LEU A 32 12.088 -1.062 -2.669 1.00 0.00 C ATOM 0 H LEU A 32 16.445 0.634 -1.401 1.00 0.00 H new ATOM 0 HA LEU A 32 14.492 -0.020 0.596 1.00 0.00 H new ATOM 0 HB2 LEU A 32 13.840 0.670 -1.638 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.788 -0.603 -2.381 1.00 0.00 H new ATOM 0 HG LEU A 32 13.318 -2.332 -1.419 1.00 0.00 H new ATOM 0 HD11 LEU A 32 11.303 -1.695 -0.134 1.00 0.00 H new ATOM 0 HD12 LEU A 32 12.786 -1.181 0.704 1.00 0.00 H new ATOM 0 HD13 LEU A 32 11.808 0.011 -0.185 1.00 0.00 H new ATOM 0 HD21 LEU A 32 11.225 -1.726 -2.630 1.00 0.00 H new ATOM 0 HD22 LEU A 32 11.749 -0.026 -2.679 1.00 0.00 H new ATOM 0 HD23 LEU A 32 12.661 -1.265 -3.574 1.00 0.00 H new ATOM 541 N LYS A 33 16.265 -2.537 -0.617 1.00 0.00 N ATOM 542 CA LYS A 33 16.532 -3.970 -0.331 1.00 0.00 C ATOM 543 C LYS A 33 16.838 -4.125 1.154 1.00 0.00 C ATOM 544 O LYS A 33 16.182 -4.862 1.863 1.00 0.00 O ATOM 545 CB LYS A 33 17.717 -4.460 -1.166 1.00 0.00 C ATOM 546 CG LYS A 33 17.279 -4.639 -2.622 1.00 0.00 C ATOM 547 CD LYS A 33 18.512 -4.806 -3.514 1.00 0.00 C ATOM 548 CE LYS A 33 19.235 -6.108 -3.160 1.00 0.00 C ATOM 549 NZ LYS A 33 20.164 -6.472 -4.266 1.00 0.00 N ATOM 0 H LYS A 33 16.833 -2.116 -1.352 1.00 0.00 H new ATOM 0 HA LYS A 33 15.658 -4.567 -0.591 1.00 0.00 H new ATOM 0 HB2 LYS A 33 18.537 -3.744 -1.108 1.00 0.00 H new ATOM 0 HB3 LYS A 33 18.089 -5.404 -0.769 1.00 0.00 H new ATOM 0 HG2 LYS A 33 16.632 -5.511 -2.713 1.00 0.00 H new ATOM 0 HG3 LYS A 33 16.698 -3.776 -2.946 1.00 0.00 H new ATOM 0 HD2 LYS A 33 18.215 -4.818 -4.563 1.00 0.00 H new ATOM 0 HD3 LYS A 33 19.185 -3.958 -3.383 1.00 0.00 H new ATOM 0 HE2 LYS A 33 19.789 -5.988 -2.229 1.00 0.00 H new ATOM 0 HE3 LYS A 33 18.511 -6.907 -3.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 20.977 -6.992 -3.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 19.666 -7.071 -4.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 20.499 -5.607 -4.737 1.00 0.00 H new ATOM 563 N GLU A 34 17.832 -3.428 1.633 1.00 0.00 N ATOM 564 CA GLU A 34 18.172 -3.537 3.082 1.00 0.00 C ATOM 565 C GLU A 34 16.899 -3.307 3.906 1.00 0.00 C ATOM 566 O GLU A 34 16.672 -3.956 4.907 1.00 0.00 O ATOM 567 CB GLU A 34 19.221 -2.483 3.445 1.00 0.00 C ATOM 568 CG GLU A 34 20.555 -2.846 2.790 1.00 0.00 C ATOM 569 CD GLU A 34 21.591 -1.766 3.109 1.00 0.00 C ATOM 570 OE1 GLU A 34 22.063 -1.740 4.233 1.00 0.00 O ATOM 571 OE2 GLU A 34 21.896 -0.985 2.222 1.00 0.00 O ATOM 0 H GLU A 34 18.419 -2.794 1.091 1.00 0.00 H new ATOM 0 HA GLU A 34 18.576 -4.526 3.295 1.00 0.00 H new ATOM 0 HB2 GLU A 34 18.895 -1.499 3.109 1.00 0.00 H new ATOM 0 HB3 GLU A 34 19.338 -2.428 4.527 1.00 0.00 H new ATOM 0 HG2 GLU A 34 20.899 -3.814 3.154 1.00 0.00 H new ATOM 0 HG3 GLU A 34 20.430 -2.937 1.711 1.00 0.00 H new ATOM 578 N LEU A 35 16.064 -2.395 3.488 1.00 0.00 N ATOM 579 CA LEU A 35 14.803 -2.131 4.242 1.00 0.00 C ATOM 580 C LEU A 35 13.885 -3.357 4.140 1.00 0.00 C ATOM 581 O LEU A 35 13.242 -3.734 5.099 1.00 0.00 O ATOM 582 CB LEU A 35 14.114 -0.893 3.658 1.00 0.00 C ATOM 583 CG LEU A 35 12.839 -0.557 4.447 1.00 0.00 C ATOM 584 CD1 LEU A 35 13.192 -0.115 5.878 1.00 0.00 C ATOM 585 CD2 LEU A 35 12.096 0.576 3.728 1.00 0.00 C ATOM 0 H LEU A 35 16.200 -1.820 2.656 1.00 0.00 H new ATOM 0 HA LEU A 35 15.027 -1.946 5.293 1.00 0.00 H new ATOM 0 HB2 LEU A 35 14.798 -0.044 3.684 1.00 0.00 H new ATOM 0 HB3 LEU A 35 13.864 -1.069 2.612 1.00 0.00 H new ATOM 0 HG LEU A 35 12.208 -1.444 4.504 1.00 0.00 H new ATOM 0 HD11 LEU A 35 12.277 0.119 6.423 1.00 0.00 H new ATOM 0 HD12 LEU A 35 13.722 -0.920 6.387 1.00 0.00 H new ATOM 0 HD13 LEU A 35 13.828 0.770 5.839 1.00 0.00 H new ATOM 0 HD21 LEU A 35 11.189 0.823 4.279 1.00 0.00 H new ATOM 0 HD22 LEU A 35 12.738 1.455 3.673 1.00 0.00 H new ATOM 0 HD23 LEU A 35 11.832 0.256 2.720 1.00 0.00 H new ATOM 597 N ILE A 36 13.834 -4.002 3.006 1.00 0.00 N ATOM 598 CA ILE A 36 12.979 -5.218 2.873 1.00 0.00 C ATOM 599 C ILE A 36 13.479 -6.292 3.848 1.00 0.00 C ATOM 600 O ILE A 36 12.711 -7.057 4.397 1.00 0.00 O ATOM 601 CB ILE A 36 13.089 -5.743 1.427 1.00 0.00 C ATOM 602 CG1 ILE A 36 12.265 -4.830 0.504 1.00 0.00 C ATOM 603 CG2 ILE A 36 12.547 -7.181 1.344 1.00 0.00 C ATOM 604 CD1 ILE A 36 12.524 -5.179 -0.967 1.00 0.00 C ATOM 0 H ILE A 36 14.348 -3.740 2.165 1.00 0.00 H new ATOM 0 HA ILE A 36 11.941 -4.977 3.101 1.00 0.00 H new ATOM 0 HB ILE A 36 14.134 -5.743 1.118 1.00 0.00 H new ATOM 0 HG12 ILE A 36 11.204 -4.939 0.728 1.00 0.00 H new ATOM 0 HG13 ILE A 36 12.525 -3.787 0.688 1.00 0.00 H new ATOM 0 HG21 ILE A 36 12.629 -7.542 0.319 1.00 0.00 H new ATOM 0 HG22 ILE A 36 13.126 -7.827 2.004 1.00 0.00 H new ATOM 0 HG23 ILE A 36 11.501 -7.194 1.650 1.00 0.00 H new ATOM 0 HD11 ILE A 36 11.933 -4.523 -1.606 1.00 0.00 H new ATOM 0 HD12 ILE A 36 13.582 -5.047 -1.191 1.00 0.00 H new ATOM 0 HD13 ILE A 36 12.241 -6.216 -1.150 1.00 0.00 H new ATOM 616 N ASN A 37 14.767 -6.376 4.025 1.00 0.00 N ATOM 617 CA ASN A 37 15.347 -7.423 4.916 1.00 0.00 C ATOM 618 C ASN A 37 14.908 -7.242 6.374 1.00 0.00 C ATOM 619 O ASN A 37 14.798 -8.202 7.110 1.00 0.00 O ATOM 620 CB ASN A 37 16.873 -7.338 4.846 1.00 0.00 C ATOM 621 CG ASN A 37 17.326 -7.451 3.389 1.00 0.00 C ATOM 622 OD1 ASN A 37 16.557 -7.209 2.481 1.00 0.00 O ATOM 623 ND2 ASN A 37 18.553 -7.812 3.126 1.00 0.00 N ATOM 0 H ASN A 37 15.451 -5.759 3.587 1.00 0.00 H new ATOM 0 HA ASN A 37 14.989 -8.394 4.574 1.00 0.00 H new ATOM 0 HB2 ASN A 37 17.215 -6.395 5.272 1.00 0.00 H new ATOM 0 HB3 ASN A 37 17.320 -8.136 5.439 1.00 0.00 H new ATOM 0 HD21 ASN A 37 18.865 -7.891 2.158 1.00 0.00 H new ATOM 0 HD22 ASN A 37 19.199 -8.015 3.888 1.00 0.00 H new ATOM 630 N ASN A 38 14.696 -6.024 6.813 1.00 0.00 N ATOM 631 CA ASN A 38 14.310 -5.786 8.247 1.00 0.00 C ATOM 632 C ASN A 38 12.831 -5.403 8.379 1.00 0.00 C ATOM 633 O ASN A 38 12.384 -5.069 9.459 1.00 0.00 O ATOM 634 CB ASN A 38 15.168 -4.649 8.804 1.00 0.00 C ATOM 635 CG ASN A 38 14.805 -4.403 10.270 1.00 0.00 C ATOM 636 OD1 ASN A 38 14.893 -5.297 11.088 1.00 0.00 O ATOM 637 ND2 ASN A 38 14.398 -3.219 10.638 1.00 0.00 N ATOM 0 H ASN A 38 14.773 -5.182 6.242 1.00 0.00 H new ATOM 0 HA ASN A 38 14.472 -6.709 8.803 1.00 0.00 H new ATOM 0 HB2 ASN A 38 16.225 -4.902 8.718 1.00 0.00 H new ATOM 0 HB3 ASN A 38 15.009 -3.741 8.222 1.00 0.00 H new ATOM 0 HD21 ASN A 38 14.154 -3.044 11.613 1.00 0.00 H new ATOM 0 HD22 ASN A 38 14.324 -2.469 9.951 1.00 0.00 H new ATOM 644 N GLU A 39 12.067 -5.427 7.310 1.00 0.00 N ATOM 645 CA GLU A 39 10.615 -5.040 7.412 1.00 0.00 C ATOM 646 C GLU A 39 9.707 -6.168 6.909 1.00 0.00 C ATOM 647 O GLU A 39 8.578 -6.288 7.344 1.00 0.00 O ATOM 648 CB GLU A 39 10.370 -3.787 6.568 1.00 0.00 C ATOM 649 CG GLU A 39 11.057 -2.587 7.224 1.00 0.00 C ATOM 650 CD GLU A 39 10.262 -2.149 8.457 1.00 0.00 C ATOM 651 OE1 GLU A 39 9.256 -2.775 8.744 1.00 0.00 O ATOM 652 OE2 GLU A 39 10.674 -1.192 9.092 1.00 0.00 O ATOM 0 H GLU A 39 12.380 -5.695 6.377 1.00 0.00 H new ATOM 0 HA GLU A 39 10.381 -4.848 8.459 1.00 0.00 H new ATOM 0 HB2 GLU A 39 10.756 -3.934 5.559 1.00 0.00 H new ATOM 0 HB3 GLU A 39 9.300 -3.601 6.476 1.00 0.00 H new ATOM 0 HG2 GLU A 39 12.075 -2.850 7.510 1.00 0.00 H new ATOM 0 HG3 GLU A 39 11.128 -1.763 6.514 1.00 0.00 H new ATOM 659 N LEU A 40 10.181 -7.000 6.012 1.00 0.00 N ATOM 660 CA LEU A 40 9.333 -8.128 5.493 1.00 0.00 C ATOM 661 C LEU A 40 9.958 -9.465 5.896 1.00 0.00 C ATOM 662 O LEU A 40 9.838 -10.454 5.201 1.00 0.00 O ATOM 663 CB LEU A 40 9.251 -8.050 3.963 1.00 0.00 C ATOM 664 CG LEU A 40 8.766 -6.661 3.523 1.00 0.00 C ATOM 665 CD1 LEU A 40 8.553 -6.656 2.005 1.00 0.00 C ATOM 666 CD2 LEU A 40 7.441 -6.317 4.224 1.00 0.00 C ATOM 0 H LEU A 40 11.119 -6.949 5.615 1.00 0.00 H new ATOM 0 HA LEU A 40 8.332 -8.049 5.916 1.00 0.00 H new ATOM 0 HB2 LEU A 40 10.230 -8.255 3.529 1.00 0.00 H new ATOM 0 HB3 LEU A 40 8.570 -8.815 3.589 1.00 0.00 H new ATOM 0 HG LEU A 40 9.516 -5.918 3.795 1.00 0.00 H new ATOM 0 HD11 LEU A 40 8.209 -5.671 1.689 1.00 0.00 H new ATOM 0 HD12 LEU A 40 9.493 -6.889 1.505 1.00 0.00 H new ATOM 0 HD13 LEU A 40 7.806 -7.404 1.740 1.00 0.00 H new ATOM 0 HD21 LEU A 40 7.106 -5.330 3.905 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.687 -7.059 3.961 1.00 0.00 H new ATOM 0 HD23 LEU A 40 7.590 -6.318 5.304 1.00 0.00 H new ATOM 678 N SER A 41 10.626 -9.500 7.017 1.00 0.00 N ATOM 679 CA SER A 41 11.262 -10.769 7.474 1.00 0.00 C ATOM 680 C SER A 41 10.193 -11.742 7.983 1.00 0.00 C ATOM 681 O SER A 41 10.377 -12.943 7.956 1.00 0.00 O ATOM 682 CB SER A 41 12.249 -10.464 8.602 1.00 0.00 C ATOM 683 OG SER A 41 13.415 -9.866 8.054 1.00 0.00 O ATOM 0 H SER A 41 10.759 -8.702 7.638 1.00 0.00 H new ATOM 0 HA SER A 41 11.788 -11.225 6.636 1.00 0.00 H new ATOM 0 HB2 SER A 41 11.791 -9.795 9.331 1.00 0.00 H new ATOM 0 HB3 SER A 41 12.510 -11.381 9.131 1.00 0.00 H new ATOM 0 HG SER A 41 13.198 -8.970 7.721 1.00 0.00 H new ATOM 689 N HIS A 42 9.081 -11.244 8.455 1.00 0.00 N ATOM 690 CA HIS A 42 8.019 -12.158 8.968 1.00 0.00 C ATOM 691 C HIS A 42 7.322 -12.860 7.800 1.00 0.00 C ATOM 692 O HIS A 42 7.177 -14.066 7.788 1.00 0.00 O ATOM 693 CB HIS A 42 6.989 -11.350 9.761 1.00 0.00 C ATOM 694 CG HIS A 42 5.911 -12.269 10.266 1.00 0.00 C ATOM 695 ND1 HIS A 42 5.117 -13.019 9.412 1.00 0.00 N ATOM 696 CD2 HIS A 42 5.484 -12.570 11.535 1.00 0.00 C ATOM 697 CE1 HIS A 42 4.262 -13.728 10.171 1.00 0.00 C ATOM 698 NE2 HIS A 42 4.442 -13.491 11.473 1.00 0.00 N ATOM 0 H HIS A 42 8.863 -10.249 8.507 1.00 0.00 H new ATOM 0 HA HIS A 42 8.476 -12.907 9.615 1.00 0.00 H new ATOM 0 HB2 HIS A 42 7.473 -10.845 10.597 1.00 0.00 H new ATOM 0 HB3 HIS A 42 6.555 -10.575 9.129 1.00 0.00 H new ATOM 0 HD2 HIS A 42 5.894 -12.155 12.444 1.00 0.00 H new ATOM 0 HE1 HIS A 42 3.520 -14.406 9.776 1.00 0.00 H new ATOM 0 HE2 HIS A 42 3.927 -13.897 12.254 1.00 0.00 H new ATOM 706 N PHE A 43 6.883 -12.116 6.823 1.00 0.00 N ATOM 707 CA PHE A 43 6.188 -12.745 5.664 1.00 0.00 C ATOM 708 C PHE A 43 7.168 -13.634 4.895 1.00 0.00 C ATOM 709 O PHE A 43 6.780 -14.578 4.235 1.00 0.00 O ATOM 710 CB PHE A 43 5.648 -11.651 4.740 1.00 0.00 C ATOM 711 CG PHE A 43 4.692 -10.771 5.513 1.00 0.00 C ATOM 712 CD1 PHE A 43 3.447 -11.274 5.912 1.00 0.00 C ATOM 713 CD2 PHE A 43 5.050 -9.455 5.835 1.00 0.00 C ATOM 714 CE1 PHE A 43 2.561 -10.462 6.630 1.00 0.00 C ATOM 715 CE2 PHE A 43 4.164 -8.644 6.554 1.00 0.00 C ATOM 716 CZ PHE A 43 2.919 -9.147 6.951 1.00 0.00 C ATOM 0 H PHE A 43 6.975 -11.101 6.776 1.00 0.00 H new ATOM 0 HA PHE A 43 5.360 -13.355 6.025 1.00 0.00 H new ATOM 0 HB2 PHE A 43 6.470 -11.055 4.344 1.00 0.00 H new ATOM 0 HB3 PHE A 43 5.139 -12.098 3.886 1.00 0.00 H new ATOM 0 HD1 PHE A 43 3.171 -12.289 5.666 1.00 0.00 H new ATOM 0 HD2 PHE A 43 6.010 -9.066 5.528 1.00 0.00 H new ATOM 0 HE1 PHE A 43 1.601 -10.850 6.936 1.00 0.00 H new ATOM 0 HE2 PHE A 43 4.441 -7.630 6.803 1.00 0.00 H new ATOM 0 HZ PHE A 43 2.235 -8.521 7.505 1.00 0.00 H new ATOM 726 N LEU A 44 8.435 -13.330 4.964 1.00 0.00 N ATOM 727 CA LEU A 44 9.442 -14.146 4.226 1.00 0.00 C ATOM 728 C LEU A 44 9.285 -15.624 4.615 1.00 0.00 C ATOM 729 O LEU A 44 9.671 -16.512 3.880 1.00 0.00 O ATOM 730 CB LEU A 44 10.864 -13.631 4.583 1.00 0.00 C ATOM 731 CG LEU A 44 11.697 -13.304 3.321 1.00 0.00 C ATOM 732 CD1 LEU A 44 11.650 -14.466 2.304 1.00 0.00 C ATOM 733 CD2 LEU A 44 11.181 -12.001 2.679 1.00 0.00 C ATOM 0 H LEU A 44 8.817 -12.551 5.500 1.00 0.00 H new ATOM 0 HA LEU A 44 9.290 -14.054 3.150 1.00 0.00 H new ATOM 0 HB2 LEU A 44 10.781 -12.739 5.204 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.384 -14.384 5.175 1.00 0.00 H new ATOM 0 HG LEU A 44 12.737 -13.168 3.619 1.00 0.00 H new ATOM 0 HD11 LEU A 44 12.244 -14.207 1.428 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.055 -15.368 2.763 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.618 -14.644 2.002 1.00 0.00 H new ATOM 0 HD21 LEU A 44 11.771 -11.775 1.791 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.135 -12.123 2.399 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.272 -11.183 3.393 1.00 0.00 H new ATOM 745 N GLU A 45 8.722 -15.897 5.759 1.00 0.00 N ATOM 746 CA GLU A 45 8.548 -17.316 6.177 1.00 0.00 C ATOM 747 C GLU A 45 7.351 -17.922 5.443 1.00 0.00 C ATOM 748 O GLU A 45 7.388 -19.052 4.999 1.00 0.00 O ATOM 749 CB GLU A 45 8.308 -17.377 7.689 1.00 0.00 C ATOM 750 CG GLU A 45 9.632 -17.168 8.428 1.00 0.00 C ATOM 751 CD GLU A 45 10.506 -18.414 8.271 1.00 0.00 C ATOM 752 OE1 GLU A 45 10.013 -19.396 7.740 1.00 0.00 O ATOM 753 OE2 GLU A 45 11.653 -18.365 8.683 1.00 0.00 O ATOM 0 H GLU A 45 8.376 -15.202 6.420 1.00 0.00 H new ATOM 0 HA GLU A 45 9.447 -17.881 5.930 1.00 0.00 H new ATOM 0 HB2 GLU A 45 7.590 -16.612 7.985 1.00 0.00 H new ATOM 0 HB3 GLU A 45 7.877 -18.341 7.960 1.00 0.00 H new ATOM 0 HG2 GLU A 45 10.149 -16.295 8.029 1.00 0.00 H new ATOM 0 HG3 GLU A 45 9.445 -16.973 9.484 1.00 0.00 H new ATOM 760 N GLU A 46 6.286 -17.179 5.316 1.00 0.00 N ATOM 761 CA GLU A 46 5.078 -17.710 4.617 1.00 0.00 C ATOM 762 C GLU A 46 5.183 -17.438 3.114 1.00 0.00 C ATOM 763 O GLU A 46 4.354 -16.760 2.540 1.00 0.00 O ATOM 764 CB GLU A 46 3.829 -17.020 5.170 1.00 0.00 C ATOM 765 CG GLU A 46 3.513 -17.575 6.560 1.00 0.00 C ATOM 766 CD GLU A 46 2.408 -16.739 7.208 1.00 0.00 C ATOM 767 OE1 GLU A 46 1.294 -16.778 6.711 1.00 0.00 O ATOM 768 OE2 GLU A 46 2.693 -16.074 8.190 1.00 0.00 O ATOM 0 H GLU A 46 6.199 -16.225 5.666 1.00 0.00 H new ATOM 0 HA GLU A 46 5.011 -18.785 4.783 1.00 0.00 H new ATOM 0 HB2 GLU A 46 3.989 -15.943 5.224 1.00 0.00 H new ATOM 0 HB3 GLU A 46 2.984 -17.183 4.501 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.198 -18.616 6.484 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.408 -17.557 7.182 1.00 0.00 H new ATOM 775 N ILE A 47 6.195 -17.972 2.471 1.00 0.00 N ATOM 776 CA ILE A 47 6.368 -17.765 0.996 1.00 0.00 C ATOM 777 C ILE A 47 6.341 -19.124 0.294 1.00 0.00 C ATOM 778 O ILE A 47 7.314 -19.851 0.289 1.00 0.00 O ATOM 779 CB ILE A 47 7.719 -17.092 0.727 1.00 0.00 C ATOM 780 CG1 ILE A 47 7.792 -15.738 1.455 1.00 0.00 C ATOM 781 CG2 ILE A 47 7.901 -16.881 -0.779 1.00 0.00 C ATOM 782 CD1 ILE A 47 6.612 -14.838 1.061 1.00 0.00 C ATOM 0 H ILE A 47 6.915 -18.547 2.908 1.00 0.00 H new ATOM 0 HA ILE A 47 5.563 -17.133 0.620 1.00 0.00 H new ATOM 0 HB ILE A 47 8.515 -17.736 1.100 1.00 0.00 H new ATOM 0 HG12 ILE A 47 7.787 -15.900 2.533 1.00 0.00 H new ATOM 0 HG13 ILE A 47 8.731 -15.240 1.212 1.00 0.00 H new ATOM 0 HG21 ILE A 47 8.862 -16.402 -0.966 1.00 0.00 H new ATOM 0 HG22 ILE A 47 7.870 -17.845 -1.288 1.00 0.00 H new ATOM 0 HG23 ILE A 47 7.100 -16.246 -1.157 1.00 0.00 H new ATOM 0 HD11 ILE A 47 6.687 -13.887 1.589 1.00 0.00 H new ATOM 0 HD12 ILE A 47 6.634 -14.659 -0.014 1.00 0.00 H new ATOM 0 HD13 ILE A 47 5.676 -15.328 1.328 1.00 0.00 H new ATOM 794 N LYS A 48 5.234 -19.468 -0.308 1.00 0.00 N ATOM 795 CA LYS A 48 5.146 -20.777 -1.018 1.00 0.00 C ATOM 796 C LYS A 48 5.716 -20.616 -2.428 1.00 0.00 C ATOM 797 O LYS A 48 6.441 -21.461 -2.914 1.00 0.00 O ATOM 798 CB LYS A 48 3.680 -21.220 -1.106 1.00 0.00 C ATOM 799 CG LYS A 48 3.213 -21.756 0.253 1.00 0.00 C ATOM 800 CD LYS A 48 1.851 -22.433 0.093 1.00 0.00 C ATOM 801 CE LYS A 48 1.465 -23.121 1.404 1.00 0.00 C ATOM 802 NZ LYS A 48 1.492 -22.128 2.515 1.00 0.00 N ATOM 0 H LYS A 48 4.388 -18.900 -0.339 1.00 0.00 H new ATOM 0 HA LYS A 48 5.714 -21.530 -0.472 1.00 0.00 H new ATOM 0 HB2 LYS A 48 3.055 -20.380 -1.409 1.00 0.00 H new ATOM 0 HB3 LYS A 48 3.569 -21.991 -1.868 1.00 0.00 H new ATOM 0 HG2 LYS A 48 3.941 -22.467 0.645 1.00 0.00 H new ATOM 0 HG3 LYS A 48 3.144 -20.941 0.973 1.00 0.00 H new ATOM 0 HD2 LYS A 48 1.096 -21.695 -0.179 1.00 0.00 H new ATOM 0 HD3 LYS A 48 1.889 -23.163 -0.716 1.00 0.00 H new ATOM 0 HE2 LYS A 48 0.471 -23.559 1.318 1.00 0.00 H new ATOM 0 HE3 LYS A 48 2.156 -23.937 1.