USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1088 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 2 ASN : amide:sc= -0.541 X(o=-0.54,f=-0.33) USER MOD Set 1.2: B 4 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 8 ASN : amide:sc= 0.0452 X(o=0.09,f=-0.0022) USER MOD Set 2.2: A 18 LYS NZ :NH3+ -158:sc= 0.0444 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= -0.527 X(o=-0.53,f=-0.89) USER MOD Single : A 3 LYS NZ :NH3+ 176:sc= 0.0326 (180deg=0.0301) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= -0.0403 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 81:sc= 0.974 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot -150:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 49 ASN : amide:sc= -0.0917 K(o=-0.092,f=-1.1) USER MOD Single : A 75 LYS NZ :NH3+ 179:sc= 0.0562 (180deg=0.0558) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl 151:sc= -0.0104 (180deg=-0.206) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 13 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 SER OG : rot 180:sc= -0.0843 USER MOD Single : B 17 SER OG : rot 180:sc= 0 USER MOD Single : B 18 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00507) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 THR OG1 : rot 68:sc= 0.602 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 SER OG : rot 98:sc= 0 USER MOD Single : B 33 THR OG1 : rot 180:sc= 0 USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 49 ASN : amide:sc= -0.361 K(o=-0.36,f=-1.2) USER MOD Single : B 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 19 N ASN A 2 -11.460 9.419 -0.287 1.00 0.00 N ATOM 20 CA ASN A 2 -10.796 10.549 -1.022 1.00 0.00 C ATOM 21 C ASN A 2 -9.478 11.021 -0.330 1.00 0.00 C ATOM 22 O ASN A 2 -8.537 11.388 -1.033 1.00 0.00 O ATOM 23 CB ASN A 2 -11.635 11.789 -1.457 1.00 0.00 C ATOM 24 CG ASN A 2 -12.139 12.770 -0.379 1.00 0.00 C ATOM 25 OD1 ASN A 2 -13.234 12.638 0.161 1.00 0.00 O ATOM 26 ND2 ASN A 2 -11.360 13.798 -0.089 1.00 0.00 N ATOM 0 HA ASN A 2 -10.599 10.048 -1.970 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -11.035 12.360 -2.165 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -12.506 11.422 -2.000 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -11.666 14.494 0.591 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -10.453 13.895 -0.545 1.00 0.00 H new ATOM 33 N LYS A 3 -9.480 11.010 1.017 1.00 0.00 N ATOM 34 CA LYS A 3 -8.417 11.451 1.973 1.00 0.00 C ATOM 35 C LYS A 3 -9.091 12.055 3.244 1.00 0.00 C ATOM 36 O LYS A 3 -8.575 11.881 4.348 1.00 0.00 O ATOM 37 CB LYS A 3 -7.297 12.419 1.481 1.00 0.00 C ATOM 38 CG LYS A 3 -6.047 12.470 2.396 1.00 0.00 C ATOM 39 CD LYS A 3 -4.918 13.421 1.944 1.00 0.00 C ATOM 40 CE LYS A 3 -5.213 14.932 2.060 1.00 0.00 C ATOM 41 NZ LYS A 3 -5.328 15.402 3.455 1.00 0.00 N ATOM 0 H LYS A 3 -10.296 10.662 1.521 1.00 0.00 H new ATOM 0 HA LYS A 3 -7.867 10.527 2.154 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -6.987 12.118 0.480 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -7.712 13.423 1.398 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -6.365 12.764 3.396 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -5.637 11.463 2.475 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -4.027 13.200 2.532 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -4.677 13.198 0.905 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -4.420 15.489 1.561 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -6.140 15.155 1.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -5.459 16.434 3.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -6.145 14.946 3.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -4.462 15.158 3.976 1.00 0.00 H new ATOM 54 N THR A 4 -10.202 12.787 3.081 1.00 0.00 N ATOM 55 CA THR A 4 -10.998 13.414 4.115 1.00 0.00 C ATOM 56 C THR A 4 -12.120 12.509 4.680 1.00 0.00 C ATOM 57 O THR A 4 -12.414 12.615 5.875 1.00 0.00 O ATOM 58 CB THR A 4 -11.512 14.679 3.405 1.00 0.00 C ATOM 59 OG1 THR A 4 -10.454 15.553 3.001 1.00 0.00 O ATOM 60 CG2 THR A 4 -12.385 15.436 4.357 1.00 0.00 C ATOM 0 H THR A 4 -10.585 12.962 2.152 1.00 0.00 H new ATOM 0 HA THR A 4 -10.430 13.632 5.019 1.00 0.00 H new ATOM 0 HB THR A 4 -12.049 14.356 2.513 1.00 0.00 H new ATOM 0 HG1 THR A 4 -10.832 16.339 2.554 1.00 0.00 H new ATOM 0 HG21 THR A 4 -12.759 16.337 3.870 1.00 0.00 H new ATOM 0 HG22 THR A 4 -13.226 14.810 4.656 1.00 0.00 H new ATOM 0 HG23 THR A 4 -11.807 15.713 5.239 1.00 0.00 H new ATOM 68 N GLU A 5 -12.769 11.669 3.848 1.00 0.00 N ATOM 69 CA GLU A 5 -13.606 10.556 4.393 1.00 0.00 C ATOM 70 C GLU A 5 -12.748 9.601 5.304 1.00 0.00 C ATOM 71 O GLU A 5 -13.299 8.948 6.194 1.00 0.00 O ATOM 72 CB GLU A 5 -14.302 9.739 3.278 1.00 0.00 C ATOM 73 CG GLU A 5 -15.111 10.488 2.201 1.00 0.00 C ATOM 74 CD GLU A 5 -16.291 11.306 2.733 1.00 0.00 C ATOM 75 OE1 GLU A 5 -16.224 12.512 2.969 1.00 0.00 O ATOM 76 OE2 GLU A 5 -17.414 10.540 2.916 1.00 0.00 O ATOM 0 H GLU A 5 -12.740 11.726 2.830 1.00 0.00 H new ATOM 0 HA GLU A 5 -14.386 11.021 4.996 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -13.535 9.157 2.768 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -14.974 9.029 3.760 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -14.439 11.155 1.661 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -15.487 9.762 1.480 1.00 0.00 H new ATOM 84 N LEU A 6 -11.404 9.563 5.088 1.00 0.00 N ATOM 85 CA LEU A 6 -10.443 8.945 5.979 1.00 0.00 C ATOM 86 C LEU A 6 -10.256 9.702 7.312 1.00 0.00 C ATOM 87 O LEU A 6 -10.150 9.040 8.327 1.00 0.00 O ATOM 88 CB LEU A 6 -9.102 8.944 5.198 1.00 0.00 C ATOM 89 CG LEU A 6 -8.547 7.504 4.990 1.00 0.00 C ATOM 90 CD1 LEU A 