USER MOD reduce.3.24.130724 H: found=0, std=0, add=680, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 679 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 45 LYS NZ :NH3+ -102:sc= 2.02 (180deg=-0.459) USER MOD Set 1.2: A 59 MET CE :methyl 166:sc= -0.0021 (180deg=-0.162) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -123:sc= 2.37 (180deg=-0.928) USER MOD Single : A 25 LYS NZ :NH3+ -157:sc= 1.28 (180deg=1.19) USER MOD Single : A 29 GLN : amide:sc= -0.359 X(o=-0.36,f=-0.16) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -170:sc= 0.041 USER MOD Single : A 35 HIS : no HD1:sc= -2.69 K(o=-2.7,f=-7.7!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl -133:sc= 0 (180deg=-1.83!) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 46 LYS NZ :NH3+ -175:sc= 1.27 (180deg=1.21) USER MOD Single : A 48 LYS NZ :NH3+ 163:sc= 2.33 (180deg=2.16) USER MOD Single : A 50 SER OG : rot 104:sc= 1.23 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 CYS SG : rot 52:sc= 1.19 USER MOD Single : A 53 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 55 GLN : amide:sc= -0.199 X(o=-0.2,f=-0.23) USER MOD Single : A 60 ASN : amide:sc= -0.123 X(o=-0.12,f=0) USER MOD Single : A 61 SER OG : rot -114:sc= 1.28 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 74 ASN : amide:sc= -0.0534 X(o=-0.053,f=-0.43) USER MOD Single : A 75 HIS : no HD1:sc= 1.02 K(o=1,f=-6.6!) USER MOD Single : A 76 THR OG1 : rot 74:sc= 1.29 USER MOD Single : A 78 LYS NZ :NH3+ 165:sc= -0.0383 (180deg=-0.252) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 178:sc= 1.28 USER MOD Single : A 92 GLN : amide:sc= 0.568 K(o=0.57,f=0) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.123 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 21 13.449 -5.799 -2.237 1.00 10.00 N ATOM 2 CA TYR A 21 12.440 -4.754 -1.963 1.00 10.00 C ATOM 3 C TYR A 21 11.580 -5.165 -0.778 1.00 10.00 C ATOM 4 O TYR A 21 11.584 -6.333 -0.383 1.00 10.00 O ATOM 5 CB TYR A 21 11.566 -4.523 -3.196 1.00 10.00 C ATOM 6 CG TYR A 21 12.315 -3.955 -4.385 1.00 10.00 C ATOM 7 CD1 TYR A 21 12.852 -2.673 -4.348 1.00 10.00 C ATOM 8 CD2 TYR A 21 12.478 -4.698 -5.547 1.00 10.00 C ATOM 9 CE1 TYR A 21 13.527 -2.150 -5.436 1.00 10.00 C ATOM 10 CE2 TYR A 21 13.154 -4.183 -6.639 1.00 10.00 C ATOM 11 CZ TYR A 21 13.674 -2.910 -6.578 1.00 10.00 C ATOM 12 OH TYR A 21 14.342 -2.389 -7.665 1.00 10.00 O ATOM 0 HA TYR A 21 12.953 -3.822 -1.723 1.00 10.00 H new ATOM 0 HB2 TYR A 21 11.108 -5.469 -3.486 1.00 10.00 H new ATOM 0 HB3 TYR A 21 10.755 -3.844 -2.932 1.00 10.00 H new ATOM 0 HD1 TYR A 21 12.740 -2.076 -3.455 1.00 10.00 H new ATOM 0 HD2 TYR A 21 12.069 -5.696 -5.599 1.00 10.00 H new ATOM 0 HE1 TYR A 21 13.937 -1.152 -5.392 1.00 10.00 H new ATOM 0 HE2 TYR A 21 13.273 -4.776 -7.534 1.00 10.00 H new ATOM 0 HH TYR A 21 14.359 -3.052 -8.387 1.00 10.00 H new ATOM 22 N ILE A 22 10.845 -4.215 -0.217 1.00 10.00 N ATOM 23 CA ILE A 22 9.996 -4.495 0.934 1.00 10.00 C ATOM 24 C ILE A 22 8.651 -5.047 0.482 1.00 10.00 C ATOM 25 O ILE A 22 8.010 -4.495 -0.412 1.00 10.00 O ATOM 26 CB ILE A 22 9.764 -3.235 1.799 1.00 10.00 C ATOM 27 CG1 ILE A 22 11.076 -2.473 2.017 1.00 10.00 C ATOM 28 CG2 ILE A 22 9.132 -3.613 3.133 1.00 10.00 C ATOM 29 CD1 ILE A 22 12.116 -3.244 2.805 1.00 10.00 C ATOM 0 H ILE A 22 10.819 -3.247 -0.538 1.00 10.00 H new ATOM 0 HA ILE A 22 10.515 -5.237 1.541 1.00 10.00 H new ATOM 0 HB ILE A 22 9.077 -2.577 1.267 1.00 10.00 H new ATOM 0 HG12 ILE A 22 11.495 -2.207 1.046 1.00 10.00 H new ATOM 0 HG13 ILE A 22 10.860 -1.540 2.537 1.00 10.00 H new ATOM 0 HG21 ILE A 22 8.976 -2.714 3.729 1.00 10.00 H new ATOM 0 HG22 ILE A 22 8.174 -4.102 2.956 1.00 10.00 H new ATOM 0 HG23 ILE A 22 9.793 -4.294 3.669 1.00 10.00 H new ATOM 0 HD11 ILE A 22 13.014 -2.636 2.915 1.00 10.00 H new ATOM 0 HD12 ILE A 22 11.719 -3.487 3.791 1.00 10.00 H new ATOM 0 HD13 ILE A 22 12.364 -4.165 2.277 1.00 10.00 H new ATOM 41 N LYS A 23 8.242 -6.149 1.088 1.00 10.00 N ATOM 42 CA LYS A 23 6.976 -6.781 0.759 1.00 10.00 C ATOM 43 C LYS A 23 5.931 -6.494 1.829 1.00 10.00 C ATOM 44 O LYS A 23 6.039 -6.967 2.963 1.00 10.00 O ATOM 45 CB LYS A 23 7.163 -8.289 0.618 1.00 10.00 C ATOM 46 CG LYS A 23 7.425 -8.751 -0.805 1.00 10.00 C ATOM 47 CD LYS A 23 8.078 -10.130 -0.843 1.00 10.00 C ATOM 48 CE LYS A 23 7.317 -11.148 -0.003 1.00 10.00 C ATOM 49 NZ LYS A 23 7.872 -11.278 1.374 1.00 10.00 N ATOM 0 H LYS A 23 8.773 -6.627 1.816 1.00 10.00 H new ATOM 0 HA LYS A 23 6.628 -6.368 -0.188 1.00 10.00 H new ATOM 0 HB2 LYS A 23 7.995 -8.602 1.249 1.00 10.00 H new ATOM 0 HB3 LYS A 23 6.272 -8.792 0.993 1.00 10.00 H new ATOM 0 HG2 LYS A 23 6.485 -8.779 -1.357 1.00 10.00 H new ATOM 0 HG3 LYS A 23 8.069 -8.030 -1.308 1.00 10.00 H new ATOM 0 HD2 LYS A 23 8.129 -10.478 -1.875 1.00 10.00 H new ATOM 0 HD3 LYS A 23 9.103 -10.055 -0.480 1.00 10.00 H new ATOM 0 HE2 LYS A 23 6.269 -10.855 0.057 1.00 10.00 H new ATOM 0 HE3 LYS A 23 7.348 -12.119 -0.497 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 8.137 -12.268 1.549 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 8.712 -10.673 1.468 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 7.154 -10.984 2.067 1.00 10.00 H new ATOM 63 N LEU A 24 4.931 -5.705 1.469 1.00 10.00 N ATOM 64 CA LEU A 24 3.853 -5.370 2.389 1.00 10.00 C ATOM 65 C LEU A 24 2.641 -6.242 2.099 1.00 10.00 C ATOM 66 O LEU A 24 2.211 -6.350 0.949 1.00 10.00 O ATOM 67 CB LEU A 24 3.476 -3.891 2.268 1.00 10.00 C ATOM 68 CG LEU A 24 4.552 -2.902 2.720 1.00 10.00 C ATOM 69 CD1 LEU A 24 4.103 -1.474 2.456 1.00 10.00 C ATOM 70 CD2 LEU A 24 4.873 -3.092 4.196 1.00 10.00 C ATOM 0 H LEU A 24 4.842 -5.283 0.544 1.00 10.00 H new ATOM 0 HA LEU A 24 4.195 -5.554 3.407 1.00 10.00 H new ATOM 0 HB2 LEU A 24 3.227 -3.681 1.228 1.00 10.00 H new ATOM 0 HB3 LEU A 24 2.574 -3.714 2.854 1.00 10.00 H new ATOM 0 HG LEU A 24 5.458 -3.095 2.145 1.00 10.00 H new ATOM 0 HD11 LEU A 24 4.879 -0.782 2.783 1.00 10.00 H new ATOM 0 HD12 LEU A 24 3.924 -1.340 1.389 1.00 10.00 H new ATOM 0 HD13 LEU A 24 3.184 -1.274 3.006 1.00 10.00 H new ATOM 0 HD21 LEU A 24 5.640 -2.379 4.496 1.00 10.00 H new ATOM 0 HD22 LEU A 24 3.973 -2.927 4.788 1.00 10.00 H new ATOM 0 HD23 LEU A 24 5.236 -4.106 4.362 1.00 10.00 H new ATOM 82 N LYS A 25 2.091 -6.856 3.135 1.00 10.00 N ATOM 83 CA LYS A 25 0.938 -7.726 2.973 1.00 10.00 C ATOM 84 C LYS A 25 -0.361 -6.953 3.146 1.00 10.00 C ATOM 85 O LYS A 25 -0.664 -6.457 4.235 1.00 10.00 O ATOM 86 CB LYS A 25 0.986 -8.883 3.973 1.00 10.00 C ATOM 87 CG LYS A 25 2.205 -9.778 3.818 1.00 10.00 C ATOM 88 CD LYS A 25 2.085 -11.035 4.663 1.00 10.00 C ATOM 89 CE LYS A 25 1.056 -11.995 4.088 1.00 10.00 C ATOM 90 NZ LYS A 25 0.835 -13.167 4.972 1.00 10.00 N ATOM 0 H LYS A 25 2.424 -6.768 4.095 1.00 10.00 H new ATOM 0 HA LYS A 25 0.972 -8.130 1.961 1.00 10.00 H new ATOM 0 HB2 LYS A 25 0.971 -8.477 4.985 1.00 10.00 H new ATOM 0 HB3 LYS A 25 0.086 -9.487 3.859 1.00 10.00 H new ATOM 0 HG2 LYS A 25 2.325 -10.053 2.770 1.00 10.00 H new ATOM 0 HG3 LYS A 25 3.100 -9.228 4.107 1.00 10.00 H new ATOM 0 HD2 LYS A 25 3.054 -11.530 4.721 1.00 10.00 H new ATOM 0 HD3 LYS A 25 1.804 -10.765 5.681 1.00 10.00 H new ATOM 0 HE2 LYS A 25 0.113 -11.469 3.940 1.00 10.00 H new ATOM 0 HE3 LYS A 25 1.387 -12.337 3.108 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 0.458 -13.958 4.412 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 1.737 -13.449 5.406 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 0.155 -12.916 5.718 1.00 10.00 H new ATOM 104 N VAL A 26 -1.117 -6.848 2.066 1.00 10.00 N ATOM 105 CA VAL A 26 -2.394 -6.155 2.090 1.00 10.00 C ATOM 106 C VAL A 26 -3.516 -7.172 2.229 1.00 10.00 C ATOM 107 O VAL A 26 -3.683 -8.042 1.372 1.00 10.00 O ATOM 108 CB VAL A 26 -2.624 -5.318 0.815 1.00 10.00 C ATOM 109 CG1 VAL A 26 -3.593 -4.185 1.095 1.00 10.00 C ATOM 110 CG2 VAL A 26 -1.310 -4.777 0.267 1.00 10.00 C ATOM 0 H VAL A 26 -0.866 -7.236 1.157 1.00 10.00 H new ATOM 0 HA VAL A 26 -2.385 -5.473 2.940 1.00 10.00 H new ATOM 0 HB VAL A 26 -3.058 -5.969 0.057 1.00 10.00 H new ATOM 0 HG11 VAL A 26 -3.745 -3.603 0.186 1.00 10.00 H new ATOM 0 HG12 VAL A 26 -4.547 -4.595 1.427 1.00 10.00 H new ATOM 0 HG13 VAL A 26 -3.184 -3.541 1.874 1.00 10.00 H new ATOM 0 HG21 VAL A 26 -1.504 -4.191 -0.632 1.00 10.00 H new ATOM 0 HG22 VAL A 26 -0.836 -4.144 1.017 1.00 10.00 H new ATOM 0 HG23 VAL A 26 -0.648 -5.608 0.023 1.00 10.00 H new ATOM 120 N ILE A 27 -4.270 -7.076 3.310 1.00 10.00 N ATOM 121 CA ILE A 27 -5.359 -8.009 3.557 1.00 10.00 C ATOM 122 C ILE A 27 -6.689 -7.442 3.072 1.00 10.00 C ATOM 123 O ILE A 27 -7.131 -6.387 3.531 1.00 10.00 O ATOM 124 CB ILE A 27 -5.471 -8.363 5.060 1.00 10.00 C ATOM 125 CG1 ILE A 27 -4.130 -8.882 5.596 1.00 10.00 C ATOM 126 CG2 ILE A 27 -6.576 -9.386 5.288 1.00 10.00 C ATOM 127 CD1 ILE A 27 -3.660 -10.163 4.937 1.00 10.00 C ATOM 0 H ILE A 27 -4.150 -6.364 4.030 1.00 10.00 H new ATOM 0 HA ILE A 27 -5.132 -8.917 2.998 1.00 10.00 H new ATOM 0 HB ILE A 27 -5.727 -7.456 5.608 1.00 10.00 H new ATOM 0 HG12 ILE A 27 -3.371 -8.113 5.455 1.00 10.00 H new ATOM 0 HG13 ILE A 27 -4.219 -9.049 6.670 1.00 10.00 H new ATOM 0 HG21 ILE A 27 -6.640 -9.622 6.350 1.00 10.00 H new ATOM 0 HG22 ILE A 27 -7.527 -8.975 4.950 1.00 10.00 H new ATOM 0 HG23 ILE A 27 -6.353 -10.294 4.727 1.00 10.00 H new ATOM 0 HD11 ILE A 27 -2.706 -10.466 5.369 1.00 10.00 H new ATOM 0 HD12 ILE A 27 -4.398 -10.948 5.100 1.00 10.00 H new ATOM 0 HD13 ILE A 27 -3.537 -9.998 3.867 1.00 10.00 H new ATOM 139 N GLY A 28 -7.307 -8.136 2.130 1.00 10.00 N ATOM 140 CA GLY A 28 -8.586 -7.702 1.610 1.00 10.00 C ATOM 141 C GLY A 28 -9.738 -8.377 2.325 1.00 10.00 C ATOM 142 O GLY A 28 -9.540 -9.371 3.025 1.00 10.00 O ATOM 0 H GLY A 28 -6.945 -8.994 1.715 1.00 10.00 H new ATOM 0 HA2 GLY A 28 -8.675 -6.621 1.717 1.00 10.00 H new ATOM 0 HA3 GLY A 28 -8.640 -7.923 0.544 1.00 10.00 H new ATOM 146 N GLN A 29 -10.946 -7.850 2.146 1.00 10.00 N ATOM 147 CA GLN A 29 -12.134 -8.413 2.785 1.00 10.00 C ATOM 148 C GLN A 29 -12.416 -9.826 2.266 1.00 10.00 C ATOM 149 O GLN A 29 -13.080 -10.621 2.928 1.00 10.00 O ATOM 150 CB GLN A 29 -13.345 -7.508 2.546 1.00 10.00 C ATOM 151 CG GLN A 29 -14.540 -7.822 3.438 1.00 10.00 C ATOM 152 CD GLN A 29 -14.215 -7.715 4.917 1.00 10.00 C ATOM 153 OE1 GLN A 29 -14.310 -6.641 5.507 1.00 10.00 O ATOM 154 NE2 GLN A 29 -13.838 -8.828 5.528 1.00 10.00 N ATOM 0 H GLN A 29 -11.129 -7.033 1.563 1.00 10.00 H new ATOM 0 HA GLN A 29 -11.947 -8.475 3.857 1.00 10.00 H new ATOM 0 HB2 GLN A 29 -13.048 -6.471 2.706 1.00 10.00 H new ATOM 0 HB3 GLN A 29 -13.650 -7.595 1.503 1.00 10.00 H new ATOM 0 HG2 GLN A 29 -15.355 -7.139 3.200 1.00 10.00 H new ATOM 0 HG3 GLN A 29 -14.895 -8.829 3.221 1.00 10.00 H new ATOM 0 HE21 GLN A 29 -13.771 -9.700 5.003 1.00 10.00 H new ATOM 0 HE22 GLN A 29 -13.614 -8.813 6.523 1.00 10.00 H new ATOM 163 N ASP A 30 -11.885 -10.132 1.088 1.00 10.00 N ATOM 164 CA ASP A 30 -12.063 -11.444 0.473 1.00 10.00 C ATOM 165 C ASP A 30 -10.996 -12.419 0.967 1.00 10.00 C ATOM 166 O ASP A 30 -10.815 -13.499 0.401 1.00 10.00 O ATOM 167 CB ASP A 30 -12.003 -11.328 -1.055 1.00 10.00 C ATOM 168 CG ASP A 30 -10.679 -10.767 -1.544 1.00 10.00 C ATOM 169 OD1 ASP A 30 -10.406 -9.574 -1.287 1.00 10.00 O ATOM 170 OD2 ASP A 30 -9.909 -11.508 -2.185 1.00 10.00 O ATOM 0 H ASP A 30 -11.323 -9.484 0.535 1.00 10.00 H new ATOM 0 HA ASP A 30 -13.042 -11.827 0.760 1.00 10.00 H new ATOM 0 HB2 ASP A 30 -12.163 -12.311 -1.497 1.00 10.00 H new ATOM 0 HB3 ASP A 30 -12.815 -10.688 -1.400 1.00 10.00 H new ATOM 175 N SER A 31 -10.297 -12.021 2.035 1.00 10.00 N ATOM 176 CA SER A 31 -9.244 -12.832 2.646 1.00 10.00 C ATOM 177 C SER A 31 -8.050 -12.999 1.705 1.00 10.00 C ATOM 178 O SER A 31 -7.455 -14.076 1.612 1.00 10.00 O ATOM 179 CB SER A 31 -9.800 -14.194 3.063 1.00 10.00 C ATOM 180 OG SER A 31 -10.937 -14.042 3.902 1.00 10.00 O ATOM 0 H SER A 31 -10.447 -11.125 2.499 1.00 10.00 H new ATOM 0 HA SER A 31 -8.890 -12.311 3.535 1.00 10.00 H new ATOM 0 HB2 SER A 31 -10.071 -14.768 2.177 1.00 10.00 H new ATOM 0 HB3 SER A 31 -9.030 -14.761 3.586 1.00 10.00 H new ATOM 0 HG SER A 31 -11.277 -14.926 4.155 1.00 10.00 H new ATOM 186 N SER A 32 -7.709 -11.923 1.012 1.00 10.00 N ATOM 187 CA SER A 32 -6.587 -11.931 0.092 1.00 10.00 C ATOM 188 C SER A 32 -5.307 -11.530 0.822 1.00 10.00 C ATOM 189 O SER A 32 -5.353 -10.837 1.839 1.00 10.00 O ATOM 190 CB SER A 32 -6.863 -10.973 -1.067 1.00 10.00 C ATOM 191 OG SER A 32 -7.745 -9.936 -0.665 1.00 10.00 O ATOM 0 H SER A 32 -8.198 -11.030 1.072 1.00 10.00 H new ATOM 0 HA SER A 32 -6.457 -12.937 -0.306 1.00 10.00 H new ATOM 0 HB2 SER A 32 -5.926 -10.543 -1.420 1.00 10.00 H new ATOM 0 HB3 SER A 32 -7.297 -11.522 -1.903 1.00 10.00 H new ATOM 0 HG SER A 32 -8.033 -9.428 -1.452 1.00 10.00 H new ATOM 197 N GLU A 33 -4.173 -11.976 0.301 1.00 10.00 N ATOM 198 CA GLU A 33 -2.876 -11.669 0.884 1.00 10.00 C ATOM 199 C GLU A 33 -1.988 -11.048 -0.184 1.00 10.00 C ATOM 200 O GLU A 33 -1.028 -11.659 -0.650 1.00 10.00 O ATOM 201 CB GLU A 33 -2.225 -12.938 1.440 1.00 10.00 C ATOM 202 CG GLU A 33 -2.768 -13.376 2.788 1.00 10.00 C ATOM 203 CD GLU A 33 -2.109 -14.644 3.288 1.00 10.00 C ATOM 204 OE1 GLU A 33 -2.811 -15.665 3.441 1.00 10.00 O ATOM 205 OE2 GLU A 33 -0.882 -14.631 3.522 1.00 10.00 O ATOM 0 H GLU A 33 -4.126 -12.559 -0.535 1.00 10.00 H new ATOM 0 HA GLU A 33 -3.007 -10.966 1.707 1.00 10.00 H new ATOM 0 HB2 GLU A 33 -2.364 -13.748 0.724 1.00 10.00 H new ATOM 0 HB3 GLU A 33 -1.151 -12.773 1.530 1.00 10.00 H new ATOM 0 HG2 GLU A 33 -2.615 -12.579 3.515 1.00 10.00 H new ATOM 0 HG3 GLU A 33 -3.844 -13.535 2.710 1.00 10.00 H new ATOM 212 N ILE A 34 -2.332 -9.837 -0.581 1.00 10.00 N ATOM 213 CA ILE A 34 -1.596 -9.127 -1.615 1.00 10.00 C ATOM 214 C ILE A 34 -0.201 -8.756 -1.125 1.00 10.00 C ATOM 215 O ILE A 34 -0.036 -8.290 0.000 1.00 10.00 O ATOM 216 CB ILE A 34 -2.351 -7.855 -2.057 1.00 10.00 C ATOM 217 CG1 ILE A 34 -3.811 -8.187 -2.404 1.00 10.00 C ATOM 218 CG2 ILE A 34 -1.656 -7.207 -3.241 1.00 10.00 C ATOM 219 CD1 ILE A 34 -3.962 -9.195 -3.526 1.00 10.00 C ATOM 0 H ILE A 34 -3.124 -9.319 -0.200 1.00 10.00 H new ATOM 0 HA ILE A 34 -1.504 -9.793 -2.473 1.00 10.00 H new ATOM 0 HB ILE A 34 -2.347 -7.148 -1.227 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -4.307 -8.573 -1.513 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -4.326 -7.268 -2.683 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -2.202 -6.312 -3.538 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.638 -6.935 -2.961 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -1.627 -7.909 -4.075 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -5.021 -9.377 -3.712 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -3.497 -8.805 -4.431 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -3.478 -10.130 -3.243 1.00 10.00 H new ATOM 231 N HIS A 35 0.797 -8.972 -1.967 1.00 10.00 N ATOM 232 CA HIS A 35 2.170 -8.664 -1.617 1.00 10.00 C ATOM 233 C HIS A 35 2.663 -7.483 -2.436 1.00 10.00 C ATOM 234 O HIS A 35 3.118 -7.640 -3.571 1.00 10.00 O ATOM 235 CB HIS A 35 3.067 -9.884 -1.835 1.00 10.00 C ATOM 236 CG HIS A 35 3.384 -10.616 -0.567 1.00 10.00 C ATOM 237 ND1 HIS A 35 3.149 -11.962 -0.434 1.00 10.00 N ATOM 238 CD2 HIS A 35 3.914 -10.147 0.586 1.00 10.00 C ATOM 239 CE1 HIS A 35 3.540 -12.277 0.789 1.00 10.00 C ATOM 240 NE2 HIS A 35 4.014 -11.212 1.446 1.00 10.00 N ATOM 0 H HIS A 35 0.678 -9.362 -2.902 1.00 10.00 H new ATOM 0 HA HIS A 35 2.211 -8.398 -0.561 1.00 10.00 H new ATOM 0 HB2 HIS A 35 2.578 -10.567 -2.529 1.00 10.00 H new ATOM 0 HB3 HIS A 35 3.997 -9.564 -2.305 1.00 10.00 H new ATOM 0 HD2 HIS A 35 4.204 -9.127 0.791 1.00 10.00 H new ATOM 0 HE1 HIS A 35 3.484 -13.271 1.206 1.00 10.00 H new ATOM 0 HE2 HIS A 35 4.378 -11.195 2.399 1.00 10.00 H new ATOM 248 N PHE A 36 2.545 -6.300 -1.865 1.00 10.00 N ATOM 249 CA PHE A 36 2.969 -5.084 -2.535 1.00 10.00 C ATOM 250 C PHE A 36 4.479 -4.910 -2.406 1.00 10.00 C ATOM 251 O PHE A 36 4.997 -4.725 -1.302 1.00 10.00 O ATOM 252 CB PHE A 36 2.235 -3.877 -1.943 1.00 10.00 C ATOM 253 CG PHE A 36 1.994 -2.771 -2.930 1.00 10.00 C ATOM 254 CD1 PHE A 36 1.433 -3.038 -4.167 1.00 10.00 C ATOM 255 CD2 PHE A 36 2.323 -1.463 -2.617 1.00 10.00 C ATOM 256 CE1 PHE A 36 1.206 -2.023 -5.073 1.00 10.00 C ATOM 257 CE2 PHE A 36 2.098 -0.444 -3.520 1.00 10.00 C ATOM 258 CZ PHE A 36 1.538 -0.725 -4.750 1.00 10.00 C ATOM 0 H PHE A 36 2.157 -6.154 -0.933 1.00 10.00 H new ATOM 0 HA PHE A 36 2.721 -5.157 -3.594 1.00 10.00 H new ATOM 0 HB2 PHE A 36 1.277 -4.207 -1.540 1.00 10.00 H new ATOM 0 HB3 PHE A 36 2.814 -3.485 -1.107 1.00 10.00 H new ATOM 0 HD1 PHE A 36 1.170 -4.053 -4.426 1.00 10.00 H new ATOM 0 HD2 PHE A 36 2.761 -1.238 -1.656 1.00 10.00 H new ATOM 0 HE1 PHE A 36 0.768 -2.245 -6.035 1.00 10.00 H new ATOM 0 HE2 PHE A 36 2.360 0.572 -3.265 1.00 10.00 H new ATOM 0 HZ PHE A 36 1.360 0.071 -5.458 1.00 10.00 H new ATOM 268 N LYS A 37 5.180 -4.996 -3.531 1.00 10.00 N ATOM 269 CA LYS A 37 6.627 -4.846 -3.541 1.00 10.00 C ATOM 270 C LYS A 37 6.984 -3.364 -3.646 1.00 10.00 C ATOM 271 O LYS A 37 6.954 -2.782 -4.732 1.00 10.00 O ATOM 272 CB LYS A 37 7.229 -5.636 -4.709 1.00 10.00 C ATOM 273 CG LYS A 37 8.722 -5.872 -4.584 1.00 10.00 C ATOM 274 CD LYS A 37 9.252 -6.748 -5.711 1.00 10.00 C ATOM 275 CE LYS A 37 8.870 -8.207 -5.519 1.00 10.00 C ATOM 276 NZ LYS A 37 9.509 -9.083 -6.537 1.00 10.00 N ATOM 0 H LYS A 37 4.768 -5.169 -4.448 1.00 10.00 H new ATOM 0 HA LYS A 37 7.042 -5.242 -2.614 1.00 10.00 H new ATOM 0 HB2 LYS A 37 6.723 -6.599 -4.783 1.00 10.00 H new ATOM 0 HB3 LYS A 37 7.032 -5.100 -5.638 1.00 10.00 H new ATOM 0 HG2 LYS A 37 9.243 -4.915 -4.592 1.00 10.00 H new ATOM 0 HG3 LYS A 37 8.936 -6.344 -3.625 1.00 10.00 H new ATOM 0 HD2 LYS A 37 8.860 -6.392 -6.664 1.00 10.00 H new ATOM 0 HD3 LYS A 37 10.337 -6.660 -5.760 1.00 10.00 H new ATOM 0 HE2 LYS A 37 9.166 -8.532 -4.522 1.00 10.00 H new ATOM 0 HE3 LYS A 37 7.787 -8.310 -5.579 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 9.225 -10.070 -6.373 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 9.206 -8.789 -7.487 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 10.543 -9.004 -6.463 1.00 10.00 H new ATOM 290 N VAL A 38 7.303 -2.761 -2.511 1.00 10.00 N ATOM 291 CA VAL A 38 7.627 -1.343 -2.465 1.00 10.00 C ATOM 292 C VAL A 38 9.135 -1.091 -2.472 1.00 10.00 C ATOM 293 O VAL A 38 9.937 -1.968 -2.139 1.00 10.00 O ATOM 294 CB VAL A 38 6.997 -0.663 -1.226 1.00 10.00 C ATOM 295 CG1 VAL A 38 5.494 -0.905 -1.188 1.00 10.00 C ATOM 296 CG2 VAL A 38 7.649 -1.152 0.058 1.00 10.00 C ATOM 0 H VAL A 38 7.345 -3.233 -1.607 1.00 10.00 H new ATOM 0 HA VAL A 38 7.205 -0.905 -3.370 1.00 10.00 H new ATOM 0 HB VAL A 38 7.173 0.410 -1.306 1.00 10.00 H new ATOM 0 HG11 VAL A 38 5.069 -0.419 -0.310 1.00 10.00 H new ATOM 0 HG12 VAL A 38 5.036 -0.493 -2.087 1.00 10.00 H new ATOM 0 HG13 VAL A 38 5.299 -1.976 -1.140 1.00 10.00 H new ATOM 0 HG21 VAL A 38 7.187 -0.657 0.912 1.00 10.00 H new ATOM 0 HG22 VAL A 38 7.515 -2.230 0.147 1.00 10.00 H new ATOM 0 HG23 VAL A 38 8.714 -0.919 0.037 1.00 10.00 H new ATOM 306 N LYS A 39 9.500 0.126 -2.857 1.00 10.00 N ATOM 307 CA LYS A 39 10.890 0.550 -2.927 1.00 10.00 C ATOM 308 C LYS A 39 11.225 1.425 -1.722 1.00 10.00 C ATOM 309 O LYS A 39 10.634 2.490 -1.537 1.00 10.00 O ATOM 310 CB LYS A 39 11.116 1.319 -4.236 1.00 10.00 C ATOM 311 CG LYS A 39 12.569 1.641 -4.543 1.00 10.00 C ATOM 312 CD LYS A 39 12.691 2.372 -5.870 1.00 10.00 C ATOM 313 CE LYS A 39 14.138 2.700 -6.204 1.00 10.00 C ATOM 314 NZ LYS A 39 14.267 3.327 -7.545 