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 0.951 -22.497 3.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 2.476 -21.958 2.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 1.067 -21.235 2.193 1.00 0.00 H new ATOM 816 N GLU A 49 5.400 -19.532 -3.089 1.00 0.00 N ATOM 817 CA GLU A 49 5.932 -19.314 -4.467 1.00 0.00 C ATOM 818 C GLU A 49 7.288 -18.606 -4.368 1.00 0.00 C ATOM 819 O GLU A 49 7.359 -17.435 -4.055 1.00 0.00 O ATOM 820 CB GLU A 49 4.946 -18.449 -5.256 1.00 0.00 C ATOM 821 CG GLU A 49 3.576 -19.132 -5.295 1.00 0.00 C ATOM 822 CD GLU A 49 2.728 -18.521 -6.414 1.00 0.00 C ATOM 823 OE1 GLU A 49 2.829 -18.997 -7.533 1.00 0.00 O ATOM 824 OE2 GLU A 49 1.992 -17.590 -6.132 1.00 0.00 O ATOM 0 H GLU A 49 4.797 -18.789 -2.734 1.00 0.00 H new ATOM 0 HA GLU A 49 6.058 -20.268 -4.978 1.00 0.00 H new ATOM 0 HB2 GLU A 49 4.860 -17.466 -4.794 1.00 0.00 H new ATOM 0 HB3 GLU A 49 5.314 -18.294 -6.270 1.00 0.00 H new ATOM 0 HG2 GLU A 49 3.697 -20.203 -5.460 1.00 0.00 H new ATOM 0 HG3 GLU A 49 3.072 -19.012 -4.336 1.00 0.00 H new ATOM 831 N GLN A 50 8.366 -19.301 -4.611 1.00 0.00 N ATOM 832 CA GLN A 50 9.711 -18.656 -4.512 1.00 0.00 C ATOM 833 C GLN A 50 10.072 -17.947 -5.825 1.00 0.00 C ATOM 834 O GLN A 50 10.911 -17.069 -5.851 1.00 0.00 O ATOM 835 CB GLN A 50 10.759 -19.732 -4.217 1.00 0.00 C ATOM 836 CG GLN A 50 12.106 -19.073 -3.906 1.00 0.00 C ATOM 837 CD GLN A 50 13.044 -20.105 -3.279 1.00 0.00 C ATOM 838 OE1 GLN A 50 13.990 -20.542 -3.904 1.00 0.00 O ATOM 839 NE2 GLN A 50 12.820 -20.516 -2.061 1.00 0.00 N ATOM 0 H GLN A 50 8.376 -20.287 -4.874 1.00 0.00 H new ATOM 0 HA GLN A 50 9.689 -17.917 -3.711 1.00 0.00 H new ATOM 0 HB2 GLN A 50 10.439 -20.343 -3.373 1.00 0.00 H new ATOM 0 HB3 GLN A 50 10.859 -20.399 -5.073 1.00 0.00 H new ATOM 0 HG2 GLN A 50 12.547 -18.672 -4.819 1.00 0.00 H new ATOM 0 HG3 GLN A 50 11.964 -18.234 -3.225 1.00 0.00 H new ATOM 0 HE21 GLN A 50 12.026 -20.149 -1.537 1.00 0.00 H new ATOM 0 HE22 GLN A 50 13.439 -21.204 -1.633 1.00 0.00 H new ATOM 848 N GLU A 51 9.469 -18.331 -6.917 1.00 0.00 N ATOM 849 CA GLU A 51 9.811 -17.688 -8.223 1.00 0.00 C ATOM 850 C GLU A 51 9.237 -16.268 -8.310 1.00 0.00 C ATOM 851 O GLU A 51 9.751 -15.441 -9.037 1.00 0.00 O ATOM 852 CB GLU A 51 9.287 -18.539 -9.382 1.00 0.00 C ATOM 853 CG GLU A 51 10.056 -19.860 -9.435 1.00 0.00 C ATOM 854 CD GLU A 51 11.484 -19.601 -9.917 1.00 0.00 C ATOM 855 OE1 GLU A 51 11.664 -19.434 -11.112 1.00 0.00 O ATOM 856 OE2 GLU A 51 12.374 -19.573 -9.082 1.00 0.00 O ATOM 0 H GLU A 51 8.756 -19.059 -6.964 1.00 0.00 H new ATOM 0 HA GLU A 51 10.897 -17.619 -8.291 1.00 0.00 H new ATOM 0 HB2 GLU A 51 8.222 -18.731 -9.253 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.402 -18.001 -10.323 1.00 0.00 H new ATOM 0 HG2 GLU A 51 10.072 -20.323 -8.448 1.00 0.00 H new ATOM 0 HG3 GLU A 51 9.555 -20.558 -10.106 1.00 0.00 H new ATOM 863 N VAL A 52 8.214 -15.951 -7.571 1.00 0.00 N ATOM 864 CA VAL A 52 7.683 -14.561 -7.628 1.00 0.00 C ATOM 865 C VAL A 52 8.626 -13.646 -6.843 1.00 0.00 C ATOM 866 O VAL A 52 8.991 -12.586 -7.311 1.00 0.00 O ATOM 867 CB VAL A 52 6.277 -14.503 -7.024 1.00 0.00 C ATOM 868 CG1 VAL A 52 5.270 -15.090 -8.013 1.00 0.00 C ATOM 869 CG2 VAL A 52 6.225 -15.302 -5.723 1.00 0.00 C ATOM 0 H VAL A 52 7.727 -16.584 -6.937 1.00 0.00 H new ATOM 0 HA VAL A 52 7.623 -14.234 -8.666 1.00 0.00 H new ATOM 0 HB VAL A 52 6.029 -13.462 -6.815 1.00 0.00 H new ATOM 0 HG11 VAL A 52 4.270 -15.048 -7.582 1.00 0.00 H new ATOM 0 HG12 VAL A 52 5.291 -14.514 -8.938 1.00 0.00 H new ATOM 0 HG13 VAL A 52 5.530 -16.127 -8.225 1.00 0.00 H new ATOM 0 HG21 VAL A 52 5.220 -15.252 -5.305 1.00 0.00 H new ATOM 0 HG22 VAL A 52 6.483 -16.342 -5.924 1.00 0.00 H new ATOM 0 HG23 VAL A 52 6.936 -14.883 -5.010 1.00 0.00 H new ATOM 879 N VAL A 53 9.040 -14.030 -5.667 1.00 0.00 N ATOM 880 CA VAL A 53 9.967 -13.155 -4.898 1.00 0.00 C ATOM 881 C VAL A 53 11.292 -13.056 -5.658 1.00 0.00 C ATOM 882 O VAL A 53 11.949 -12.034 -5.656 1.00 0.00 O ATOM 883 CB VAL A 53 10.211 -13.755 -3.508 1.00 0.00 C ATOM 884 CG1 VAL A 53 11.317 -12.971 -2.796 1.00 0.00 C ATOM 885 CG2 VAL A 53 8.925 -13.673 -2.683 1.00 0.00 C ATOM 0 H VAL A 53 8.779 -14.903 -5.209 1.00 0.00 H new ATOM 0 HA VAL A 53 9.531 -12.163 -4.782 1.00 0.00 H new ATOM 0 HB VAL A 53 10.513 -14.797 -3.614 1.00 0.00 H new ATOM 0 HG11 VAL A 53 11.489 -13.399 -1.808 1.00 0.00 H new ATOM 0 HG12 VAL A 53 12.236 -13.026 -3.380 1.00 0.00 H new ATOM 0 HG13 VAL A 53 11.015 -11.929 -2.692 1.00 0.00 H new ATOM 0 HG21 VAL A 53 9.099 -14.100 -1.695 1.00 0.00 H new ATOM 0 HG22 VAL A 53 8.624 -12.630 -2.580 1.00 0.00 H new ATOM 0 HG23 VAL A 53 8.134 -14.231 -3.185 1.00 0.00 H new ATOM 895 N ASP A 54 11.686 -14.115 -6.309 1.00 0.00 N ATOM 896 CA ASP A 54 12.964 -14.092 -7.072 1.00 0.00 C ATOM 897 C ASP A 54 12.921 -12.974 -8.116 1.00 0.00 C ATOM 898 O ASP A 54 13.872 -12.240 -8.291 1.00 0.00 O ATOM 899 CB ASP A 54 13.162 -15.437 -7.773 1.00 0.00 C ATOM 900 CG ASP A 54 13.345 -16.538 -6.727 1.00 0.00 C ATOM 901 OD1 ASP A 54 13.560 -16.202 -5.574 1.00 0.00 O ATOM 902 OD2 ASP A 54 13.266 -17.698 -7.096 1.00 0.00 O ATOM 0 H ASP A 54 11.176 -14.998 -6.345 1.00 0.00 H new ATOM 0 HA ASP A 54 13.792 -13.913 -6.386 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.302 -15.660 -8.404 1.00 0.00 H new ATOM 0 HB3 ASP A 54 14.033 -15.393 -8.426 1.00 0.00 H new ATOM 907 N LYS A 55 11.828 -12.847 -8.823 1.00 0.00 N ATOM 908 CA LYS A 55 11.740 -11.783 -9.864 1.00 0.00 C ATOM 909 C LYS A 55 11.687 -10.407 -9.199 1.00 0.00 C ATOM 910 O LYS A 55 12.111 -9.424 -9.773 1.00 0.00 O ATOM 911 CB LYS A 55 10.495 -11.997 -10.726 1.00 0.00 C ATOM 912 CG LYS A 55 10.687 -13.237 -11.602 1.00 0.00 C ATOM 913 CD LYS A 55 9.428 -13.471 -12.440 1.00 0.00 C ATOM 914 CE LYS A 55 9.676 -14.615 -13.425 1.00 0.00 C ATOM 915 NZ LYS A 55 10.870 -14.303 -14.259 1.00 0.00 N ATOM 0 H LYS A 55 10.998 -13.431 -8.725 1.00 0.00 H new ATOM 0 HA LYS A 55 12.623 -11.835 -10.501 1.00 0.00 H new ATOM 0 HB2 LYS A 55 9.617 -12.119 -10.092 1.00 0.00 H new ATOM 0 HB3 LYS A 55 10.317 -11.122 -11.351 1.00 0.00 H new ATOM 0 HG2 LYS A 55 11.551 -13.105 -12.254 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.889 -14.108 -10.978 1.00 0.00 H new ATOM 0 HD2 LYS A 55 8.586 -13.712 -11.791 1.00 0.00 H new ATOM 0 HD3 LYS A 55 9.164 -12.562 -12.981 1.00 0.00 H new ATOM 0 HE2 LYS A 55 9.831 -15.548 -12.883 1.00 0.00 H new ATOM 0 HE3 LYS A 55 8.802 -14.757 -14.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 10.789 -14.787 -15.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 10.927 -13.276 -14.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 11.729 -14.628 -13.771 1.00 0.00 H new ATOM 929 N VAL A 56 11.210 -10.318 -7.988 1.00 0.00 N ATOM 930 CA VAL A 56 11.184 -8.997 -7.299 1.00 0.00 C ATOM 931 C VAL A 56 12.626 -8.545 -7.063 1.00 0.00 C ATOM 932 O VAL A 56 13.032 -7.485 -7.493 1.00 0.00 O ATOM 933 CB VAL A 56 10.470 -9.141 -5.953 1.00 0.00 C ATOM 934 CG1 VAL A 56 10.580 -7.830 -5.172 1.00 0.00 C ATOM 935 CG2 VAL A 56 8.994 -9.464 -6.197 1.00 0.00 C ATOM 0 H VAL A 56 10.839 -11.099 -7.448 1.00 0.00 H new ATOM 0 HA VAL A 56 10.656 -8.265 -7.910 1.00 0.00 H new ATOM 0 HB VAL A 56 10.932 -9.944 -5.379 1.00 0.00 H new ATOM 0 HG11 VAL A 56 10.071 -7.934 -4.214 1.00 0.00 H new ATOM 0 HG12 VAL A 56 11.631 -7.595 -5.002 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.117 -7.026 -5.744 1.00 0.00 H new ATOM 0 HG21 VAL A 56 8.481 -9.568 -5.241 1.00 0.00 H new ATOM 0 HG22 VAL A 56 8.535 -8.658 -6.769 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.913 -10.397 -6.755 1.00 0.00 H new ATOM 945 N MET A 57 13.402 -9.342 -6.381 1.00 0.00 N ATOM 946 CA MET A 57 14.815 -8.953 -6.116 1.00 0.00 C ATOM 947 C MET A 57 15.505 -8.586 -7.430 1.00 0.00 C ATOM 948 O MET A 57 16.433 -7.801 -7.452 1.00 0.00 O ATOM 949 CB MET A 57 15.553 -10.121 -5.457 1.00 0.00 C ATOM 950 CG MET A 57 15.027 -10.322 -4.034 1.00 0.00 C ATOM 951 SD MET A 57 15.711 -9.043 -2.952 1.00 0.00 S ATOM 952 CE MET A 57 15.540 -9.947 -1.393 1.00 0.00 C ATOM 0 H MET A 57 13.119 -10.244 -5.997 1.00 0.00 H new ATOM 0 HA MET A 57 14.832 -8.091 -5.449 1.00 0.00 H new ATOM 0 HB2 MET A 57 15.410 -11.031 -6.040 1.00 0.00 H new ATOM 0 HB3 MET A 57 16.624 -9.922 -5.435 1.00 0.00 H new ATOM 0 HG2 MET A 57 13.938 -10.275 -4.027 1.00 0.00 H new ATOM 0 HG3 MET A 57 15.306 -11.310 -3.668 1.00 0.00 H new ATOM 0 HE1 MET A 57 15.910 -9.331 -0.573 1.00 0.00 H new ATOM 0 HE2 MET A 57 14.490 -10.185 -1.224 1.00 0.00 H new ATOM 0 HE3 MET A 57 16.118 -10.870 -1.442 1.00 0.00 H new ATOM 962 N GLU A 58 15.044 -9.116 -8.535 1.00 0.00 N ATOM 963 CA GLU A 58 15.657 -8.759 -9.849 1.00 0.00 C ATOM 964 C GLU A 58 14.995 -7.487 -10.376 1.00 0.00 C ATOM 965 O GLU A 58 15.632 -6.667 -11.007 1.00 0.00 O ATOM 966 CB GLU A 58 15.488 -9.905 -10.848 1.00 0.00 C ATOM 967 CG GLU A 58 16.409 -9.679 -12.048 1.00 0.00 C ATOM 968 CD GLU A 58 17.860 -9.932 -11.634 1.00 0.00 C ATOM 969 OE1 GLU A 58 18.239 -11.088 -11.552 1.00 0.00 O ATOM 970 OE2 GLU A 58 18.567 -8.964 -11.405 1.00 0.00 O ATOM 0 H GLU A 58 14.271 -9.779 -8.583 1.00 0.00 H new ATOM 0 HA GLU A 58 16.725 -8.585 -9.717 1.00 0.00 H new ATOM 0 HB2 GLU A 58 15.724 -10.856 -10.370 1.00 0.00 H new ATOM 0 HB3 GLU A 58 14.451 -9.963 -11.178 1.00 0.00 H new ATOM 0 HG2 GLU A 58 16.131 -10.346 -12.864 1.00 0.00 H new ATOM 0 HG3 GLU A 58 16.298 -8.660 -12.418 1.00 0.00 H new ATOM 977 N THR A 59 13.733 -7.294 -10.113 1.00 0.00 N ATOM 978 CA THR A 59 13.073 -6.050 -10.594 1.00 0.00 C ATOM 979 C THR A 59 13.664 -4.871 -9.821 1.00 0.00 C ATOM 980 O THR A 59 14.066 -3.886 -10.407 1.00 0.00 O ATOM 981 CB THR A 59 11.555 -6.135 -10.383 1.00 0.00 C ATOM 982 OG1 THR A 59 11.118 -7.460 -10.649 1.00 0.00 O ATOM 983 CG2 THR A 59 10.845 -5.163 -11.329 1.00 0.00 C ATOM 0 H THR A 59 13.136 -7.936 -9.592 1.00 0.00 H new ATOM 0 HA THR A 59 13.248 -5.917 -11.662 1.00 0.00 H new ATOM 0 HB THR A 59 11.317 -5.870 -9.353 1.00 0.00 H new ATOM 0 HG1 THR A 59 11.334 -8.035 -9.885 1.00 0.00 H new ATOM 0 HG21 THR A 59 9.768 -5.227 -11.175 1.00 0.00 H new ATOM 0 HG22 THR A 59 11.181 -4.146 -11.125 1.00 0.00 H new ATOM 0 HG23 THR A 59 11.080 -5.423 -12.361 1.00 0.00 H new ATOM 991 N LEU A 60 13.766 -4.961 -8.525 1.00 0.00 N ATOM 992 CA LEU A 60 14.383 -3.840 -7.766 1.00 0.00 C ATOM 993 C LEU A 60 15.809 -3.638 -8.279 1.00 0.00 C ATOM 994 O LEU A 60 16.169 -2.568 -8.728 1.00 0.00 O ATOM 995 CB LEU A 60 14.430 -4.190 -6.276 1.00 0.00 C ATOM 996 CG LEU A 60 13.039 -4.615 -5.794 1.00 0.00 C ATOM 997 CD1 LEU A 60 13.129 -5.079 -4.338 1.00 0.00 C ATOM 998 CD2 LEU A 60 12.069 -3.430 -5.894 1.00 0.00 C ATOM 0 H LEU A 60 13.453 -5.753 -7.964 1.00 0.00 H new ATOM 0 HA LEU A 60 13.796 -2.931 -7.902 1.00 0.00 H new ATOM 0 HB2 LEU A 60 15.145 -4.995 -6.105 1.00 0.00 H new ATOM 0 HB3 LEU A 60 14.776 -3.330 -5.703 1.00 0.00 H new ATOM 0 HG LEU A 60 12.674 -5.430 -6.418 1.00 0.00 H new ATOM 0 HD11 LEU A 60 12.141 -5.382 -3.991 1.00 0.00 H new ATOM 0 HD12 LEU A 60 13.814 -5.924 -4.267 1.00 0.00 H new ATOM 0 HD13 LEU A 60 13.496 -4.261 -3.718 1.00 0.00 H new ATOM 0 HD21 LEU A 60 11.082 -3.738 -5.550 1.00 0.00 H new ATOM 0 HD22 LEU A 60 12.430 -2.611 -5.273 1.00 0.00 H new ATOM 0 HD23 LEU A 60 12.005 -3.099 -6.930 1.00 0.00 H new ATOM 1010 N ASP A 61 16.624 -4.657 -8.226 1.00 0.00 N ATOM 1011 CA ASP A 61 18.020 -4.511 -8.722 1.00 0.00 C ATOM 1012 C ASP A 61 17.990 -3.914 -10.130 1.00 0.00 C ATOM 1013 O ASP A 61 18.959 -3.345 -10.593 1.00 0.00 O ATOM 1014 CB ASP A 61 18.696 -5.883 -8.763 1.00 0.00 C ATOM 1015 CG ASP A 61 18.938 -6.377 -7.336 1.00 0.00 C ATOM 1016 OD1 ASP A 61 18.060 -6.193 -6.510 1.00 0.00 O ATOM 1017 OD2 ASP A 61 19.998 -6.931 -7.094 1.00 0.00 O ATOM 0 H ASP A 61 16.384 -5.579 -7.862 1.00 0.00 H new ATOM 0 HA ASP A 61 18.580 -3.855 -8.055 1.00 0.00 H new ATOM 0 HB2 ASP A 61 18.069 -6.593 -9.303 1.00 0.00 H new ATOM 0 HB3 ASP A 61 19.641 -5.818 -9.302 1.00 0.00 H new ATOM 1022 N GLU A 62 16.878 -4.041 -10.815 1.00 0.00 N ATOM 1023 CA GLU A 62 16.764 -3.485 -12.202 1.00 0.00 C ATOM 1024 C GLU A 62 15.961 -2.193 -12.156 1.00 0.00 C ATOM 1025 O GLU A 62 15.123 -1.921 -12.992 1.00 0.00 O ATOM 1026 CB GLU A 62 16.049 -4.465 -13.081 1.00 0.00 C ATOM 1027 CG GLU A 62 16.952 -5.662 -13.375 1.00 0.00 C ATOM 1028 CD GLU A 62 18.077 -5.231 -14.318 1.00 0.00 C ATOM 1029 OE1 GLU A 62 17.821 -5.129 -15.506 1.00 0.00 O ATOM 1030 OE2 GLU A 62 19.176 -5.011 -13.835 1.00 0.00 O ATOM 0 H GLU A 62 16.039 -4.509 -10.471 1.00 0.00 H new ATOM 0 HA GLU A 62 17.762 -3.296 -12.598 1.00 0.00 H new ATOM 0 HB2 GLU A 62 15.133 -4.801 -12.595 1.00 0.00 H new ATOM 0 HB3 GLU A 62 15.756 -3.983 -14.014 1.00 0.00 H new ATOM 0 HG2 GLU A 62 17.370 -6.053 -12.447 1.00 0.00 H new ATOM 0 HG3 GLU A 62 16.372 -6.467 -13.827 1.00 0.00 H new ATOM 1037 N ASP A 63 16.230 -1.413 -11.183 1.00 0.00 N ATOM 1038 CA ASP A 63 15.524 -0.108 -11.015 1.00 0.00 C ATOM 1039 C ASP A 63 15.426 0.602 -12.366 1.00 0.00 C ATOM 1040 O ASP A 63 14.435 1.226 -12.687 1.00 0.00 O ATOM 1041 CB ASP A 63 16.362 0.766 -10.072 1.00 0.00 C ATOM 1042 CG ASP A 63 15.548 1.991 -9.646 1.00 0.00 C ATOM 1043 OD1 ASP A 63 14.347 1.853 -9.485 1.00 0.00 O ATOM 1044 OD2 ASP A 63 16.142 3.044 -9.485 1.00 0.00 O ATOM 0 H ASP A 63 16.927 -1.613 -10.466 1.00 0.00 H new ATOM 0 HA ASP A 63 14.524 -0.275 -10.615 1.00 0.00 H new ATOM 0 HB2 ASP A 63 16.658 0.191 -9.195 1.00 0.00 H new ATOM 0 HB3 ASP A 63 17.278 1.082 -10.571 1.00 0.00 H new ATOM 1049 N GLY A 64 16.444 0.462 -13.166 1.00 0.00 N ATOM 1050 CA GLY A 64 16.456 1.073 -14.532 1.00 0.00 C ATOM 1051 C GLY A 64 16.128 2.576 -14.505 1.00 0.00 C ATOM 1052 O GLY A 64 16.290 3.249 -15.504 1.00 0.00 O ATOM 0 H GLY A 64 17.288 -0.060 -12.930 1.00 0.00 H new ATOM 0 HA2 GLY A 64 17.437 0.926 -14.984 1.00 0.00 H new ATOM 0 HA3 GLY A 64 15.733 0.557 -15.164 1.00 0.00 H new ATOM 1056 N ASP A 65 15.673 3.119 -13.395 1.00 0.00 N ATOM 1057 CA ASP A 65 15.342 4.596 -13.352 1.00 0.00 C ATOM 1058 C ASP A 65 16.387 5.407 -12.545 1.00 0.00 C ATOM 1059 O ASP A 65 16.619 6.558 -12.860 1.00 0.00 O ATOM 1060 CB ASP A 65 13.975 4.772 -12.694 1.00 0.00 C ATOM 1061 CG ASP A 65 13.948 4.020 -11.362 1.00 0.00 C ATOM 1062 OD1 ASP A 65 14.541 4.512 -10.416 1.00 0.00 O ATOM 1063 OD2 ASP A 65 13.333 2.968 -11.310 1.00 0.00 O ATOM 0 H ASP A 65 15.516 2.614 -12.523 1.00 0.00 H new ATOM 0 HA ASP A 65 15.344 4.970 -14.376 1.00 0.00 H new ATOM 0 HB2 ASP A 65 13.772 5.830 -12.530 1.00 0.00 H new ATOM 0 HB3 ASP A 65 13.192 4.396 -13.352 1.00 0.00 H new ATOM 1068 N GLY A 66 17.022 4.863 -11.522 1.00 0.00 N ATOM 1069 CA GLY A 66 18.030 5.657 -10.746 1.00 0.00 C ATOM 1070 C GLY A 66 17.416 6.101 -9.415 1.00 0.00 C ATOM 1071 O GLY A 66 18.116 6.326 -8.448 1.00 0.00 O ATOM 0 H GLY A 66 16.883 3.907 -11.196 1.00 0.00 H new ATOM 0 HA2 GLY A 66 18.921 5.056 -10.565 1.00 0.00 H new ATOM 0 HA3 GLY A 66 18.344 6.527 -11.322 1.00 0.00 H new ATOM 1075 N GLU A 67 16.111 6.218 -9.345 1.00 0.00 N ATOM 1076 CA GLU A 67 15.469 6.636 -8.057 1.00 0.00 C ATOM 1077 C GLU A 67 14.067 6.028 -7.938 1.00 0.00 C ATOM 1078 O GLU A 67 13.259 6.142 -8.839 1.00 0.00 O ATOM 1079 CB GLU A 67 15.362 8.163 -8.016 1.00 0.00 C ATOM 1080 CG GLU A 67 16.752 8.776 -7.835 1.00 0.00 C ATOM 1081 CD GLU A 67 16.614 10.277 -7.573 1.00 0.00 C ATOM 1082 OE1 GLU A 67 16.175 10.978 -8.469 1.00 0.00 O ATOM 1083 OE2 GLU A 67 16.950 10.700 -6.478 1.00 0.00 O ATOM 0 H GLU A 67 15.467 6.044 -10.117 1.00 0.00 H new ATOM 0 HA GLU A 67 16.080 6.282 -7.227 1.00 0.00 H new ATOM 0 HB2 GLU A 67 14.910 8.530 -8.938 1.00 0.00 H new ATOM 0 HB3 GLU A 67 14.710 8.469 -7.198 1.00 0.00 H new ATOM 0 HG2 GLU A 67 17.268 8.296 -7.003 1.00 0.00 H new ATOM 0 HG3 GLU A 67 17.356 8.605 -8.726 1.00 0.00 H new ATOM 1090 N CYS A 68 13.762 5.398 -6.827 1.00 0.00 N ATOM 1091 CA CYS A 68 12.401 4.796 -6.635 1.00 0.00 C ATOM 1092 C CYS A 68 11.598 5.683 -5.672 1.00 0.00 C ATOM 1093 O CYS A 68 12.047 6.003 -4.590 1.00 0.00 O ATOM 1094 CB CYS A 68 12.542 3.385 -6.048 1.00 0.00 C ATOM 1095 SG CYS A 68 13.958 2.555 -6.811 1.00 0.00 S ATOM 0 H CYS A 68 14.400 5.274 -6.041 1.00 0.00 H new ATOM 0 HA CYS A 68 11.884 4.732 -7.592 1.00 0.00 H new ATOM 0 HB2 CYS A 68 12.678 3.440 -4.968 1.00 0.00 H new ATOM 0 HB3 CYS A 68 11.632 2.813 -6.226 1.00 0.00 H new ATOM 0 HG CYS A 68 13.743 2.413 -8.085 1.00 0.00 H new ATOM 1101 N ASP A 69 10.420 6.093 -6.064 1.00 0.00 N ATOM 1102 CA ASP A 69 9.597 6.972 -5.178 1.00 0.00 C ATOM 1103 C ASP A 69 8.828 6.124 -4.158 1.00 0.00 C ATOM 1104 O ASP A 69 9.006 4.926 -4.069 1.00 0.00 O ATOM 1105 CB ASP A 69 8.601 7.761 -6.032 1.00 0.00 C ATOM 1106 CG ASP A 69 8.002 8.900 -5.203 1.00 0.00 C ATOM 1107 OD1 ASP A 69 8.694 9.402 -4.333 1.00 0.00 O ATOM 1108 OD2 ASP A 69 6.860 9.250 -5.454 1.00 0.00 O ATOM 0 H ASP A 69 9.991 5.858 -6.959 1.00 0.00 H new ATOM 0 HA ASP A 69 10.256 7.658 -4.646 1.00 0.00 H new ATOM 0 HB2 ASP A 69 9.101 8.163 -6.913 1.00 0.00 H new ATOM 0 HB3 ASP A 69 7.809 7.102 -6.388 1.00 0.00 H new ATOM 1113 N PHE A 70 7.962 6.742 -3.397 1.00 0.00 N ATOM 1114 CA PHE A 70 7.166 5.977 -2.393 1.00 0.00 C ATOM 1115 C PHE A 70 6.089 5.178 -3.129 1.00 0.00 C ATOM 1116 O PHE A 70 5.655 4.139 -2.673 1.00 0.00 O ATOM 1117 CB PHE A 70 6.516 6.952 -1.405 1.00 0.00 C ATOM 1118 CG PHE A 70 5.783 6.191 -0.322 1.00 0.00 C ATOM 1119 CD1 PHE A 70 4.517 5.648 -0.577 1.00 0.00 C ATOM 1120 CD2 PHE A 70 6.366 6.041 0.942 1.00 0.00 C ATOM 1121 CE1 PHE A 70 3.837 4.953 0.433 1.00 0.00 C ATOM 1122 CE2 PHE A 70 5.687 5.347 1.949 1.00 0.00 C ATOM 1123 CZ PHE A 70 4.423 4.803 1.696 1.00 0.00 C ATOM 0 H PHE A 70 7.772 7.744 -3.428 1.00 0.00 H new ATOM 0 HA PHE A 70 7.812 5.296 -1.839 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.279 7.590 -0.958 1.00 0.00 H new ATOM 0 HB3 PHE A 70 5.822 7.606 -1.933 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.065 5.765 -1.551 1.00 0.00 H new ATOM 0 HD2 PHE A 70 7.341 6.462 1.140 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.861 4.533 0.237 1.00 0.00 H new ATOM 0 HE2 PHE A 70 6.139 5.231 2.923 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.900 4.268 2.474 1.00 0.00 H new ATOM 1133 N GLN A 71 5.666 5.641 -4.272 1.00 0.00 N ATOM 1134 CA GLN A 71 4.632 4.890 -5.039 1.00 0.00 C ATOM 1135 C GLN A 71 5.222 3.551 -5.481 1.00 0.00 C ATOM 1136 O GLN A 71 4.581 2.522 -5.399 1.00 0.00 O ATOM 1137 CB GLN A 71 4.226 5.695 -6.275 1.00 0.00 C ATOM 1138 CG GLN A 71 3.570 7.008 -5.842 1.00 0.00 C ATOM 1139 CD GLN A 71 3.039 7.742 -7.074 1.00 0.00 C ATOM 1140 OE1 GLN A 71 3.312 8.911 -7.265 1.00 0.00 O ATOM 1141 NE2 GLN A 71 2.287 7.101 -7.927 1.00 0.00 N ATOM 0 H GLN A 71 5.990 6.504 -4.708 1.00 0.00 H new ATOM 0 HA GLN A 71 3.756 4.724 -4.412 1.00 0.00 H new ATOM 0 HB2 GLN A 71 5.102 5.900 -6.891 1.00 0.00 H new ATOM 0 HB3 GLN A 71 3.534 5.116 -6.887 1.00 0.00 H new ATOM 0 HG2 GLN A 71 2.756 6.808 -5.145 1.00 0.00 H new ATOM 0 HG3 GLN A 71 4.293 7.632 -5.317 1.00 0.00 H new ATOM 0 HE21 GLN A 71 2.057 6.120 -7.768 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.929 7.581 -8.753 1.00 0.00 H new ATOM 1150 N GLU A 72 6.442 3.550 -5.941 1.00 0.00 N ATOM 1151 CA GLU A 72 7.071 2.273 -6.377 1.00 0.00 C ATOM 1152 C GLU A 72 7.299 1.380 -5.154 1.00 0.00 C ATOM 1153 O GLU A 72 7.326 0.171 -5.249 1.00 0.00 O ATOM 1154 CB GLU A 72 8.405 2.560 -7.069 1.00 0.00 C ATOM 1155 CG GLU A 72 8.145 3.208 -8.431 1.00 0.00 C ATOM 1156 CD GLU A 72 9.474 3.438 -9.151 1.00 0.00 C ATOM 1157 OE1 GLU A 72 10.099 2.459 -9.527 1.00 0.00 O ATOM 1158 OE2 GLU A 72 9.845 4.589 -9.316 1.00 0.00 O ATOM 0 H GLU A 72 7.030 4.378 -6.034 1.00 0.00 H new ATOM 0 HA GLU A 72 6.412 1.764 -7.081 1.00 0.00 H new ATOM 0 HB2 GLU A 72 9.013 3.220 -6.450 1.00 0.00 H new ATOM 0 HB3 GLU A 72 8.967 1.635 -7.196 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.500 2.568 -9.033 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.622 4.155 -8.301 1.00 0.00 H new ATOM 1165 N PHE A 73 7.414 1.974 -3.998 1.00 0.00 N ATOM 1166 CA PHE A 73 7.592 1.178 -2.750 1.00 0.00 C ATOM 1167 C PHE A 73 6.244 0.573 -2.352 1.00 0.00 C ATOM 1168 O PHE A 73 6.175 -0.564 -1.933 1.00 0.00 O ATOM 1169 CB PHE A 73 8.140 2.076 -1.634 1.00 0.00 C ATOM 1170 CG PHE A 73 8.070 1.365 -0.297 1.00 0.00 C ATOM 1171 CD1 PHE A 73 8.734 0.146 -0.116 1.00 0.00 C ATOM 1172 CD2 PHE A 73 7.349 1.931 0.765 1.00 0.00 C ATOM 1173 CE1 PHE A 73 8.677 -0.507 1.122 1.00 0.00 C ATOM 1174 CE2 PHE A 73 7.294 1.278 2.002 1.00 0.00 C ATOM 1175 CZ PHE A 73 7.958 0.059 2.181 1.00 0.00 C ATOM 0 H PHE A 73 7.392 2.985 -3.863 1.00 0.00 H new ATOM 0 HA PHE A 73 8.307 0.373 -2.918 1.00 0.00 H new ATOM 0 HB2 PHE A 73 9.172 2.350 -1.853 1.00 0.00 H new ATOM 0 HB3 PHE A 73 7.567 3.002 -1.590 1.00 0.00 H new ATOM 0 HD1 PHE A 73 9.291 -0.291 -0.932 1.00 0.00 H new ATOM 0 HD2 PHE A 73 6.836 2.871 0.628 1.00 0.00 H new ATOM 0 HE1 PHE A 73 9.188 -1.448 1.259 1.00 0.00 H new ATOM 0 HE2 PHE A 73 6.739 1.715 2.819 1.00 0.00 H new ATOM 0 HZ PHE A 73 7.916 -0.444 3.136 1.00 0.00 H new ATOM 1185 N MET A 74 5.172 1.293 -2.487 1.00 0.00 N ATOM 1186 CA MET A 74 3.862 0.694 -2.113 1.00 0.00 C ATOM 1187 C MET A 74 3.510 -0.395 -3.131 1.00 0.00 C ATOM 1188 O MET A 74 2.837 -1.351 -2.800 1.00 0.00 O ATOM 1189 CB MET A 74 2.772 1.767 -2.093 1.00 0.00 C ATOM 1190 CG MET A 74 1.552 1.243 -1.329 1.00 0.00 C ATOM 1191 SD MET A 74 1.952 1.110 0.437 1.00 0.00 S ATOM 1192 CE MET A 74 1.827 -0.693 0.604 1.00 0.00 C ATOM 0 H MET A 74 5.141 2.252 -2.833 1.00 0.00 H new ATOM 0 HA MET A 74 3.931 0.260 -1.116 1.00 0.00 H new ATOM 0 HB2 MET A 74 3.148 2.674 -1.620 1.00 0.00 H new ATOM 0 HB3 MET A 74 2.490 2.033 -3.112 1.00 0.00 H new ATOM 0 HG2 MET A 74 0.705 1.914 -1.471 1.00 0.00 H new ATOM 0 HG3 MET A 74 1.256 0.269 -1.720 1.00 0.00 H new ATOM 0 HE1 MET A 74 1.757 -0.957 1.659 1.00 0.00 H new ATOM 0 HE2 MET A 74 0.937 -1.046 0.082 1.00 0.00 H new ATOM 0 HE3 MET A 74 2.711 -1.161 0.171 1.00 0.00 H new ATOM 1202 N ALA A 75 3.967 -0.299 -4.349 1.00 0.00 N ATOM 1203 CA ALA A 75 3.663 -1.367 -5.346 1.00 0.00 C ATOM 1204 C ALA A 75 4.571 -2.580 -5.106 1.00 0.00 C ATOM 1205 O ALA A 75 4.112 -3.704 -5.099 1.00 0.00 O ATOM 1206 CB ALA A 75 3.904 -0.824 -6.756 1.00 0.00 C ATOM 0 H ALA A 75 4.537 0.471 -4.698 1.00 0.00 H new ATOM 0 HA ALA A 75 2.622 -1.673 -5.240 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.683 -1.601 -7.488 1.00 0.00 H new ATOM 0 HB2 ALA A 75 3.255 0.034 -6.931 1.00 0.00 H new ATOM 0 HB3 ALA A 75 4.945 -0.518 -6.855 1.00 0.00 H new ATOM 1212 N PHE A 76 5.848 -2.382 -4.910 1.00 0.00 N ATOM 1213 CA PHE A 76 6.737 -3.559 -4.676 1.00 0.00 C ATOM 1214 C PHE A 76 6.367 -4.208 -3.336 1.00 0.00 C ATOM 1215 O PHE A 76 6.463 -5.408 -3.168 1.00 0.00 O ATOM 1216 CB PHE A 76 8.216 -3.120 -4.657 1.00 0.00 C ATOM 1217 CG PHE A 76 8.755 -3.015 -6.076 1.00 0.00 C ATOM 1218 CD1 PHE A 76 8.760 -4.141 -6.916 1.00 0.00 C ATOM 1219 CD2 PHE A 76 9.245 -1.791 -6.554 1.00 0.00 C ATOM 1220 CE1 PHE A 76 9.250 -4.037 -8.223 1.00 0.00 C ATOM 1221 CE2 PHE A 76 9.736 -1.692 -7.861 1.00 0.00 C ATOM 1222 CZ PHE A 76 9.737 -2.814 -8.695 1.00 0.00 C ATOM 0 H PHE A 76 6.309 -1.472 -4.901 1.00 0.00 H new ATOM 0 HA PHE A 76 6.602 -4.279 -5.484 1.00 0.00 H new ATOM 0 HB2 PHE A 76 8.310 -2.158 -4.153 1.00 0.00 H new ATOM 0 HB3 PHE A 76 8.808 -3.837 -4.088 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.386 -5.087 -6.553 1.00 0.00 H new ATOM 0 HD2 PHE A 76 9.243 -0.923 -5.912 1.00 0.00 H new ATOM 0 HE1 PHE A 76 9.252 -4.903 -8.868 1.00 0.00 H new ATOM 0 HE2 PHE A 76 10.114 -0.748 -8.225 1.00 0.00 H new ATOM 0 HZ PHE A 76 10.114 -2.736 -9.704 1.00 0.00 H new ATOM 1232 N VAL A 77 5.937 -3.424 -2.387 1.00 0.00 N ATOM 1233 CA VAL A 77 5.551 -3.997 -1.064 1.00 0.00 C ATOM 1234 C VAL A 77 4.367 -4.950 -1.263 1.00 0.00 C ATOM 1235 O VAL A 77 4.254 -5.960 -0.598 1.00 0.00 O ATOM 1236 CB VAL A 77 5.158 -2.851 -0.113 1.00 0.00 C ATOM 1237 CG1 VAL A 77 4.367 -3.392 1.088 1.00 0.00 C ATOM 1238 CG2 VAL A 77 6.426 -2.150 0.394 1.00 0.00 C ATOM 0 H VAL A 77 5.836 -2.412 -2.469 1.00 0.00 H new ATOM 0 HA VAL A 77 6.386 -4.547 -0.631 1.00 0.00 H new ATOM 0 HB VAL A 77 4.533 -2.145 -0.659 1.00 0.00 H new ATOM 0 HG11 VAL A 77 4.099 -2.567 1.748 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.461 -3.884 0.735 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.980 -4.109 1.634 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.149 -1.339 1.067 1.00 0.00 H new ATOM 0 HG22 VAL A 77 7.050 -2.867 0.928 1.00 0.00 H new ATOM 0 HG23 VAL A 77 6.981 -1.746 -0.452 1.00 0.00 H new ATOM 1248 N SER A 78 3.486 -4.639 -2.173 1.00 0.00 N ATOM 1249 CA SER A 78 2.317 -5.532 -2.409 1.00 0.00 C ATOM 1250 C SER A 78 2.793 -6.837 -3.056 1.00 0.00 C ATOM 1251 O SER A 78 2.476 -7.918 -2.603 1.00 0.00 O ATOM 1252 CB SER A 78 1.322 -4.832 -3.336 1.00 0.00 C ATOM 1253 OG SER A 78 0.474 -5.804 -3.934 1.00 0.00 O ATOM 0 H SER A 78 3.525 -3.807 -2.762 1.00 0.00 H new ATOM 0 HA SER A 78 1.831 -5.756 -1.459 1.00 0.00 H new ATOM 0 HB2 SER A 78 0.728 -4.111 -2.774 1.00 0.00 H new ATOM 0 HB3 SER A 78 1.855 -4.274 -4.106 1.00 0.00 H new ATOM 0 HG SER A 78 -0.166 -5.359 -4.528 1.00 0.00 H new ATOM 1259 N MET A 79 3.538 -6.741 -4.123 1.00 0.00 N ATOM 1260 CA MET A 79 4.022 -7.969 -4.818 1.00 0.00 C ATOM 1261 C MET A 79 4.657 -8.939 -3.817 1.00 0.00 C ATOM 1262 O MET A 79 4.494 -10.139 -3.917 1.00 0.00 O ATOM 1263 CB MET A 79 5.064 -7.575 -5.867 1.00 0.00 C ATOM 1264 CG MET A 79 4.371 -6.865 -7.032 1.00 0.00 C ATOM 1265 SD MET A 79 5.595 -6.458 -8.304 1.00 0.00 S ATOM 1266 CE MET A 79 5.340 -7.911 -9.354 1.00 0.00 C ATOM 0 H MET A 79 3.834 -5.861 -4.546 1.00 0.00 H new ATOM 0 HA MET A 79 3.174 -8.461 -5.295 1.00 0.00 H new ATOM 0 HB2 MET A 79 5.814 -6.921 -5.422 1.00 0.00 H new ATOM 0 HB3 MET A 79 5.587 -8.461 -6.226 1.00 0.00 H new ATOM 0 HG2 MET A 79 3.594 -7.504 -7.451 1.00 0.00 H new ATOM 0 HG3 MET A 79 3.881 -5.957 -6.679 1.00 0.00 H new ATOM 0 HE1 MET A 79 6.008 -7.861 -10.214 1.00 0.00 H new ATOM 0 HE2 MET A 79 5.552 -8.815 -8.782 1.00 0.00 H new ATOM 0 HE3 MET A 79 4.306 -7.934 -9.699 1.00 0.00 H new ATOM 1276 N VAL A 80 5.379 -8.435 -2.856 1.00 0.00 N ATOM 1277 CA VAL A 80 6.019 -9.342 -1.859 1.00 0.00 C ATOM 1278 C VAL A 80 4.957 -9.886 -0.904 1.00 0.00 C ATOM 1279 O VAL A 80 4.916 -11.067 -0.620 1.00 0.00 O ATOM 1280 CB VAL A 80 7.073 -8.570 -1.060 1.00 0.00 C ATOM 1281 CG1 VAL A 80 7.697 -9.494 -0.012 1.00 0.00 C ATOM 1282 CG2 VAL A 80 8.166 -8.064 -2.004 1.00 0.00 C ATOM 0 H VAL A 80 5.554 -7.440 -2.717 1.00 0.00 H new ATOM 0 HA VAL A 80 6.496 -10.170 -2.383 1.00 0.00 H new ATOM 0 HB VAL A 80 6.600 -7.722 -0.565 1.00 0.00 H new ATOM 0 HG11 VAL A 80 8.447 -8.945 0.557 1.00 0.00 H new ATOM 0 HG12 VAL A 80 6.921 -9.854 0.664 1.00 0.00 H new ATOM 0 HG13 VAL A 80 8.168 -10.342 -0.509 1.00 0.00 H new ATOM 0 HG21 VAL A 80 8.915 -7.515 -1.433 1.00 0.00 H new ATOM 0 HG22 VAL A 80 8.638 -8.911 -2.501 1.00 0.00 H new ATOM 0 HG23 VAL A 80 7.725 -7.405 -2.751 1.00 0.00 H new ATOM 1292 N THR A 81 4.086 -9.048 -0.417 1.00 0.00 N ATOM 1293 CA THR A 81 3.025 -9.544 0.502 1.00 0.00 C ATOM 1294 C THR A 81 2.043 -10.406 -0.296 1.00 0.00 C ATOM 1295 O THR A 81 1.602 -11.445 0.154 1.00 0.00 O ATOM 1296 CB THR A 81 2.281 -8.356 1.118 1.00 0.00 C ATOM 1297 OG1 THR A 81 3.223 -7.396 1.576 1.00 0.00 O ATOM 1298 CG2 THR A 81 1.429 -8.840 2.293 1.00 0.00 C ATOM 0 H THR A 81 4.062 -8.047 -0.614 1.00 0.00 H new ATOM 0 HA THR A 81 3.474 -10.136 1.300 1.00 0.00 H new ATOM 0 HB THR A 81 1.635 -7.901 0.367 1.00 0.00 H new ATOM 0 HG1 THR A 81 3.522 -6.845 0.822 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.900 -7.994 2.731 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.707 -9.576 1.940 1.00 0.00 H new ATOM 0 HG23 THR A 81 2.073 -9.295 3.046 1.00 0.00 H new ATOM 1306 N THR A 82 1.700 -9.978 -1.480 1.00 0.00 N ATOM 1307 CA THR A 82 0.749 -10.762 -2.319 1.00 0.00 C ATOM 1308 C THR A 82 1.448 -12.001 -2.886 1.00 0.00 C ATOM 1309 O THR A 82 0.812 -12.975 -3.237 1.00 0.00 O ATOM 1310 CB THR A 82 0.244 -9.889 -3.470 1.00 0.00 C ATOM 1311 OG1 THR A 82 1.353 -9.366 -4.184 1.00 0.00 O ATOM 1312 CG2 THR A 82 -0.596 -8.740 -2.911 1.00 0.00 C ATOM 0 H THR A 82 2.039 -9.115 -1.905 1.00 0.00 H new ATOM 0 HA THR A 82 -0.093 -11.078 -1.703 1.00 0.00 H new ATOM 0 HB THR A 82 -0.370 -10.489 -4.141 1.00 0.00 H new ATOM 0 HG1 THR A 82 2.023 -9.035 -3.550 1.00 0.00 H new ATOM 0 HG21 THR A 82 -0.955 -8.119 -3.732 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.447 -9.145 -2.363 1.00 0.00 H new ATOM 0 HG23 THR A 82 0.014 -8.136 -2.239 1.00 0.00 H new ATOM 1320 N ALA A 83 2.752 -11.981 -2.978 1.00 0.00 N ATOM 1321 CA ALA A 83 3.472 -13.169 -3.520 1.00 0.00 C ATOM 1322 C ALA A 83 3.125 -14.388 -2.666 1.00 0.00 C ATOM 1323 O ALA A 83 3.215 -15.517 -3.107 1.00 0.00 O ATOM 1324 CB ALA A 83 4.986 -12.921 -3.481 1.00 0.00 C ATOM 0 H ALA A 83 3.346 -11.198 -2.703 1.00 0.00 H new ATOM 0 HA ALA A 83 3.171 -13.344 -4.553 1.00 0.00 H new ATOM 0 HB1 ALA A 83 5.508 -13.792 -3.878 1.00 0.00 H new ATOM 0 HB2 ALA A 83 5.227 -12.047 -4.086 1.00 0.00 H new ATOM 0 HB3 ALA A 83 5.300 -12.748 -2.452 1.00 0.00 H new ATOM 1481 N SER B 1 7.671 -5.495 14.382 1.00 0.00 N ATOM 1482 CA SER B 1 7.844 -4.015 14.390 1.00 0.00 C ATOM 1483 C SER B 1 6.480 -3.352 14.187 1.00 0.00 C ATOM 1484 O SER B 1 5.530 -3.984 13.771 1.00 0.00 O ATOM 1485 CB SER B 1 8.785 -3.602 13.259 1.00 0.00 C ATOM 1486 OG SER B 1 8.071 -3.604 12.030 1.00 0.00 O ATOM 0 H1 SER B 1 8.304 -5.922 15.087 1.00 0.00 H new ATOM 0 H2 SER B 1 6.685 -5.731 14.614 1.00 0.00 H new ATOM 0 H3 SER B 1 7.903 -5.867 13.439 1.00 0.00 H new ATOM 0 HA SER B 1 8.269 -3.701 15.343 1.00 0.00 H new ATOM 0 HB2 SER B 1 9.193 -2.610 13.454 1.00 0.00 H new ATOM 0 HB3 SER B 1 9.629 -4.289 13.204 1.00 0.00 H new ATOM 0 HG SER B 1 8.671 -3.338 11.303 1.00 0.00 H new ATOM 1492 N GLU B 2 6.371 -2.085 14.478 1.00 0.00 N ATOM 1493 CA GLU B 2 5.063 -1.397 14.302 1.00 0.00 C ATOM 1494 C GLU B 2 4.549 -1.632 12.879 1.00 0.00 C ATOM 1495 O GLU B 2 3.362 -1.757 12.649 1.00 0.00 O ATOM 1496 CB GLU B 2 5.241 0.105 14.537 1.00 0.00 C ATOM 1497 CG GLU B 2 3.870 0.769 14.674 1.00 0.00 C ATOM 1498 CD GLU B 2 4.022 2.287 14.556 1.00 0.00 C ATOM 1499 OE1 GLU B 2 4.776 2.722 13.702 1.00 0.00 O ATOM 1500 OE2 GLU B 2 3.383 2.987 15.323 1.00 0.00 O ATOM 0 H GLU B 2 7.129 -1.499 14.829 1.00 0.00 H new ATOM 0 HA GLU B 2 4.345 -1.795 15.018 1.00 0.00 H new ATOM 0 HB2 GLU B 2 5.830 0.275 15.438 1.00 0.00 H new ATOM 0 HB3 GLU B 2 5.791 0.550 13.708 1.00 0.00 H new ATOM 0 HG2 GLU B 2 3.197 0.399 13.901 1.00 0.00 H new ATOM 0 HG3 GLU B 2 3.424 0.511 15.635 1.00 0.00 H new ATOM 1507 N LEU B 3 5.434 -1.678 11.919 1.00 0.00 N ATOM 1508 CA LEU B 3 4.997 -1.888 10.510 1.00 0.00 C ATOM 1509 C LEU B 3 4.363 -3.272 10.358 1.00 0.00 C ATOM 1510 O LEU B 3 3.257 -3.404 9.874 1.00 0.00 O ATOM 1511 CB LEU B 3 6.208 -1.774 9.577 1.00 0.00 C ATOM 