6 -8.841 6.383 6.015 1.00 0.00 C ATOM 91 CD2 LEU A 6 -8.780 6.986 3.559 1.00 0.00 C ATOM 0 H LEU A 6 -10.972 9.978 4.263 1.00 0.00 H new ATOM 0 HA LEU A 6 -10.793 7.950 6.256 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -9.247 9.420 4.228 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -8.367 9.541 5.739 1.00 0.00 H new ATOM 0 HG LEU A 6 -7.496 7.709 5.191 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -8.366 5.458 5.688 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -8.446 6.669 6.990 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -9.918 6.232 6.090 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -8.375 5.978 3.466 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -9.849 6.968 3.348 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -8.281 7.645 2.848 1.00 0.00 H new ATOM 103 N ILE A 7 -10.203 11.046 7.330 1.00 0.00 N ATOM 104 CA ILE A 7 -10.091 11.882 8.571 1.00 0.00 C ATOM 105 C ILE A 7 -11.275 11.601 9.540 1.00 0.00 C ATOM 106 O ILE A 7 -11.047 11.353 10.727 1.00 0.00 O ATOM 107 CB ILE A 7 -9.933 13.391 8.196 1.00 0.00 C ATOM 108 CG1 ILE A 7 -8.690 13.581 7.286 1.00 0.00 C ATOM 109 CG2 ILE A 7 -9.832 14.324 9.427 1.00 0.00 C ATOM 110 CD1 ILE A 7 -8.663 14.846 6.448 1.00 0.00 C ATOM 0 H ILE A 7 -10.236 11.604 6.477 1.00 0.00 H new ATOM 0 HA ILE A 7 -9.189 11.603 9.116 1.00 0.00 H new ATOM 0 HB ILE A 7 -10.840 13.676 7.664 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -7.799 13.567 7.914 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -8.621 12.724 6.616 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -9.724 15.356 9.093 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -10.735 14.230 10.030 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -8.965 14.044 10.026 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -7.749 14.870 5.854 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -9.527 14.861 5.784 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -8.693 15.717 7.103 1.00 0.00 H new ATOM 122 N ASN A 8 -12.515 11.606 9.010 1.00 0.00 N ATOM 123 CA ASN A 8 -13.706 11.136 9.772 1.00 0.00 C ATOM 124 C ASN A 8 -13.686 9.612 10.148 1.00 0.00 C ATOM 125 O ASN A 8 -14.411 9.238 11.070 1.00 0.00 O ATOM 126 CB ASN A 8 -15.017 11.476 9.007 1.00 0.00 C ATOM 127 CG ASN A 8 -15.312 12.972 8.769 1.00 0.00 C ATOM 128 OD1 ASN A 8 -15.789 13.678 9.655 1.00 0.00 O ATOM 129 ND2 ASN A 8 -15.055 13.480 7.572 1.00 0.00 N ATOM 0 H ASN A 8 -12.724 11.927 8.065 1.00 0.00 H new ATOM 0 HA ASN A 8 -13.668 11.677 10.718 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -14.985 10.977 8.038 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -15.854 11.048 9.559 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -15.253 14.462 7.382 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -14.659 12.889 6.841 1.00 0.00 H new ATOM 136 N ALA A 9 -12.888 8.748 9.477 1.00 0.00 N ATOM 137 CA ALA A 9 -12.651 7.343 9.911 1.00 0.00 C ATOM 138 C ALA A 9 -11.844 7.224 11.213 1.00 0.00 C ATOM 139 O ALA A 9 -12.204 6.456 12.102 1.00 0.00 O ATOM 140 CB ALA A 9 -11.789 6.582 8.863 1.00 0.00 C ATOM 0 H ALA A 9 -12.391 9.000 8.623 1.00 0.00 H new ATOM 0 HA ALA A 9 -13.653 6.933 10.039 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -11.628 5.558 9.199 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -12.307 6.572 7.904 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -10.827 7.083 8.750 1.00 0.00 H new ATOM 146 N VAL A 10 -10.737 7.975 11.273 1.00 0.00 N ATOM 147 CA VAL A 10 -9.752 7.974 12.357 1.00 0.00 C ATOM 148 C VAL A 10 -10.333 8.573 13.607 1.00 0.00 C ATOM 149 O VAL A 10 -10.346 7.936 14.657 1.00 0.00 O ATOM 150 CB VAL A 10 -8.407 8.663 11.972 1.00 0.00 C ATOM 151 CG1 VAL A 10 -7.215 8.147 12.758 1.00 0.00 C ATOM 152 CG2 VAL A 10 -8.109 8.534 10.492 1.00 0.00 C ATOM 0 H VAL A 10 -10.494 8.631 10.530 1.00 0.00 H new ATOM 0 HA VAL A 10 -9.508 6.929 12.550 1.00 0.00 H new ATOM 0 HB VAL A 10 -8.551 9.712 12.229 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -6.314 8.670 12.438 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -7.378 8.321 13.822 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -7.096 7.078 12.579 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -7.164 9.028 10.267 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -8.040 7.479 10.225 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -8.908 9.002 9.918 1.00 0.00 H new ATOM 162 N ALA A 11 -10.844 9.794 13.436 1.00 0.00 N ATOM 163 CA ALA A 11 -11.528 10.483 14.509 1.00 0.00 C ATOM 164 C ALA A 11 -12.839 9.821 15.012 1.00 0.00 C ATOM 165 O ALA A 11 -13.181 10.032 16.180 1.00 0.00 O ATOM 166 CB ALA A 11 -11.705 11.934 14.063 1.00 0.00 C ATOM 0 H ALA A 11 -10.792 10.318 12.562 1.00 0.00 H new ATOM 0 HA ALA A 11 -10.911 10.424 15.406 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -12.219 12.495 14.844 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -10.728 12.380 13.879 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -12.295 11.964 13.147 1.00 0.00 H new ATOM 172 N GLU A 12 -13.543 9.015 14.176 1.00 0.00 N ATOM 173 CA GLU A 12 -14.669 8.183 14.661 1.00 0.00 C ATOM 174 C GLU A 12 -14.150 6.927 15.413 1.00 0.00 C ATOM 175 O GLU A 12 -14.589 6.718 16.549 1.00 0.00 O ATOM 176 CB GLU A 12 -15.650 7.861 13.503 1.00 0.00 C ATOM 177 CG GLU A 12 -16.896 7.036 13.888 1.00 0.00 C ATOM 178 CD GLU A 12 -17.840 6.811 12.704 1.00 0.00 C ATOM 179 OE1 GLU A 12 -17.771 5.833 11.961 1.00 0.00 O ATOM 180 OE2 GLU A 12 -18.758 7.822 12.572 1.00 0.00 O ATOM 0 H GLU A 12 -13.353 8.926 13.178 1.00 0.00 H new ATOM 0 HA GLU A 12 -15.244 8.749 15.394 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -15.982 