1.00 10.00 N ATOM 0 H LYS A 39 8.835 0.849 -3.131 1.00 10.00 H new ATOM 0 HA LYS A 39 11.545 -0.321 -2.910 1.00 10.00 H new ATOM 0 HB2 LYS A 39 10.706 0.735 -5.060 1.00 10.00 H new ATOM 0 HB3 LYS A 39 10.553 2.251 -4.195 1.00 10.00 H new ATOM 0 HG2 LYS A 39 12.987 2.255 -3.745 1.00 10.00 H new ATOM 0 HG3 LYS A 39 13.151 0.720 -4.575 1.00 10.00 H new ATOM 0 HD2 LYS A 39 12.265 1.758 -6.664 1.00 10.00 H new ATOM 0 HD3 LYS A 39 12.109 3.293 -5.832 1.00 10.00 H new ATOM 0 HE2 LYS A 39 14.542 3.373 -5.448 1.00 10.00 H new ATOM 0 HE3 LYS A 39 14.734 1.788 -6.170 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 15.268 3.536 -7.736 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 13.905 2.675 -8.270 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 13.719 4.210 -7.569 1.00 10.00 H new ATOM 328 N MET A 40 12.171 0.972 -0.905 1.00 10.00 N ATOM 329 CA MET A 40 12.565 1.706 0.293 1.00 10.00 C ATOM 330 C MET A 40 13.452 2.905 -0.046 1.00 10.00 C ATOM 331 O MET A 40 14.680 2.809 -0.019 1.00 10.00 O ATOM 332 CB MET A 40 13.283 0.778 1.284 1.00 10.00 C ATOM 333 CG MET A 40 13.719 1.472 2.572 1.00 10.00 C ATOM 334 SD MET A 40 12.328 2.069 3.551 1.00 10.00 S ATOM 335 CE MET A 40 11.820 0.552 4.357 1.00 10.00 C ATOM 0 H MET A 40 12.679 0.100 -1.051 1.00 10.00 H new ATOM 0 HA MET A 40 11.655 2.085 0.758 1.00 10.00 H new ATOM 0 HB2 MET A 40 12.622 -0.052 1.535 1.00 10.00 H new ATOM 0 HB3 MET A 40 14.160 0.351 0.798 1.00 10.00 H new ATOM 0 HG2 MET A 40 14.308 0.778 3.172 1.00 10.00 H new ATOM 0 HG3 MET A 40 14.370 2.311 2.325 1.00 10.00 H new ATOM 0 HE1 MET A 40 10.738 0.443 4.278 1.00 10.00 H new ATOM 0 HE2 MET A 40 12.307 -0.296 3.876 1.00 10.00 H new ATOM 0 HE3 MET A 40 12.105 0.585 5.408 1.00 10.00 H new ATOM 345 N THR A 41 12.809 4.015 -0.389 1.00 10.00 N ATOM 346 CA THR A 41 13.493 5.264 -0.713 1.00 10.00 C ATOM 347 C THR A 41 12.494 6.271 -1.273 1.00 10.00 C ATOM 348 O THR A 41 12.581 7.465 -0.993 1.00 10.00 O ATOM 349 CB THR A 41 14.678 5.075 -1.703 1.00 10.00 C ATOM 350 OG1 THR A 41 15.545 6.220 -1.659 1.00 10.00 O ATOM 351 CG2 THR A 41 14.206 4.857 -3.135 1.00 10.00 C ATOM 0 H THR A 41 11.793 4.076 -0.451 1.00 10.00 H new ATOM 0 HA THR A 41 13.923 5.640 0.216 1.00 10.00 H new ATOM 0 HB THR A 41 15.217 4.182 -1.388 1.00 10.00 H new ATOM 0 HG1 THR A 41 16.289 6.091 -2.284 1.00 10.00 H new ATOM 0 HG21 THR A 41 15.070 4.730 -3.788 1.00 10.00 H new ATOM 0 HG22 THR A 41 13.583 3.964 -3.181 1.00 10.00 H new ATOM 0 HG23 THR A 41 13.627 5.721 -3.463 1.00 10.00 H new ATOM 359 N THR A 42 11.534 5.776 -2.043 1.00 10.00 N ATOM 360 CA THR A 42 10.515 6.622 -2.633 1.00 10.00 C ATOM 361 C THR A 42 9.346 6.794 -1.667 1.00 10.00 C ATOM 362 O THR A 42 9.005 5.869 -0.926 1.00 10.00 O ATOM 363 CB THR A 42 10.004 6.014 -3.955 1.00 10.00 C ATOM 364 OG1 THR A 42 11.110 5.505 -4.716 1.00 10.00 O ATOM 365 CG2 THR A 42 9.244 7.046 -4.781 1.00 10.00 C ATOM 0 H THR A 42 11.443 4.786 -2.272 1.00 10.00 H new ATOM 0 HA THR A 42 10.959 7.596 -2.839 1.00 10.00 H new ATOM 0 HB THR A 42 9.320 5.201 -3.712 1.00 10.00 H new ATOM 0 HG1 THR A 42 10.780 5.118 -5.554 1.00 10.00 H new ATOM 0 HG21 THR A 42 8.897 6.587 -5.707 1.00 10.00 H new ATOM 0 HG22 THR A 42 8.388 7.408 -4.212 1.00 10.00 H new ATOM 0 HG23 THR A 42 9.904 7.881 -5.016 1.00 10.00 H new ATOM 373 N HIS A 43 8.757 7.984 -1.661 1.00 10.00 N ATOM 374 CA HIS A 43 7.619 8.275 -0.795 1.00 10.00 C ATOM 375 C HIS A 43 6.442 7.369 -1.134 1.00 10.00 C ATOM 376 O HIS A 43 6.286 6.939 -2.282 1.00 10.00 O ATOM 377 CB HIS A 43 7.203 9.739 -0.929 1.00 10.00 C ATOM 378 CG HIS A 43 7.916 10.653 0.017 1.00 10.00 C ATOM 379 ND1 HIS A 43 9.164 11.155 -0.271 1.00 10.00 N ATOM 380 CD2 HIS A 43 7.514 11.120 1.221 1.00 10.00 C ATOM 381 CE1 HIS A 43 9.489 11.917 0.760 1.00 10.00 C ATOM 382 NE2 HIS A 43 8.520 11.924 1.688 1.00 10.00 N ATOM 0 H HIS A 43 9.049 8.766 -2.248 1.00 10.00 H new ATOM 0 HA HIS A 43 7.921 8.088 0.235 1.00 10.00 H new ATOM 0 HB2 HIS A 43 7.390 10.069 -1.951 1.00 10.00 H new ATOM 0 HB3 HIS A 43 6.129 9.820 -0.760 1.00 10.00 H new ATOM 0 HD2 HIS A 43 6.580 10.901 1.718 1.00 10.00 H new ATOM 0 HE1 HIS A 43 10.416 12.464 0.844 1.00 10.00 H new ATOM 0 HE2 HIS A 43 8.530 12.431 2.573 1.00 10.00 H new ATOM 390 N LEU A 44 5.596 7.110 -0.142 1.00 10.00 N ATOM 391 CA LEU A 44 4.433 6.247 -0.321 1.00 10.00 C ATOM 392 C LEU A 44 3.428 6.852 -1.297 1.00 10.00 C ATOM 393 O LEU A 44 2.468 6.196 -1.690 1.00 10.00 O ATOM 394 CB LEU A 44 3.768 5.963 1.028 1.00 10.00 C ATOM 395 CG LEU A 44 4.378 4.793 1.807 1.00 10.00 C ATOM 396 CD1 LEU A 44 4.188 4.979 3.302 1.00 10.00 C ATOM 397 CD2 LEU A 44 3.764 3.476 1.353 1.00 10.00 C ATOM 0 H LEU A 44 5.695 7.488 0.800 1.00 10.00 H new ATOM 0 HA LEU A 44 4.780 5.306 -0.748 1.00 10.00 H new ATOM 0 HB2 LEU A 44 3.826 6.861 1.643 1.00 10.00 H new ATOM 0 HB3 LEU A 44 2.710 5.759 0.861 1.00 10.00 H new ATOM 0 HG LEU A 44 5.448 4.769 1.601 1.00 10.00 H new ATOM 0 HD11 LEU A 44 4.630 4.135 3.833 1.00 10.00 H new ATOM 0 HD12 LEU A 44 4.674 5.902 3.619 1.00 10.00 H new ATOM 0 HD13 LEU A 44 3.123 5.034 3.529 1.00 10.00 H new ATOM 0 HD21 LEU A 44 4.208 2.655 1.916 1.00 10.00 H new ATOM 0 HD22 LEU A 44 2.688 3.497 1.528 1.00 10.00 H new ATOM 0 HD23 LEU A 44 3.956 3.333 0.290 1.00 10.00 H new ATOM 409 N LYS A 45 3.663 8.103 -1.685 1.00 10.00 N ATOM 410 CA LYS A 45 2.808 8.797 -2.640 1.00 10.00 C ATOM 411 C LYS A 45 2.717 7.998 -3.939 1.00 10.00 C ATOM 412 O LYS A 45 1.627 7.734 -4.449 1.00 10.00 O ATOM 413 CB LYS A 45 3.375 10.197 -2.920 1.00 10.00 C ATOM 414 CG LYS A 45 2.766 10.888 -4.132 1.00 10.00 C ATOM 415 CD LYS A 45 1.325 11.287 -3.879 1.00 10.00 C ATOM 416 CE LYS A 45 0.614 11.661 -5.166 1.00 10.00 C ATOM 417 NZ LYS A 45 -0.835 11.906 -4.946 1.00 10.00 N ATOM 0 H LYS A 45 4.448 8.660 -1.347 1.00 10.00 H new ATOM 0 HA LYS A 45 1.808 8.895 -2.219 1.00 10.00 H new ATOM 0 HB2 LYS A 45 3.217 10.823 -2.042 1.00 10.00 H new ATOM 0 HB3 LYS A 45 4.452 10.118 -3.065 1.00 10.00 H new ATOM 0 HG2 LYS A 45 3.352 11.773 -4.380 1.00 10.00 H new ATOM 0 HG3 LYS A 45 2.814 10.223 -4.994 1.00 10.00 H new ATOM 0 HD2 LYS A 45 0.798 10.463 -3.398 1.00 10.00 H new ATOM 0 HD3 LYS A 45 1.296 12.130 -3.189 1.00 10.00 H new ATOM 0 HE2 LYS A 45 1.073 12.555 -5.588 1.00 10.00 H new ATOM 0 HE3 LYS A 45 0.741 10.862 -5.896 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 -1.379 11.078 -5.261 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 -1.010 12.070 -3.934 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 -1.132 12.742 -5.488 1.00 10.00 H new ATOM 431 N LYS A 46 3.878 7.580 -4.437 1.00 10.00 N ATOM 432 CA LYS A 46 3.958 6.816 -5.673 1.00 10.00 C ATOM 433 C LYS A 46 3.387 5.415 -5.483 1.00 10.00 C ATOM 434 O LYS A 46 2.811 4.833 -6.402 1.00 10.00 O ATOM 435 CB LYS A 46 5.415 6.733 -6.144 1.00 10.00 C ATOM 436 CG LYS A 46 5.579 6.106 -7.519 1.00 10.00 C ATOM 437 CD LYS A 46 4.985 6.987 -8.603 1.00 10.00 C ATOM 438 CE LYS A 46 4.705 6.207 -9.876 1.00 10.00 C ATOM 439 NZ LYS A 46 3.868 6.987 -10.820 1.00 10.00 N ATOM 0 H LYS A 46 4.781 7.761 -3.998 1.00 10.00 H new ATOM 0 HA LYS A 46 3.365 7.326 -6.432 1.00 10.00 H new ATOM 0 HB2 LYS A 46 5.840 7.737 -6.159 1.00 10.00 H new ATOM 0 HB3 LYS A 46 5.989 6.155 -5.420 1.00 10.00 H new ATOM 0 HG2 LYS A 46 6.637 5.941 -7.721 1.00 10.00 H new ATOM 0 HG3 LYS A 46 5.095 5.130 -7.536 1.00 10.00 H new ATOM 0 HD2 LYS A 46 4.060 7.435 -8.241 1.00 10.00 H new ATOM 0 HD3 LYS A 46 5.671 7.805 -8.822 1.00 10.00 H new ATOM 0 HE2 LYS A 46 5.647 5.943 -10.357 1.00 10.00 H new ATOM 0 HE3 LYS A 46 4.201 5.273 -9.628 1.00 10.00 H new ATOM 0 HZ1 LYS A 46 3.626 6.395 -11.640 1.00 10.00 H new ATOM 0 HZ2 LYS A 46 2.996 7.290 -10.342 1.00 10.00 H new ATOM 0 HZ3 LYS A 46 4.395 7.824 -11.141 1.00 10.00 H new ATOM 453 N LEU A 47 3.536 4.886 -4.280 1.00 10.00 N ATOM 454 CA LEU A 47 3.043 3.553 -3.963 1.00 10.00 C ATOM 455 C LEU A 47 1.516 3.527 -3.911 1.00 10.00 C ATOM 456 O LEU A 47 0.881 2.630 -4.471 1.00 10.00 O ATOM 457 CB LEU A 47 3.618 3.079 -2.622 1.00 10.00 C ATOM 458 CG LEU A 47 5.068 2.565 -2.655 1.00 10.00 C ATOM 459 CD1 LEU A 47 5.264 1.580 -3.793 1.00 10.00 C ATOM 460 CD2 LEU A 47 6.056 3.716 -2.776 1.00 10.00 C ATOM 0 H LEU A 47 3.996 5.360 -3.503 1.00 10.00 H new ATOM 0 HA LEU A 47 3.370 2.878 -4.754 1.00 10.00 H new ATOM 0 HB2 LEU A 47 3.562 3.905 -1.913 1.00 10.00 H new ATOM 0 HB3 LEU A 47 2.980 2.284 -2.236 1.00 10.00 H new ATOM 0 HG LEU A 47 5.259 2.050 -1.713 1.00 10.00 H new ATOM 0 HD11 LEU A 47 6.296 1.230 -3.797 1.00 10.00 H new ATOM 0 HD12 LEU A 47 4.593 0.731 -3.659 1.00 10.00 H new ATOM 0 HD13 LEU A 47 5.044 2.071 -4.741 1.00 10.00 H new ATOM 0 HD21 LEU A 47 7.072 3.322 -2.797 1.00 10.00 H new ATOM 0 HD22 LEU A 47 5.861 4.267 -3.696 1.00 10.00 H new ATOM 0 HD23 LEU A 47 5.943 4.384 -1.922 1.00 10.00 H new ATOM 472 N LYS A 48 0.935 4.524 -3.256 1.00 10.00 N ATOM 473 CA LYS A 48 -0.512 4.620 -3.109 1.00 10.00 C ATOM 474 C LYS A 48 -1.225 4.707 -4.457 1.00 10.00 C ATOM 475 O LYS A 48 -2.207 3.998 -4.686 1.00 10.00 O ATOM 476 CB LYS A 48 -0.880 5.830 -2.248 1.00 10.00 C ATOM 477 CG LYS A 48 -0.485 5.682 -0.786 1.00 10.00 C ATOM 478 CD LYS A 48 -0.784 6.946 0.007 1.00 10.00 C ATOM 479 CE LYS A 48 -2.280 7.153 0.183 1.00 10.00 C ATOM 480 NZ LYS A 48 -2.587 8.404 0.925 1.00 10.00 N ATOM 0 H LYS A 48 1.450 5.285 -2.814 1.00 10.00 H new ATOM 0 HA LYS A 48 -0.846 3.706 -2.617 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -0.397 6.717 -2.658 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -1.956 5.995 -2.310 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -1.022 4.841 -0.347 1.00 10.00 H new ATOM 0 HG3 LYS A 48 0.578 5.452 -0.717 1.00 10.00 H new ATOM 0 HD2 LYS A 48 -0.307 6.885 0.985 1.00 10.00 H new ATOM 0 HD3 LYS A 48 -0.354 