1512 CG LEU B 3 5.740 -1.621 8.117 1.00 0.00 C ATOM 1513 CD1 LEU B 3 5.274 -0.179 7.842 1.00 0.00 C ATOM 1514 CD2 LEU B 3 6.900 -1.963 7.175 1.00 0.00 C ATOM 0 H LEU B 3 6.441 -1.579 12.051 1.00 0.00 H new ATOM 0 HA LEU B 3 4.260 -1.129 10.248 1.00 0.00 H new ATOM 0 HB2 LEU B 3 6.818 -0.917 9.863 1.00 0.00 H new ATOM 0 HB3 LEU B 3 6.837 -2.659 9.675 1.00 0.00 H new ATOM 0 HG LEU B 3 4.903 -2.299 7.946 1.00 0.00 H new ATOM 0 HD11 LEU B 3 4.948 -0.093 6.805 1.00 0.00 H new ATOM 0 HD12 LEU B 3 4.445 0.068 8.505 1.00 0.00 H new ATOM 0 HD13 LEU B 3 6.099 0.510 8.021 1.00 0.00 H new ATOM 0 HD21 LEU B 3 6.573 -1.856 6.141 1.00 0.00 H new ATOM 0 HD22 LEU B 3 7.734 -1.286 7.364 1.00 0.00 H new ATOM 0 HD23 LEU B 3 7.220 -2.990 7.350 1.00 0.00 H new ATOM 1526 N GLU B 4 5.048 -4.308 10.762 1.00 0.00 N ATOM 1527 CA GLU B 4 4.465 -5.671 10.630 1.00 0.00 C ATOM 1528 C GLU B 4 3.101 -5.698 11.320 1.00 0.00 C ATOM 1529 O GLU B 4 2.119 -6.166 10.780 1.00 0.00 O ATOM 1530 CB GLU B 4 5.397 -6.694 11.282 1.00 0.00 C ATOM 1531 CG GLU B 4 6.754 -6.668 10.575 1.00 0.00 C ATOM 1532 CD GLU B 4 7.750 -7.537 11.344 1.00 0.00 C ATOM 1533 OE1 GLU B 4 8.181 -7.112 12.403 1.00 0.00 O ATOM 1534 OE2 GLU B 4 8.066 -8.611 10.861 1.00 0.00 O ATOM 0 H GLU B 4 5.980 -4.269 11.175 1.00 0.00 H new ATOM 0 HA GLU B 4 4.346 -5.921 9.576 1.00 0.00 H new ATOM 0 HB2 GLU B 4 5.522 -6.466 12.341 1.00 0.00 H new ATOM 0 HB3 GLU B 4 4.961 -7.691 11.220 1.00 0.00 H new ATOM 0 HG2 GLU B 4 6.650 -7.034 9.553 1.00 0.00 H new ATOM 0 HG3 GLU B 4 7.123 -5.644 10.511 1.00 0.00 H new ATOM 1541 N LYS B 5 3.045 -5.180 12.516 1.00 0.00 N ATOM 1542 CA LYS B 5 1.765 -5.141 13.277 1.00 0.00 C ATOM 1543 C LYS B 5 0.658 -4.538 12.408 1.00 0.00 C ATOM 1544 O LYS B 5 -0.463 -5.004 12.388 1.00 0.00 O ATOM 1545 CB LYS B 5 1.956 -4.241 14.505 1.00 0.00 C ATOM 1546 CG LYS B 5 2.873 -4.931 15.534 1.00 0.00 C ATOM 1547 CD LYS B 5 2.067 -5.898 16.414 1.00 0.00 C ATOM 1548 CE LYS B 5 2.939 -6.371 17.579 1.00 0.00 C ATOM 1549 NZ LYS B 5 2.149 -7.282 18.454 1.00 0.00 N ATOM 0 H LYS B 5 3.844 -4.776 13.005 1.00 0.00 H new ATOM 0 HA LYS B 5 1.488 -6.153 13.572 1.00 0.00 H new ATOM 0 HB2 LYS B 5 2.390 -3.288 14.202 1.00 0.00 H new ATOM 0 HB3 LYS B 5 0.989 -4.022 14.958 1.00 0.00 H new ATOM 0 HG2 LYS B 5 3.664 -5.474 15.017 1.00 0.00 H new ATOM 0 HG3 LYS B 5 3.357 -4.180 16.158 1.00 0.00 H new ATOM 0 HD2 LYS B 5 1.172 -5.403 16.792 1.00 0.00 H new ATOM 0 HD3 LYS B 5 1.734 -6.752 15.824 1.00 0.00 H new ATOM 0 HE2 LYS B 5 3.821 -6.888 17.200 1.00 0.00 H new ATOM 0 HE3 LYS B 5 3.293 -5.515 18.153 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 2.742 -7.603 19.246 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 1.321 -6.775 18.825 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 1.832 -8.105 17.902 1.00 0.00 H new ATOM 1563 N ALA B 6 0.975 -3.478 11.712 1.00 0.00 N ATOM 1564 CA ALA B 6 -0.031 -2.788 10.854 1.00 0.00 C ATOM 1565 C ALA B 6 -0.270 -3.545 9.540 1.00 0.00 C ATOM 1566 O ALA B 6 -1.384 -3.584 9.054 1.00 0.00 O ATOM 1567 CB ALA B 6 0.462 -1.363 10.561 1.00 0.00 C ATOM 0 H ALA B 6 1.903 -3.055 11.702 1.00 0.00 H new ATOM 0 HA ALA B 6 -0.981 -2.756 11.387 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -0.266 -0.848 9.934 1.00 0.00 H new ATOM 0 HB2 ALA B 6 0.582 -0.820 11.498 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.420 -1.409 10.043 1.00 0.00 H new ATOM 1573 N MET B 7 0.720 -4.155 8.952 1.00 0.00 N ATOM 1574 CA MET B 7 0.437 -4.887 7.684 1.00 0.00 C ATOM 1575 C MET B 7 -0.611 -5.959 7.988 1.00 0.00 C ATOM 1576 O MET B 7 -1.620 -6.072 7.314 1.00 0.00 O ATOM 1577 CB MET B 7 1.712 -5.546 7.145 1.00 0.00 C ATOM 1578 CG MET B 7 2.708 -4.472 6.685 1.00 0.00 C ATOM 1579 SD MET B 7 2.005 -3.504 5.320 1.00 0.00 S ATOM 1580 CE MET B 7 1.863 -4.843 4.108 1.00 0.00 C ATOM 0 H MET B 7 1.685 -4.181 9.280 1.00 0.00 H new ATOM 0 HA MET B 7 0.072 -4.193 6.927 1.00 0.00 H new ATOM 0 HB2 MET B 7 2.165 -6.166 7.919 1.00 0.00 H new ATOM 0 HB3 MET B 7 1.466 -6.205 6.312 1.00 0.00 H new ATOM 0 HG2 MET B 7 2.954 -3.813 7.518 1.00 0.00 H new ATOM 0 HG3 MET B 7 3.638 -4.942 6.365 1.00 0.00 H new ATOM 0 HE1 MET B 7 1.899 -4.428 3.101 1.00 0.00 H new ATOM 0 HE2 MET B 7 2.688 -5.543 4.241 1.00 0.00 H new ATOM 0 HE3 MET B 7 0.917 -5.365 4.252 1.00 0.00 H new ATOM 1590 N VAL B 8 -0.395 -6.729 9.017 1.00 0.00 N ATOM 1591 CA VAL B 8 -1.388 -7.773 9.383 1.00 0.00 C ATOM 1592 C VAL B 8 -2.709 -7.091 9.738 1.00 0.00 C ATOM 1593 O VAL B 8 -3.776 -7.596 9.456 1.00 0.00 O ATOM 1594 CB VAL B 8 -0.878 -8.566 10.587 1.00 0.00 C ATOM 1595 CG1 VAL B 8 -1.792 -9.768 10.830 1.00 0.00 C ATOM 1596 CG2 VAL B 8 0.543 -9.058 10.305 1.00 0.00 C ATOM 0 H VAL B 8 0.426 -6.680 9.620 1.00 0.00 H new ATOM 0 HA VAL B 8 -1.537 -8.455 8.546 1.00 0.00 H new ATOM 0 HB VAL B 8 -0.875 -7.926 11.470 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -1.429 -10.334 11.688 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -2.806 -9.420 11.027 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -1.793 -10.408 9.948 1.00 0.00 H new ATOM 0 HG21 VAL B 8 0.909 -9.624 11.162 1.00 0.00 H new ATOM 0 HG22 VAL B 8 0.538 -9.698 9.423 1.00 0.00 H new ATOM 0 HG23 VAL B 8 1.196 -8.203 10.129 1.00 0.00 H new ATOM 1606 N ALA B 9 -2.644 -5.936 10.346 1.00 0.00 N ATOM 1607 CA ALA B 9 -3.895 -5.212 10.706 1.00 0.00 C ATOM 1608 C ALA B 9 -4.684 -4.917 9.429 1.00 0.00 C ATOM 1609 O ALA B 9 -5.872 -5.153 9.358 1.00 0.00 O ATOM 1610 CB ALA B 9 -3.536 -3.894 11.399 1.00 0.00 C ATOM 0 H ALA B 9 -1.779 -5.464 10.608 1.00 0.00 H new ATOM 0 HA ALA B 9 -4.497 -5.823 11.378 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -4.450 -3.362 11.664 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -2.963 -4.102 12.302 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -2.940 -3.279 10.725 1.00 0.00 H new ATOM 1616 N LEU B 10 -4.038 -4.384 8.426 1.00 0.00 N ATOM 1617 CA LEU B 10 -4.764 -4.057 7.159 1.00 0.00 C ATOM 1618 C LEU B 10 -5.672 -5.233 6.783 1.00 0.00 C ATOM 1619 O LEU B 10 -6.786 -5.050 6.333 1.00 0.00 O ATOM 1620 CB LEU B 10 -3.729 -3.819 6.028 1.00 0.00 C ATOM 1621 CG LEU B 10 -3.395 -2.320 5.902 1.00 0.00 C ATOM 1622 CD1 LEU B 10 -2.618 -1.858 7.136 1.00 0.00 C ATOM 1623 CD2 LEU B 10 -2.539 -2.092 4.652 1.00 0.00 C ATOM 0 H LEU B 10 -3.043 -4.161 8.427 1.00 0.00 H new ATOM 0 HA LEU B 10 -5.367 -3.160 7.297 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -2.820 -4.383 6.236 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -4.125 -4.189 5.082 1.00 0.00 H new ATOM 0 HG LEU B 10 -4.321 -1.751 5.823 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -2.384 -0.798 7.043 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -3.223 -2.019 8.028 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -1.693 -2.428 7.218 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -2.302 -1.032 4.562 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -1.615 -2.665 4.734 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -3.090 -2.417 3.769 1.00 0.00 H new ATOM 1635 N ILE B 11 -5.214 -6.441 6.990 1.00 0.00 N ATOM 1636 CA ILE B 11 -6.078 -7.611 6.665 1.00 0.00 C ATOM 1637 C ILE B 11 -7.260 -7.601 7.640 1.00 0.00 C ATOM 1638 O ILE B 11 -8.386 -7.883 7.280 1.00 0.00 O ATOM 1639 CB ILE B 11 -5.278 -8.917 6.814 1.00 0.00 C ATOM 1640 CG1 ILE B 11 -4.335 -9.087 5.614 1.00 0.00 C ATOM 1641 CG2 ILE B 11 -6.235 -10.115 6.866 1.00 0.00 C ATOM 1642 CD1 ILE B 11 -3.225 -8.034 5.663 1.00 0.00 C ATOM 0 H ILE B 11 -4.292 -6.665 7.365 1.00 0.00 H new ATOM 0 HA ILE B 11 -6.433 -7.549 5.636 1.00 0.00 H new ATOM 0 HB ILE B 11 -4.699 -8.870 7.737 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -3.900 -10.086 5.623 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -4.896 -8.992 4.684 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -5.661 -11.035 6.972 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -6.907 -10.007 7.717 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -6.818 -10.155 5.946 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -2.562 -8.164 4.807 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -3.667 -7.038 5.632 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -2.655 -8.149 6.585 1.00 0.00 H new ATOM 1654 N ASP B 12 -7.001 -7.258 8.874 1.00 0.00 N ATOM 1655 CA ASP B 12 -8.085 -7.201 9.892 1.00 0.00 C ATOM 1656 C ASP B 12 -9.255 -6.393 9.342 1.00 0.00 C ATOM 1657 O ASP B 12 -10.385 -6.841 9.316 1.00 0.00 O ATOM 1658 CB ASP B 12 -7.555 -6.495 11.149 1.00 0.00 C ATOM 1659 CG ASP B 12 -8.496 -6.766 12.327 1.00 0.00 C ATOM 1660 OD1 ASP B 12 -8.520 -7.893 12.793 1.00 0.00 O ATOM 1661 OD2 ASP B 12 -9.175 -5.841 12.741 1.00 0.00 O ATOM 0 H ASP B 12 -6.074 -7.013 9.221 1.00 0.00 H new ATOM 0 HA ASP B 12 -8.411 -8.213 10.133 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -6.552 -6.851 11.383 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -7.479 -5.422 10.971 1.00 0.00 H new ATOM 1666 N VAL B 13 -8.985 -5.187 8.919 1.00 0.00 N ATOM 1667 CA VAL B 13 -10.068 -4.316 8.387 1.00 0.00 C ATOM 1668 C VAL B 13 -10.458 -4.742 6.968 1.00 0.00 C ATOM 1669 O VAL B 13 -11.615 -4.669 6.601 1.00 0.00 O ATOM 1670 CB VAL B 13 -9.600 -2.857 8.399 1.00 0.00 C ATOM 1671 CG1 VAL B 13 -10.615 -1.978 7.663 1.00 0.00 C ATOM 1672 CG2 VAL B 13 -9.468 -2.377 9.850 1.00 0.00 C ATOM 0 H VAL B 13 -8.055 -4.767 8.920 1.00 0.00 H new ATOM 0 HA VAL B 13 -10.949 -4.416 9.021 1.00 0.00 H new ATOM 0 HB VAL B 13 -8.634 -2.786 7.898 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -10.276 -0.942 7.675 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -10.709 -2.317 6.631 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -11.584 -2.049 8.158 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -9.135 -1.339 9.861 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -10.435 -2.453 10.348 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -8.740 -2.997 10.374 1.00 0.00 H new ATOM 1682 N PHE B 14 -9.537 -5.177 6.157 1.00 0.00 N ATOM 1683 CA PHE B 14 -9.942 -5.577 4.781 1.00 0.00 C ATOM 1684 C PHE B 14 -10.866 -6.791 4.872 1.00 0.00 C ATOM 1685 O PHE B 14 -11.801 -6.937 4.110 1.00 0.00 O ATOM 1686 CB PHE B 14 -8.716 -5.929 3.937 1.00 0.00 C ATOM 1687 CG PHE B 14 -9.161 -6.199 2.518 1.00 0.00 C ATOM 1688 CD1 PHE B 14 -9.581 -7.482 2.147 1.00 0.00 C ATOM 1689 CD2 PHE B 14 -9.162 -5.164 1.575 1.00 0.00 C ATOM 1690 CE1 PHE B 14 -10.002 -7.731 0.833 1.00 0.00 C ATOM 1691 CE2 PHE B 14 -9.583 -5.412 0.262 1.00 0.00 C ATOM 1692 CZ PHE B 14 -10.003 -6.696 -0.109 1.00 0.00 C ATOM 0 H PHE B 14 -8.546 -5.272 6.378 1.00 0.00 H new ATOM 0 HA PHE B 14 -10.459 -4.744 4.305 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -7.997 -5.110 3.957 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -8.214 -6.805 4.348 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -9.581 -8.281 2.874 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -8.838 -4.174 1.860 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -10.325 -8.721 0.548 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -9.584 -4.613 -0.465 1.00 0.00 H new ATOM 0 HZ PHE B 14 -10.327 -6.887 -1.121 1.00 0.00 H new ATOM 1702 N HIS B 15 -10.604 -7.665 5.807 1.00 0.00 N ATOM 1703 CA HIS B 15 -11.456 -8.876 5.962 1.00 0.00 C ATOM 1704 C HIS B 15 -12.737 -8.513 6.716 1.00 0.00 C ATOM 1705 O HIS B 15 -13.776 -9.114 6.526 1.00 0.00 O ATOM 1706 CB HIS B 15 -10.689 -9.942 6.748 1.00 0.00 C ATOM 1707 CG HIS B 15 -11.409 -11.258 6.646 1.00 0.00 C ATOM 1708 ND1 HIS B 15 -11.679 -11.863 5.428 1.00 0.00 N ATOM 1709 CD2 HIS B 15 -11.922 -12.099 7.603 1.00 0.00 C ATOM 1710 CE1 HIS B 15 -12.326 -13.015 5.681 1.00 0.00 C ATOM 1711 NE2 HIS B 15 -12.500 -13.207 6.991 1.00 0.00 N ATOM 0 H HIS B 15 -9.834 -7.591 6.471 1.00 0.00 H new ATOM 0 HA HIS B 15 -11.714 -9.263 4.976 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -9.676 -10.039 6.357 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -10.600 -9.644 7.793 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -11.883 -11.927 8.668 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -12.663 -13.701 4.918 1.00 0.00 H new ATOM 0 HE2 HIS B 15 -12.958 -13.997 7.446 1.00 0.00 H new ATOM 1719 N GLN B 16 -12.661 -7.542 7.588 1.00 0.00 N ATOM 1720 CA GLN B 16 -13.863 -7.146 8.376 1.00 0.00 C ATOM 1721 C GLN B 16 -15.019 -6.821 7.430 1.00 0.00 C ATOM 1722 O GLN B 16 -16.137 -7.252 7.635 1.00 0.00 O ATOM 1723 CB GLN B 16 -13.532 -5.920 9.231 1.00 0.00 C ATOM 1724 CG GLN B 16 -14.676 -5.644 10.211 1.00 0.00 C ATOM 1725 CD GLN B 16 -14.201 -4.665 11.287 1.00 0.00 C ATOM 1726 OE1 GLN B 16 -13.931 -5.057 12.405 1.00 0.00 O ATOM 1727 NE2 GLN B 16 -14.087 -3.399 10.994 1.00 0.00 N ATOM 0 H GLN B 16 -11.817 -7.006 7.788 1.00 0.00 H new ATOM 0 HA GLN B 16 -14.157 -7.971 9.025 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -12.605 -6.087 9.779 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -13.372 -5.052 8.591 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -15.532 -5.229 9.679 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -15.007 -6.575 10.672 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -14.314 -3.070 10.055 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -13.771 -2.738 11.703 1.00 0.00 H new ATOM 1736 N TYR B 17 -14.768 -6.068 6.393 1.00 0.00 N ATOM 1737 CA TYR B 17 -15.861 -5.726 5.443 1.00 0.00 C ATOM 1738 C TYR B 17 -16.222 -6.970 4.632 1.00 0.00 C ATOM 1739 O TYR B 17 -17.379 -7.306 4.471 1.00 0.00 O ATOM 1740 CB TYR B 17 -15.387 -4.616 4.496 1.00 0.00 C ATOM 1741 CG TYR B 17 -15.434 -3.283 5.211 1.00 0.00 C ATOM 1742 CD1 TYR B 17 -14.531 -3.014 6.247 1.00 0.00 C ATOM 1743 CD2 TYR B 17 -16.378 -2.317 4.838 1.00 0.00 C ATOM 1744 CE1 TYR B 17 -14.573 -1.781 6.910 1.00 0.00 C ATOM 1745 CE2 TYR B 17 -16.419 -1.085 5.501 1.00 0.00 C ATOM 1746 CZ TYR B 17 -15.517 -0.817 6.536 1.00 0.00 C ATOM 1747 OH TYR B 17 -15.558 0.397 7.190 1.00 0.00 O ATOM 0 H TYR B 17 -13.854 -5.676 6.164 1.00 0.00 H new ATOM 0 HA TYR B 17 -16.735 -5.379 5.995 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -14.372 -4.822 4.157 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -16.020 -4.587 3.609 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -13.802 -3.757 6.535 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -17.074 -2.523 4.039 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -13.877 -1.574 7.710 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -17.147 -0.341 5.213 1.00 0.00 H new ATOM 0 HH TYR B 17 -14.660 0.629 7.506 1.00 0.00 H new ATOM 1757 N SER B 18 -15.237 -7.655 4.115 1.00 0.00 N ATOM 1758 CA SER B 18 -15.509 -8.880 3.308 1.00 0.00 C ATOM 1759 C SER B 18 -15.342 -10.126 4.181 1.00 0.00 C ATOM 1760 O SER B 18 -14.533 -10.984 3.890 1.00 0.00 O ATOM 1761 CB SER B 18 -14.520 -8.946 2.144 1.00 0.00 C ATOM 1762 OG SER B 18 -13.208 -8.687 2.627 1.00 0.00 O ATOM 0 H SER B 18 -14.250 -7.417 4.218 1.00 0.00 H new ATOM 0 HA SER B 18 -16.530 -8.841 2.927 1.00 0.00 H new ATOM 0 HB2 SER B 18 -14.559 -9.928 1.674 1.00 0.00 H new ATOM 0 HB3 SER B 18 -14.790 -8.216 1.381 1.00 0.00 H new ATOM 0 HG SER B 18 -13.112 -7.730 2.817 1.00 0.00 H new ATOM 1768 N GLY B 19 -16.117 -10.248 5.237 1.00 0.00 N ATOM 1769 CA GLY B 19 -16.028 -11.457 6.123 1.00 0.00 C ATOM 1770 C GLY B 19 -17.394 -12.144 6.118 1.00 0.00 C ATOM 1771 O GLY B 19 -17.530 -13.285 6.513 1.00 0.00 O ATOM 0 H GLY B 19 -16.811 -9.558 5.524 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -15.257 -12.138 5.763 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -15.750 -11.168 7.136 1.00 0.00 H new ATOM 1775 N