8.801 13.061 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -15.104 7.320 12.730 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -16.580 6.071 14.285 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -17.434 7.548 14.685 1.00 0.00 H new ATOM 188 N THR A 13 -13.238 6.116 14.827 1.00 0.00 N ATOM 189 CA THR A 13 -12.732 4.875 15.508 1.00 0.00 C ATOM 190 C THR A 13 -11.491 4.975 16.450 1.00 0.00 C ATOM 191 O THR A 13 -10.895 3.966 16.840 1.00 0.00 O ATOM 192 CB THR A 13 -12.717 3.737 14.462 1.00 0.00 C ATOM 193 OG1 THR A 13 -13.027 2.492 15.078 1.00 0.00 O ATOM 194 CG2 THR A 13 -11.455 3.561 13.627 1.00 0.00 C ATOM 0 H THR A 13 -12.837 6.283 13.904 1.00 0.00 H new ATOM 0 HA THR A 13 -13.440 4.643 16.304 1.00 0.00 H new ATOM 0 HB THR A 13 -13.478 4.059 13.751 1.00 0.00 H new ATOM 0 HG1 THR A 13 -13.015 1.781 14.403 1.00 0.00 H new ATOM 0 HG21 THR A 13 -11.588 2.727 12.938 1.00 0.00 H new ATOM 0 HG22 THR A 13 -11.263 4.473 13.061 1.00 0.00 H new ATOM 0 HG23 THR A 13 -10.610 3.357 14.284 1.00 0.00 H new ATOM 202 N SER A 14 -11.178 6.208 16.841 1.00 0.00 N ATOM 203 CA SER A 14 -10.074 6.542 17.789 1.00 0.00 C ATOM 204 C SER A 14 -10.442 7.667 18.801 1.00 0.00 C ATOM 205 O SER A 14 -9.988 7.589 19.948 1.00 0.00 O ATOM 206 CB SER A 14 -8.748 6.922 17.082 1.00 0.00 C ATOM 207 OG SER A 14 -8.356 5.947 16.124 1.00 0.00 O ATOM 0 H SER A 14 -11.683 7.031 16.512 1.00 0.00 H new ATOM 0 HA SER A 14 -9.924 5.613 18.340 1.00 0.00 H new ATOM 0 HB2 SER A 14 -8.864 7.888 16.590 1.00 0.00 H new ATOM 0 HB3 SER A 14 -7.960 7.036 17.826 1.00 0.00 H new ATOM 0 HG SER A 14 -7.517 6.224 15.700 1.00 0.00 H new ATOM 213 N GLY A 15 -11.202 8.716 18.405 1.00 0.00 N ATOM 214 CA GLY A 15 -11.507 9.867 19.294 1.00 0.00 C ATOM 215 C GLY A 15 -10.330 10.811 19.603 1.00 0.00 C ATOM 216 O GLY A 15 -9.936 11.002 20.756 1.00 0.00 O ATOM 0 H GLY A 15 -11.616 8.790 17.476 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -12.306 10.452 18.838 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -11.894 9.480 20.237 1.00 0.00 H new ATOM 220 N LEU A 16 -9.828 11.410 18.526 1.00 0.00 N ATOM 221 CA LEU A 16 -8.725 12.395 18.532 1.00 0.00 C ATOM 222 C LEU A 16 -9.383 13.773 18.197 1.00 0.00 C ATOM 223 O LEU A 16 -10.305 14.242 18.873 1.00 0.00 O ATOM 224 CB LEU A 16 -7.431 11.784 17.874 1.00 0.00 C ATOM 225 CG LEU A 16 -7.657 11.090 16.523 1.00 0.00 C ATOM 226 CD1 LEU A 16 -8.524 11.788 15.535 1.00 0.00 C ATOM 227 CD2 LEU A 16 -6.659 10.167 15.811 1.00 0.00 C ATOM 0 H LEU A 16 -10.183 11.224 17.588 1.00 0.00 H new ATOM 0 HA LEU A 16 -8.219 12.648 19.464 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -6.700 12.581 17.739 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -6.994 11.065 18.567 1.00 0.00 H new ATOM 0 HG LEU A 16 -8.169 10.330 17.113 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.598 11.188 14.628 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -9.518 11.929 15.959 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.092 12.759 15.294 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -7.090 9.821 14.872 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -5.738 10.714 15.608 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -6.439 9.309 16.447 1.00 0.00 H new ATOM 239 N SER A 17 -8.857 14.395 17.163 1.00 0.00 N ATOM 240 CA SER A 17 -9.386 15.628 16.530 1.00 0.00 C ATOM 241 C SER A 17 -9.456 15.443 14.989 1.00 0.00 C ATOM 242 O SER A 17 -8.739 14.641 14.396 1.00 0.00 O ATOM 243 CB SER A 17 -8.537 16.860 16.895 1.00 0.00 C ATOM 244 OG SER A 17 -8.455 17.055 18.303 1.00 0.00 O ATOM 0 H SER A 17 -8.011 14.056 16.706 1.00 0.00 H new ATOM 0 HA SER A 17 -10.392 15.803 16.912 1.00 0.00 H new ATOM 0 HB2 SER A 17 -7.533 16.742 16.487 1.00 0.00 H new ATOM 0 HB3 SER A 17 -8.968 17.747 16.431 1.00 0.00 H new ATOM 0 HG SER A 17 -7.907 17.845 18.492 1.00 0.00 H new ATOM 250 N LYS A 18 -10.304 16.220 14.301 1.00 0.00 N ATOM 251 CA LYS A 18 -10.324 16.278 12.801 1.00 0.00 C ATOM 252 C LYS A 18 -8.954 16.795 12.257 1.00 0.00 C ATOM 253 O LYS A 18 -8.379 16.151 11.384 1.00 0.00 O ATOM 254 CB LYS A 18 -11.540 17.074 12.256 1.00 0.00 C ATOM 255 CG LYS A 18 -12.941 16.548 12.652 1.00 0.00 C ATOM 256 CD LYS A 18 -13.335 15.173 12.060 1.00 0.00 C ATOM 257 CE LYS A 18 -14.610 14.553 12.666 1.00 0.00 C ATOM 258 NZ LYS A 18 -15.839 15.316 12.373 1.00 0.00 N ATOM 0 H LYS A 18 -10.994 16.826 14.745 1.00 0.00 H new ATOM 0 HA LYS A 18 -10.459 15.264 12.424 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -11.454 18.106 12.597 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -11.477 17.092 11.168 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -12.990 16.482 13.739 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -13.685 17.282 12.343 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -13.476 15.282 10.985 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -12.506 14.480 12.204 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -14.725 13.537 12.287 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -14.489 14.478 13.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -16.567 15.087 13.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -15.632 16.335 12.