7.808 -0.504 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -2.759 7.186 -0.796 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -2.703 6.302 0.717 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -3.585 8.659 0.778 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -2.413 8.257 1.940 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -1.979 9.172 0.577 1.00 10.00 H new ATOM 494 N GLU A 49 -0.734 5.564 -5.349 1.00 10.00 N ATOM 495 CA GLU A 49 -1.357 5.729 -6.660 1.00 10.00 C ATOM 496 C GLU A 49 -1.210 4.465 -7.507 1.00 10.00 C ATOM 497 O GLU A 49 -2.135 4.084 -8.224 1.00 10.00 O ATOM 498 CB GLU A 49 -0.784 6.943 -7.398 1.00 10.00 C ATOM 499 CG GLU A 49 0.731 6.948 -7.514 1.00 10.00 C ATOM 500 CD GLU A 49 1.253 8.148 -8.277 1.00 10.00 C ATOM 501 OE1 GLU A 49 1.014 9.289 -7.834 1.00 10.00 O ATOM 502 OE2 GLU A 49 1.912 7.954 -9.317 1.00 10.00 O ATOM 0 H GLU A 49 0.086 6.150 -5.191 1.00 10.00 H new ATOM 0 HA GLU A 49 -2.420 5.904 -6.496 1.00 10.00 H new ATOM 0 HB2 GLU A 49 -1.213 6.980 -8.399 1.00 10.00 H new ATOM 0 HB3 GLU A 49 -1.100 7.849 -6.882 1.00 10.00 H new ATOM 0 HG2 GLU A 49 1.168 6.939 -6.516 1.00 10.00 H new ATOM 0 HG3 GLU A 49 1.056 6.035 -8.013 1.00 10.00 H new ATOM 509 N SER A 50 -0.059 3.804 -7.404 1.00 10.00 N ATOM 510 CA SER A 50 0.188 2.583 -8.161 1.00 10.00 C ATOM 511 C SER A 50 -0.791 1.480 -7.755 1.00 10.00 C ATOM 512 O SER A 50 -1.273 0.725 -8.599 1.00 10.00 O ATOM 513 CB SER A 50 1.629 2.106 -7.960 1.00 10.00 C ATOM 514 OG SER A 50 2.562 3.086 -8.394 1.00 10.00 O ATOM 0 H SER A 50 0.714 4.094 -6.805 1.00 10.00 H new ATOM 0 HA SER A 50 0.036 2.808 -9.217 1.00 10.00 H new ATOM 0 HB2 SER A 50 1.797 1.882 -6.906 1.00 10.00 H new ATOM 0 HB3 SER A 50 1.788 1.180 -8.512 1.00 10.00 H new ATOM 0 HG SER A 50 2.950 3.536 -7.615 1.00 10.00 H new ATOM 520 N TYR A 51 -1.097 1.401 -6.461 1.00 10.00 N ATOM 521 CA TYR A 51 -2.024 0.393 -5.958 1.00 10.00 C ATOM 522 C TYR A 51 -3.437 0.669 -6.470 1.00 10.00 C ATOM 523 O TYR A 51 -4.158 -0.252 -6.854 1.00 10.00 O ATOM 524 CB TYR A 51 -2.014 0.360 -4.426 1.00 10.00 C ATOM 525 CG TYR A 51 -2.725 -0.843 -3.844 1.00 10.00 C ATOM 526 CD1 TYR A 51 -2.066 -2.055 -3.694 1.00 10.00 C ATOM 527 CD2 TYR A 51 -4.054 -0.766 -3.449 1.00 10.00 C ATOM 528 CE1 TYR A 51 -2.710 -3.157 -3.166 1.00 10.00 C ATOM 529 CE2 TYR A 51 -4.706 -1.864 -2.920 1.00 10.00 C ATOM 530 CZ TYR A 51 -4.030 -3.056 -2.782 1.00 10.00 C ATOM 531 OH TYR A 51 -4.675 -4.152 -2.256 1.00 10.00 O ATOM 0 H TYR A 51 -0.717 2.021 -5.746 1.00 10.00 H new ATOM 0 HA TYR A 51 -1.700 -0.581 -6.325 1.00 10.00 H new ATOM 0 HB2 TYR A 51 -0.981 0.366 -4.077 1.00 10.00 H new ATOM 0 HB3 TYR A 51 -2.484 1.268 -4.048 1.00 10.00 H new ATOM 0 HD1 TYR A 51 -1.032 -2.138 -3.995 1.00 10.00 H new ATOM 0 HD2 TYR A 51 -4.587 0.167 -3.557 1.00 10.00 H new ATOM 0 HE1 TYR A 51 -2.182 -4.093 -3.055 1.00 10.00 H new ATOM 0 HE2 TYR A 51 -5.740 -1.788 -2.617 1.00 10.00 H new ATOM 0 HH TYR A 51 -5.599 -3.913 -2.036 1.00 10.00 H new ATOM 541 N CYS A 52 -3.818 1.943 -6.488 1.00 10.00 N ATOM 542 CA CYS A 52 -5.140 2.336 -6.963 1.00 10.00 C ATOM 543 C CYS A 52 -5.306 1.951 -8.430 1.00 10.00 C ATOM 544 O CYS A 52 -6.318 1.365 -8.824 1.00 10.00 O ATOM 545 CB CYS A 52 -5.341 3.844 -6.790 1.00 10.00 C ATOM 546 SG CYS A 52 -5.104 4.435 -5.094 1.00 10.00 S ATOM 0 H CYS A 52 -3.232 2.719 -6.180 1.00 10.00 H new ATOM 0 HA CYS A 52 -5.892 1.813 -6.373 1.00 10.00 H new ATOM 0 HB2 CYS A 52 -4.647 4.369 -7.446 1.00 10.00 H new ATOM 0 HB3 CYS A 52 -6.348 4.105 -7.116 1.00 10.00 H new ATOM 0 HG CYS A 52 -3.955 4.022 -4.647 1.00 10.00 H new ATOM 552 N GLN A 53 -4.287 2.252 -9.227 1.00 10.00 N ATOM 553 CA GLN A 53 -4.310 1.945 -10.651 1.00 10.00 C ATOM 554 C GLN A 53 -4.253 0.436 -10.882 1.00 10.00 C ATOM 555 O GLN A 53 -4.712 -0.062 -11.908 1.00 10.00 O ATOM 556 CB GLN A 53 -3.154 2.652 -11.359 1.00 10.00 C ATOM 557 CG GLN A 53 -3.232 4.168 -11.247 1.00 10.00 C ATOM 558 CD GLN A 53 -2.079 4.876 -11.929 1.00 10.00 C ATOM 559 OE1 GLN A 53 -0.977 4.340 -12.040 1.00 10.00 O ATOM 560 NE2 GLN A 53 -2.326 6.092 -12.388 1.00 10.00 N ATOM 0 H GLN A 53 -3.433 2.710 -8.909 1.00 10.00 H new ATOM 0 HA GLN A 53 -5.247 2.309 -11.072 1.00 10.00 H new ATOM 0 HB2 GLN A 53 -2.210 2.309 -10.935 1.00 10.00 H new ATOM 0 HB3 GLN A 53 -3.152 2.370 -12.412 1.00 10.00 H new ATOM 0 HG2 GLN A 53 -4.170 4.511 -11.684 1.00 10.00 H new ATOM 0 HG3 GLN A 53 -3.250 4.448 -10.194 1.00 10.00 H new ATOM 0 HE21 GLN A 53 -3.254 6.501 -12.276 1.00 10.00 H new ATOM 0 HE22 GLN A 53 -1.589 6.621 -12.854 1.00 10.00 H new ATOM 569 N ARG A 54 -3.687 -0.287 -9.921 1.00 10.00 N ATOM 570 CA ARG A 54 -3.600 -1.740 -10.006 1.00 10.00 C ATOM 571 C ARG A 54 -4.990 -2.343 -9.841 1.00 10.00 C ATOM 572 O ARG A 54 -5.365 -3.277 -10.547 1.00 10.00 O ATOM 573 CB ARG A 54 -2.653 -2.285 -8.930 1.00 10.00 C ATOM 574 CG ARG A 54 -2.692 -3.800 -8.771 1.00 10.00 C ATOM 575 CD ARG A 54 -2.035 -4.507 -9.945 1.00 10.00 C ATOM 576 NE ARG A 54 -1.743 -5.914 -9.658 1.00 10.00 N ATOM 577 CZ ARG A 54 -1.235 -6.764 -10.550 1.00 10.00 C ATOM 578 NH1 ARG A 54 -0.966 -6.346 -11.783 1.00 10.00 N ATOM 579 NH2 ARG A 54 -0.987 -8.023 -10.209 1.00 10.00 N ATOM 0 H ARG A 54 -3.281 0.110 -9.074 1.00 10.00 H new ATOM 0 HA ARG A 54 -3.202 -2.016 -10.982 1.00 10.00 H new ATOM 0 HB2 ARG A 54 -1.634 -1.983 -9.172 1.00 10.00 H new ATOM 0 HB3 ARG A 54 -2.904 -1.824 -7.974 1.00 10.00 H new ATOM 0 HG2 ARG A 54 -2.186 -4.082 -7.848 1.00 10.00 H new ATOM 0 HG3 ARG A 54 -3.727 -4.130 -8.681 1.00 10.00 H new ATOM 0 HD2 ARG A 54 -2.689 -4.445 -10.815 1.00 10.00 H new ATOM 0 HD3 ARG A 54 -1.110 -3.992 -10.204 1.00 10.00 H new ATOM 0 HE ARG A 54 -1.940 -6.263 -8.720 1.00 10.00 H new ATOM 0 HH11 ARG A 54 -1.148 -5.377 -12.044 1.00 10.00 H new ATOM 0 HH12 ARG A 54 -0.577 -6.994 -12.468 1.00 10.00 H new ATOM 0 HH21 ARG A 54 -1.185 -8.343 -9.261 1.00 10.00 H new ATOM 0 HH22 ARG A 54 -0.598 -8.670 -10.895 1.00 10.00 H new ATOM 593 N GLN A 55 -5.749 -1.790 -8.902 1.00 10.00 N ATOM 594 CA GLN A 55 -7.102 -2.248 -8.637 1.00 10.00 C ATOM 595 C GLN A 55 -8.050 -1.770 -9.734 1.00 10.00 C ATOM 596 O GLN A 55 -9.078 -2.391 -9.995 1.00 10.00 O ATOM 597 CB GLN A 55 -7.583 -1.734 -7.280 1.00 10.00 C ATOM 598 CG GLN A 55 -6.838 -2.330 -6.092 1.00 10.00 C ATOM 599 CD GLN A 55 -6.921 -3.843 -6.049 1.00 10.00 C ATOM 600 OE1 GLN A 55 -6.032 -4.542 -6.530 1.00 10.00 O ATOM 601 NE2 GLN A 55 -8.001 -4.358 -5.485 1.00 10.00 N ATOM 0 H GLN A 55 -5.445 -1.018 -8.309 1.00 10.00 H new ATOM 0 HA GLN A 55 -7.097 -3.338 -8.622 1.00 10.00 H new ATOM 0 HB2 GLN A 55 -7.477 -0.649 -7.255 1.00 10.00 H new ATOM 0 HB3 GLN A 55 -8.646 -1.953 -7.176 1.00 10.00 H new ATOM 0 HG2 GLN A 55 -5.791 -2.029 -6.136 1.00 10.00 H new ATOM 0 HG3 GLN A 55 -7.249 -1.921 -5.169 1.00 10.00 H new ATOM 0 HE21 GLN A 55 -8.716 -3.743 -5.097 1.00 10.00 H new ATOM 0 HE22 GLN A 55 -8.118 -5.370 -5.438 1.00 10.00 H new ATOM 610 N GLY A 56 -7.694 -0.660 -10.368 1.00 10.00 N ATOM 611 CA GLY A 56 -8.515 -0.113 -11.430 1.00 10.00 C ATOM 612 C GLY A 56 -9.442 0.968 -10.925 1.00 10.00 C ATOM 613 O GLY A 56 -10.532 1.171 -11.466 1.00 10.00 O ATOM 0 H GLY A 56 -6.848 -0.127 -10.164 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -7.874 0.295 -12.211 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -9.102 -0.912 -11.883 1.00 10.00 H new ATOM 617 N VAL A 57 -9.012 1.662 -9.883 1.00 10.00 N ATOM 618 CA VAL A 57 -9.803 2.730 -9.291 1.00 10.00 C ATOM 619 C VAL A 57 -8.973 4.004 -9.165 1.00 10.00 C ATOM 620 O VAL A 57 -7.746 3.944 -9.111 1.00 10.00 O ATOM 621 CB VAL A 57 -10.340 2.335 -7.893 1.00 10.00 C ATOM 622 CG1 VAL A 57 -11.431 1.283 -8.007 1.00 10.00 C ATOM 623 CG2 VAL A 57 -9.213 1.838 -7.002 1.00 10.00 C ATOM 0 H VAL A 57 -8.113 1.503 -9.427 1.00 10.00 H new ATOM 0 HA VAL A 57 -10.651 2.906 -9.953 1.00 10.00 H new ATOM 0 HB VAL A 57 -10.772 3.226 -7.437 1.00 10.00 H new ATOM 0 HG11 VAL A 57 -11.791 1.023 -7.012 1.00 10.00 H new ATOM 0 HG12 VAL A 57 -12.256 1.677 -8.600 1.00 10.00 H new ATOM 0 HG13 VAL A 57 -11.029 0.393 -8.491 1.00 10.00 H new ATOM 0 HG21 VAL A 57 -9.614 1.566 -6.025 1.00 10.00 H new ATOM 0 HG22 VAL A 57 -8.746 0.965 -7.458 1.00 10.00 H new ATOM 0 HG23 VAL A 57 -8.469 2.626 -6.882 1.00 10.00 H new ATOM 633 N PRO A 58 -9.625 5.176 -9.147 1.00 10.00 N ATOM 634 CA PRO A 58 -8.929 6.459 -9.002 1.00 10.00 C ATOM 635 C PRO A 58 -8.293 6.597 -7.621 1.00 10.00 C ATOM 636 O PRO A 58 -8.563 5.800 -6.724 1.00 10.00 O ATOM 637 CB PRO A 58 -10.041 7.496 -9.187 1.00 10.00 C ATOM 638 CG PRO A 58 -11.300 6.771 -8.856 1.00 10.00 C ATOM 639 CD PRO A 58 -11.082 5.347 -9.276 1.00 10.00 C ATOM 0 HA PRO A 58 -8.113 6.571 -9.715 1.00 10.00 H new ATOM 0 HB2 PRO A 58 -9.895 8.354 -8.530 1.00 10.00 H new ATOM 0 HB3 PRO A 58 -10.061 7.876 -10.208 1.00 10.00 H new ATOM 0 HG2 PRO A 58 -11.517 6.834 -7.790 1.00 10.00 H new ATOM 0 HG3 PRO A 58 -12.150 7.207 -9.381 1.00 10.00 H new ATOM 0 HD2 PRO A 58 -11.627 4.651 -8.638 1.00 10.00 H new ATOM 0 HD3 PRO A 58 -11.419 5.173 -10.298 1.00 10.00 H new ATOM 647 N MET A 59 -7.457 7.608 -7.440 1.00 10.00 N ATOM 648 CA MET A 59 -6.801 7.814 -6.159 1.00 10.00 C ATOM 649 C MET A 59 -7.745 8.512 -5.182 1.00 10.00 C ATOM 650 O MET A 59 -8.718 9.138 -5.599 1.00 10.00 O ATOM 651 CB MET A 59 -5.516 8.631 -6.339 1.00 10.00 C ATOM 652 CG MET A 59 -4.480 8.375 -5.255 1.00 10.00 C ATOM 653 SD MET A 59 -3.030 9.434 -5.404 1.00 10.00 S ATOM 654 CE MET A 59 -1.994 8.757 -4.111 1.00 10.00 C ATOM 0 H MET A 59 -7.219 8.293 -8.157 1.00 10.00 H new ATOM 0 HA MET A 59 -6.536 6.840 -5.747 1.00 10.00 H new ATOM 0 HB2 MET A 59 -5.080 8.398 -7.310 1.00 10.00 H new ATOM 0 HB3 MET A 59 -5.767 9.692 -6.348 1.00 10.00 H new ATOM 0 HG2 MET A 59 -4.938 8.531 -4.278 1.00 10.00 H new