ARG B 20 -18.398 -11.468 5.632 1.00 0.00 N ATOM 1776 CA ARG B 20 -19.752 -12.083 5.549 1.00 0.00 C ATOM 1777 C ARG B 20 -19.691 -13.265 4.587 1.00 0.00 C ATOM 1778 O ARG B 20 -20.397 -14.239 4.763 1.00 0.00 O ATOM 1779 CB ARG B 20 -20.767 -11.056 5.044 1.00 0.00 C ATOM 1780 CG ARG B 20 -20.801 -9.856 5.992 1.00 0.00 C ATOM 1781 CD ARG B 20 -21.596 -8.720 5.346 1.00 0.00 C ATOM 1782 NE ARG B 20 -21.711 -7.583 6.302 1.00 0.00 N ATOM 1783 CZ ARG B 20 -22.497 -6.578 6.028 1.00 0.00 C ATOM 1784 NH1 ARG B 20 -22.576 -6.126 4.806 1.00 0.00 N ATOM 1785 NH2 ARG B 20 -23.205 -6.025 6.975 1.00 0.00 N ATOM 0 H ARG B 20 -18.338 -10.510 5.287 1.00 0.00 H new ATOM 0 HA ARG B 20 -20.064 -12.421 6.537 1.00 0.00 H new ATOM 0 HB2 ARG B 20 -20.500 -10.730 4.039 1.00 0.00 H new ATOM 0 HB3 ARG B 20 -21.756 -11.509 4.980 1.00 0.00 H new ATOM 0 HG2 ARG B 20 -21.257 -10.141 6.940 1.00 0.00 H new ATOM 0 HG3 ARG B 20 -19.786 -9.525 6.213 1.00 0.00 H new ATOM 0 HD2 ARG B 20 -21.102 -8.391 4.432 1.00 0.00 H new ATOM 0 HD3 ARG B 20 -22.588 -9.072 5.063 1.00 0.00 H new ATOM 0 HE ARG B 20 -21.176 -7.590 7.170 1.00 0.00 H new ATOM 0 HH11 ARG B 20 -22.023 -6.558 4.066 1.00 0.00 H new ATOM 0 HH12 ARG B 20 -23.190 -5.340 4.592 1.00 0.00 H new ATOM 0 HH21 ARG B 20 -23.144 -6.378 7.930 1.00 0.00 H new ATOM 0 HH22 ARG B 20 -23.819 -5.239 6.760 1.00 0.00 H new ATOM 1799 N GLU B 21 -18.844 -13.227 3.593 1.00 0.00 N ATOM 1800 CA GLU B 21 -18.751 -14.401 2.671 1.00 0.00 C ATOM 1801 C GLU B 21 -17.322 -14.534 2.148 1.00 0.00 C ATOM 1802 O GLU B 21 -16.770 -15.615 2.112 1.00 0.00 O ATOM 1803 CB GLU B 21 -19.715 -14.218 1.497 1.00 0.00 C ATOM 1804 CG GLU B 21 -21.158 -14.355 1.988 1.00 0.00 C ATOM 1805 CD GLU B 21 -22.108 -14.356 0.789 1.00 0.00 C ATOM 1806 OE1 GLU B 21 -21.821 -13.657 -0.169 1.00 0.00 O ATOM 1807 OE2 GLU B 21 -23.106 -15.054 0.849 1.00 0.00 O ATOM 0 H GLU B 21 -18.221 -12.448 3.380 1.00 0.00 H new ATOM 0 HA GLU B 21 -19.020 -15.305 3.217 1.00 0.00 H new ATOM 0 HB2 GLU B 21 -19.567 -13.239 1.042 1.00 0.00 H new ATOM 0 HB3 GLU B 21 -19.511 -14.962 0.727 1.00 0.00 H new ATOM 0 HG2 GLU B 21 -21.273 -15.277 2.557 1.00 0.00 H new ATOM 0 HG3 GLU B 21 -21.404 -13.533 2.660 1.00 0.00 H new ATOM 1814 N GLY B 22 -16.712 -13.450 1.744 1.00 0.00 N ATOM 1815 CA GLY B 22 -15.313 -13.531 1.226 1.00 0.00 C ATOM 1816 C GLY B 22 -15.203 -14.696 0.242 1.00 0.00 C ATOM 1817 O GLY B 22 -14.120 -15.137 -0.090 1.00 0.00 O ATOM 0 H GLY B 22 -17.120 -12.515 1.750 1.00 0.00 H new ATOM 0 HA2 GLY B 22 -15.041 -12.597 0.733 1.00 0.00 H new ATOM 0 HA3 GLY B 22 -14.615 -13.671 2.052 1.00 0.00 H new ATOM 1821 N ASP B 23 -16.313 -15.195 -0.236 1.00 0.00 N ATOM 1822 CA ASP B 23 -16.261 -16.325 -1.208 1.00 0.00 C ATOM 1823 C ASP B 23 -15.247 -15.974 -2.297 1.00 0.00 C ATOM 1824 O ASP B 23 -14.264 -16.661 -2.490 1.00 0.00 O ATOM 1825 CB ASP B 23 -17.641 -16.527 -1.838 1.00 0.00 C ATOM 1826 CG ASP B 23 -17.635 -17.799 -2.688 1.00 0.00 C ATOM 1827 OD1 ASP B 23 -16.666 -18.006 -3.401 1.00 0.00 O ATOM 1828 OD2 ASP B 23 -18.598 -18.544 -2.612 1.00 0.00 O ATOM 0 H ASP B 23 -17.250 -14.870 0.004 1.00 0.00 H new ATOM 0 HA ASP B 23 -15.967 -17.244 -0.701 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -18.400 -16.601 -1.059 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -17.900 -15.666 -2.455 1.00 0.00 H new ATOM 1833 N LYS B 24 -15.460 -14.884 -2.986 1.00 0.00 N ATOM 1834 CA LYS B 24 -14.489 -14.461 -4.033 1.00 0.00 C ATOM 1835 C LYS B 24 -13.446 -13.555 -3.372 1.00 0.00 C ATOM 1836 O LYS B 24 -13.685 -12.981 -2.328 1.00 0.00 O ATOM 1837 CB LYS B 24 -15.225 -13.693 -5.137 1.00 0.00 C ATOM 1838 CG LYS B 24 -16.549 -14.392 -5.449 1.00 0.00 C ATOM 1839 CD LYS B 24 -17.189 -13.747 -6.681 1.00 0.00 C ATOM 1840 CE LYS B 24 -18.621 -14.262 -6.842 1.00 0.00 C ATOM 1841 NZ LYS B 24 -18.637 -15.743 -6.682 1.00 0.00 N ATOM 0 H LYS B 24 -16.265 -14.269 -2.868 1.00 0.00 H new ATOM 0 HA LYS B 24 -14.004 -15.330 -4.478 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -15.409 -12.667 -4.820 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -14.608 -13.643 -6.034 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -16.379 -15.454 -5.628 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -17.222 -14.317 -4.595 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -17.191 -12.662 -6.577 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -16.605 -13.980 -7.571 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -19.271 -13.798 -6.100 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -19.010 -13.987 -7.823 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -19.485 -16.133 -7.142 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -17.787 -16.149 -7.122 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -18.651 -15.983 -5.670 1.00 0.00 H new ATOM 1855 N HIS B 25 -12.302 -13.401 -3.988 1.00 0.00 N ATOM 1856 CA HIS B 25 -11.238 -12.508 -3.428 1.00 0.00 C ATOM 1857 C HIS B 25 -11.107 -11.311 -4.364 1.00 0.00 C ATOM 1858 O HIS B 25 -10.022 -10.909 -4.737 1.00 0.00 O ATOM 1859 CB HIS B 25 -9.910 -13.266 -3.372 1.00 0.00 C ATOM 1860 CG HIS B 25 -10.131 -14.614 -2.740 1.00 0.00 C ATOM 1861 ND1 HIS B 25 -10.307 -15.763 -3.495 1.00 0.00 N ATOM 1862 CD2 HIS B 25 -10.208 -15.011 -1.428 1.00 0.00 C ATOM 1863 CE1 HIS B 25 -10.479 -16.787 -2.639 1.00 0.00 C ATOM 1864 NE2 HIS B 25 -10.428 -16.384 -1.367 1.00 0.00 N ATOM 0 H HIS B 25 -12.055 -13.860 -4.865 1.00 0.00 H new ATOM 0 HA HIS B 25 -11.496 -12.183 -2.420 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -9.504 -13.385 -4.376 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -9.178 -12.698 -2.797 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -10.112 -14.358 -0.573 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -10.639 -17.811 -2.944 1.00 0.00 H new ATOM 0 HE2 HIS B 25 -10.529 -16.959 -0.530 1.00 0.00 H new ATOM 1872 N LYS B 26 -12.222 -10.743 -4.744 1.00 0.00 N ATOM 1873 CA LYS B 26 -12.213 -9.564 -5.660 1.00 0.00 C ATOM 1874 C LYS B 26 -13.142 -8.479 -5.107 1.00 0.00 C ATOM 1875 O LYS B 26 -14.144 -8.771 -4.485 1.00 0.00 O ATOM 1876 CB LYS B 26 -12.707 -10.000 -7.041 1.00 0.00 C ATOM 1877 CG LYS B 26 -11.843 -11.157 -7.547 1.00 0.00 C ATOM 1878 CD LYS B 26 -12.395 -11.663 -8.881 1.00 0.00 C ATOM 1879 CE LYS B 26 -11.500 -12.784 -9.412 1.00 0.00 C ATOM 1880 NZ LYS B 26 -11.491 -13.915 -8.441 1.00 0.00 N ATOM 0 H LYS B 26 -13.150 -11.050 -4.454 1.00 0.00 H new ATOM 0 HA LYS B 26 -11.201 -9.168 -5.738 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -13.751 -10.308 -6.985 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -12.658 -9.163 -7.738 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -10.811 -10.827 -7.670 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -11.834 -11.965 -6.815 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -13.414 -12.028 -8.750 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -12.439 -10.846 -9.602 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -11.863 -13.126 -10.381 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -10.486 -12.413 -9.564 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -11.150 -14.776 -8.914 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -10.862 -13.685 -7.646 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -12.455 -14.074 -8.085 1.00 0.00 H new ATOM 1894 N LEU B 27 -12.816 -7.230 -5.335 1.00 0.00 N ATOM 1895 CA LEU B 27 -13.671 -6.103 -4.834 1.00 0.00 C ATOM 1896 C LEU B 27 -14.120 -5.261 -6.032 1.00 0.00 C ATOM 1897 O LEU B 27 -13.374 -5.059 -6.969 1.00 0.00 O ATOM 1898 CB LEU B 27 -12.846 -5.241 -3.868 1.00 0.00 C ATOM 1899 CG LEU B 27 -13.769 -4.339 -3.028 1.00 0.00 C ATOM 1900 CD1 LEU B 27 -14.507 -5.161 -1.952 1.00 0.00 C ATOM 1901 CD2 LEU B 27 -12.923 -3.255 -2.348 1.00 0.00 C ATOM 0 H LEU B 27 -11.986 -6.938 -5.852 1.00 0.00 H new ATOM 0 HA LEU B 27 -14.545 -6.490 -4.311 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -12.258 -5.882 -3.211 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -12.141 -4.628 -4.430 1.00 0.00 H new ATOM 0 HG LEU B 27 -14.511 -3.884 -3.685 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -15.153 -4.503 -1.371 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -15.111 -5.931 -2.433 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -13.779 -5.631 -1.291 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -13.568 -2.611 -1.751 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -12.181 -3.724 -1.702 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -12.418 -2.658 -3.107 1.00 0.00 H new ATOM 1913 N LYS B 28 -15.337 -4.775 -6.022 1.00 0.00 N ATOM 1914 CA LYS B 28 -15.827 -3.956 -7.175 1.00 0.00 C ATOM 1915 C LYS B 28 -15.602 -2.468 -6.894 1.00 0.00 C ATOM 1916 O LYS B 28 -15.543 -2.044 -5.757 1.00 0.00 O ATOM 1917 CB LYS B 28 -17.323 -4.205 -7.381 1.00 0.00 C ATOM 1918 CG LYS B 28 -17.611 -5.709 -7.331 1.00 0.00 C ATOM 1919 CD LYS B 28 -18.983 -5.991 -7.952 1.00 0.00 C ATOM 1920 CE LYS B 28 -20.068 -5.271 -7.149 1.00 0.00 C ATOM 1921 NZ LYS B 28 -21.405 -5.808 -7.531 1.00 0.00 N ATOM 0 H LYS B 28 -16.011 -4.909 -5.268 1.00 0.00 H new ATOM 0 HA LYS B 28 -15.277 -4.243 -8.071 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -17.896 -3.690 -6.610 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -17.640 -3.796 -8.340 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -16.837 -6.256 -7.870 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -17.589 -6.060 -6.299 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -19.000 -5.655 -8.989 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -19.175 -7.064 -7.962 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -19.899 -5.411 -6.081 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -20.026 -4.199 -7.340 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -22.144 -5.320 -6.986 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -21.564 -5.653 -8.547 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -21.441 -6.827 -7.327 1.00 0.00 H new ATOM 1935 N LYS B 29 -15.489 -1.669 -7.921 1.00 0.00 N ATOM 1936 CA LYS B 29 -15.284 -0.208 -7.713 1.00 0.00 C ATOM 1937 C LYS B 29 -16.453 0.373 -6.903 1.00 0.00 C ATOM 1938 O LYS B 29 -16.274 1.233 -6.064 1.00 0.00 O ATOM 1939 CB LYS B 29 -15.177 0.501 -9.081 1.00 0.00 C ATOM 1940 CG LYS B 29 -16.497 0.444 -9.874 1.00 0.00 C ATOM 1941 CD LYS B 29 -16.839 -1.006 -10.254 1.00 0.00 C ATOM 1942 CE LYS B 29 -17.786 -1.015 -11.459 1.00 0.00 C ATOM 1943 NZ LYS B 29 -18.085 -2.423 -11.846 1.00 0.00 N ATOM 0 H LYS B 29 -15.530 -1.966 -8.896 1.00 0.00 H new ATOM 0 HA LYS B 29 -14.360 -0.048 -7.158 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -14.893 1.542 -8.927 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -14.383 0.037 -9.667 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -17.304 0.869 -9.278 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -16.412 1.051 -10.775 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -15.927 -1.554 -10.492 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -17.305 -1.513 -9.409 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -18.709 -0.490 -11.213 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -17.331 -0.485 -12.296 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -18.728 -2.429 -12.664 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -17.201 -2.909 -12.097 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -18.536 -2.914 -11.048 1.00 0.00 H new ATOM 1957 N SER B 30 -17.646 -0.081 -7.167 1.00 0.00 N ATOM 1958 CA SER B 30 -18.839 0.445 -6.441 1.00 0.00 C ATOM 1959 C SER B 30 -18.731 0.168 -4.939 1.00 0.00 C ATOM 1960 O SER B 30 -19.041 1.012 -4.112 1.00 0.00 O ATOM 1961 CB SER B 30 -20.092 -0.244 -6.981 1.00 0.00 C ATOM 1962 OG SER B 30 -19.915 -1.653 -6.920 1.00 0.00 O ATOM 0 H SER B 30 -17.849 -0.801 -7.861 1.00 0.00 H new ATOM 0 HA SER B 30 -18.894 1.523 -6.596 1.00 0.00 H new ATOM 0 HB2 SER B 30 -20.964 0.050 -6.397 1.00 0.00 H new ATOM 0 HB3 SER B 30 -20.278 0.067 -8.009 1.00 0.00 H new ATOM 0 HG SER B 30 -20.717 -2.099 -7.264 1.00 0.00 H new ATOM 1968 N GLU B 31 -18.299 -1.010 -4.574 1.00 0.00 N ATOM 1969 CA GLU B 31 -18.193 -1.330 -3.124 1.00 0.00 C ATOM 1970 C GLU B 31 -16.985 -0.599 -2.543 1.00 0.00 C ATOM 1971 O GLU B 31 -16.983 -0.165 -1.408 1.00 0.00 O ATOM 1972 CB GLU B 31 -18.031 -2.840 -2.934 1.00 0.00 C ATOM 1973 CG GLU B 31 -18.323 -3.206 -1.477 1.00 0.00 C ATOM 1974 CD GLU B 31 -18.186 -4.718 -1.291 1.00 0.00 C ATOM 1975 OE1 GLU B 31 -18.771 -5.447 -2.075 1.00 0.00 O ATOM 1976 OE2 GLU B 31 -17.499 -5.121 -0.367 1.00 0.00 O ATOM 0 H GLU B 31 -18.018 -1.756 -5.211 1.00 0.00 H new ATOM 0 HA GLU B 31 -19.099 -1.009 -2.609 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -18.710 -3.376 -3.598 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -17.019 -3.144 -3.201 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -17.632 -2.684 -0.815 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -19.329 -2.886 -1.205 1.00 0.00 H new ATOM 1983 N LEU B 32 -15.960 -0.454 -3.338 1.00 0.00 N ATOM 1984 CA LEU B 32 -14.737 0.256 -2.879 1.00 0.00 C ATOM 1985 C LEU B 32 -15.088 1.714 -2.586 1.00 0.00 C ATOM 1986 O LEU B 32 -14.627 2.281 -1.617 1.00 0.00 O ATOM 1987 CB LEU B 32 -13.670 0.177 -3.981 1.00 0.00 C ATOM 1988 CG LEU B 32 -12.489 1.110 -3.677 1.00 0.00 C ATOM 1989 CD1 LEU B 32 -11.912 0.796 -2.295 1.00 0.00 C ATOM 1990 CD2 LEU B 32 -11.404 0.896 -4.737 1.00 0.00 C ATOM 0 H LEU B 32 -15.920 -0.802 -4.296 1.00 0.00 H new ATOM 0 HA LEU B 32 -14.348 -0.206 -1.972 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -13.313 -0.849 -4.072 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -14.113 0.447 -4.940 1.00 0.00 H new ATOM 0 HG LEU B 32 -12.832 2.144 -3.691 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -11.075 1.464 -2.090 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -12.683 0.938 -1.538 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -11.566 -0.237 -2.271 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -10.560 1.554 -4.531 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -11.070 -0.141 -4.712 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -11.809 1.123 -5.723 1.00 0.00 H new ATOM 2002 N LYS B 33 -15.874 2.349 -3.415 1.00 0.00 N ATOM 2003 CA LYS B 33 -16.183 3.776 -3.146 1.00 0.00 C ATOM 2004 C LYS B 33 -16.746 3.898 -1.735 1.00 0.00 C ATOM 2005 O LYS B 33 -16.223 4.613 -0.904 1.00 0.00 O ATOM 2006 CB LYS B 33 -17.203 4.293 -4.164 1.00 0.00 C ATOM 2007 CG LYS B 33 -16.515 4.504 -5.515 1.00 0.00 C ATOM 2008 CD LYS B 33 -17.572 4.699 -6.606 1.00 0.00 C ATOM 2009 CE LYS B 33 -18.344 5.997 -6.352 1.00 0.00 C ATOM 2010 NZ LYS B 33 -19.063 6.393 -7.595 1.00 0.00 N ATOM 0 H LYS B 33 -16.305 1.949 -4.248 1.00 0.00 H new ATOM 0 HA LYS B 33 -15.275 4.372 -3.233 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -18.022 3.581 -4.268 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -17.638 5.230 -3.815 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -15.861 5.375 -5.469 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -15.887 3.645 -5.753 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -17.095 4.734 -7.585 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -18.259 3.852 -6.616 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -19.054 5.858 -5.536 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -17.659 6.788 -6.047 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -19.964 6.849 -7.345 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -18.477 7.059 -8.138 