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -16.186 15.065 11.425 1.00 0.00 H new ATOM 271 N LYS A 19 -8.394 17.878 12.835 1.00 0.00 N ATOM 272 CA LYS A 19 -6.991 18.311 12.589 1.00 0.00 C ATOM 273 C LYS A 19 -5.934 17.219 12.983 1.00 0.00 C ATOM 274 O LYS A 19 -4.978 17.057 12.220 1.00 0.00 O ATOM 275 CB LYS A 19 -6.752 19.673 13.298 1.00 0.00 C ATOM 276 CG LYS A 19 -5.384 20.358 13.042 1.00 0.00 C ATOM 277 CD LYS A 19 -5.003 20.664 11.572 1.00 0.00 C ATOM 278 CE LYS A 19 -5.935 21.612 10.788 1.00 0.00 C ATOM 279 NZ LYS A 19 -5.928 22.995 11.302 1.00 0.00 N ATOM 0 H LYS A 19 -8.897 18.481 13.486 1.00 0.00 H new ATOM 0 HA LYS A 19 -6.849 18.446 11.517 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -7.540 20.360 12.990 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -6.862 19.522 14.372 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -5.369 21.297 13.596 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -4.605 19.724 13.467 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -4.001 21.092 11.564 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -4.950 19.719 11.032 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -5.635 21.620 9.740 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -6.953 21.223 10.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -6.573 23.580 10.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -6.241 22.998 12.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -4.965 23.383 11.242 1.00 0.00 H new ATOM 292 N ASP A 20 -6.084 16.468 14.110 1.00 0.00 N ATOM 293 CA ASP A 20 -5.154 15.333 14.433 1.00 0.00 C ATOM 294 C ASP A 20 -5.254 14.110 13.467 1.00 0.00 C ATOM 295 O ASP A 20 -4.236 13.464 13.225 1.00 0.00 O ATOM 296 CB ASP A 20 -5.306 14.864 15.907 1.00 0.00 C ATOM 297 CG ASP A 20 -4.599 15.768 16.926 1.00 0.00 C ATOM 298 OD1 ASP A 20 -5.193 16.543 17.674 1.00 0.00 O ATOM 299 OD2 ASP A 20 -3.236 15.606 16.906 1.00 0.00 O ATOM 0 H ASP A 20 -6.820 16.618 14.800 1.00 0.00 H new ATOM 0 HA ASP A 20 -4.159 15.753 14.287 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -6.366 14.815 16.154 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -4.910 13.852 15.998 1.00 0.00 H new ATOM 305 N ALA A 21 -6.446 13.795 12.933 1.00 0.00 N ATOM 306 CA ALA A 21 -6.660 12.740 11.913 1.00 0.00 C ATOM 307 C ALA A 21 -6.136 13.110 10.487 1.00 0.00 C ATOM 308 O ALA A 21 -5.614 12.230 9.800 1.00 0.00 O ATOM 309 CB ALA A 21 -8.151 12.376 11.971 1.00 0.00 C ATOM 0 H ALA A 21 -7.307 14.272 13.199 1.00 0.00 H new ATOM 0 HA ALA A 21 -6.054 11.863 12.143 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -8.365 11.600 11.237 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -8.398 12.010 12.968 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -8.750 13.259 11.750 1.00 0.00 H new ATOM 315 N THR A 22 -6.238 14.391 10.059 1.00 0.00 N ATOM 316 CA THR A 22 -5.616 14.937 8.818 1.00 0.00 C ATOM 317 C THR A 22 -4.070 14.790 8.818 1.00 0.00 C ATOM 318 O THR A 22 -3.480 14.281 7.860 1.00 0.00 O ATOM 319 CB THR A 22 -6.037 16.434 8.649 1.00 0.00 C ATOM 320 OG1 THR A 22 -7.408 16.675 8.941 1.00 0.00 O ATOM 321 CG2 THR A 22 -5.801 16.917 7.222 1.00 0.00 C ATOM 0 H THR A 22 -6.766 15.094 10.576 1.00 0.00 H new ATOM 0 HA THR A 22 -5.978 14.356 7.970 1.00 0.00 H new ATOM 0 HB THR A 22 -5.417 16.975 9.364 1.00 0.00 H new ATOM 0 HG1 THR A 22 -7.529 16.741 9.911 1.00 0.00 H new ATOM 0 HG21 THR A 22 -6.103 17.961 7.136 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.743 16.824 6.977 1.00 0.00 H new ATOM 0 HG23 THR A 22 -6.388 16.312 6.531 1.00 0.00 H new ATOM 329 N LYS A 23 -3.457 15.238 9.925 1.00 0.00 N ATOM 330 CA LYS A 23 -2.027 15.047 10.219 1.00 0.00 C ATOM 331 C LYS A 23 -1.594 13.573 10.221 1.00 0.00 C ATOM 332 O LYS A 23 -0.689 13.245 9.476 1.00 0.00 O ATOM 333 CB LYS A 23 -1.753 15.590 11.651 1.00 0.00 C ATOM 334 CG LYS A 23 -1.673 17.126 11.779 1.00 0.00 C ATOM 335 CD LYS A 23 -1.518 17.588 13.244 1.00 0.00 C ATOM 336 CE LYS A 23 -1.386 19.112 13.430 1.00 0.00 C ATOM 337 NZ LYS A 23 -0.079 19.638 12.991 1.00 0.00 N ATOM 0 H LYS A 23 -3.950 15.753 10.655 1.00 0.00 H new ATOM 0 HA LYS A 23 -1.472 15.567 9.438 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -2.540 15.229 12.314 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -0.815 15.164 12.008 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -0.830 17.493 11.194 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -2.573 17.571 11.354 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -2.380 17.240 13.813 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -0.638 17.106 13.671 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -2.178 19.610 12.871 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -1.535 19.358 14.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -0.051 20.667 13.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 0.679 19.187 13.541 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 0.057 19.431 11.981 1.00 0.00 H new ATOM 350 N ALA A 24 -2.245 12.740 11.040 1.00 0.00 N ATOM 351 CA ALA A 24 -1.950 11.310 11.226 1.00 0.00 C ATOM 352 C ALA A 24 -1.949 10.423 9.964 1.00 0.00 C ATOM 353 O ALA A 24 -1.081 9.565 9.837 1.00 0.00 O ATOM 354 CB ALA A 24 -2.882 10.838 12.325 1.00 0.00 C ATOM 0 H ALA A 24 -3.025 13.054 11.617 1.00 0.00 H new ATOM 0 HA ALA A 24 -0.903 11.200 11.508 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -2.714 9.778 12.514 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -2.687 11.404 13.236 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -3.916 10.992 12.016 1.00 0.00 H new ATOM 360 N VAL A 25 -2.878 10.660 9.026 1.00 0.00 N ATOM 361 CA VAL A 25 -2.823 10.122 7.632 1.00 0.00 C ATOM 362 C VAL A 25 -1.515 10.645 6.940 1.00 0.00 C ATOM 363 O VAL A 25 -0.689 9.820 6.549 1.00 0.00 O ATOM 364 CB VAL A 25 -4.163 10.697 7.014 1.00 0.00 C ATOM 365 CG1 VAL A 25 -4.114 10.917 5.485 1.00 0.00 C ATOM 366 CG2 VAL A 25 -5.391 9.841 7.374 1.00 0.00 C ATOM 0 H VAL A 25 -3.702 11.235 9.202 1.00 0.00 H new ATOM 0 HA VAL A 25 -2.772 9.038 7.528 1.00 0.00 H new ATOM 0 HB VAL A 25 -4.264 11.679 7.476 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.071 