ATOM 0 HG3 MET A 59 -4.167 7.332 -5.298 1.00 10.00 H new ATOM 0 HE1 MET A 59 -0.976 9.127 -4.230 1.00 10.00 H new ATOM 0 HE2 MET A 59 -2.380 9.062 -3.138 1.00 10.00 H new ATOM 0 HE3 MET A 59 -1.995 7.669 -4.176 1.00 10.00 H new ATOM 664 N ASN A 60 -7.458 8.361 -3.885 1.00 10.00 N ATOM 665 CA ASN A 60 -8.253 8.968 -2.809 1.00 10.00 C ATOM 666 C ASN A 60 -9.584 8.237 -2.618 1.00 10.00 C ATOM 667 O ASN A 60 -10.459 8.692 -1.880 1.00 10.00 O ATOM 668 CB ASN A 60 -8.487 10.465 -3.065 1.00 10.00 C ATOM 669 CG ASN A 60 -8.669 11.264 -1.785 1.00 10.00 C ATOM 670 OD1 ASN A 60 -7.699 11.737 -1.189 1.00 10.00 O ATOM 671 ND2 ASN A 60 -9.909 11.424 -1.353 1.00 10.00 N ATOM 0 H ASN A 60 -6.666 7.813 -3.549 1.00 10.00 H new ATOM 0 HA ASN A 60 -7.680 8.869 -1.887 1.00 10.00 H new ATOM 0 HB2 ASN A 60 -7.642 10.869 -3.622 1.00 10.00 H new ATOM 0 HB3 ASN A 60 -9.370 10.587 -3.692 1.00 10.00 H new ATOM 0 HD21 ASN A 60 -10.087 11.954 -0.500 1.00 10.00 H new ATOM 0 HD22 ASN A 60 -10.687 11.018 -1.873 1.00 10.00 H new ATOM 678 N SER A 61 -9.730 7.099 -3.280 1.00 10.00 N ATOM 679 CA SER A 61 -10.940 6.303 -3.163 1.00 10.00 C ATOM 680 C SER A 61 -10.783 5.297 -2.028 1.00 10.00 C ATOM 681 O SER A 61 -11.703 5.066 -1.241 1.00 10.00 O ATOM 682 CB SER A 61 -11.213 5.574 -4.481 1.00 10.00 C ATOM 683 OG SER A 61 -10.086 4.806 -4.871 1.00 10.00 O ATOM 0 H SER A 61 -9.025 6.707 -3.904 1.00 10.00 H new ATOM 0 HA SER A 61 -11.783 6.958 -2.943 1.00 10.00 H new ATOM 0 HB2 SER A 61 -12.081 4.925 -4.370 1.00 10.00 H new ATOM 0 HB3 SER A 61 -11.453 6.298 -5.260 1.00 10.00 H new ATOM 0 HG SER A 61 -9.704 5.179 -5.693 1.00 10.00 H new ATOM 689 N LEU A 62 -9.594 4.716 -1.947 1.00 10.00 N ATOM 690 CA LEU A 62 -9.286 3.736 -0.924 1.00 10.00 C ATOM 691 C LEU A 62 -8.356 4.337 0.121 1.00 10.00 C ATOM 692 O LEU A 62 -7.423 5.073 -0.211 1.00 10.00 O ATOM 693 CB LEU A 62 -8.626 2.504 -1.549 1.00 10.00 C ATOM 694 CG LEU A 62 -9.375 1.879 -2.729 1.00 10.00 C ATOM 695 CD1 LEU A 62 -8.518 0.814 -3.397 1.00 10.00 C ATOM 696 CD2 LEU A 62 -10.701 1.289 -2.272 1.00 10.00 C ATOM 0 H LEU A 62 -8.823 4.911 -2.586 1.00 10.00 H new ATOM 0 HA LEU A 62 -10.218 3.437 -0.444 1.00 10.00 H new ATOM 0 HB2 LEU A 62 -7.625 2.780 -1.882 1.00 10.00 H new ATOM 0 HB3 LEU A 62 -8.507 1.746 -0.775 1.00 10.00 H new ATOM 0 HG LEU A 62 -9.584 2.662 -3.458 1.00 10.00 H new ATOM 0 HD11 LEU A 62 -9.065 0.379 -4.234 1.00 10.00 H new ATOM 0 HD12 LEU A 62 -7.595 1.265 -3.762 1.00 10.00 H new ATOM 0 HD13 LEU A 62 -8.279 0.033 -2.675 1.00 10.00 H new ATOM 0 HD21 LEU A 62 -11.217 0.850 -3.126 1.00 10.00 H new ATOM 0 HD22 LEU A 62 -10.518 0.518 -1.523 1.00 10.00 H new ATOM 0 HD23 LEU A 62 -11.319 2.075 -1.839 1.00 10.00 H new ATOM 708 N ARG A 63 -8.618 4.032 1.381 1.00 10.00 N ATOM 709 CA ARG A 63 -7.800 4.531 2.469 1.00 10.00 C ATOM 710 C ARG A 63 -6.856 3.442 2.960 1.00 10.00 C ATOM 711 O ARG A 63 -7.277 2.322 3.269 1.00 10.00 O ATOM 712 CB ARG A 63 -8.668 5.045 3.625 1.00 10.00 C ATOM 713 CG ARG A 63 -9.568 3.990 4.254 1.00 10.00 C ATOM 714 CD ARG A 63 -10.255 4.516 5.508 1.00 10.00 C ATOM 715 NE ARG A 63 -11.074 3.490 6.157 1.00 10.00 N ATOM 716 CZ ARG A 63 -12.403 3.416 6.052 1.00 10.00 C ATOM 717 NH1 ARG A 63 -13.075 4.330 5.359 1.00 10.00 N ATOM 718 NH2 ARG A 63 -13.061 2.433 6.659 1.00 10.00 N ATOM 0 H ARG A 63 -9.394 3.439 1.674 1.00 10.00 H new ATOM 0 HA ARG A 63 -7.211 5.368 2.093 1.00 10.00 H new ATOM 0 HB2 ARG A 63 -8.017 5.457 4.397 1.00 10.00 H new ATOM 0 HB3 ARG A 63 -9.288 5.864 3.261 1.00 10.00 H new ATOM 0 HG2 ARG A 63 -10.320 3.675 3.531 1.00 10.00 H new ATOM 0 HG3 ARG A 63 -8.977 3.109 4.504 1.00 10.00 H new ATOM 0 HD2 ARG A 63 -9.502 4.876 6.209 1.00 10.00 H new ATOM 0 HD3 ARG A 63 -10.882 5.369 5.247 1.00 10.00 H new ATOM 0 HE ARG A 63 -10.599 2.788 6.725 1.00 10.00 H new ATOM 0 HH11 ARG A 63 -12.575 5.094 4.903 1.00 10.00 H new ATOM 0 HH12 ARG A 63 -14.090 4.268 5.283 1.00 10.00 H new ATOM 0 HH21 ARG A 63 -12.551 1.738 7.203 1.00 10.00 H new ATOM 0 HH22 ARG A 63 -14.076 2.374 6.580 1.00 10.00 H new ATOM 732 N PHE A 64 -5.578 3.771 3.007 1.00 10.00 N ATOM 733 CA PHE A 64 -4.566 2.837 3.463 1.00 10.00 C ATOM 734 C PHE A 64 -4.363 3.008 4.959 1.00 10.00 C ATOM 735 O PHE A 64 -3.968 4.078 5.420 1.00 10.00 O ATOM 736 CB PHE A 64 -3.253 3.066 2.712 1.00 10.00 C ATOM 737 CG PHE A 64 -3.343 2.761 1.244 1.00 10.00 C ATOM 738 CD1 PHE A 64 -3.785 3.722 0.351 1.00 10.00 C ATOM 739 CD2 PHE A 64 -2.988 1.513 0.761 1.00 10.00 C ATOM 740 CE1 PHE A 64 -3.873 3.444 -0.997 1.00 10.00 C ATOM 741 CE2 PHE A 64 -3.072 1.230 -0.588 1.00 10.00 C ATOM 742 CZ PHE A 64 -3.517 2.198 -1.467 1.00 10.00 C ATOM 0 H PHE A 64 -5.215 4.684 2.733 1.00 10.00 H new ATOM 0 HA PHE A 64 -4.897 1.818 3.261 1.00 10.00 H new ATOM 0 HB2 PHE A 64 -2.945 4.104 2.841 1.00 10.00 H new ATOM 0 HB3 PHE A 64 -2.476 2.445 3.157 1.00 10.00 H new ATOM 0 HD1 PHE A 64 -4.064 4.700 0.714 1.00 10.00 H new ATOM 0 HD2 PHE A 64 -2.642 0.753 1.446 1.00 10.00 H new ATOM 0 HE1 PHE A 64 -4.220 4.202 -1.684 1.00 10.00 H new ATOM 0 HE2 PHE A 64 -2.790 0.254 -0.955 1.00 10.00 H new ATOM 0 HZ PHE A 64 -3.586 1.979 -2.522 1.00 10.00 H new ATOM 752 N LEU A 65 -4.642 1.961 5.714 1.00 10.00 N ATOM 753 CA LEU A 65 -4.514 2.013 7.158 1.00 10.00 C ATOM 754 C LEU A 65 -3.359 1.156 7.640 1.00 10.00 C ATOM 755 O LEU A 65 -3.221 -0.006 7.252 1.00 10.00 O ATOM 756 CB LEU A 65 -5.812 1.554 7.819 1.00 10.00 C ATOM 757 CG LEU A 65 -7.052 2.369 7.445 1.00 10.00 C ATOM 758 CD1 LEU A 65 -8.311 1.662 7.915 1.00 10.00 C ATOM 759 CD2 LEU A 65 -6.979 3.767 8.040 1.00 10.00 C ATOM 0 H LEU A 65 -4.959 1.063 5.350 1.00 10.00 H new ATOM 0 HA LEU A 65 -4.311 3.047 7.439 1.00 10.00 H new ATOM 0 HB2 LEU A 65 -5.988 0.511 7.554 1.00 10.00 H new ATOM 0 HB3 LEU A 65 -5.684 1.591 8.901 1.00 10.00 H new ATOM 0 HG LEU A 65 -7.086 2.460 6.359 1.00 10.00 H new ATOM 0 HD11 LEU A 65 -9.184 2.254 7.642 1.00 10.00 H new ATOM 0 HD12 LEU A 65 -8.375 0.681 7.443 1.00 10.00 H new ATOM 0 HD13 LEU A 65 -8.278 1.542 8.998 1.00 10.00 H new ATOM 0 HD21 LEU A 65 -7.871 4.328 7.761 1.00 10.00 H new ATOM 0 HD22 LEU A 65 -6.919 3.697 9.126 1.00 10.00 H new ATOM 0 HD23 LEU A 65 -6.095 4.279 7.660 1.00 10.00 H new ATOM 771 N PHE A 66 -2.535 1.746 8.483 1.00 10.00 N ATOM 772 CA PHE A 66 -1.389 1.066 9.049 1.00 10.00 C ATOM 773 C PHE A 66 -1.303 1.382 10.536 1.00 10.00 C ATOM 774 O PHE A 66 -1.103 2.539 10.915 1.00 10.00 O ATOM 775 CB PHE A 66 -0.104 1.494 8.335 1.00 10.00 C ATOM 776 CG PHE A 66 1.097 0.659 8.687 1.00 10.00 C ATOM 777 CD1 PHE A 66 1.313 -0.561 8.068 1.00 10.00 C ATOM 778 CD2 PHE A 66 2.009 1.098 9.634 1.00 10.00 C ATOM 779 CE1 PHE A 66 2.418 -1.326 8.386 1.00 10.00 C ATOM 780 CE2 PHE A 66 3.115 0.335 9.957 1.00 10.00 C ATOM 781 CZ PHE A 66 3.320 -0.878 9.333 1.00 10.00 C ATOM 0 H PHE A 66 -2.642 2.711 8.795 1.00 10.00 H new ATOM 0 HA PHE A 66 -1.506 -0.009 8.915 1.00 10.00 H new ATOM 0 HB2 PHE A 66 -0.265 1.445 7.258 1.00 10.00 H new ATOM 0 HB3 PHE A 66 0.106 2.535 8.579 1.00 10.00 H new ATOM 0 HD1 PHE A 66 0.610 -0.918 7.329 1.00 10.00 H new ATOM 0 HD2 PHE A 66 1.853 2.047 10.125 1.00 10.00 H new ATOM 0 HE1 PHE A 66 2.577 -2.274 7.895 1.00 10.00 H new ATOM 0 HE2 PHE A 66 3.818 0.688 10.697 1.00 10.00 H new ATOM 0 HZ PHE A 66 4.183 -1.476 9.584 1.00 10.00 H new ATOM 791 N GLU A 67 -1.486 0.358 11.368 1.00 10.00 N ATOM 792 CA GLU A 67 -1.447 0.511 12.823 1.00 10.00 C ATOM 793 C GLU A 67 -2.549 1.456 13.296 1.00 10.00 C ATOM 794 O GLU A 67 -2.398 2.172 14.287 1.00 10.00 O ATOM 795 CB GLU A 67 -0.071 1.010 13.283 1.00 10.00 C ATOM 796 CG GLU A 67 1.057 0.027 13.007 1.00 10.00 C ATOM 797 CD GLU A 67 0.947 -1.244 13.828 1.00 10.00 C ATOM 798 OE1 GLU A 67 -0.015 -2.017 13.619 1.00 10.00 O ATOM 799 OE2 GLU A 67 1.824 -1.484 14.679 1.00 10.00 O ATOM 0 H GLU A 67 -1.665 -0.596 11.056 1.00 10.00 H new ATOM 0 HA GLU A 67 -1.620 -0.467 13.271 1.00 10.00 H new ATOM 0 HB2 GLU A 67 0.150 1.953 12.783 1.00 10.00 H new ATOM 0 HB3 GLU A 67 -0.108 1.217 14.353 1.00 10.00 H new ATOM 0 HG2 GLU A 67 1.057 -0.230 11.948 1.00 10.00 H new ATOM 0 HG3 GLU A 67 2.012 0.509 13.219 1.00 10.00 H new ATOM 806 N GLY A 68 -3.660 1.457 12.566 1.00 10.00 N ATOM 807 CA GLY A 68 -4.783 2.306 12.916 1.00 10.00 C ATOM 808 C GLY A 68 -4.729 3.672 12.254 1.00 10.00 C ATOM 809 O GLY A 68 -5.762 4.304 12.038 1.00 10.00 O ATOM 0 H GLY A 68 -3.802 0.882 11.735 1.00 10.00 H new ATOM 0 HA2 GLY A 68 -5.710 1.808 12.631 1.00 10.00 H new ATOM 0 HA3 GLY A 68 -4.810 2.435 13.998 1.00 10.00 H new ATOM 813 N GLN A 69 -3.525 4.123 11.917 1.00 10.00 N ATOM 814 CA GLN A 69 -3.347 5.426 11.285 1.00 10.00 C ATOM 815 C GLN A 69 -3.532 5.330 9.775 1.00 10.00 C ATOM 816 O GLN A 69 -3.298 4.278 9.179 1.00 10.00 O ATOM 817 CB GLN A 69 -1.954 5.985 11.593 1.00 10.00 C ATOM 818 CG GLN A 69 -1.596 5.980 13.072 1.00 10.00 C ATOM 819 CD GLN A 69 -0.320 6.748 13.363 1.00 10.00 C ATOM 820 OE1 GLN A 69 0.569 6.850 12.516 1.00 10.00 O ATOM 821 NE2 GLN A 69 -0.217 7.287 14.565 1.00 10.00 N ATOM 0 H GLN A 69 -2.659 3.606 12.071 1.00 10.00 H new ATOM 0 HA GLN A 69 -4.104 6.098 11.690 1.00 10.00 H new ATOM 0 HB2 GLN A 69 -1.212 5.402 11.048 1.00 10.00 H new ATOM 0 HB3 GLN A 69 -1.893 7.007 11.219 1.00 10.00 H new ATOM 0 HG2 GLN A 69 -2.416 6.415 13.643 1.00 10.00 H new ATOM 0 HG3 GLN A 69 -1.482 4.951 13.412 1.00 10.00 H new ATOM 0 HE21 GLN A 69 -0.975 7.180 15.239 1.00 10.00 H new ATOM 0 HE22 GLN A 69 0.621 7.810 14.819 1.00 10.00 H new ATOM 830 N ARG A 70 -3.961 6.424 9.161 1.00 10.00 N ATOM 831 CA ARG A 70 -4.151 6.453 7.718 1.00 10.00 C ATOM 832 C ARG A 70 -2.895 6.988 7.039 1.00 10.00 C ATOM 833 O ARG A 70 -2.373 8.043 7.404 1.00 10.00 O ATOM 834 CB ARG A 70 -5.387 7.280 7.332 1.00 10.00 C ATOM 835 CG ARG A 70 -5.362 8.722 7.817 1.00 10.00 