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -19.251 5.548 -8.171 1.00 0.00 H new ATOM 2024 N GLU B 34 -17.810 3.196 -1.455 1.00 0.00 N ATOM 2025 CA GLU B 34 -18.399 3.272 -0.086 1.00 0.00 C ATOM 2026 C GLU B 34 -17.291 3.015 0.943 1.00 0.00 C ATOM 2027 O GLU B 34 -17.242 3.639 1.984 1.00 0.00 O ATOM 2028 CB GLU B 34 -19.497 2.217 0.061 1.00 0.00 C ATOM 2029 CG GLU B 34 -20.695 2.603 -0.809 1.00 0.00 C ATOM 2030 CD GLU B 34 -21.773 1.523 -0.704 1.00 0.00 C ATOM 2031 OE1 GLU B 34 -22.435 1.473 0.320 1.00 0.00 O ATOM 2032 OE2 GLU B 34 -21.919 0.765 -1.648 1.00 0.00 O ATOM 0 H GLU B 34 -18.294 2.579 -2.107 1.00 0.00 H new ATOM 0 HA GLU B 34 -18.833 4.259 0.077 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -19.118 1.239 -0.236 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -19.802 2.137 1.104 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -21.096 3.564 -0.488 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -20.382 2.719 -1.847 1.00 0.00 H new ATOM 2039 N LEU B 35 -16.398 2.108 0.657 1.00 0.00 N ATOM 2040 CA LEU B 35 -15.290 1.819 1.614 1.00 0.00 C ATOM 2041 C LEU B 35 -14.366 3.041 1.704 1.00 0.00 C ATOM 2042 O LEU B 35 -13.900 3.391 2.770 1.00 0.00 O ATOM 2043 CB LEU B 35 -14.511 0.590 1.130 1.00 0.00 C ATOM 2044 CG LEU B 35 -13.395 0.228 2.122 1.00 0.00 C ATOM 2045 CD1 LEU B 35 -13.995 -0.245 3.457 1.00 0.00 C ATOM 2046 CD2 LEU B 35 -12.539 -0.892 1.517 1.00 0.00 C ATOM 0 H LEU B 35 -16.387 1.553 -0.199 1.00 0.00 H new ATOM 0 HA LEU B 35 -15.695 1.611 2.604 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -15.190 -0.255 1.015 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -14.081 0.789 0.148 1.00 0.00 H new ATOM 0 HG LEU B 35 -12.782 1.109 2.311 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -13.191 -0.497 4.148 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -14.604 0.551 3.884 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -14.616 -1.125 3.286 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -11.743 -1.158 2.213 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -13.163 -1.766 1.329 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -12.102 -0.550 0.579 1.00 0.00 H new ATOM 2058 N ILE B 36 -14.115 3.712 0.613 1.00 0.00 N ATOM 2059 CA ILE B 36 -13.248 4.926 0.662 1.00 0.00 C ATOM 2060 C ILE B 36 -13.909 5.979 1.560 1.00 0.00 C ATOM 2061 O ILE B 36 -13.248 6.727 2.254 1.00 0.00 O ATOM 2062 CB ILE B 36 -13.101 5.485 -0.768 1.00 0.00 C ATOM 2063 CG1 ILE B 36 -12.128 4.589 -1.554 1.00 0.00 C ATOM 2064 CG2 ILE B 36 -12.549 6.921 -0.719 1.00 0.00 C ATOM 2065 CD1 ILE B 36 -12.124 4.974 -3.038 1.00 0.00 C ATOM 0 H ILE B 36 -14.473 3.472 -0.312 1.00 0.00 H new ATOM 0 HA ILE B 36 -12.266 4.674 1.063 1.00 0.00 H new ATOM 0 HB ILE B 36 -14.076 5.498 -1.256 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -11.123 4.686 -1.144 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -12.417 3.544 -1.444 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -12.449 7.307 -1.733 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -13.234 7.555 -0.155 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -11.573 6.919 -0.233 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -11.430 4.330 -3.579 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -13.127 4.853 -3.448 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -11.812 6.013 -3.143 1.00 0.00 H new ATOM 2077 N ASN B 37 -15.208 6.067 1.510 1.00 0.00 N ATOM 2078 CA ASN B 37 -15.934 7.096 2.310 1.00 0.00 C ATOM 2079 C ASN B 37 -15.758 6.878 3.818 1.00 0.00 C ATOM 2080 O ASN B 37 -15.777 7.819 4.585 1.00 0.00 O ATOM 2081 CB ASN B 37 -17.424 7.022 1.972 1.00 0.00 C ATOM 2082 CG ASN B 37 -17.613 7.173 0.461 1.00 0.00 C ATOM 2083 OD1 ASN B 37 -16.697 6.947 -0.304 1.00 0.00 O ATOM 2084 ND2 ASN B 37 -18.774 7.547 -0.005 1.00 0.00 N ATOM 0 H ASN B 37 -15.805 5.465 0.944 1.00 0.00 H new ATOM 0 HA ASN B 37 -15.520 8.073 2.059 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -17.837 6.071 2.308 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -17.966 7.808 2.497 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -18.911 7.649 -1.011 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -19.544 7.737 0.637 1.00 0.00 H new ATOM 2091 N ASN B 38 -15.629 5.648 4.257 1.00 0.00 N ATOM 2092 CA ASN B 38 -15.501 5.375 5.730 1.00 0.00 C ATOM 2093 C ASN B 38 -14.069 4.979 6.111 1.00 0.00 C ATOM 2094 O ASN B 38 -13.820 4.617 7.244 1.00 0.00 O ATOM 2095 CB ASN B 38 -16.446 4.229 6.100 1.00 0.00 C ATOM 2096 CG ASN B 38 -16.346 3.947 7.601 1.00 0.00 C ATOM 2097 OD1 ASN B 38 -16.575 4.822 8.412 1.00 0.00 O ATOM 2098 ND2 ASN B 38 -16.013 2.752 8.006 1.00 0.00 N ATOM 0 H ASN B 38 -15.607 4.820 3.662 1.00 0.00 H new ATOM 0 HA ASN B 38 -15.756 6.286 6.271 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -17.471 4.489 5.836 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -16.188 3.334 5.533 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -15.945 2.552 9.004 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -15.821 2.018 7.325 1.00 0.00 H new ATOM 2105 N GLU B 39 -13.129 5.024 5.194 1.00 0.00 N ATOM 2106 CA GLU B 39 -11.718 4.625 5.539 1.00 0.00 C ATOM 2107 C GLU B 39 -10.734 5.759 5.232 1.00 0.00 C ATOM 2108 O GLU B 39 -9.699 5.862 5.861 1.00 0.00 O ATOM 2109 CB GLU B 39 -11.331 3.391 4.721 1.00 0.00 C ATOM 2110 CG GLU B 39 -12.125 2.180 5.217 1.00 0.00 C ATOM 2111 CD GLU B 39 -11.560 1.708 6.559 1.00 0.00 C ATOM 2112 OE1 GLU B 39 -10.618 2.321 7.034 1.00 0.00 O ATOM 2113 OE2 GLU B 39 -12.079 0.739 7.089 1.00 0.00 O ATOM 0 H GLU B 39 -13.273 5.317 4.228 1.00 0.00 H new ATOM 0 HA GLU B 39 -11.672 4.405 6.606 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -11.534 3.564 3.664 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -10.262 3.201 4.814 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -13.177 2.443 5.327 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -12.072 1.374 4.485 1.00 0.00 H new ATOM 2120 N LEU B 40 -11.041 6.615 4.287 1.00 0.00 N ATOM 2121 CA LEU B 40 -10.112 7.750 3.952 1.00 0.00 C ATOM 2122 C LEU B 40 -10.796 9.081 4.272 1.00 0.00 C ATOM 2123 O LEU B 40 -10.554 10.086 3.633 1.00 0.00 O ATOM 2124 CB LEU B 40 -9.763 7.708 2.459 1.00 0.00 C ATOM 2125 CG LEU B 40 -9.212 6.326 2.077 1.00 0.00 C ATOM 2126 CD1 LEU B 40 -8.735 6.356 0.621 1.00 0.00 C ATOM 2127 CD2 LEU B 40 -8.031 5.958 2.991 1.00 0.00 C ATOM 0 H LEU B 40 -11.895 6.580 3.730 1.00 0.00 H new ATOM 0 HA LEU B 40 -9.200 7.654 4.542 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -10.650 7.930 1.865 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -9.025 8.477 2.230 1.00 0.00 H new ATOM 0 HG LEU B 40 -10.000 5.582 2.194 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -8.343 5.377 0.346 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -9.571 6.608 -0.031 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -7.951 7.105 0.510 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -7.647 4.977 2.712 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -7.241 6.701 2.882 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -8.367 5.935 4.028 1.00 0.00 H new ATOM 2139 N SER B 41 -11.651 9.094 5.259 1.00 0.00 N ATOM 2140 CA SER B 41 -12.355 10.355 5.627 1.00 0.00 C ATOM 2141 C SER B 41 -11.390 11.309 6.340 1.00 0.00 C ATOM 2142 O SER B 41 -11.564 12.512 6.310 1.00 0.00 O ATOM 2143 CB SER B 41 -13.525 10.029 6.557 1.00 0.00 C ATOM 2144 OG SER B 41 -14.579 9.452 5.798 1.00 0.00 O ATOM 0 H SER B 41 -11.893 8.283 5.828 1.00 0.00 H new ATOM 0 HA SER B 41 -12.725 10.834 4.721 1.00 0.00 H new ATOM 0 HB2 SER B 41 -13.203 9.340 7.338 1.00 0.00 H new ATOM 0 HB3 SER B 41 -13.873 10.934 7.055 1.00 0.00 H new ATOM 0 HG SER B 41 -14.297 8.577 5.459 1.00 0.00 H new ATOM 2150 N HIS B 42 -10.379 10.793 6.987 1.00 0.00 N ATOM 2151 CA HIS B 42 -9.422 11.688 7.702 1.00 0.00 C ATOM 2152 C HIS B 42 -8.530 12.413 6.692 1.00 0.00 C ATOM 2153 O HIS B 42 -8.382 13.618 6.734 1.00 0.00 O ATOM 2154 CB HIS B 42 -8.550 10.855 8.642 1.00 0.00 C ATOM 2155 CG HIS B 42 -7.575 11.755 9.352 1.00 0.00 C ATOM 2156 ND1 HIS B 42 -6.642 12.520 8.669 1.00 0.00 N ATOM 2157 CD2 HIS B 42 -7.377 12.024 10.683 1.00 0.00 C ATOM 2158 CE1 HIS B 42 -5.932 13.206 9.584 1.00 0.00 C ATOM 2159 NE2 HIS B 42 -6.339 12.940 10.828 1.00 0.00 N ATOM 0 H HIS B 42 -10.175 9.796 7.052 1.00 0.00 H new ATOM 0 HA HIS B 42 -9.984 12.424 8.277 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -9.174 10.333 9.367 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -8.013 10.093 8.077 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -7.941 11.590 11.495 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -5.131 13.888 9.342 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -5.969 13.325 11.697 1.00 0.00 H new ATOM 2167 N PHE B 43 -7.927 11.690 5.789 1.00 0.00 N ATOM 2168 CA PHE B 43 -7.038 12.342 4.785 1.00 0.00 C ATOM 2169 C PHE B 43 -7.866 13.255 3.878 1.00 0.00 C ATOM 2170 O PHE B 43 -7.366 14.212 3.320 1.00 0.00 O ATOM 2171 CB PHE B 43 -6.346 11.267 3.944 1.00 0.00 C ATOM 2172 CG PHE B 43 -5.543 10.363 4.852 1.00 0.00 C ATOM 2173 CD1 PHE B 43 -4.386 10.848 5.475 1.00 0.00 C ATOM 2174 CD2 PHE B 43 -5.955 9.042 5.074 1.00 0.00 C ATOM 2175 CE1 PHE B 43 -3.642 10.014 6.317 1.00 0.00 C ATOM 2176 CE2 PHE B 43 -5.210 8.209 5.917 1.00 0.00 C ATOM 2177 CZ PHE B 43 -4.053 8.695 6.539 1.00 0.00 C ATOM 0 H PHE B 43 -8.011 10.677 5.702 1.00 0.00 H new ATOM 0 HA PHE B 43 -6.285 12.939 5.300 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -7.087 10.685 3.395 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -5.694 11.731 3.204 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -4.068 11.866 5.305 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -6.847 8.667 4.595 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -2.750 10.389 6.796 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -5.528 7.191 6.088 1.00 0.00 H new ATOM 0 HZ PHE B 43 -3.478 8.052 7.189 1.00 0.00 H new ATOM 2187 N LEU B 44 -9.126 12.958 3.716 1.00 0.00 N ATOM 2188 CA LEU B 44 -9.986 13.797 2.833 1.00 0.00 C ATOM 2189 C LEU B 44 -9.897 15.265 3.279 1.00 0.00 C ATOM 2190 O LEU B 44 -10.145 16.171 2.510 1.00 0.00 O ATOM 2191 CB LEU B 44 -11.449 13.282 2.922 1.00 0.00 C ATOM 2192 CG LEU B 44 -12.049 12.990 1.526 1.00 0.00 C ATOM 2193 CD1 LEU B 44 -11.821 14.176 0.561 1.00 0.00 C ATOM 2194 CD2 LEU B 44 -11.430 11.700 0.953 1.00 0.00 C ATOM 0 H LEU B 44 -9.598 12.169 4.158 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.648 13.730 1.799 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -11.477 12.375 3.525 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -12.064 14.024 3.432 1.00 0.00 H new ATOM 0 HG LEU B 44 -13.125 12.853 1.634 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -12.253 13.942 -0.412 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -12.297 15.070 0.964 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -10.751 14.354 0.449 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -11.855 11.498 -0.030 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -10.351 11.823 0.863 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -11.646 10.865 1.620 1.00 0.00 H new ATOM 2206 N GLU B 45 -9.544 15.507 4.511 1.00 0.00 N ATOM 2207 CA GLU B 45 -9.443 16.914 4.988 1.00 0.00 C ATOM 2208 C GLU B 45 -8.134 17.530 4.490 1.00 0.00 C ATOM 2209 O GLU B 45 -8.090 18.671 4.075 1.00 0.00 O ATOM 2210 CB GLU B 45 -9.472 16.938 6.520 1.00 0.00 C ATOM 2211 CG GLU B 45 -10.906 16.720 7.009 1.00 0.00 C ATOM 2212 CD GLU B 45 -11.736 17.974 6.731 1.00 0.00 C ATOM 2213 OE1 GLU B 45 -11.155 18.965 6.319 1.00 0.00 O ATOM 2214 OE2 GLU B 45 -12.938 17.922 6.934 1.00 0.00 O ATOM 0 H GLU B 45 -9.322 14.794 5.206 1.00 0.00 H new ATOM 0 HA GLU B 45 -10.284 17.490 4.601 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -8.819 16.162 6.919 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -9.093 17.892 6.886 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -11.347 15.860 6.505 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -10.908 16.499 8.076 1.00 0.00 H new ATOM 2221 N GLU B 46 -7.065 16.784 4.534 1.00 0.00 N ATOM 2222 CA GLU B 46 -5.751 17.323 4.071 1.00 0.00 C ATOM 2223 C GLU B 46 -5.592 17.088 2.567 1.00 0.00 C ATOM 2224 O GLU B 46 -4.676 16.419 2.132 1.00 0.00 O ATOM 2225 CB GLU B 46 -4.620 16.613 4.818 1.00 0.00 C ATOM 2226 CG GLU B 46 -4.553 17.133 6.256 1.00 0.00 C ATOM 2227 CD GLU B 46 -3.580 16.275 7.066 1.00 0.00 C ATOM 2228 OE1 GLU B 46 -2.397 16.319 6.774 1.00 0.00 O ATOM 2229 OE2 GLU B 46 -4.036 15.588 7.967 1.00 0.00 O ATOM 0 H GLU B 46 -7.043 15.822 4.871 1.00 0.00 H new ATOM 0 HA GLU B 46 -5.711 18.393 4.273 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -4.789 15.536 4.817 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -3.670 16.787 4.312 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -4.229 18.174 6.263 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -5.543 17.105 6.710 1.00 0.00 H new ATOM 2236 N ILE B 47 -6.473 17.644 1.770 1.00 0.00 N ATOM 2237 CA ILE B 47 -6.385 17.473 0.282 1.00 0.00 C ATOM 2238 C ILE B 47 -6.232 18.847 -0.371 1.00 0.00 C ATOM 2239 O ILE B 47 -7.188 19.580 -0.528 1.00 0.00 O ATOM 2240 CB ILE B 47 -7.669 16.814 -0.236 1.00 0.00 C ATOM 2241 CG1 ILE B 47 -7.871 15.444 0.435 1.00 0.00 C ATOM 2242 CG2 ILE B 47 -7.584 16.640 -1.755 1.00 0.00 C ATOM 2243 CD1 ILE B 47 -6.642 14.546 0.232 1.00 0.00 C ATOM 0 H ILE B 47 -7.257 18.214 2.088 1.00 0.00 H new ATOM 0 HA ILE B 47 -5.528 16.845 0.038 1.00 0.00 H new ATOM 0 HB ILE B 47 -8.517 17.454 0.007 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -8.054 15.580 1.501 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -8.754 14.958 0.019 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -8.498 16.171 -2.119 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -7.463 17.615 -2.227 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -6.730 16.009 -2.002 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -6.810 13.584 0.716 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -6.476 14.392 -0.834 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -5.766 15.024 0.670 1.00 0.00 H new ATOM 2255 N LYS B 48 -5.036 19.199 -0.760 1.00 0.00 N ATOM 2256 CA LYS B 48 -4.822 20.523 -1.411 1.00 0.00 C ATOM 2257 C LYS B 48 -5.136 20.400 -2.903 1.00 0.00 C ATOM 2258 O LYS B 48 -5.763 21.261 -3.488 1.00 0.00 O ATOM 2259 CB LYS B 48 -3.363 20.959 -1.229 1.00 0.00 C ATOM 2260 CG LYS B 48 -3.141 21.460 0.203 1.00 0.00 C ATOM 2261 CD LYS B 48 -1.770 22.132 0.302 1.00 0.00 C ATOM 2262 CE LYS B 48 -1.619 22.787 1.677 1.00 0.00 C ATOM 2263 NZ LYS B 48 -1.844 21.768 2.741 1.00 0.00 N ATOM 0 H LYS B 48 -4.198 18.627 -0.655 1.00 0.00 H new ATOM 0 HA LYS B 48 -5.476 21.266 -0.955 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -2.696 20.123 -1.438 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -3.119 21.747 -1.941 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -3.925 22.166 0.478 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -3.201 20.628 0.904 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -0.981 21.396 0.150 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -1.663 22.881 -0.483 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -0.624 23.220 1.778 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -2.334 23.603 1.783 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -1.453 22.114 3.641 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -2.864 21.598 2.849 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -1.371 