11.312 5.143 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -3.322 11.626 5.245 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -3.915 9.968 4.987 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -6.283 10.278 6.926 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.253 8.829 6.994 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.507 9.809 8.457 1.00 0.00 H new ATOM 376 N ASP A 26 -1.307 11.980 6.835 1.00 0.00 N ATOM 377 CA ASP A 26 -0.010 12.568 6.340 1.00 0.00 C ATOM 378 C ASP A 26 1.214 12.505 7.349 1.00 0.00 C ATOM 379 O ASP A 26 2.148 13.309 7.336 1.00 0.00 O ATOM 380 CB ASP A 26 -0.295 14.034 5.935 1.00 0.00 C ATOM 381 CG ASP A 26 -1.240 14.239 4.738 1.00 0.00 C ATOM 382 OD1 ASP A 26 -2.432 14.518 4.858 1.00 0.00 O ATOM 383 OD2 ASP A 26 -0.602 14.063 3.536 1.00 0.00 O ATOM 0 H ASP A 26 -2.009 12.678 7.082 1.00 0.00 H new ATOM 0 HA ASP A 26 0.316 11.951 5.503 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -0.717 14.551 6.797 1.00 0.00 H new ATOM 0 HB3 ASP A 26 0.655 14.517 5.707 1.00 0.00 H new ATOM 389 N ALA A 27 1.135 11.515 8.234 1.00 0.00 N ATOM 390 CA ALA A 27 2.118 11.108 9.260 1.00 0.00 C ATOM 391 C ALA A 27 2.585 9.658 8.964 1.00 0.00 C ATOM 392 O ALA A 27 3.789 9.385 8.977 1.00 0.00 O ATOM 393 CB ALA A 27 1.539 11.296 10.663 1.00 0.00 C ATOM 0 H ALA A 27 0.310 10.916 8.262 1.00 0.00 H new ATOM 0 HA ALA A 27 3.001 11.746 9.221 1.00 0.00 H new ATOM 0 HB1 ALA A 27 2.277 10.991 11.405 1.00 0.00 H new ATOM 0 HB2 ALA A 27 1.285 12.345 10.814 1.00 0.00 H new ATOM 0 HB3 ALA A 27 0.642 10.686 10.771 1.00 0.00 H new ATOM 399 N VAL A 28 1.622 8.749 8.665 1.00 0.00 N ATOM 400 CA VAL A 28 1.888 7.430 8.043 1.00 0.00 C ATOM 401 C VAL A 28 2.554 7.695 6.653 1.00 0.00 C ATOM 402 O VAL A 28 3.764 7.531 6.510 1.00 0.00 O ATOM 403 CB VAL A 28 0.584 6.565 7.807 1.00 0.00 C ATOM 404 CG1 VAL A 28 0.942 5.153 7.350 1.00 0.00 C ATOM 405 CG2 VAL A 28 -0.382 6.444 8.953 1.00 0.00 C ATOM 0 H VAL A 28 0.633 8.914 8.851 1.00 0.00 H new ATOM 0 HA VAL A 28 2.524 6.865 8.724 1.00 0.00 H new ATOM 0 HB VAL A 28 0.063 7.139 7.041 1.00 0.00 H new ATOM 0 HG11 VAL A 28 0.029 4.578 7.195 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.502 5.204 6.416 1.00 0.00 H new ATOM 0 HG13 VAL A 28 1.551 4.667 8.112 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -1.227 5.825 8.652 1.00 0.00 H new ATOM 0 HG22 VAL A 28 0.120 5.984 9.805 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.739 7.435 9.234 1.00 0.00 H new ATOM 415 N PHE A 29 1.719 8.204 5.727 1.00 0.00 N ATOM 416 CA PHE A 29 1.998 8.439 4.294 1.00 0.00 C ATOM 417 C PHE A 29 3.114 9.453 3.954 1.00 0.00 C ATOM 418 O PHE A 29 3.503 9.488 2.788 1.00 0.00 O ATOM 419 CB PHE A 29 0.631 8.723 3.579 1.00 0.00 C ATOM 420 CG PHE A 29 -0.443 7.613 3.714 1.00 0.00 C ATOM 421 CD1 PHE A 29 -0.139 6.290 3.378 1.00 0.00 C ATOM 422 CD2 PHE A 29 -1.676 7.891 4.312 1.00 0.00 C ATOM 423 CE1 PHE A 29 -1.007 5.256 3.701 1.00 0.00 C ATOM 424 CE2 PHE A 29 -2.546 6.858 4.646 1.00 0.00 C ATOM 425 CZ PHE A 29 -2.198 5.541 4.356 1.00 0.00 C ATOM 0 H PHE A 29 0.769 8.481 5.974 1.00 0.00 H new ATOM 0 HA PHE A 29 2.452 7.529 3.901 1.00 0.00 H new ATOM 0 HB2 PHE A 29 0.220 9.651 3.977 1.00 0.00 H new ATOM 0 HB3 PHE A 29 0.824 8.889 2.519 1.00 0.00 H new ATOM 0 HD1 PHE A 29 0.783 6.070 2.861 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -1.955 8.914 4.516 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -0.758 4.237 3.445 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -3.487 7.076 5.128 1.00 0.00 H new ATOM 0 HZ PHE A 29 -2.859 4.736 4.642 1.00 0.00 H new ATOM 435 N ASP A 30 3.628 10.237 4.928 1.00 0.00 N ATOM 436 CA ASP A 30 4.858 11.062 4.740 1.00 0.00 C ATOM 437 C ASP A 30 6.179 10.268 4.983 1.00 0.00 C ATOM 438 O ASP A 30 7.166 10.460 4.269 1.00 0.00 O ATOM 439 CB ASP A 30 4.792 12.294 5.668 1.00 0.00 C ATOM 440 CG ASP A 30 5.676 13.466 5.222 1.00 0.00 C ATOM 441 OD1 ASP A 30 6.827 13.636 5.620 1.00 0.00 O ATOM 442 OD2 ASP A 30 5.034 14.288 4.330 1.00 0.00 O ATOM 0 H ASP A 30 3.214 10.320 5.857 1.00 0.00 H new ATOM 0 HA ASP A 30 4.882 11.374 3.696 1.00 0.00 H new ATOM 0 HB2 ASP A 30 3.758 12.635 5.727 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.087 11.994 6.674 1.00 0.00 H new ATOM 448 N SER A 31 6.182 9.412 6.015 1.00 0.00 N ATOM 449 CA SER A 31 7.299 8.464 6.286 1.00 0.00 C ATOM 450 C SER A 31 7.420 7.300 5.248 1.00 0.00 C ATOM 451 O SER A 31 8.524 6.787 5.075 1.00 0.00 O ATOM 452 CB SER A 31 7.191 7.886 7.708 1.00 0.00 C ATOM 453 OG SER A 31 7.155 8.916 8.691 1.00 0.00 O ATOM 0 H SER A 31 5.419 9.349 6.689 1.00 0.00 H new ATOM 0 HA SER A 31 8.209 9.056 6.190 1.00 0.00 H new ATOM 0 HB2 SER A 31 6.291 7.276 7.786 1.00 0.00 H new ATOM 0 HB3 SER A 31 8.039 7.229 7.900 1.00 0.00 H new ATOM 0 HG SER A 31 7.554 8.587 9.524 1.00 0.00 H new ATOM 459 N ILE A 32 6.329 6.895 4.554 1.00 0.00 N ATOM 460 CA ILE A 32 6.321 5.874 3.478 1.00 0.00 C ATOM 461 C ILE A 32 6.927 6.462 2.208 1.00 0.00 C ATOM 462 O ILE A 32 7.800 5.827 1.648 1.00 0.00 O ATOM 463 CB ILE A 32 4.918 5.278 3.181 1.00 0.00 C ATOM 464 CG1 ILE A 32 4.213 5.040 4.518 1.00 0.00 C ATOM 465 CG2 ILE A 32 5.073 4.061 2.241 1.00 0.00 C ATOM 466 CD1 ILE A 32 2.885 4.372 4.620 1.00 0.00 C ATOM 0 H ILE A 32 5.402 7.281 4.733 1.00 0.00 H new ATOM 0 HA ILE A 32 6.925 5.041 3.838 1.00 0.00 H new ATOM 0 HB ILE A 32 4.263 5.953 2.630 1.00 0.00 H new ATOM 0 HG12 ILE A 32 4.901 4.460 5.133 1.00 0.00 H new ATOM 0 HG13 ILE A 32 4.107 6.016 4.992 1.00 0.00 H new ATOM 0 HG21 ILE A 32 4.091 3.638 2.029 1.00 0.00 H new ATOM 0 HG22 ILE A 32 5.541 4.378 1.309 1.00 0.00 H new ATOM 0 HG23 ILE A 32 5.697 3.307 2.722 1.00 