C ATOM 836 CD ARG A 70 -6.718 9.393 7.643 1.00 10.00 C ATOM 837 NE ARG A 70 -7.034 9.683 6.240 1.00 10.00 N ATOM 838 CZ ARG A 70 -8.104 9.210 5.592 1.00 10.00 C ATOM 839 NH1 ARG A 70 -8.946 8.374 6.185 1.00 10.00 N ATOM 840 NH2 ARG A 70 -8.340 9.573 4.341 1.00 10.00 N ATOM 0 H ARG A 70 -4.183 7.299 9.637 1.00 10.00 H new ATOM 0 HA ARG A 70 -4.327 5.434 7.373 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -5.485 7.277 6.246 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -6.275 6.791 7.733 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -5.074 8.749 8.868 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -4.605 9.280 7.265 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -7.493 8.749 8.059 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -6.734 10.322 8.214 1.00 10.00 H new ATOM 0 HE ARG A 70 -6.394 10.286 5.724 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -8.782 8.083 7.149 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -9.758 8.022 5.677 1.00 10.00 H new ATOM 0 HH21 ARG A 70 -7.705 10.216 3.868 1.00 10.00 H new ATOM 0 HH22 ARG A 70 -9.157 9.210 3.850 1.00 10.00 H new ATOM 854 N ILE A 71 -2.404 6.239 6.064 1.00 10.00 N ATOM 855 CA ILE A 71 -1.203 6.608 5.331 1.00 10.00 C ATOM 856 C ILE A 71 -1.443 7.833 4.454 1.00 10.00 C ATOM 857 O ILE A 71 -2.325 7.832 3.587 1.00 10.00 O ATOM 858 CB ILE A 71 -0.703 5.438 4.450 1.00 10.00 C ATOM 859 CG1 ILE A 71 -0.396 4.209 5.315 1.00 10.00 C ATOM 860 CG2 ILE A 71 0.527 5.850 3.650 1.00 10.00 C ATOM 861 CD1 ILE A 71 0.653 4.464 6.378 1.00 10.00 C ATOM 0 H ILE A 71 -2.825 5.361 5.759 1.00 10.00 H new ATOM 0 HA ILE A 71 -0.440 6.847 6.072 1.00 10.00 H new ATOM 0 HB ILE A 71 -1.494 5.178 3.747 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -1.315 3.874 5.796 1.00 10.00 H new ATOM 0 HG13 ILE A 71 -0.059 3.397 4.671 1.00 10.00 H new ATOM 0 HG21 ILE A 71 0.861 5.012 3.038 1.00 10.00 H new ATOM 0 HG22 ILE A 71 0.276 6.693 3.005 1.00 10.00 H new ATOM 0 HG23 ILE A 71 1.325 6.141 4.333 1.00 10.00 H new ATOM 0 HD11 ILE A 71 0.819 3.552 6.951 1.00 10.00 H new ATOM 0 HD12 ILE A 71 1.585 4.769 5.903 1.00 10.00 H new ATOM 0 HD13 ILE A 71 0.310 5.255 7.045 1.00 10.00 H new ATOM 873 N ALA A 72 -0.660 8.872 4.690 1.00 10.00 N ATOM 874 CA ALA A 72 -0.764 10.107 3.933 1.00 10.00 C ATOM 875 C ALA A 72 0.069 10.020 2.660 1.00 10.00 C ATOM 876 O ALA A 72 0.763 9.029 2.428 1.00 10.00 O ATOM 877 CB ALA A 72 -0.312 11.280 4.787 1.00 10.00 C ATOM 0 H ALA A 72 0.063 8.883 5.409 1.00 10.00 H new ATOM 0 HA ALA A 72 -1.806 10.261 3.651 1.00 10.00 H new ATOM 0 HB1 ALA A 72 -0.393 12.202 4.211 1.00 10.00 H new ATOM 0 HB2 ALA A 72 -0.943 11.349 5.673 1.00 10.00 H new ATOM 0 HB3 ALA A 72 0.725 11.132 5.090 1.00 10.00 H new ATOM 883 N ASP A 73 -0.002 11.052 1.834 1.00 10.00 N ATOM 884 CA ASP A 73 0.751 11.079 0.588 1.00 10.00 C ATOM 885 C ASP A 73 2.169 11.573 0.845 1.00 10.00 C ATOM 886 O ASP A 73 3.053 11.456 -0.002 1.00 10.00 O ATOM 887 CB ASP A 73 0.043 11.956 -0.448 1.00 10.00 C ATOM 888 CG ASP A 73 -1.103 11.231 -1.135 1.00 10.00 C ATOM 889 OD1 ASP A 73 -1.787 10.425 -0.469 1.00 10.00 O ATOM 890 OD2 ASP A 73 -1.323 11.464 -2.344 1.00 10.00 O ATOM 0 H ASP A 73 -0.572 11.881 2.003 1.00 10.00 H new ATOM 0 HA ASP A 73 0.807 10.067 0.187 1.00 10.00 H new ATOM 0 HB2 ASP A 73 -0.338 12.853 0.039 1.00 10.00 H new ATOM 0 HB3 ASP A 73 0.764 12.282 -1.197 1.00 10.00 H new ATOM 895 N ASN A 74 2.374 12.116 2.035 1.00 10.00 N ATOM 896 CA ASN A 74 3.679 12.618 2.446 1.00 10.00 C ATOM 897 C ASN A 74 4.308 11.649 3.442 1.00 10.00 C ATOM 898 O ASN A 74 5.122 12.030 4.285 1.00 10.00 O ATOM 899 CB ASN A 74 3.548 14.015 3.064 1.00 10.00 C ATOM 900 CG ASN A 74 2.607 14.048 4.257 1.00 10.00 C ATOM 901 OD1 ASN A 74 1.388 14.135 4.101 1.00 10.00 O ATOM 902 ND2 ASN A 74 3.163 13.992 5.455 1.00 10.00 N ATOM 0 H ASN A 74 1.645 12.222 2.741 1.00 10.00 H new ATOM 0 HA ASN A 74 4.323 12.696 1.570 1.00 10.00 H new ATOM 0 HB2 ASN A 74 4.533 14.363 3.375 1.00 10.00 H new ATOM 0 HB3 ASN A 74 3.189 14.710 2.305 1.00 10.00 H new ATOM 0 HD21 ASN A 74 2.578 14.021 6.290 1.00 10.00 H new ATOM 0 HD22 ASN A 74 4.177 13.920 5.544 1.00 10.00 H new ATOM 909 N HIS A 75 3.922 10.389 3.324 1.00 10.00 N ATOM 910 CA HIS A 75 4.419 9.339 4.200 1.00 10.00 C ATOM 911 C HIS A 75 5.584 8.597 3.551 1.00 10.00 C ATOM 912 O HIS A 75 5.564 8.315 2.352 1.00 10.00 O ATOM 913 CB HIS A 75 3.294 8.349 4.519 1.00 10.00 C ATOM 914 CG HIS A 75 2.869 8.345 5.956 1.00 10.00 C ATOM 915 ND1 HIS A 75 1.627 8.788 6.338 1.00 10.00 N ATOM 916 CD2 HIS A 75 3.542 7.926 7.054 1.00 10.00 C ATOM 917 CE1 HIS A 75 1.572 8.632 7.649 1.00 10.00 C ATOM 918 NE2 HIS A 75 2.710 8.112 8.128 1.00 10.00 N ATOM 0 H HIS A 75 3.258 10.065 2.621 1.00 10.00 H new ATOM 0 HA HIS A 75 4.771 9.801 5.122 1.00 10.00 H new ATOM 0 HB2 HIS A 75 2.431 8.585 3.897 1.00 10.00 H new ATOM 0 HB3 HIS A 75 3.620 7.345 4.245 1.00 10.00 H new ATOM 0 HD2 HIS A 75 4.543 7.522 7.079 1.00 10.00 H new ATOM 0 HE1 HIS A 75 0.718 8.891 8.257 1.00 10.00 H new ATOM 0 HE2 HIS A 75 2.917 7.896 9.103 1.00 10.00 H new ATOM 926 N THR A 76 6.597 8.296 4.342 1.00 10.00 N ATOM 927 CA THR A 76 7.759 7.570 3.855 1.00 10.00 C ATOM 928 C THR A 76 7.852 6.225 4.578 1.00 10.00 C ATOM 929 O THR A 76 7.607 6.158 5.780 1.00 10.00 O ATOM 930 CB THR A 76 9.057 8.375 4.082 1.00 10.00 C ATOM 931 OG1 THR A 76 8.739 9.725 4.450 1.00 10.00 O ATOM 932 CG2 THR A 76 9.913 8.385 2.825 1.00 10.00 C ATOM 0 H THR A 76 6.640 8.544 5.330 1.00 10.00 H new ATOM 0 HA THR A 76 7.644 7.411 2.783 1.00 10.00 H new ATOM 0 HB THR A 76 9.617 7.897 4.886 1.00 10.00 H new ATOM 0 HG1 THR A 76 8.411 9.744 5.373 1.00 10.00 H new ATOM 0 HG21 THR A 76 10.822 8.958 3.008 1.00 10.00 H new ATOM 0 HG22 THR A 76 10.177 7.362 2.556 1.00 10.00 H new ATOM 0 HG23 THR A 76 9.355 8.842 2.008 1.00 10.00 H new ATOM 940 N PRO A 77 8.201 5.134 3.870 1.00 10.00 N ATOM 941 CA PRO A 77 8.303 3.790 4.475 1.00 10.00 C ATOM 942 C PRO A 77 9.344 3.704 5.596 1.00 10.00 C ATOM 943 O PRO A 77 9.448 2.687 6.283 1.00 10.00 O ATOM 944 CB PRO A 77 8.721 2.894 3.302 1.00 10.00 C ATOM 945 CG PRO A 77 8.365 3.657 2.076 1.00 10.00 C ATOM 946 CD PRO A 77 8.513 5.107 2.430 1.00 10.00 C ATOM 0 HA PRO A 77 7.363 3.503 4.946 1.00 10.00 H new ATOM 0 HB2 PRO A 77 9.789 2.678 3.334 1.00 10.00 H new ATOM 0 HB3 PRO A 77 8.201 1.937 3.334 1.00 10.00 H new ATOM 0 HG2 PRO A 77 9.020 3.390 1.247 1.00 10.00 H new ATOM 0 HG3 PRO A 77 7.345 3.435 1.761 1.00 10.00 H new ATOM 0 HD2 PRO A 77 9.521 5.470 2.229 1.00 10.00 H new ATOM 0 HD3 PRO A 77 7.829 5.733 1.858 1.00 10.00 H new ATOM 954 N LYS A 78 10.117 4.769 5.769 1.00 10.00 N ATOM 955 CA LYS A 78 11.148 4.812 6.797 1.00 10.00 C ATOM 956 C LYS A 78 10.573 5.262 8.145 1.00 10.00 C ATOM 957 O LYS A 78 11.199 5.075 9.189 1.00 10.00 O ATOM 958 CB LYS A 78 12.276 5.756 6.364 1.00 10.00 C ATOM 959 CG LYS A 78 13.519 5.691 7.239 1.00 10.00 C ATOM 960 CD LYS A 78 14.226 4.348 7.121 1.00 10.00 C ATOM 961 CE LYS A 78 14.891 4.172 5.762 1.00 10.00 C ATOM 962 NZ LYS A 78 15.991 5.152 5.545 1.00 10.00 N ATOM 0 H LYS A 78 10.048 5.618 5.208 1.00 10.00 H new ATOM 0 HA LYS A 78 11.546 3.805 6.922 1.00 10.00 H new ATOM 0 HB2 LYS A 78 12.556 5.521 5.337 1.00 10.00 H new ATOM 0 HB3 LYS A 78 11.898 6.779 6.365 1.00 10.00 H new ATOM 0 HG2 LYS A 78 14.205 6.489 6.955 1.00 10.00 H new ATOM 0 HG3 LYS A 78 13.241 5.865 8.278 1.00 10.00 H new ATOM 0 HD2 LYS A 78 14.977 4.263 7.906 1.00 10.00 H new ATOM 0 HD3 LYS A 78 13.507 3.544 7.280 1.00 10.00 H new ATOM 0 HE2 LYS A 78 15.287 3.160 5.681 1.00 10.00 H new ATOM 0 HE3 LYS A 78 14.144 4.286 4.976 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 16.575 4.846 4.741 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 15.587 6.089 5.343 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 16.581 5.207 6.400 1.00 10.00 H new ATOM 976 N GLU A 79 9.387 5.858 8.124 1.00 10.00 N ATOM 977 CA GLU A 79 8.759 6.322 9.356 1.00 10.00 C ATOM 978 C GLU A 79 7.647 5.369 9.785 1.00 10.00 C ATOM 979 O GLU A 79 7.352 4.403 9.075 1.00 10.00 O ATOM 980 CB GLU A 79 8.213 7.744 9.194 1.00 10.00 C ATOM 981 CG GLU A 79 7.055 7.860 8.214 1.00 10.00 C ATOM 982 CD GLU A 79 6.828 9.283 7.756 1.00 10.00 C ATOM 983 OE1 GLU A 79 6.126 10.035 8.458 1.00 10.00 O ATOM 984 OE2 GLU A 79 7.361 9.660 6.691 1.00 10.00 O ATOM 0 H GLU A 79 8.845 6.030 7.277 1.00 10.00 H new ATOM 0 HA GLU A 79 9.521 6.339 10.135 1.00 10.00 H new ATOM 0 HB2 GLU A 79 7.888 8.109 10.168 1.00 10.00 H new ATOM 0 HB3 GLU A 79 9.021 8.396 8.863 1.00 10.00 H new ATOM 0 HG2 GLU A 79 7.252 7.229 7.347 1.00 10.00 H new ATOM 0 HG3 GLU A 79 6.146 7.483 8.683 1.00 10.00 H new ATOM 991 N LEU A 80 7.051 5.647 10.950 1.00 10.00 N ATOM 992 CA LEU A 80 5.973 4.830 11.521 1.00 10.00 C ATOM 993 C LEU A 80 6.528 3.503 12.035 1.00 10.00 C ATOM 994 O LEU A 80 6.500 3.233 13.234 1.00 10.00 O ATOM 995 CB LEU A 80 4.849 4.586 10.501 1.00 10.00 C ATOM 996 CG LEU A 80 3.435 4.926 10.987 1.00 10.00 C ATOM 997 CD1 LEU A 80 2.450 4.884 9.829 1.00 10.00 C ATOM 998 CD2 LEU A 80 3.005 3.969 12.092 1.00 10.00 C ATOM 0 H LEU A 80 7.304 6.449 11.527 1.00 10.00 H new ATOM 0 HA LEU A 80 5.544 5.381 12.358 1.00 10.00 H new ATOM 0 HB2 LEU A 80 5.059 5.173 9.607 1.00 10.00 H new ATOM 0 HB3 LEU A 80 4.871 3.537 10.205 1.00 10.00 H new ATOM 0 HG LEU A 80 3.444 5.937 11.394 1.00 10.00 H new ATOM 0 HD11 LEU A 80 1.451 5.128 10.192 1.00 10.00 H new ATOM 0 HD12 LEU A 80 2.748 5.609 9.071 1.00 10.00 H new ATOM 0 HD13 LEU A 80 2.444 3.885 9.393 1.00 10.00 H new ATOM 0 HD21 LEU A 80 1.999 4.226 12.424 1.00 10.00 H new ATOM 0 HD22 LEU A 80 3.012 2.947 11.712 1.00 10.00 H new ATOM 0 HD23 LEU A 80 3.696 4.048 12.931 1.00 10.00 H new ATOM 1010 N GLY A 81 7.060 2.697 11.128 1.00 10.00 N ATOM 1011 