20.880 2.477 1.00 0.00 H new ATOM 2277 N GLU B 49 -4.711 19.330 -3.525 1.00 0.00 N ATOM 2278 CA GLU B 49 -4.992 19.148 -4.979 1.00 0.00 C ATOM 2279 C GLU B 49 -6.346 18.447 -5.137 1.00 0.00 C ATOM 2280 O GLU B 49 -6.473 17.268 -4.871 1.00 0.00 O ATOM 2281 CB GLU B 49 -3.885 18.295 -5.604 1.00 0.00 C ATOM 2282 CG GLU B 49 -2.527 18.971 -5.385 1.00 0.00 C ATOM 2283 CD GLU B 49 -1.497 18.382 -6.352 1.00 0.00 C ATOM 2284 OE1 GLU B 49 -1.400 18.884 -7.460 1.00 0.00 O ATOM 2285 OE2 GLU B 49 -0.825 17.439 -5.968 1.00 0.00 O ATOM 0 H GLU B 49 -4.182 18.575 -3.088 1.00 0.00 H new ATOM 0 HA GLU B 49 -5.022 20.115 -5.481 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -3.883 17.300 -5.158 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -4.070 18.166 -6.670 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -2.615 20.046 -5.542 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -2.199 18.825 -4.356 1.00 0.00 H new ATOM 2292 N GLN B 50 -7.363 19.154 -5.549 1.00 0.00 N ATOM 2293 CA GLN B 50 -8.706 18.514 -5.703 1.00 0.00 C ATOM 2294 C GLN B 50 -8.832 17.839 -7.076 1.00 0.00 C ATOM 2295 O GLN B 50 -9.655 16.967 -7.271 1.00 0.00 O ATOM 2296 CB GLN B 50 -9.788 19.590 -5.571 1.00 0.00 C ATOM 2297 CG GLN B 50 -11.169 18.931 -5.518 1.00 0.00 C ATOM 2298 CD GLN B 50 -12.201 19.954 -5.040 1.00 0.00 C ATOM 2299 OE1 GLN B 50 -13.022 20.412 -5.811 1.00 0.00 O ATOM 2300 NE2 GLN B 50 -12.194 20.335 -3.792 1.00 0.00 N ATOM 0 H GLN B 50 -7.325 20.145 -5.786 1.00 0.00 H new ATOM 0 HA GLN B 50 -8.826 17.756 -4.929 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -9.621 20.179 -4.669 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -9.735 20.278 -6.415 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -11.443 18.555 -6.504 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -11.150 18.075 -4.844 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -11.505 19.951 -3.145 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -12.877 21.017 -3.463 1.00 0.00 H new ATOM 2309 N GLU B 51 -8.046 18.246 -8.036 1.00 0.00 N ATOM 2310 CA GLU B 51 -8.154 17.636 -9.397 1.00 0.00 C ATOM 2311 C GLU B 51 -7.576 16.215 -9.416 1.00 0.00 C ATOM 2312 O GLU B 51 -7.956 15.408 -10.242 1.00 0.00 O ATOM 2313 CB GLU B 51 -7.433 18.510 -10.425 1.00 0.00 C ATOM 2314 CG GLU B 51 -8.178 19.837 -10.580 1.00 0.00 C ATOM 2315 CD GLU B 51 -9.500 19.598 -11.311 1.00 0.00 C ATOM 2316 OE1 GLU B 51 -9.467 19.461 -12.523 1.00 0.00 O ATOM 2317 OE2 GLU B 51 -10.522 19.556 -10.647 1.00 0.00 O ATOM 0 H GLU B 51 -7.336 18.972 -7.940 1.00 0.00 H new ATOM 0 HA GLU B 51 -9.211 17.575 -9.656 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -6.407 18.692 -10.107 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -7.383 17.995 -11.384 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -8.366 20.277 -9.601 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -7.566 20.547 -11.136 1.00 0.00 H new ATOM 2324 N VAL B 52 -6.700 15.874 -8.517 1.00 0.00 N ATOM 2325 CA VAL B 52 -6.170 14.482 -8.514 1.00 0.00 C ATOM 2326 C VAL B 52 -7.238 13.554 -7.930 1.00 0.00 C ATOM 2327 O VAL B 52 -7.517 12.508 -8.481 1.00 0.00 O ATOM 2328 CB VAL B 52 -4.892 14.401 -7.674 1.00 0.00 C ATOM 2329 CG1 VAL B 52 -3.726 15.005 -8.456 1.00 0.00 C ATOM 2330 CG2 VAL B 52 -5.068 15.169 -6.365 1.00 0.00 C ATOM 0 H VAL B 52 -6.330 16.489 -7.792 1.00 0.00 H new ATOM 0 HA VAL B 52 -5.929 14.180 -9.533 1.00 0.00 H new ATOM 0 HB VAL B 52 -4.686 13.354 -7.450 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -2.817 14.947 -7.857 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -3.585 14.451 -9.384 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -3.943 16.048 -8.685 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -4.152 15.103 -5.778 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -5.284 16.215 -6.583 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -5.894 14.738 -5.799 1.00 0.00 H new ATOM 2340 N VAL B 53 -7.851 13.914 -6.835 1.00 0.00 N ATOM 2341 CA VAL B 53 -8.901 13.026 -6.263 1.00 0.00 C ATOM 2342 C VAL B 53 -10.072 12.952 -7.246 1.00 0.00 C ATOM 2343 O VAL B 53 -10.721 11.936 -7.384 1.00 0.00 O ATOM 2344 CB VAL B 53 -9.385 13.594 -4.923 1.00 0.00 C ATOM 2345 CG1 VAL B 53 -10.599 12.801 -4.436 1.00 0.00 C ATOM 2346 CG2 VAL B 53 -8.263 13.485 -3.888 1.00 0.00 C ATOM 0 H VAL B 53 -7.673 14.775 -6.317 1.00 0.00 H new ATOM 0 HA VAL B 53 -8.493 12.029 -6.097 1.00 0.00 H new ATOM 0 HB VAL B 53 -9.663 14.640 -5.055 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -10.941 13.207 -3.484 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -11.401 12.875 -5.171 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -10.322 11.755 -4.306 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -8.606 13.889 -2.935 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -7.986 12.438 -3.760 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -7.396 14.050 -4.230 1.00 0.00 H new ATOM 2356 N ASP B 54 -10.343 14.030 -7.930 1.00 0.00 N ATOM 2357 CA ASP B 54 -11.467 14.033 -8.906 1.00 0.00 C ATOM 2358 C ASP B 54 -11.243 12.940 -9.954 1.00 0.00 C ATOM 2359 O ASP B 54 -12.150 12.216 -10.311 1.00 0.00 O ATOM 2360 CB ASP B 54 -11.537 15.396 -9.598 1.00 0.00 C ATOM 2361 CG ASP B 54 -11.898 16.472 -8.573 1.00 0.00 C ATOM 2362 OD1 ASP B 54 -12.314 16.110 -7.485 1.00 0.00 O ATOM 2363 OD2 ASP B 54 -11.754 17.640 -8.894 1.00 0.00 O ATOM 0 H ASP B 54 -9.833 14.910 -7.854 1.00 0.00 H new ATOM 0 HA ASP B 54 -12.402 13.842 -8.380 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -10.579 15.629 -10.063 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -12.281 15.373 -10.394 1.00 0.00 H new ATOM 2368 N LYS B 55 -10.044 12.822 -10.460 1.00 0.00 N ATOM 2369 CA LYS B 55 -9.775 11.783 -11.496 1.00 0.00 C ATOM 2370 C LYS B 55 -9.843 10.391 -10.865 1.00 0.00 C ATOM 2371 O LYS B 55 -10.162 9.425 -11.528 1.00 0.00 O ATOM 2372 CB LYS B 55 -8.399 12.010 -12.119 1.00 0.00 C ATOM 2373 CG LYS B 55 -8.431 13.271 -12.985 1.00 0.00 C ATOM 2374 CD LYS B 55 -7.044 13.517 -13.583 1.00 0.00 C ATOM 2375 CE LYS B 55 -7.112 14.686 -14.567 1.00 0.00 C ATOM 2376 NZ LYS B 55 -8.142 14.401 -15.606 1.00 0.00 N ATOM 0 H LYS B 55 -9.242 13.398 -10.202 1.00 0.00 H new ATOM 0 HA LYS B 55 -10.531 11.855 -12.278 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -7.647 12.112 -11.337 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -8.115 11.148 -12.723 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -9.167 13.159 -13.781 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -8.737 14.128 -12.386 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -6.328 13.736 -12.791 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -6.691 12.620 -14.092 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -7.358 15.607 -14.038 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -6.140 14.838 -15.036 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -7.825 14.778 -16.522 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -8.281 13.373 -15.684 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -9.040 14.852 -15.338 1.00 0.00 H new ATOM 2390 N VAL B 56 -9.587 10.271 -9.591 1.00 0.00 N ATOM 2391 CA VAL B 56 -9.685 8.934 -8.941 1.00 0.00 C ATOM 2392 C VAL B 56 -11.146 8.486 -8.974 1.00 0.00 C ATOM 2393 O VAL B 56 -11.473 7.438 -9.494 1.00 0.00 O ATOM 2394 CB VAL B 56 -9.218 9.041 -7.488 1.00 0.00 C ATOM 2395 CG1 VAL B 56 -9.467 7.713 -6.770 1.00 0.00 C ATOM 2396 CG2 VAL B 56 -7.721 9.361 -7.460 1.00 0.00 C ATOM 0 H VAL B 56 -9.315 11.037 -8.975 1.00 0.00 H new ATOM 0 HA VAL B 56 -9.059 8.213 -9.467 1.00 0.00 H new ATOM 0 HB VAL B 56 -9.772 9.834 -6.985 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -9.134 7.791 -5.735 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -10.532 7.482 -6.792 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -8.913 6.919 -7.271 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -7.385 9.438 -6.426 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -7.170 8.566 -7.963 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -7.541 10.307 -7.971 1.00 0.00 H new ATOM 2406 N MET B 57 -12.029 9.270 -8.419 1.00 0.00 N ATOM 2407 CA MET B 57 -13.467 8.885 -8.416 1.00 0.00 C ATOM 2408 C MET B 57 -13.916 8.552 -9.840 1.00 0.00 C ATOM 2409 O MET B 57 -14.827 7.774 -10.043 1.00 0.00 O ATOM 2410 CB MET B 57 -14.307 10.041 -7.869 1.00 0.00 C ATOM 2411 CG MET B 57 -14.039 10.205 -6.370 1.00 0.00 C ATOM 2412 SD MET B 57 -14.906 8.904 -5.457 1.00 0.00 S ATOM 2413 CE MET B 57 -15.009 9.770 -3.871 1.00 0.00 C ATOM 0 H MET B 57 -11.816 10.160 -7.968 1.00 0.00 H new ATOM 0 HA MET B 57 -13.603 8.008 -7.783 1.00 0.00 H new ATOM 0 HB2 MET B 57 -14.062 10.963 -8.396 1.00 0.00 H new ATOM 0 HB3 MET B 57 -15.366 9.848 -8.041 1.00 0.00 H new ATOM 0 HG2 MET B 57 -12.968 10.151 -6.173 1.00 0.00 H new ATOM 0 HG3 MET B 57 -14.376 11.186 -6.035 1.00 0.00 H new ATOM 0 HE1 MET B 57 -15.518 9.138 -3.144 1.00 0.00 H new ATOM 0 HE2 MET B 57 -14.004 9.997 -3.514 1.00 0.00 H new ATOM 0 HE3 MET B 57 -15.567 10.698 -3.999 1.00 0.00 H new ATOM 2423 N GLU B 58 -13.267 9.106 -10.833 1.00 0.00 N ATOM 2424 CA GLU B 58 -13.641 8.785 -12.243 1.00 0.00 C ATOM 2425 C GLU B 58 -12.898 7.521 -12.676 1.00 0.00 C ATOM 2426 O GLU B 58 -13.416 6.720 -13.429 1.00 0.00 O ATOM 2427 CB GLU B 58 -13.296 9.953 -13.168 1.00 0.00 C ATOM 2428 CG GLU B 58 -13.993 9.760 -14.516 1.00 0.00 C ATOM 2429 CD GLU B 58 -15.493 10.012 -14.357 1.00 0.00 C ATOM 2430 OE1 GLU B 58 -15.878 11.169 -14.315 1.00 0.00 O ATOM 2431 OE2 GLU B 58 -16.231 9.044 -14.280 1.00 0.00 O ATOM 0 H GLU B 58 -12.496 9.765 -10.728 1.00 0.00 H new ATOM 0 HA GLU B 58 -14.716 8.615 -12.305 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -13.610 10.894 -12.716 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -12.217 10.012 -13.310 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -13.575 10.444 -15.254 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -13.821 8.749 -14.885 1.00 0.00 H new ATOM 2438 N THR B 59 -11.702 7.314 -12.199 1.00 0.00 N ATOM 2439 CA THR B 59 -10.970 6.078 -12.588 1.00 0.00 C ATOM 2440 C THR B 59 -11.690 4.884 -11.959 1.00 0.00 C ATOM 2441 O THR B 59 -11.986 3.916 -12.631 1.00 0.00 O ATOM 2442 CB THR B 59 -9.514 6.148 -12.111 1.00 0.00 C ATOM 2443 OG1 THR B 59 -9.034 7.476 -12.264 1.00 0.00 O ATOM 2444 CG2 THR B 59 -8.650 5.194 -12.941 1.00 0.00 C ATOM 0 H THR B 59 -11.205 7.939 -11.564 1.00 0.00 H new ATOM 0 HA THR B 59 -10.955 5.973 -13.673 1.00 0.00 H new ATOM 0 HB THR B 59 -9.462 5.857 -11.062 1.00 0.00 H new ATOM 0 HG1 THR B 59 -9.340 8.023 -11.511 1.00 0.00 H new ATOM 0 HG21 THR B 59 -7.617 5.248 -12.598 1.00 0.00 H new ATOM 0 HG22 THR B 59 -9.019 4.175 -12.825 1.00 0.00 H new ATOM 0 HG23 THR B 59 -8.699 5.480 -13.992 1.00 0.00 H new ATOM 2452 N LEU B 60 -12.019 4.944 -10.700 1.00 0.00 N ATOM 2453 CA LEU B 60 -12.762 3.809 -10.089 1.00 0.00 C ATOM 2454 C LEU B 60 -14.076 3.628 -10.849 1.00 0.00 C ATOM 2455 O LEU B 60 -14.353 2.571 -11.380 1.00 0.00 O ATOM 2456 CB LEU B 60 -13.069 4.124 -8.622 1.00 0.00 C ATOM 2457 CG LEU B 60 -11.784 4.529 -7.893 1.00 0.00 C ATOM 2458 CD1 LEU B 60 -12.127 4.959 -6.464 1.00 0.00 C ATOM 2459 CD2 LEU B 60 -10.814 3.340 -7.850 1.00 0.00 C ATOM 0 H LEU B 60 -11.808 5.721 -10.073 1.00 0.00 H new ATOM 0 HA LEU B 60 -12.163 2.900 -10.143 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -13.801 4.929 -8.560 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -13.512 3.253 -8.139 1.00 0.00 H new ATOM 0 HG LEU B 60 -11.313 5.357 -8.423 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -11.215 5.248 -5.942 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -12.812 5.806 -6.494 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -12.599 4.129 -5.938 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -9.902 3.633 -7.331 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -11.281 2.508 -7.322 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -10.570 3.033 -8.867 1.00 0.00 H new ATOM 2471 N ASP B 61 -14.886 4.651 -10.916 1.00 0.00 N ATOM 2472 CA ASP B 61 -16.173 4.525 -11.653 1.00 0.00 C ATOM 2473 C ASP B 61 -15.898 3.961 -13.047 1.00 0.00 C ATOM 2474 O ASP B 61 -16.770 3.408 -13.687 1.00 0.00 O ATOM 2475 CB ASP B 61 -16.829 5.902 -11.778 1.00 0.00 C ATOM 2476 CG ASP B 61 -17.317 6.363 -10.404 1.00 0.00 C ATOM 2477 OD1 ASP B 61 -16.597 6.154 -9.441 1.00 0.00 O ATOM 2478 OD2 ASP B 61 -18.401 6.918 -10.338 1.00 0.00 O ATOM 0 H ASP B 61 -14.712 5.563 -10.494 1.00 0.00 H new ATOM 0 HA ASP B 61 -16.842 3.856 -11.112 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -16.116 6.621 -12.182 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -17.665 5.856 -12.476 1.00 0.00 H new ATOM 2483 N GLU B 62 -14.683 4.096 -13.522 1.00 0.00 N ATOM 2484 CA GLU B 62 -14.329 3.568 -14.877 1.00 0.00 C ATOM 2485 C GLU B 62 -13.550 2.272 -14.727 1.00 0.00 C ATOM 2486 O GLU B 62 -12.576 2.018 -15.409 1.00 0.00 O ATOM 2487 CB GLU B 62 -13.464 4.569 -15.593 1.00 0.00 C ATOM 2488 CG GLU B 62 -14.301 5.779 -16.015 1.00 0.00 C ATOM 2489 CD GLU B 62 -15.244 5.378 -17.151 1.00 0.00 C ATOM 2490 OE1 GLU B 62 -14.783 5.302 -18.278 1.00 0.00 O ATOM 2491 OE2 GLU B 62 -16.411 5.153 -16.875 1.00 0.00 O ATOM 0 H GLU B 62 -13.917 4.552 -13.026 1.00 0.00 H new ATOM 0 HA GLU B 62 -15.243 3.391 -15.444 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -12.650 4.889 -14.943 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -13.009 4.108 -16.470 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -14.875 6.151 -15.166 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -13.649 6.590 -16.339 1.00 0.00 H new ATOM 2498 N ASP B 63 -13.988 1.471 -13.836 1.00 0.00 N ATOM 2499 CA ASP B 63 -13.324 0.157 -13.572 1.00 0.00 C ATOM 2500 C ASP B 63 -12.991 -0.517 -14.906 1.00 0.00 C ATOM 2501 O ASP B 63 -11.959 -1.140 -15.064 1.00 0.00 O ATOM 2502 CB ASP B 63 -14.312 -0.730 -12.813 1.00 0.00 C ATOM 2503 CG ASP B 63 -13.589 -1.968 -12.284 1.00 0.00 C ATOM 2504 OD1 ASP B 63 -12.434 -1.842 -11.913 1.00 0.00 O ATOM 2505 OD2 ASP B 63 -14.204 -3.022 -12.257 1.00 0.00 O ATOM 0 H ASP B 63 -14.802 1.658 -13.251 1.00 0.00 H new ATOM 0 HA ASP B 63 -12.411 0.305 -12.995 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -14.754 -0.174 -11.986 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -15.129 -1.027 -13.471 1.00 0.00 H new ATOM 2510 N GLY B 64 -13.850 -0.350 -15.869 1.00 0.00 N ATOM 2511 CA GLY B 64 -13.623 -0.927 -17.228 1.00 0.00 C ATOM 2512 C GLY B 64 -13.309 -2.434 -17.183 1.00 0.00 C ATOM 2513 O GLY B 64 -13.293 -3.082 -18.212 1.00 0.00 O ATOM 0 H GLY B 64 -14.720 0.173 -15.773 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -14.508 -0.762 -17.842 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -12.798 -0.401 -17.709 1.00 0.00 H new ATOM 2517 N ASP B 65 -13.056 -3.006 -16.026 1.00 0.00 N ATOM 2518 CA ASP B 65 -12.741 -4.483 -15.962 1.00 0.00 C ATOM 2519 C ASP B 65 -13.913 -5.309 -15.370 1.00 0.00 C ATOM 2520 O ASP B 65 -14.088 -6.450 -15.749 1.00 0.00 O ATOM 2521 CB ASP B 65 -11.511 -4.685 -15.077 1.00 0.00 C ATOM 2522 CG ASP B 65 -11.717 -3.966 -13.743 1.00 0.00 C ATOM 2523 OD1 ASP B 65 -12.468 -4.476 -12.929 1.00 0.00 O ATOM 2524 OD2 ASP B 65 -11.119 -2.919 -13.559 1.00 0.00 O ATOM 0 H ASP B 65 -13.053 -2.523 -15.128 1.00 0.00 H new ATOM 0 HA ASP B 65 -12.564 -4.830 -16.980 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -11.343 -5.748 -14.907 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -10.623 -4.298 -15.577 1.00 0.00 H new ATOM 2529 N GLY