0.00 H new ATOM 0 HD11 ILE A 32 2.586 4.315 5.667 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.145 4.946 4.062 1.00 0.00 H new ATOM 0 HD13 ILE A 32 2.951 3.366 4.206 1.00 0.00 H new ATOM 478 N THR A 33 6.452 7.609 1.718 1.00 0.00 N ATOM 479 CA THR A 33 7.129 8.307 0.580 1.00 0.00 C ATOM 480 C THR A 33 8.640 8.616 0.813 1.00 0.00 C ATOM 481 O THR A 33 9.404 8.537 -0.146 1.00 0.00 O ATOM 482 CB THR A 33 6.329 9.561 0.166 1.00 0.00 C ATOM 483 OG1 THR A 33 6.946 10.255 -0.915 1.00 0.00 O ATOM 484 CG2 THR A 33 6.053 10.537 1.318 1.00 0.00 C ATOM 0 H THR A 33 5.619 8.081 2.070 1.00 0.00 H new ATOM 0 HA THR A 33 7.131 7.602 -0.251 1.00 0.00 H new ATOM 0 HB THR A 33 5.364 9.172 -0.159 1.00 0.00 H new ATOM 0 HG1 THR A 33 6.409 11.041 -1.148 1.00 0.00 H new ATOM 0 HG21 THR A 33 5.487 11.390 0.944 1.00 0.00 H new ATOM 0 HG22 THR A 33 5.477 10.031 2.093 1.00 0.00 H new ATOM 0 HG23 THR A 33 6.998 10.884 1.736 1.00 0.00 H new ATOM 492 N GLU A 34 9.053 8.939 2.057 1.00 0.00 N ATOM 493 CA GLU A 34 10.484 8.996 2.442 1.00 0.00 C ATOM 494 C GLU A 34 11.139 7.584 2.470 1.00 0.00 C ATOM 495 O GLU A 34 12.293 7.493 2.058 1.00 0.00 O ATOM 496 CB GLU A 34 10.623 9.793 3.765 1.00 0.00 C ATOM 497 CG GLU A 34 12.072 10.104 4.195 1.00 0.00 C ATOM 498 CD GLU A 34 12.132 10.970 5.454 1.00 0.00 C ATOM 499 OE1 GLU A 34 12.239 12.196 5.429 1.00 0.00 O ATOM 500 OE2 GLU A 34 12.050 10.224 6.602 1.00 0.00 O ATOM 0 H GLU A 34 8.413 9.166 2.818 1.00 0.00 H new ATOM 0 HA GLU A 34 11.050 9.533 1.681 1.00 0.00 H new ATOM 0 HB2 GLU A 34 10.081 10.733 3.663 1.00 0.00 H new ATOM 0 HB3 GLU A 34 10.137 9.230 4.562 1.00 0.00 H new ATOM 0 HG2 GLU A 34 12.604 9.169 4.374 1.00 0.00 H new ATOM 0 HG3 GLU A 34 12.588 10.614 3.382 1.00 0.00 H new ATOM 508 N ALA A 35 10.448 6.504 2.904 1.00 0.00 N ATOM 509 CA ALA A 35 10.948 5.116 2.763 1.00 0.00 C ATOM 510 C ALA A 35 11.125 4.685 1.281 1.00 0.00 C ATOM 511 O ALA A 35 12.228 4.346 0.869 1.00 0.00 O ATOM 512 CB ALA A 35 9.974 4.118 3.472 1.00 0.00 C ATOM 0 H ALA A 35 9.537 6.568 3.358 1.00 0.00 H new ATOM 0 HA ALA A 35 11.931 5.091 3.234 1.00 0.00 H new ATOM 0 HB1 ALA A 35 10.351 3.101 3.362 1.00 0.00 H new ATOM 0 HB2 ALA A 35 9.905 4.367 4.531 1.00 0.00 H new ATOM 0 HB3 ALA A 35 8.986 4.189 3.018 1.00 0.00 H new ATOM 518 N LEU A 36 10.059 4.775 0.478 1.00 0.00 N ATOM 519 CA LEU A 36 9.986 4.362 -0.938 1.00 0.00 C ATOM 520 C LEU A 36 10.941 5.180 -1.808 1.00 0.00 C ATOM 521 O LEU A 36 11.752 4.570 -2.513 1.00 0.00 O ATOM 522 CB LEU A 36 8.500 4.379 -1.368 1.00 0.00 C ATOM 523 CG LEU A 36 7.508 3.631 -0.375 1.00 0.00 C ATOM 524 CD1 LEU A 36 6.180 3.223 -0.988 1.00 0.00 C ATOM 525 CD2 LEU A 36 7.858 2.623 0.764 1.00 0.00 C ATOM 0 H LEU A 36 9.174 5.158 0.811 1.00 0.00 H new ATOM 0 HA LEU A 36 10.340 3.341 -1.076 1.00 0.00 H new ATOM 0 HB2 LEU A 36 8.178 5.415 -1.468 1.00 0.00 H new ATOM 0 HB3 LEU A 36 8.417 3.922 -2.354 1.00 0.00 H new ATOM 0 HG LEU A 36 7.562 4.535 0.232 1.00 0.00 H new ATOM 0 HD11 LEU A 36 5.571 2.720 -0.236 1.00 0.00 H new ATOM 0 HD12 LEU A 36 5.656 4.110 -1.345 1.00 0.00 H new ATOM 0 HD13 LEU A 36 6.358 2.545 -1.823 1.00 0.00 H new ATOM 0 HD21 LEU A 36 6.941 2.296 1.255 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.371 1.759 0.341 1.00 0.00 H new ATOM 0 HD23 LEU A 36 8.507 3.109 1.493 1.00 0.00 H new ATOM 537 N ARG A 37 10.935 6.533 -1.712 1.00 0.00 N ATOM 538 CA ARG A 37 11.938 7.326 -2.448 1.00 0.00 C ATOM 539 C ARG A 37 13.423 7.005 -2.058 1.00 0.00 C ATOM 540 O ARG A 37 14.304 7.104 -2.915 1.00 0.00 O ATOM 541 CB ARG A 37 11.666 8.851 -2.429 1.00 0.00 C ATOM 542 CG ARG A 37 12.162 9.621 -1.177 1.00 0.00 C ATOM 543 CD ARG A 37 11.663 11.063 -1.149 1.00 0.00 C ATOM 544 NE ARG A 37 12.036 11.777 0.100 1.00 0.00 N ATOM 545 CZ ARG A 37 11.178 12.432 0.911 1.00 0.00 C ATOM 546 NH1 ARG A 37 9.862 12.496 0.715 1.00 0.00 N ATOM 547 NH2 ARG A 37 11.674 13.049 1.967 1.00 0.00 N ATOM 0 H ARG A 37 10.274 7.075 -1.155 1.00 0.00 H new ATOM 0 HA ARG A 37 11.814 6.997 -3.480 1.00 0.00 H new ATOM 0 HB2 ARG A 37 12.132 9.293 -3.310 1.00 0.00 H new ATOM 0 HB3 ARG A 37 10.592 9.008 -2.524 1.00 0.00 H new ATOM 0 HG2 ARG A 37 11.825 9.105 -0.278 1.00 0.00 H new ATOM 0 HG3 ARG A 37 13.252 9.615 -1.158 1.00 0.00 H new ATOM 0 HD2 ARG A 37 12.071 11.601 -2.005 1.00 0.00 H new ATOM 0 HD3 ARG A 37 10.578 11.070 -1.256 1.00 0.00 H new ATOM 0 HE ARG A 37 13.021 11.772 0.366 1.00 0.00 H new ATOM 0 HH11 ARG A 37 9.443 12.031 -0.090 1.00 0.00 H new ATOM 0 HH12 ARG A 37 9.273 13.010 1.370 1.00 0.00 H new ATOM 0 HH21 ARG A 37 12.677 13.021 2.149 1.00 0.00 H new ATOM 0 HH22 ARG A 37 11.054 13.553 2.601 1.00 0.00 H new ATOM 560 N LYS A 38 13.675 6.654 -0.769 1.00 0.00 N ATOM 561 CA LYS A 38 15.040 6.338 -0.280 1.00 0.00 C ATOM 562 C LYS A 38 15.538 4.869 -0.535 1.00 0.00 C ATOM 563 O LYS A 38 16.737 4.612 -0.388 1.00 0.00 O ATOM 564 CB LYS A 38 15.035 6.683 1.236 1.00 0.00 C ATOM 565 CG LYS A 38 16.343 6.537 2.041 1.00 0.00 C ATOM 566 CD LYS A 38 16.182 7.042 3.490 1.00 0.00 C ATOM 567 CE LYS A 38 17.317 6.566 4.411 1.00 0.00 C ATOM 568 NZ LYS A 38 17.166 7.097 5.777 1.00 0.00 N ATOM 0 H LYS A 38 12.952 6.583 -0.053 1.00 0.00 H new ATOM 0 HA LYS A 38 15.756 6.928 -0.851 1.00 0.00 H new ATOM 0 HB2 LYS A 38 14.700 7.715 1.337 1.00 0.00 H new ATOM 0 HB3 LYS A 38 14.283 6.055 1.714 1.00 0.00 H new ATOM 0 HG2 LYS A 38 16.648 5.491 2.052 1.00 0.00 H new ATOM 0 HG3 LYS A 38 17.138 7.096 1.547 1.00 0.00 H new ATOM 0 HD2 LYS A 38 16.152 8.132 3.490 1.00 0.00 H new ATOM 0 HD3 LYS A 38 15.228 6.697 3.887 1.00 0.00 H new ATOM 0 HE2 LYS A 38 17.328 5.477 4.443 1.00 0.00 H new ATOM 0 HE3 LYS A 38 18.276 6.883 4.