CA GLY A 81 7.621 1.416 11.502 1.00 10.00 C ATOM 1012 C GLY A 81 7.213 0.316 10.546 1.00 10.00 C ATOM 1013 O GLY A 81 6.581 -0.662 10.947 1.00 10.00 O ATOM 0 H GLY A 81 7.113 2.910 10.132 1.00 10.00 H new ATOM 0 HA2 GLY A 81 8.708 1.490 11.526 1.00 10.00 H new ATOM 0 HA3 GLY A 81 7.296 1.159 12.510 1.00 10.00 H new ATOM 1017 N MET A 82 7.570 0.485 9.282 1.00 10.00 N ATOM 1018 CA MET A 82 7.241 -0.493 8.256 1.00 10.00 C ATOM 1019 C MET A 82 8.419 -1.427 8.017 1.00 10.00 C ATOM 1020 O MET A 82 9.547 -0.976 7.806 1.00 10.00 O ATOM 1021 CB MET A 82 6.869 0.206 6.946 1.00 10.00 C ATOM 1022 CG MET A 82 5.461 0.773 6.928 1.00 10.00 C ATOM 1023 SD MET A 82 5.063 1.573 5.363 1.00 10.00 S ATOM 1024 CE MET A 82 3.299 1.804 5.554 1.00 10.00 C ATOM 0 H MET A 82 8.090 1.294 8.941 1.00 10.00 H new ATOM 0 HA MET A 82 6.387 -1.074 8.603 1.00 10.00 H new ATOM 0 HB2 MET A 82 7.578 1.014 6.763 1.00 10.00 H new ATOM 0 HB3 MET A 82 6.975 -0.503 6.125 1.00 10.00 H new ATOM 0 HG2 MET A 82 4.747 -0.029 7.115 1.00 10.00 H new ATOM 0 HG3 MET A 82 5.352 1.493 7.739 1.00 10.00 H new ATOM 0 HE1 MET A 82 2.897 2.290 4.665 1.00 10.00 H new ATOM 0 HE2 MET A 82 2.817 0.835 5.687 1.00 10.00 H new ATOM 0 HE3 MET A 82 3.106 2.428 6.427 1.00 10.00 H new ATOM 1034 N GLU A 83 8.161 -2.723 8.064 1.00 10.00 N ATOM 1035 CA GLU A 83 9.202 -3.713 7.844 1.00 10.00 C ATOM 1036 C GLU A 83 8.732 -4.784 6.868 1.00 10.00 C ATOM 1037 O GLU A 83 7.601 -4.740 6.383 1.00 10.00 O ATOM 1038 CB GLU A 83 9.626 -4.354 9.168 1.00 10.00 C ATOM 1039 CG GLU A 83 10.909 -3.770 9.739 1.00 10.00 C ATOM 1040 CD GLU A 83 12.060 -3.834 8.754 1.00 10.00 C ATOM 1041 OE1 GLU A 83 12.736 -2.805 8.554 1.00 10.00 O ATOM 1042 OE2 GLU A 83 12.288 -4.919 8.169 1.00 10.00 O ATOM 0 H GLU A 83 7.238 -3.115 8.253 1.00 10.00 H new ATOM 0 HA GLU A 83 10.064 -3.205 7.411 1.00 10.00 H new ATOM 0 HB2 GLU A 83 8.824 -4.231 9.896 1.00 10.00 H new ATOM 0 HB3 GLU A 83 9.759 -5.425 9.018 1.00 10.00 H new ATOM 0 HG2 GLU A 83 10.737 -2.733 10.026 1.00 10.00 H new ATOM 0 HG3 GLU A 83 11.179 -4.311 10.646 1.00 10.00 H new ATOM 1049 N GLU A 84 9.613 -5.732 6.579 1.00 10.00 N ATOM 1050 CA GLU A 84 9.308 -6.819 5.662 1.00 10.00 C ATOM 1051 C GLU A 84 8.202 -7.707 6.228 1.00 10.00 C ATOM 1052 O GLU A 84 8.198 -8.016 7.425 1.00 10.00 O ATOM 1053 CB GLU A 84 10.577 -7.643 5.399 1.00 10.00 C ATOM 1054 CG GLU A 84 10.360 -8.865 4.513 1.00 10.00 C ATOM 1055 CD GLU A 84 9.983 -8.511 3.086 1.00 10.00 C ATOM 1056 OE1 GLU A 84 10.125 -7.331 2.703 1.00 10.00 O ATOM 1057 OE2 GLU A 84 9.550 -9.417 2.339 1.00 10.00 O ATOM 0 H GLU A 84 10.554 -5.769 6.972 1.00 10.00 H new ATOM 0 HA GLU A 84 8.954 -6.399 4.721 1.00 10.00 H new ATOM 0 HB2 GLU A 84 11.324 -7.000 4.934 1.00 10.00 H new ATOM 0 HB3 GLU A 84 10.988 -7.970 6.354 1.00 10.00 H new ATOM 0 HG2 GLU A 84 11.270 -9.465 4.503 1.00 10.00 H new ATOM 0 HG3 GLU A 84 9.575 -9.485 4.946 1.00 10.00 H new ATOM 1064 N GLU A 85 7.261 -8.087 5.362 1.00 10.00 N ATOM 1065 CA GLU A 85 6.140 -8.948 5.736 1.00 10.00 C ATOM 1066 C GLU A 85 5.214 -8.256 6.729 1.00 10.00 C ATOM 1067 O GLU A 85 4.675 -8.892 7.639 1.00 10.00 O ATOM 1068 CB GLU A 85 6.641 -10.271 6.317 1.00 10.00 C ATOM 1069 CG GLU A 85 7.150 -11.236 5.264 1.00 10.00 C ATOM 1070 CD GLU A 85 6.041 -11.769 4.382 1.00 10.00 C ATOM 1071 OE1 GLU A 85 5.239 -12.598 4.865 1.00 10.00 O ATOM 1072 OE2 GLU A 85 5.975 -11.368 3.201 1.00 10.00 O ATOM 0 H GLU A 85 7.255 -7.806 4.382 1.00 10.00 H new ATOM 0 HA GLU A 85 5.571 -9.156 4.830 1.00 10.00 H new ATOM 0 HB2 GLU A 85 7.440 -10.067 7.029 1.00 10.00 H new ATOM 0 HB3 GLU A 85 5.832 -10.745 6.873 1.00 10.00 H new ATOM 0 HG2 GLU A 85 7.893 -10.734 4.644 1.00 10.00 H new ATOM 0 HG3 GLU A 85 7.654 -12.070 5.753 1.00 10.00 H new ATOM 1079 N ASP A 86 5.032 -6.954 6.554 1.00 10.00 N ATOM 1080 CA ASP A 86 4.157 -6.191 7.432 1.00 10.00 C ATOM 1081 C ASP A 86 2.716 -6.299 6.958 1.00 10.00 C ATOM 1082 O ASP A 86 2.453 -6.812 5.871 1.00 10.00 O ATOM 1083 CB ASP A 86 4.579 -4.725 7.488 1.00 10.00 C ATOM 1084 CG ASP A 86 4.489 -4.156 8.888 1.00 10.00 C ATOM 1085 OD1 ASP A 86 3.424 -4.302 9.532 1.00 10.00 O ATOM 1086 OD2 ASP A 86 5.489 -3.568 9.350 1.00 10.00 O ATOM 0 H ASP A 86 5.476 -6.407 5.816 1.00 10.00 H new ATOM 0 HA ASP A 86 4.237 -6.608 8.436 1.00 10.00 H new ATOM 0 HB2 ASP A 86 5.602 -4.629 7.124 1.00 10.00 H new ATOM 0 HB3 ASP A 86 3.947 -4.141 6.819 1.00 10.00 H new ATOM 1091 N VAL A 87 1.788 -5.802 7.757 1.00 10.00 N ATOM 1092 CA VAL A 87 0.376 -5.871 7.412 1.00 10.00 C ATOM 1093 C VAL A 87 -0.218 -4.481 7.230 1.00 10.00 C ATOM 1094 O VAL A 87 -0.123 -3.634 8.114 1.00 10.00 O ATOM 1095 CB VAL A 87 -0.433 -6.621 8.491 1.00 10.00 C ATOM 1096 CG1 VAL A 87 -1.887 -6.776 8.072 1.00 10.00 C ATOM 1097 CG2 VAL A 87 0.186 -7.980 8.780 1.00 10.00 C ATOM 0 H VAL A 87 1.985 -5.347 8.648 1.00 10.00 H new ATOM 0 HA VAL A 87 0.312 -6.417 6.471 1.00 10.00 H new ATOM 0 HB VAL A 87 -0.404 -6.028 9.405 1.00 10.00 H new ATOM 0 HG11 VAL A 87 -2.435 -7.308 8.850 1.00 10.00 H new ATOM 0 HG12 VAL A 87 -2.330 -5.791 7.925 1.00 10.00 H new ATOM 0 HG13 VAL A 87 -1.939 -7.340 7.141 1.00 10.00 H new ATOM 0 HG21 VAL A 87 -0.400 -8.492 9.543 1.00 10.00 H new ATOM 0 HG22 VAL A 87 0.195 -8.577 7.868 1.00 10.00 H new ATOM 0 HG23 VAL A 87 1.208 -7.846 9.136 1.00 10.00 H new ATOM 1107 N ILE A 88 -0.827 -4.258 6.076 1.00 10.00 N ATOM 1108 CA ILE A 88 -1.457 -2.985 5.772 1.00 10.00 C ATOM 1109 C ILE A 88 -2.893 -3.224 5.309 1.00 10.00 C ATOM 1110 O ILE A 88 -3.160 -4.145 4.533 1.00 10.00 O ATOM 1111 CB ILE A 88 -0.658 -2.196 4.703 1.00 10.00 C ATOM 1112 CG1 ILE A 88 -1.377 -0.892 4.335 1.00 10.00 C ATOM 1113 CG2 ILE A 88 -0.414 -3.047 3.463 1.00 10.00 C ATOM 1114 CD1 ILE A 88 -0.534 0.049 3.500 1.00 10.00 C ATOM 0 H ILE A 88 -0.898 -4.949 5.329 1.00 10.00 H new ATOM 0 HA ILE A 88 -1.467 -2.379 6.678 1.00 10.00 H new ATOM 0 HB ILE A 88 0.311 -1.940 5.131 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.289 -1.131 3.788 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -1.678 -0.382 5.250 1.00 10.00 H new ATOM 0 HG21 ILE A 88 0.148 -2.469 2.730 1.00 10.00 H new ATOM 0 HG22 ILE A 88 0.154 -3.936 3.738 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -1.370 -3.346 3.033 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -1.106 0.950 3.277 1.00 10.00 H new ATOM 0 HD12 ILE A 88 0.366 0.318 4.052 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.254 -0.443 2.568 1.00 10.00 H new ATOM 1126 N GLU A 89 -3.819 -2.417 5.806 1.00 10.00 N ATOM 1127 CA GLU A 89 -5.222 -2.567 5.452 1.00 10.00 C ATOM 1128 C GLU A 89 -5.643 -1.524 4.430 1.00 10.00 C ATOM 1129 O GLU A 89 -5.087 -0.425 4.382 1.00 10.00 O ATOM 1130 CB GLU A 89 -6.101 -2.443 6.694 1.00 10.00 C ATOM 1131 CG GLU A 89 -5.814 -3.485 7.758 1.00 10.00 C ATOM 1132 CD GLU A 89 -6.684 -3.302 8.978 1.00 10.00 C ATOM 1133 OE1 GLU A 89 -7.834 -3.784 8.974 1.00 10.00 O ATOM 1134 OE2 GLU A 89 -6.224 -2.668 9.951 1.00 10.00 O ATOM 0 H GLU A 89 -3.624 -1.654 6.454 1.00 10.00 H new ATOM 0 HA GLU A 89 -5.349 -3.557 5.015 1.00 10.00 H new ATOM 0 HB2 GLU A 89 -5.965 -1.451 7.125 1.00 10.00 H new ATOM 0 HB3 GLU A 89 -7.147 -2.521 6.396 1.00 10.00 H new ATOM 0 HG2 GLU A 89 -5.975 -4.480 7.344 1.00 10.00 H new ATOM 0 HG3 GLU A 89 -4.765 -3.427 8.049 1.00 10.00 H new ATOM 1141 N VAL A 90 -6.635 -1.870 3.626 1.00 10.00 N ATOM 1142 CA VAL A 90 -7.151 -0.969 2.610 1.00 10.00 C ATOM 1143 C VAL A 90 -8.674 -1.079 2.541 1.00 10.00 C ATOM 1144 O VAL A 90 -9.226 -2.169 2.373 1.00 10.00 O ATOM 1145 CB VAL A 90 -6.522 -1.243 1.219 1.00 10.00 C ATOM 1146 CG1 VAL A 90 -6.795 -2.664 0.751 1.00 10.00 C ATOM 1147 CG2 VAL A 90 -7.026 -0.239 0.196 1.00 10.00 C ATOM 0 H VAL A 90 -7.102 -2.776 3.659 1.00 10.00 H new ATOM 0 HA VAL A 90 -6.876 0.047 2.894 1.00 10.00 H new ATOM 0 HB VAL A 90 -5.443 -1.129 1.318 1.00 10.00 H new ATOM 0 HG11 VAL A 90 -6.339 -2.819 -0.227 1.00 10.00 H new ATOM 0 HG12 VAL A 90 -6.371 -3.370 1.465 1.00 10.00 H new ATOM 0 HG13 VAL A 90 -7.871 -2.823 0.679 1.00 10.00 H new ATOM 0 HG21 VAL A 90 -6.573 -0.448 -0.773 1.00 10.00 H new ATOM 0 HG22 VAL A 90 -8.110 -0.316 0.114 1.00 10.00 H new ATOM 0 HG23 VAL A 90 -6.757 0.769 0.512 1.00 10.00 H new ATOM 1157 N TYR A 91 -9.348 0.045 2.721 1.00 10.00 N ATOM 1158 CA TYR A 91 -10.803 0.080 2.682 1.00 10.00 C ATOM 1159 C TYR A 91 -11.262 1.254 1.834 1.00 10.00 C ATOM 1160 O TYR A 91 -10.496 2.185 1.605 1.00 10.00 O ATOM 1161 CB TYR A 91 -11.381 0.195 4.098 1.00 10.00 C ATOM 1162 CG TYR A 91 -11.023 -0.962 5.009 1.00 10.00 C ATOM 1163 CD1 TYR A 91 -11.739 -2.153 4.972 1.00 10.00 C ATOM 1164 CD2 TYR A 91 -9.971 -0.860 5.911 1.00 10.00 C ATOM 1165 CE1 TYR A 91 -11.418 -3.207 5.806 1.00 10.00 C ATOM 1166 CE2 TYR A 91 -9.643 -1.910 6.747 1.00 10.00 C ATOM 1167 CZ TYR A 91 -10.369 -3.080 6.693 1.00 10.00 C ATOM 1168 OH TYR A 91 -10.048 -4.127 7.528 1.00 10.00 O ATOM 0 H TYR A 91 -8.910 0.949 2.896 1.00 10.00 H new ATOM 0 HA TYR A 91 -11.164 -0.849 2.240 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -11.027 1.122 4.549 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -12.466 0.268 4.031 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -12.561 -2.256 4.279 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -9.400 0.055 5.959 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -11.985 -4.125 5.764 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -8.821 -1.814 7.440 1.00 10.00 H new ATOM 0 HH TYR A 91 -9.262 -3.890 8.063 1.00 10.00 H new ATOM 1178 N GLN A 92 -12.500 1.220 1.374 1.00 10.00 N ATOM 1179 CA GLN A 92 -13.025 2.294 0.542 1.00 10.00 C ATOM 1180 C GLN A 92 -13.593 3.411 1.402 1.00 10.00 C ATOM 1181 O GLN A 92 -14.337 3.163 2.353 1.00 10.00 O ATOM 1182 CB GLN A 92 -14.108 1.765 -0.397 1.00 10.00 C ATOM 