B 66 -14.715 -4.787 -14.463 1.00 0.00 N ATOM 2530 CA GLY B 66 -15.845 -5.590 -13.896 1.00 0.00 C ATOM 2531 C GLY B 66 -15.476 -6.069 -12.487 1.00 0.00 C ATOM 2532 O GLY B 66 -16.336 -6.314 -11.665 1.00 0.00 O ATOM 0 H GLY B 66 -14.632 -3.840 -14.094 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -16.752 -4.986 -13.860 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -16.056 -6.445 -14.539 1.00 0.00 H new ATOM 2536 N GLU B 67 -14.204 -6.197 -12.192 1.00 0.00 N ATOM 2537 CA GLU B 67 -13.800 -6.650 -10.822 1.00 0.00 C ATOM 2538 C GLU B 67 -12.439 -6.053 -10.444 1.00 0.00 C ATOM 2539 O GLU B 67 -11.486 -6.151 -11.191 1.00 0.00 O ATOM 2540 CB GLU B 67 -13.704 -8.178 -10.800 1.00 0.00 C ATOM 2541 CG GLU B 67 -15.106 -8.787 -10.882 1.00 0.00 C ATOM 2542 CD GLU B 67 -15.020 -10.295 -10.635 1.00 0.00 C ATOM 2543 OE1 GLU B 67 -14.431 -10.977 -11.458 1.00 0.00 O ATOM 2544 OE2 GLU B 67 -15.543 -10.742 -9.628 1.00 0.00 O ATOM 0 H GLU B 67 -13.434 -6.009 -12.834 1.00 0.00 H new ATOM 0 HA GLU B 67 -14.548 -6.313 -10.104 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -13.097 -8.525 -11.636 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -13.207 -8.507 -9.887 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -15.760 -8.323 -10.144 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -15.543 -8.592 -11.862 1.00 0.00 H new ATOM 2551 N CYS B 68 -12.334 -5.452 -9.281 1.00 0.00 N ATOM 2552 CA CYS B 68 -11.026 -4.864 -8.838 1.00 0.00 C ATOM 2553 C CYS B 68 -10.407 -5.778 -7.772 1.00 0.00 C ATOM 2554 O CYS B 68 -11.040 -6.120 -6.793 1.00 0.00 O ATOM 2555 CB CYS B 68 -11.265 -3.466 -8.252 1.00 0.00 C ATOM 2556 SG CYS B 68 -12.524 -2.609 -9.230 1.00 0.00 S ATOM 0 H CYS B 68 -13.100 -5.343 -8.617 1.00 0.00 H new ATOM 0 HA CYS B 68 -10.348 -4.781 -9.687 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -11.587 -3.545 -7.214 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -10.336 -2.895 -8.255 1.00 0.00 H new ATOM 0 HG CYS B 68 -12.073 -2.400 -10.431 1.00 0.00 H new ATOM 2562 N ASP B 69 -9.179 -6.186 -7.960 1.00 0.00 N ATOM 2563 CA ASP B 69 -8.526 -7.091 -6.965 1.00 0.00 C ATOM 2564 C ASP B 69 -7.947 -6.272 -5.806 1.00 0.00 C ATOM 2565 O ASP B 69 -8.136 -5.075 -5.721 1.00 0.00 O ATOM 2566 CB ASP B 69 -7.397 -7.865 -7.650 1.00 0.00 C ATOM 2567 CG ASP B 69 -6.955 -9.027 -6.757 1.00 0.00 C ATOM 2568 OD1 ASP B 69 -7.790 -9.546 -6.035 1.00 0.00 O ATOM 2569 OD2 ASP B 69 -5.788 -9.379 -6.811 1.00 0.00 O ATOM 0 H ASP B 69 -8.599 -5.932 -8.760 1.00 0.00 H new ATOM 0 HA ASP B 69 -9.269 -7.786 -6.574 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -7.735 -8.243 -8.615 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -6.554 -7.202 -7.845 1.00 0.00 H new ATOM 2574 N PHE B 70 -7.229 -6.913 -4.920 1.00 0.00 N ATOM 2575 CA PHE B 70 -6.620 -6.177 -3.773 1.00 0.00 C ATOM 2576 C PHE B 70 -5.429 -5.368 -4.289 1.00 0.00 C ATOM 2577 O PHE B 70 -5.080 -4.343 -3.738 1.00 0.00 O ATOM 2578 CB PHE B 70 -6.156 -7.179 -2.711 1.00 0.00 C ATOM 2579 CG PHE B 70 -5.624 -6.449 -1.497 1.00 0.00 C ATOM 2580 CD1 PHE B 70 -4.331 -5.907 -1.512 1.00 0.00 C ATOM 2581 CD2 PHE B 70 -6.419 -6.325 -0.352 1.00 0.00 C ATOM 2582 CE1 PHE B 70 -3.838 -5.241 -0.382 1.00 0.00 C ATOM 2583 CE2 PHE B 70 -5.927 -5.659 0.776 1.00 0.00 C ATOM 2584 CZ PHE B 70 -4.637 -5.117 0.762 1.00 0.00 C ATOM 0 H PHE B 70 -7.038 -7.915 -4.942 1.00 0.00 H new ATOM 0 HA PHE B 70 -7.352 -5.505 -3.325 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -6.986 -7.823 -2.422 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -5.381 -7.824 -3.124 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.715 -6.003 -2.394 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -7.414 -6.744 -0.339 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.842 -4.823 -0.393 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -6.543 -5.563 1.658 1.00 0.00 H new ATOM 0 HZ PHE B 70 -4.257 -4.603 1.633 1.00 0.00 H new ATOM 2594 N GLN B 71 -4.813 -5.806 -5.351 1.00 0.00 N ATOM 2595 CA GLN B 71 -3.659 -5.044 -5.905 1.00 0.00 C ATOM 2596 C GLN B 71 -4.160 -3.690 -6.412 1.00 0.00 C ATOM 2597 O GLN B 71 -3.540 -2.668 -6.193 1.00 0.00 O ATOM 2598 CB GLN B 71 -3.044 -5.822 -7.070 1.00 0.00 C ATOM 2599 CG GLN B 71 -2.477 -7.148 -6.561 1.00 0.00 C ATOM 2600 CD GLN B 71 -1.739 -7.856 -7.698 1.00 0.00 C ATOM 2601 OE1 GLN B 71 -1.976 -9.018 -7.962 1.00 0.00 O ATOM 2602 NE2 GLN B 71 -0.847 -7.199 -8.390 1.00 0.00 N ATOM 0 H GLN B 71 -5.058 -6.656 -5.858 1.00 0.00 H new ATOM 0 HA GLN B 71 -2.906 -4.899 -5.130 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -3.798 -6.007 -7.835 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -2.255 -5.233 -7.537 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -1.798 -6.969 -5.728 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -3.282 -7.780 -6.186 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -0.647 -6.223 -8.169 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -0.350 -7.662 -9.151 1.00 0.00 H new ATOM 2611 N GLU B 72 -5.280 -3.672 -7.078 1.00 0.00 N ATOM 2612 CA GLU B 72 -5.820 -2.380 -7.587 1.00 0.00 C ATOM 2613 C GLU B 72 -6.257 -1.515 -6.402 1.00 0.00 C ATOM 2614 O GLU B 72 -6.265 -0.304 -6.470 1.00 0.00 O ATOM 2615 CB GLU B 72 -7.012 -2.643 -8.509 1.00 0.00 C ATOM 2616 CG GLU B 72 -6.518 -3.260 -9.819 1.00 0.00 C ATOM 2617 CD GLU B 72 -7.700 -3.464 -10.767 1.00 0.00 C ATOM 2618 OE1 GLU B 72 -8.247 -2.473 -11.223 1.00 0.00 O ATOM 2619 OE2 GLU B 72 -8.038 -4.608 -11.023 1.00 0.00 O ATOM 0 H GLU B 72 -5.844 -4.494 -7.292 1.00 0.00 H new ATOM 0 HA GLU B 72 -5.047 -1.858 -8.152 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -7.720 -3.314 -8.023 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -7.542 -1.712 -8.710 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -5.776 -2.610 -10.282 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -6.028 -4.214 -9.622 1.00 0.00 H new ATOM 2626 N PHE B 73 -6.574 -2.136 -5.299 1.00 0.00 N ATOM 2627 CA PHE B 73 -6.968 -1.368 -4.081 1.00 0.00 C ATOM 2628 C PHE B 73 -5.710 -0.782 -3.439 1.00 0.00 C ATOM 2629 O PHE B 73 -5.713 0.345 -2.986 1.00 0.00 O ATOM 2630 CB PHE B 73 -7.706 -2.289 -3.101 1.00 0.00 C ATOM 2631 CG PHE B 73 -7.870 -1.611 -1.756 1.00 0.00 C ATOM 2632 CD1 PHE B 73 -8.553 -0.392 -1.665 1.00 0.00 C ATOM 2633 CD2 PHE B 73 -7.348 -2.206 -0.598 1.00 0.00 C ATOM 2634 CE1 PHE B 73 -8.714 0.231 -0.421 1.00 0.00 C ATOM 2635 CE2 PHE B 73 -7.510 -1.583 0.645 1.00 0.00 C ATOM 2636 CZ PHE B 73 -8.193 -0.365 0.734 1.00 0.00 C ATOM 0 H PHE B 73 -6.577 -3.150 -5.187 1.00 0.00 H new ATOM 0 HA PHE B 73 -7.641 -0.554 -4.351 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -8.684 -2.550 -3.505 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -7.152 -3.220 -2.980 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -8.956 0.068 -2.555 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -6.820 -3.146 -0.665 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -9.240 1.172 -0.353 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -7.108 -2.043 1.536 1.00 0.00 H new ATOM 0 HZ PHE B 73 -8.318 0.115 1.693 1.00 0.00 H new ATOM 2646 N MET B 74 -4.632 -1.505 -3.400 1.00 0.00 N ATOM 2647 CA MET B 74 -3.407 -0.923 -2.788 1.00 0.00 C ATOM 2648 C MET B 74 -2.879 0.188 -3.701 1.00 0.00 C ATOM 2649 O MET B 74 -2.273 1.132 -3.234 1.00 0.00 O ATOM 2650 CB MET B 74 -2.340 -2.003 -2.603 1.00 0.00 C ATOM 2651 CG MET B 74 -1.272 -1.504 -1.624 1.00 0.00 C ATOM 2652 SD MET B 74 -1.976 -1.411 0.047 1.00 0.00 S ATOM 2653 CE MET B 74 -1.878 0.386 0.277 1.00 0.00 C ATOM 0 H MET B 74 -4.543 -2.456 -3.757 1.00 0.00 H new ATOM 0 HA MET B 74 -3.649 -0.512 -1.808 1.00 0.00 H new ATOM 0 HB2 MET B 74 -2.796 -2.918 -2.225 1.00 0.00 H new ATOM 0 HB3 MET B 74 -1.884 -2.247 -3.562 1.00 0.00 H new ATOM 0 HG2 MET B 74 -0.414 -2.177 -1.632 1.00 0.00 H new ATOM 0 HG3 MET B 74 -0.911 -0.523 -1.933 1.00 0.00 H new ATOM 0 HE1 MET B 74 -2.628 0.701 1.002 1.00 0.00 H new ATOM 0 HE2 MET B 74 -0.886 0.653 0.642 1.00 0.00 H new ATOM 0 HE3 MET B 74 -2.061 0.885 -0.675 1.00 0.00 H new ATOM 2663 N ALA B 75 -3.115 0.123 -4.983 1.00 0.00 N ATOM 2664 CA ALA B 75 -2.639 1.213 -5.884 1.00 0.00 C ATOM 2665 C ALA B 75 -3.573 2.425 -5.778 1.00 0.00 C ATOM 2666 O ALA B 75 -3.120 3.547 -5.663 1.00 0.00 O ATOM 2667 CB ALA B 75 -2.630 0.705 -7.328 1.00 0.00 C ATOM 0 H ALA B 75 -3.616 -0.636 -5.446 1.00 0.00 H new ATOM 0 HA ALA B 75 -1.633 1.510 -5.589 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -2.283 1.498 -7.990 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -1.962 -0.153 -7.408 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -3.639 0.408 -7.615 1.00 0.00 H new ATOM 2673 N PHE B 76 -4.864 2.231 -5.814 1.00 0.00 N ATOM 2674 CA PHE B 76 -5.778 3.408 -5.712 1.00 0.00 C ATOM 2675 C PHE B 76 -5.649 4.022 -4.312 1.00 0.00 C ATOM 2676 O PHE B 76 -5.771 5.218 -4.134 1.00 0.00 O ATOM 2677 CB PHE B 76 -7.239 2.977 -5.963 1.00 0.00 C ATOM 2678 CG PHE B 76 -7.520 2.910 -7.457 1.00 0.00 C ATOM 2679 CD1 PHE B 76 -7.375 4.055 -8.257 1.00 0.00 C ATOM 2680 CD2 PHE B 76 -7.921 1.700 -8.044 1.00 0.00 C ATOM 2681 CE1 PHE B 76 -7.628 3.985 -9.632 1.00 0.00 C ATOM 2682 CE2 PHE B 76 -8.175 1.635 -9.419 1.00 0.00 C ATOM 2683 CZ PHE B 76 -8.027 2.776 -10.212 1.00 0.00 C ATOM 0 H PHE B 76 -5.321 1.324 -5.908 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.501 4.145 -6.466 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.422 2.004 -5.508 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.920 3.684 -5.489 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -7.068 4.990 -7.811 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -8.034 0.817 -7.433 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -7.515 4.866 -10.246 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -8.485 0.703 -9.867 1.00 0.00 H new ATOM 0 HZ PHE B 76 -8.221 2.725 -11.273 1.00 0.00 H new ATOM 2693 N VAL B 77 -5.394 3.213 -3.322 1.00 0.00 N ATOM 2694 CA VAL B 77 -5.245 3.752 -1.938 1.00 0.00 C ATOM 2695 C VAL B 77 -4.042 4.702 -1.903 1.00 0.00 C ATOM 2696 O VAL B 77 -4.046 5.696 -1.203 1.00 0.00 O ATOM 2697 CB VAL B 77 -5.028 2.582 -0.961 1.00 0.00 C ATOM 2698 CG1 VAL B 77 -4.459 3.089 0.373 1.00 0.00 C ATOM 2699 CG2 VAL B 77 -6.366 1.877 -0.702 1.00 0.00 C ATOM 0 H VAL B 77 -5.282 2.203 -3.409 1.00 0.00 H new ATOM 0 HA VAL B 77 -6.142 4.297 -1.645 1.00 0.00 H new ATOM 0 HB VAL B 77 -4.318 1.885 -1.406 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -4.313 2.247 1.050 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -3.504 3.583 0.197 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -5.156 3.797 0.820 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -6.213 1.049 -0.010 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -7.073 2.585 -0.269 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -6.764 1.496 -1.642 1.00 0.00 H new ATOM 2709 N SER B 78 -3.016 4.408 -2.650 1.00 0.00 N ATOM 2710 CA SER B 78 -1.822 5.299 -2.655 1.00 0.00 C ATOM 2711 C SER B 78 -2.175 6.621 -3.344 1.00 0.00 C ATOM 2712 O SER B 78 -1.940 7.690 -2.816 1.00 0.00 O ATOM 2713 CB SER B 78 -0.681 4.615 -3.411 1.00 0.00 C ATOM 2714 OG SER B 78 0.261 5.596 -3.826 1.00 0.00 O ATOM 0 H SER B 78 -2.952 3.591 -3.257 1.00 0.00 H new ATOM 0 HA SER B 78 -1.510 5.498 -1.630 1.00 0.00 H new ATOM 0 HB2 SER B 78 -0.197 3.877 -2.772 1.00 0.00 H new ATOM 0 HB3 SER B 78 -1.072 4.080 -4.277 1.00 0.00 H new ATOM 0 HG SER B 78 0.994 5.161 -4.309 1.00 0.00 H new ATOM 2720 N MET B 79 -2.720 6.555 -4.528 1.00 0.00 N ATOM 2721 CA MET B 79 -3.072 7.803 -5.267 1.00 0.00 C ATOM 2722 C MET B 79 -3.871 8.752 -4.370 1.00 0.00 C ATOM 2723 O MET B 79 -3.692 9.953 -4.409 1.00 0.00 O ATOM 2724 CB MET B 79 -3.914 7.440 -6.492 1.00 0.00 C ATOM 2725 CG MET B 79 -3.029 6.754 -7.534 1.00 0.00 C ATOM 2726 SD MET B 79 -4.011 6.385 -9.011 1.00 0.00 S ATOM 2727 CE MET B 79 -3.572 7.860 -9.964 1.00 0.00 C ATOM 0 H MET B 79 -2.938 5.687 -5.018 1.00 0.00 H new ATOM 0 HA MET B 79 -2.153 8.301 -5.575 1.00 0.00 H new ATOM 0 HB2 MET B 79 -4.731 6.780 -6.202 1.00 0.00 H new ATOM 0 HB3 MET B 79 -4.364 8.338 -6.916 1.00 0.00 H new ATOM 0 HG2 MET B 79 -2.189 7.398 -7.794 1.00 0.00 H new ATOM 0 HG3 MET B 79 -2.611 5.835 -7.123 1.00 0.00 H new ATOM 0 HE1 MET B 79 -4.079 7.834 -10.929 1.00 0.00 H new ATOM 0 HE2 MET B 79 -3.879 8.751 -9.417 1.00 0.00 H new ATOM 0 HE3 MET B 79 -2.494 7.884 -10.121 1.00 0.00 H new ATOM 2737 N VAL B 80 -4.752 8.230 -3.563 1.00 0.00 N ATOM 2738 CA VAL B 80 -5.556 9.118 -2.672 1.00 0.00 C ATOM 2739 C VAL B 80 -4.677 9.632 -1.532 1.00 0.00 C ATOM 2740 O VAL B 80 -4.684 10.806 -1.216 1.00 0.00 O ATOM 2741 CB VAL B 80 -6.735 8.333 -2.089 1.00 0.00 C ATOM 2742 CG1 VAL B 80 -7.532 9.236 -1.145 1.00 0.00 C ATOM 2743 CG2 VAL B 80 -7.647 7.857 -3.223 1.00 0.00 C ATOM 0 H VAL B 80 -4.951 7.233 -3.480 1.00 0.00 H new ATOM 0 HA VAL B 80 -5.932 9.961 -3.251 1.00 0.00 H new ATOM 0 HB VAL B 80 -6.357 7.471 -1.540 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -8.371 8.678 -0.730 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -6.886 9.576 -0.335 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -7.907 10.098 -1.697 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -8.485 7.299 -2.806 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -8.023 8.719 -3.773 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -7.083 7.214 -3.898 1.00 0.00 H new ATOM 2753 N THR B 81 -3.907 8.778 -0.920 1.00 0.00 N ATOM 2754 CA THR B 81 -3.022 9.245 0.183 1.00 0.00 C ATOM 2755 C THR B 81 -1.914 10.120 -0.408 1.00 0.00 C ATOM 2756 O THR B 81 -1.558 11.145 0.137 1.00 0.00 O ATOM 2757 CB THR B 81 -2.401 8.038 0.891 1.00 0.00 C ATOM 2758 OG1 THR B 81 -3.411 7.074 1.153 1.00 0.00 O ATOM 2759 CG2 THR B 81 -1.769 8.489 2.209 1.00 0.00 C ATOM 0 H THR B 81 -3.851 7.782 -1.134 1.00 0.00 H new ATOM 0 HA THR B 81 -3.603 9.820 0.904 1.00 0.00 H new ATOM 0 HB THR B 81 -1.634 7.597 0.255 1.00 0.00 H new ATOM 0 HG1 THR B 81 -3.562 6.532 0.350 1.00 0.00 H new ATOM 0 HG21 THR B 81 -1.327 7.630 2.713 1.00 0.00 H new ATOM 0 HG22 THR B 81 -0.995 9.229 2.007 1.00 0.00 H new ATOM 0 HG23 THR B 81 -2.535 8.930 2.847 1.00 0.00 H new ATOM 2767 N THR B 82 -1.369 9.718 -1.524 1.00 0.00 N ATOM 2768 CA THR B 82 -0.284 10.515 -2.163 1.00 0.00 C ATOM 2769 C THR B 82 -0.871 11.772 -2.814 1.00 0.00 C ATOM 2770 O THR B 82 -0.180 12.750 -3.024 1.00 0.00 O ATOM 2771 CB THR B 82 0.414 9.667 -3.229 1.00 0.00 C ATOM 2772 OG1 THR B 82 -0.553 9.167 -4.140 1.00 0.00 O ATOM 2773 CG2 THR B 82 1.140 8.499 -2.559 1.00 0.00 C ATOM 0 H THR B 82 -1.630 8.867 -2.023 1.00 0.00 H new ATOM 0 HA THR B 82 0.437 10.811 -1.401 1.00 0.00 H new ATOM 0 HB THR B 82 1.137 10.280 -3.767 1.00 0.00 H new ATOM 0 HG1 THR B 82 -1.358 8.899 -3.649 1.00 0.00 H new ATOM 0 HG21 THR B 82 1.637 7.896 -3.319 1.00 0.00 H new ATOM 0 HG22 THR B 82 1.882 8.885 -1.860 1.00 0.00 H new ATOM 0 HG23 THR B 82 0.419 7.883 -2.021 1.00 0.00 H new ATOM 2781 N ALA B 83 -2.138 11.762 -3.134 1.00 0.00 N ATOM 2782 CA ALA B 83 -2.749 12.967 -3.765 1.00 0.00 C ATOM 2783 C ALA B 83 -2.555 14.164 -2.834 1.00 0.00 C ATOM 2784 O ALA B 83 -2.564 15.303 -3.256 1.00 0.00 O ATOM 2785 CB ALA B 83 -4.247 12.728 -3.999 1.00 0.00 C ATOM 0 H ALA B 83 -2.772 10.977 -2.987 1.00 0.00 H new ATOM 0 HA ALA B 83 -2.270 13.164 -4.724 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -4.689 13.611 -4.460 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -4.380 11.870 -4.658 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -4.738 12.533 -3.045 1.00 0.00 H new