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 17.949 6.756 6.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 17.181 8.137 5.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 16.262 6.774 6.177 1.00 0.00 H new ATOM 581 N GLY A 39 14.652 3.921 -0.902 1.00 0.00 N ATOM 582 CA GLY A 39 14.982 2.474 -0.974 1.00 0.00 C ATOM 583 C GLY A 39 14.800 1.690 0.362 1.00 0.00 C ATOM 584 O GLY A 39 15.595 0.796 0.660 1.00 0.00 O ATOM 0 H GLY A 39 13.687 4.132 -1.158 1.00 0.00 H new ATOM 0 HA2 GLY A 39 14.356 2.011 -1.737 1.00 0.00 H new ATOM 0 HA3 GLY A 39 16.016 2.368 -1.302 1.00 0.00 H new ATOM 588 N ASP A 40 13.744 2.020 1.131 1.00 0.00 N ATOM 589 CA ASP A 40 13.414 1.409 2.447 1.00 0.00 C ATOM 590 C ASP A 40 12.062 0.660 2.361 1.00 0.00 C ATOM 591 O ASP A 40 11.076 1.180 1.824 1.00 0.00 O ATOM 592 CB ASP A 40 13.415 2.424 3.619 1.00 0.00 C ATOM 593 CG ASP A 40 14.691 3.246 3.875 1.00 0.00 C ATOM 594 OD1 ASP A 40 15.794 2.987 3.393 1.00 0.00 O ATOM 595 OD2 ASP A 40 14.449 4.302 4.714 1.00 0.00 O ATOM 0 H ASP A 40 13.075 2.738 0.852 1.00 0.00 H new ATOM 0 HA ASP A 40 14.209 0.699 2.672 1.00 0.00 H new ATOM 0 HB2 ASP A 40 12.597 3.125 3.452 1.00 0.00 H new ATOM 0 HB3 ASP A 40 13.184 1.876 4.533 1.00 0.00 H new ATOM 601 N LYS A 41 12.028 -0.565 2.921 1.00 0.00 N ATOM 602 CA LYS A 41 10.795 -1.391 2.965 1.00 0.00 C ATOM 603 C LYS A 41 10.010 -1.029 4.252 1.00 0.00 C ATOM 604 O LYS A 41 10.524 -1.079 5.375 1.00 0.00 O ATOM 605 CB LYS A 41 11.037 -2.920 2.972 1.00 0.00 C ATOM 606 CG LYS A 41 11.987 -3.471 1.886 1.00 0.00 C ATOM 607 CD LYS A 41 12.014 -5.014 1.844 1.00 0.00 C ATOM 608 CE LYS A 41 12.849 -5.615 0.696 1.00 0.00 C ATOM 609 NZ LYS A 41 14.302 -5.428 0.871 1.00 0.00 N ATOM 0 H LYS A 41 12.839 -1.009 3.351 1.00 0.00 H new ATOM 0 HA LYS A 41 10.248 -1.166 2.049 1.00 0.00 H new ATOM 0 HB2 LYS A 41 11.436 -3.198 3.948 1.00 0.00 H new ATOM 0 HB3 LYS A 41 10.073 -3.419 2.868 1.00 0.00 H new ATOM 0 HG2 LYS A 41 11.678 -3.091 0.912 1.00 0.00 H new ATOM 0 HG3 LYS A 41 12.995 -3.099 2.068 1.00 0.00 H new ATOM 0 HD2 LYS A 41 12.407 -5.382 2.792 1.00 0.00 H new ATOM 0 HD3 LYS A 41 10.990 -5.379 1.760 1.00 0.00 H new ATOM 0 HE2 LYS A 41 12.634 -6.681 0.619 1.00 0.00 H new ATOM 0 HE3 LYS A 41 12.542 -5.159 -0.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 14.806 -5.854 0.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 14.518 -4.412 0.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 14.607 -5.887 1.753 1.00 0.00 H new ATOM 622 N VAL A 42 8.738 -0.709 4.045 1.00 0.00 N ATOM 623 CA VAL A 42 7.777 -0.316 5.070 1.00 0.00 C ATOM 624 C VAL A 42 6.939 -1.573 5.381 1.00 0.00 C ATOM 625 O VAL A 42 6.561 -2.370 4.515 1.00 0.00 O ATOM 626 CB VAL A 42 6.978 0.827 4.398 1.00 0.00 C ATOM 627 CG1 VAL A 42 5.809 1.344 5.177 1.00 0.00 C ATOM 628 CG2 VAL A 42 7.808 2.078 4.196 1.00 0.00 C ATOM 0 H VAL A 42 8.328 -0.717 3.111 1.00 0.00 H new ATOM 0 HA VAL A 42 8.184 0.035 6.018 1.00 0.00 H new ATOM 0 HB VAL A 42 6.660 0.341 3.476 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.321 2.141 4.615 1.00 0.00 H new ATOM 0 HG12 VAL A 42 5.100 0.535 5.349 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.154 1.734 6.135 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.198 2.847 3.721 1.00 0.00 H new ATOM 0 HG22 VAL A 42 8.161 2.440 5.161 1.00 0.00 H new ATOM 0 HG23 VAL A 42 8.663 1.849 3.560 1.00 0.00 H new ATOM 638 N GLN A 43 6.673 -1.699 6.674 1.00 0.00 N ATOM 639 CA GLN A 43 5.996 -2.899 7.242 1.00 0.00 C ATOM 640 C GLN A 43 4.778 -2.563 8.156 1.00 0.00 C ATOM 641 O GLN A 43 4.769 -1.581 8.902 1.00 0.00 O ATOM 642 CB GLN A 43 7.025 -3.960 7.731 1.00 0.00 C ATOM 643 CG GLN A 43 7.918 -4.579 6.630 1.00 0.00 C ATOM 644 CD GLN A 43 8.898 -5.674 7.084 1.00 0.00 C ATOM 645 OE1 GLN A 43 8.865 -6.182 8.206 1.00 0.00 O ATOM 646 NE2 GLN A 43 9.798 -6.064 6.194 1.00 0.00 N ATOM 0 H GLN A 43 6.910 -0.990 7.368 1.00 0.00 H new ATOM 0 HA GLN A 43 5.479 -3.424 6.439 1.00 0.00 H new ATOM 0 HB2 GLN A 43 7.669 -3.498 8.479 1.00 0.00 H new ATOM 0 HB3 GLN A 43 6.483 -4.764 8.229 1.00 0.00 H new ATOM 0 HG2 GLN A 43 7.271 -4.997 5.859 1.00 0.00 H new ATOM 0 HG3 GLN A 43 8.492 -3.778 6.164 1.00 0.00 H new ATOM 0 HE21 GLN A 43 9.817 -5.637 5.268 1.00 0.00 H new ATOM 0 HE22 GLN A 43 10.472 -6.791 6.435 1.00 0.00 H new ATOM 655 N LEU A 44 3.725 -3.397 8.016 1.00 0.00 N ATOM 656 CA LEU A 44 2.430 -3.281 8.731 1.00 0.00 C ATOM 657 C LEU A 44 1.946 -4.743 8.984 1.00 0.00 C ATOM 658 O LEU A 44 1.600 -5.457 8.036 1.00 0.00 O ATOM 659 CB LEU A 44 1.323 -2.517 7.930 1.00 0.00 C ATOM 660 CG LEU A 44 1.698 -1.137 7.317 1.00 0.00 C ATOM 661 CD1 LEU A 44 2.285 -1.219 5.890 1.00 0.00 C ATOM 662 CD2 LEU A 44 0.481 -0.192 7.287 1.00 0.00 C ATOM 0 H LEU A 44 3.751 -4.196 7.383 1.00 0.00 H new ATOM 0 HA LEU A 44 2.588 -2.704 9.642 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.988 -3.164 7.120 1.00 0.00 H new ATOM 0 HB3 LEU A 44 0.471 -2.369 8.593 1.00 0.00 H new ATOM 0 HG LEU A 44 2.476 -0.746 7.973 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.520 -0.216 5.535 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.194 -1.821 5.904 1.00 0.00 H new ATOM 0 HD13 LEU A 44 1.556 -1.679 5.223 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.774 0.764 6.854 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.310 -0.637 6.684 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.118 -0.034 8.303 1.00 0.00 H new ATOM 674 N ILE A 45 1.894 -5.210 10.246 1.00 0.00 N ATOM 675 CA ILE A 45 1.446 -6.597 10.573 1.00 0.00 C ATOM 676 C ILE A 45 -0.110 -6.705 10.480 1.00 0.00 C ATOM 677 O ILE A 45 -0.854 -5.787 10.846 1.00 0.00 O ATOM 678 CB ILE A 45 2.105 -7.120 11.894 1.00 0.00 C ATOM 679 