1183 CG GLN A 92 -14.441 2.715 -1.536 1.00 10.00 C ATOM 1184 CD GLN A 92 -15.894 2.637 -1.952 1.00 10.00 C ATOM 1185 OE1 GLN A 92 -16.274 1.797 -2.769 1.00 10.00 O ATOM 1186 NE2 GLN A 92 -16.714 3.512 -1.392 1.00 10.00 N ATOM 0 H GLN A 92 -13.160 0.465 1.560 1.00 10.00 H new ATOM 0 HA GLN A 92 -12.203 2.691 -0.053 1.00 10.00 H new ATOM 0 HB2 GLN A 92 -13.783 0.812 -0.813 1.00 10.00 H new ATOM 0 HB3 GLN A 92 -15.013 1.569 0.179 1.00 10.00 H new ATOM 0 HG2 GLN A 92 -14.208 3.736 -1.233 1.00 10.00 H new ATOM 0 HG3 GLN A 92 -13.808 2.485 -2.393 1.00 10.00 H new ATOM 0 HE21 GLN A 92 -16.355 4.190 -0.720 1.00 10.00 H new ATOM 0 HE22 GLN A 92 -17.705 3.508 -1.632 1.00 10.00 H new ATOM 1195 N GLU A 93 -13.236 4.640 1.068 1.00 10.00 N ATOM 1196 CA GLU A 93 -13.717 5.797 1.800 1.00 10.00 C ATOM 1197 C GLU A 93 -15.182 6.059 1.475 1.00 10.00 C ATOM 1198 O GLU A 93 -15.670 5.677 0.406 1.00 10.00 O ATOM 1199 CB GLU A 93 -12.874 7.030 1.467 1.00 10.00 C ATOM 1200 CG GLU A 93 -11.459 6.974 2.024 1.00 10.00 C ATOM 1201 CD GLU A 93 -11.399 7.230 3.517 1.00 10.00 C ATOM 1202 OE1 GLU A 93 -12.209 6.642 4.265 1.00 10.00 O ATOM 1203 OE2 GLU A 93 -10.529 8.013 3.953 1.00 10.00 O ATOM 0 H GLU A 93 -12.612 4.861 0.292 1.00 10.00 H new ATOM 0 HA GLU A 93 -13.626 5.591 2.867 1.00 10.00 H new ATOM 0 HB2 GLU A 93 -12.824 7.143 0.384 1.00 10.00 H new ATOM 0 HB3 GLU A 93 -13.374 7.917 1.857 1.00 10.00 H new ATOM 0 HG2 GLU A 93 -11.029 5.995 1.811 1.00 10.00 H new ATOM 0 HG3 GLU A 93 -10.843 7.711 1.510 1.00 10.00 H new ATOM 1210 N GLN A 94 -15.876 6.716 2.394 1.00 10.00 N ATOM 1211 CA GLN A 94 -17.290 7.032 2.216 1.00 10.00 C ATOM 1212 C GLN A 94 -17.485 8.029 1.072 1.00 10.00 C ATOM 1213 O GLN A 94 -18.584 8.179 0.543 1.00 10.00 O ATOM 1214 CB GLN A 94 -17.869 7.595 3.520 1.00 10.00 C ATOM 1215 CG GLN A 94 -19.385 7.697 3.524 1.00 10.00 C ATOM 1216 CD GLN A 94 -19.911 8.458 4.724 1.00 10.00 C ATOM 1217 OE1 GLN A 94 -20.021 9.684 4.696 1.00 10.00 O ATOM 1218 NE2 GLN A 94 -20.243 7.737 5.783 1.00 10.00 N ATOM 0 H GLN A 94 -15.482 7.043 3.276 1.00 10.00 H new ATOM 0 HA GLN A 94 -17.820 6.115 1.959 1.00 10.00 H new ATOM 0 HB2 GLN A 94 -17.555 6.962 4.350 1.00 10.00 H new ATOM 0 HB3 GLN A 94 -17.447 8.584 3.697 1.00 10.00 H new ATOM 0 HG2 GLN A 94 -19.715 8.192 2.611 1.00 10.00 H new ATOM 0 HG3 GLN A 94 -19.814 6.695 3.517 1.00 10.00 H new ATOM 0 HE21 GLN A 94 -20.136 6.723 5.763 1.00 10.00 H new ATOM 0 HE22 GLN A 94 -20.606 8.195 6.619 1.00 10.00 H new ATOM 1227 N THR A 95 -16.405 8.701 0.691 1.00 10.00 N ATOM 1228 CA THR A 95 -16.443 9.678 -0.384 1.00 10.00 C ATOM 1229 C THR A 95 -16.549 9.003 -1.750 1.00 10.00 C ATOM 1230 O THR A 95 -16.921 9.638 -2.739 1.00 10.00 O ATOM 1231 CB THR A 95 -15.185 10.557 -0.349 1.00 10.00 C ATOM 1232 OG1 THR A 95 -14.152 9.879 0.378 1.00 10.00 O ATOM 1233 CG2 THR A 95 -15.478 11.899 0.304 1.00 10.00 C ATOM 0 H THR A 95 -15.486 8.583 1.117 1.00 10.00 H new ATOM 0 HA THR A 95 -17.328 10.296 -0.234 1.00 10.00 H new ATOM 0 HB THR A 95 -14.858 10.740 -1.373 1.00 10.00 H new ATOM 0 HG1 THR A 95 -13.347 10.438 0.400 1.00 10.00 H new ATOM 0 HG21 THR A 95 -14.571 12.503 0.317 1.00 10.00 H new ATOM 0 HG22 THR A 95 -16.252 12.418 -0.262 1.00 10.00 H new ATOM 0 HG23 THR A 95 -15.822 11.739 1.326 1.00 10.00 H new ATOM 1241 N GLY A 96 -16.220 7.715 -1.797 1.00 10.00 N ATOM 1242 CA GLY A 96 -16.284 6.976 -3.044 1.00 10.00 C ATOM 1243 C GLY A 96 -15.049 7.174 -3.898 1.00 10.00 C ATOM 1244 O GLY A 96 -14.299 6.231 -4.144 1.00 10.00 O ATOM 0 H GLY A 96 -15.910 7.170 -0.992 1.00 10.00 H new ATOM 0 HA2 GLY A 96 -16.406 5.915 -2.828 1.00 10.00 H new ATOM 0 HA3 GLY A 96 -17.164 7.291 -3.605 1.00 10.00 H new ATOM 1286 N ARG B 359 -2.247 -14.960 -2.767 1.00 10.00 N ATOM 1287 CA ARG B 359 -1.284 -13.867 -2.767 1.00 10.00 C ATOM 1288 C ARG B 359 -1.013 -13.362 -4.181 1.00 10.00 C ATOM 1289 O ARG B 359 -1.317 -14.043 -5.163 1.00 10.00 O ATOM 1290 CB ARG B 359 0.024 -14.329 -2.127 1.00 10.00 C ATOM 1291 CG ARG B 359 -0.131 -14.778 -0.685 1.00 10.00 C ATOM 1292 CD ARG B 359 1.212 -14.896 0.012 1.00 10.00 C ATOM 1293 NE ARG B 359 1.067 -15.241 1.424 1.00 10.00 N ATOM 1294 CZ ARG B 359 2.081 -15.576 2.217 1.00 10.00 C ATOM 1295 NH1 ARG B 359 3.322 -15.608 1.744 1.00 10.00 N ATOM 1296 NH2 ARG B 359 1.848 -15.881 3.487 1.00 10.00 N ATOM 0 HA ARG B 359 -1.708 -13.046 -2.189 1.00 10.00 H new ATOM 0 HB2 ARG B 359 0.435 -15.151 -2.713 1.00 10.00 H new ATOM 0 HB3 ARG B 359 0.747 -13.515 -2.170 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -0.759 -14.067 -0.148 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -0.642 -15.740 -0.656 1.00 10.00 H new ATOM 0 HD2 ARG B 359 1.814 -15.656 -0.487 1.00 10.00 H new ATOM 0 HD3 ARG B 359 1.751 -13.953 -0.077 1.00 10.00 H new ATOM 0 HE ARG B 359 0.130 -15.224 1.827 1.00 10.00 H new ATOM 0 HH11 ARG B 359 3.502 -15.375 0.767 1.00 10.00 H new ATOM 0 HH12 ARG B 359 4.095 -15.866 2.357 1.00 10.00 H new ATOM 0 HH21 ARG B 359 0.895 -15.858 3.851 1.00 10.00 H new ATOM 0 HH22 ARG B 359 2.622 -16.139 4.100 1.00 10.00 H new ATOM 1310 N ASP B 360 -0.442 -12.166 -4.269 1.00 10.00 N ATOM 1311 CA ASP B 360 -0.108 -11.550 -5.553 1.00 10.00 C ATOM 1312 C ASP B 360 0.959 -10.477 -5.365 1.00 10.00 C ATOM 1313 O ASP B 360 0.707 -9.456 -4.727 1.00 10.00 O ATOM 1314 CB ASP B 360 -1.345 -10.925 -6.208 1.00 10.00 C ATOM 1315 CG ASP B 360 -1.060 -10.391 -7.603 1.00 10.00 C ATOM 1316 OD1 ASP B 360 -1.254 -9.179 -7.835 1.00 10.00 O ATOM 1317 OD2 ASP B 360 -0.643 -11.186 -8.477 1.00 10.00 O ATOM 0 H ASP B 360 -0.198 -11.597 -3.459 1.00 10.00 H new ATOM 0 HA ASP B 360 0.274 -12.335 -6.206 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -2.138 -11.670 -6.263 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -1.713 -10.114 -5.580 1.00 10.00 H new ATOM 1322 N PRO B 361 2.174 -10.710 -5.886 1.00 10.00 N ATOM 1323 CA PRO B 361 3.267 -9.751 -5.781 1.00 10.00 C ATOM 1324 C PRO B 361 3.178 -8.659 -6.848 1.00 10.00 C ATOM 1325 O PRO B 361 3.284 -8.932 -8.048 1.00 10.00 O ATOM 1326 CB PRO B 361 4.515 -10.616 -5.978 1.00 10.00 C ATOM 1327 CG PRO B 361 4.070 -11.787 -6.792 1.00 10.00 C ATOM 1328 CD PRO B 361 2.578 -11.937 -6.598 1.00 10.00 C ATOM 0 HA PRO B 361 3.259 -9.214 -4.833 1.00 10.00 H new ATOM 0 HB2 PRO B 361 5.301 -10.059 -6.489 1.00 10.00 H new ATOM 0 HB3 PRO B 361 4.924 -10.938 -5.020 1.00 10.00 H new ATOM 0 HG2 PRO B 361 4.306 -11.633 -7.845 1.00 10.00 H new ATOM 0 HG3 PRO B 361 4.590 -12.692 -6.478 1.00 10.00 H new ATOM 0 HD2 PRO B 361 2.061 -12.031 -7.553 1.00 10.00 H new ATOM 0 HD3 PRO B 361 2.341 -12.829 -6.018 1.00 10.00 H new ATOM 1336 N ILE B 362 2.986 -7.424 -6.406 1.00 10.00 N ATOM 1337 CA ILE B 362 2.872 -6.295 -7.317 1.00 10.00 C ATOM 1338 C ILE B 362 4.111 -5.414 -7.266 1.00 10.00 C ATOM 1339 O ILE B 362 4.488 -4.933 -6.201 1.00 10.00 O ATOM 1340 CB ILE B 362 1.634 -5.432 -6.989 1.00 10.00 C ATOM 1341 CG1 ILE B 362 0.392 -6.308 -6.825 1.00 10.00 C ATOM 1342 CG2 ILE B 362 1.408 -4.387 -8.072 1.00 10.00 C ATOM 1343 CD1 ILE B 362 -0.765 -5.592 -6.162 1.00 10.00 C ATOM 0 H ILE B 362 2.906 -7.179 -5.419 1.00 10.00 H new ATOM 0 HA ILE B 362 2.767 -6.711 -8.319 1.00 10.00 H new ATOM 0 HB ILE B 362 1.818 -4.918 -6.046 1.00 10.00 H new ATOM 0 HG12 ILE B 362 0.076 -6.664 -7.805 1.00 10.00 H new ATOM 0 HG13 ILE B 362 0.652 -7.187 -6.235 1.00 10.00 H new ATOM 0 HG21 ILE B 362 0.531 -3.789 -7.823 1.00 10.00 H new ATOM 0 HG22 ILE B 362 2.282 -3.739 -8.140 1.00 10.00 H new ATOM 0 HG23 ILE B 362 1.249 -4.884 -9.029 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -1.613 -6.272 -6.077 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -0.466 -5.260 -5.168 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -1.051 -4.728 -6.763 1.00 10.00 H new ATOM 1355 N VAL B 363 4.743 -5.213 -8.416 1.00 10.00 N ATOM 1356 CA VAL B 363 5.933 -4.377 -8.503 1.00 10.00 C ATOM 1357 C VAL B 363 5.561 -3.009 -9.065 1.00 10.00 C ATOM 1358 O VAL B 363 4.862 -2.914 -10.073 1.00 10.00 O ATOM 1359 CB VAL B 363 7.018 -5.015 -9.397 1.00 10.00 C ATOM 1360 CG1 VAL B 363 8.363 -4.342 -9.168 1.00 10.00 C ATOM 1361 CG2 VAL B 363 7.117 -6.510 -9.142 1.00 10.00 C ATOM 0 H VAL B 363 4.449 -5.620 -9.304 1.00 10.00 H new ATOM 0 HA VAL B 363 6.339 -4.275 -7.497 1.00 10.00 H new ATOM 0 HB VAL B 363 6.732 -4.866 -10.438 1.00 10.00 H new ATOM 0 HG11 VAL B 363 9.115 -4.805 -9.807 1.00 10.00 H new ATOM 0 HG12 VAL B 363 8.285 -3.282 -9.409 1.00 10.00 H new ATOM 0 HG13 VAL B 363 8.654 -4.456 -8.124 1.00 10.00 H new ATOM 0 HG21 VAL B 363 7.888 -6.938 -9.783 1.00 10.00 H new ATOM 0 HG22 VAL B 363 7.375 -6.685 -8.098 1.00 10.00 H new ATOM 0 HG23 VAL B 363 6.159 -6.981 -9.362 1.00 10.00 H new ATOM 1371 N ILE B 364 6.018 -1.956 -8.409 1.00 10.00 N ATOM 1372 CA ILE B 364 5.711 -0.597 -8.838 1.00 10.00 C ATOM 1373 C ILE B 364 6.801 -0.022 -9.734 1.00 10.00 C ATOM 1374 O ILE B 364 7.883 -0.597 -9.870 1.00 10.00 O ATOM 1375 CB ILE B 364 5.508 0.342 -7.633 1.00 10.00 C ATOM 1376 CG1 ILE B 364 6.776 0.399 -6.771 1.00 10.00 C ATOM 1377 CG2 ILE B 364 4.317 -0.118 -6.803 1.00 10.00 C ATOM 1378 CD1 ILE B 364 7.487 1.738 -6.815 1.00 10.00 C ATOM 0 H ILE B 364 6.604 -2.013 -7.576 1.00 10.00 H new ATOM 0 HA ILE B 364 4.784 -0.661 -9.408 1.00 10.00 H new ATOM 0 HB ILE B 364 5.306 1.346 -8.006 1.00 10.00 H new ATOM 0 HG12 ILE B 364 6.512 0.172 -5.738 1.00 10.00 H new ATOM 0 HG13 ILE B 364 7.464 -0.378 -7.102 1.00 10.00 H new ATOM 0 HG21 ILE B 364 4.184 0.553 -5.955 1.00 10.00 H new ATOM 0 HG22 ILE B 364 3.418 -0.107 -7.419 1.00 10.00 H new ATOM 0 HG23 ILE B 364 4.496 -1.130 -6.440 1.00 10.00 H new ATOM 0 HD11 ILE B 364 8.373 1.700 -6.181 1.00 10.00 H new ATOM 0 HD12 ILE B 364 7.783 1.959 -7.840 1.00 10.00 H new ATOM 0 HD13 ILE B 364 6.816 2.518 -6.455 1.00 10.00 H new