CG1 ILE A 45 2.073 -8.674 12.001 1.00 0.00 C ATOM 680 CG2 ILE A 45 1.509 -6.451 13.146 1.00 0.00 C ATOM 681 CD1 ILE A 45 3.004 -9.286 13.060 1.00 0.00 C ATOM 0 H ILE A 45 2.154 -4.656 11.062 1.00 0.00 H new ATOM 0 HA ILE A 45 1.812 -7.296 9.821 1.00 0.00 H new ATOM 0 HB ILE A 45 3.155 -6.830 11.845 1.00 0.00 H new ATOM 0 HG12 ILE A 45 1.051 -8.984 12.219 1.00 0.00 H new ATOM 0 HG13 ILE A 45 2.333 -9.093 11.029 1.00 0.00 H new ATOM 0 HG21 ILE A 45 1.997 -6.846 14.037 1.00 0.00 H new ATOM 0 HG22 ILE A 45 1.667 -5.374 13.093 1.00 0.00 H new ATOM 0 HG23 ILE A 45 0.440 -6.659 13.196 1.00 0.00 H new ATOM 0 HD11 ILE A 45 2.903 -10.371 13.050 1.00 0.00 H new ATOM 0 HD12 ILE A 45 4.036 -9.016 12.837 1.00 0.00 H new ATOM 0 HD13 ILE A 45 2.734 -8.906 14.045 1.00 0.00 H new ATOM 693 N GLY A 46 -0.569 -7.845 9.951 1.00 0.00 N ATOM 694 CA GLY A 46 -2.012 -8.083 9.690 1.00 0.00 C ATOM 695 C GLY A 46 -2.694 -7.329 8.506 1.00 0.00 C ATOM 696 O GLY A 46 -3.902 -7.505 8.329 1.00 0.00 O ATOM 0 H GLY A 46 0.033 -8.626 9.691 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -2.146 -9.152 9.522 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -2.558 -7.833 10.600 1.00 0.00 H new ATOM 700 N PHE A 47 -1.957 -6.527 7.701 1.00 0.00 N ATOM 701 CA PHE A 47 -2.537 -5.672 6.642 1.00 0.00 C ATOM 702 C PHE A 47 -1.644 -5.403 5.394 1.00 0.00 C ATOM 703 O PHE A 47 -2.202 -5.400 4.292 1.00 0.00 O ATOM 704 CB PHE A 47 -2.905 -4.308 7.308 1.00 0.00 C ATOM 705 CG PHE A 47 -3.731 -3.385 6.387 1.00 0.00 C ATOM 706 CD1 PHE A 47 -5.080 -3.656 6.131 1.00 0.00 C ATOM 707 CD2 PHE A 47 -3.063 -2.429 5.607 1.00 0.00 C ATOM 708 CE1 PHE A 47 -5.726 -3.018 5.076 1.00 0.00 C ATOM 709 CE2 PHE A 47 -3.718 -1.808 4.549 1.00 0.00 C ATOM 710 CZ PHE A 47 -5.044 -2.117 4.280 1.00 0.00 C ATOM 0 H PHE A 47 -0.942 -6.456 7.769 1.00 0.00 H new ATOM 0 HA PHE A 47 -3.391 -6.220 6.243 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -3.468 -4.497 8.222 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -1.989 -3.794 7.599 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -5.618 -4.358 6.750 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -2.037 -2.175 5.829 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -6.767 -3.228 4.878 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -3.196 -1.087 3.938 1.00 0.00 H new ATOM 0 HZ PHE A 47 -5.545 -1.651 3.445 1.00 0.00 H new ATOM 720 N GLY A 48 -0.346 -5.063 5.545 1.00 0.00 N ATOM 721 CA GLY A 48 0.464 -4.576 4.411 1.00 0.00 C ATOM 722 C GLY A 48 1.993 -4.635 4.532 1.00 0.00 C ATOM 723 O GLY A 48 2.555 -4.714 5.623 1.00 0.00 O ATOM 0 H GLY A 48 0.157 -5.116 6.431 1.00 0.00 H new ATOM 0 HA2 GLY A 48 0.178 -5.148 3.528 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.185 -3.539 4.224 1.00 0.00 H new ATOM 727 N ASN A 49 2.674 -4.554 3.378 1.00 0.00 N ATOM 728 CA ASN A 49 4.154 -4.457 3.326 1.00 0.00 C ATOM 729 C ASN A 49 4.506 -3.696 2.019 1.00 0.00 C ATOM 730 O ASN A 49 4.646 -4.308 0.955 1.00 0.00 O ATOM 731 CB ASN A 49 4.839 -5.850 3.489 1.00 0.00 C ATOM 732 CG ASN A 49 6.382 -5.918 3.391 1.00 0.00 C ATOM 733 OD1 ASN A 49 7.087 -4.943 3.126 1.00 0.00 O ATOM 734 ND2 ASN A 49 6.940 -7.100 3.603 1.00 0.00 N ATOM 0 H ASN A 49 2.227 -4.553 2.461 1.00 0.00 H new ATOM 0 HA ASN A 49 4.553 -3.895 4.170 1.00 0.00 H new ATOM 0 HB2 ASN A 49 4.548 -6.253 4.459 1.00 0.00 H new ATOM 0 HB3 ASN A 49 4.427 -6.515 2.730 1.00 0.00 H new ATOM 0 HD21 ASN A 49 7.953 -7.203 3.547 1.00 0.00 H new ATOM 0 HD22 ASN A 49 6.357 -7.907 3.822 1.00 0.00 H new ATOM 741 N PHE A 50 4.680 -2.359 2.096 1.00 0.00 N ATOM 742 CA PHE A 50 5.124 -1.559 0.922 1.00 0.00 C ATOM 743 C PHE A 50 6.640 -1.766 0.728 1.00 0.00 C ATOM 744 O PHE A 50 7.410 -1.787 1.694 1.00 0.00 O ATOM 745 CB PHE A 50 4.923 -0.019 0.981 1.00 0.00 C ATOM 746 CG PHE A 50 3.555 0.562 1.262 1.00 0.00 C ATOM 747 CD1 PHE A 50 3.040 0.496 2.561 1.00 0.00 C ATOM 748 CD2 PHE A 50 2.921 1.358 0.303 1.00 0.00 C ATOM 749 CE1 PHE A 50 1.851 1.142 2.872 1.00 0.00 C ATOM 750 CE2 PHE A 50 1.739 2.012 0.623 1.00 0.00 C ATOM 751 CZ PHE A 50 1.196 1.874 1.892 1.00 0.00 C ATOM 0 H PHE A 50 4.524 -1.813 2.943 1.00 0.00 H new ATOM 0 HA PHE A 50 4.487 -1.925 0.117 1.00 0.00 H new ATOM 0 HB2 PHE A 50 5.600 0.366 1.744 1.00 0.00 H new ATOM 0 HB3 PHE A 50 5.256 0.387 0.026 1.00 0.00 H new ATOM 0 HD1 PHE A 50 3.568 -0.058 3.323 1.00 0.00 H new ATOM 0 HD2 PHE A 50 3.349 1.464 -0.683 1.00 0.00 H new ATOM 0 HE1 PHE A 50 1.439 1.075 3.868 1.00 0.00 H new ATOM 0 HE2 PHE A 50 1.244 2.627 -0.114 1.00 0.00 H new ATOM 0 HZ PHE A 50 0.250 2.343 2.120 1.00 0.00 H new ATOM 761 N GLU A 51 7.059 -1.907 -0.532 1.00 0.00 N ATOM 762 CA GLU A 51 8.494 -2.052 -0.851 1.00 0.00 C ATOM 763 C GLU A 51 8.711 -1.695 -2.326 1.00 0.00 C ATOM 764 O GLU A 51 8.031 -2.194 -3.226 1.00 0.00 O ATOM 765 CB GLU A 51 9.092 -3.436 -0.459 1.00 0.00 C ATOM 766 CG GLU A 51 8.420 -4.699 -1.049 1.00 0.00 C ATOM 767 CD GLU A 51 9.048 -5.989 -0.523 1.00 0.00 C ATOM 768 OE1 GLU A 51 9.891 -6.637 -1.143 1.00 0.00 O ATOM 769 OE2 GLU A 51 8.564 -6.333 0.714 1.00 0.00 O ATOM 0 H GLU A 51 6.440 -1.925 -1.343 1.00 0.00 H new ATOM 0 HA GLU A 51 9.054 -1.352 -0.230 1.00 0.00 H new ATOM 0 HB2 GLU A 51 10.141 -3.445 -0.754 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.066 -3.518 0.628 1.00 0.00 H new ATOM 0 HG2 GLU A 51 7.357 -4.690 -0.806 1.00 0.00 H new ATOM 0 HG3 GLU A 51 8.499 -4.676 -2.136 1.00 0.00 H new ATOM 777 N VAL A 52 9.705 -0.832 -2.560 1.00 0.00 N ATOM 778 CA VAL A 52 9.989 -0.251 -3.872 1.00 0.00 C ATOM 779 C VAL A 52 10.771 -1.246 -4.798 1.00 0.00 C ATOM 780 O VAL A 52 11.451 -2.154 -4.303 1.00 0.00 O ATOM 781 CB VAL A 52 10.640 1.123 -3.456 1.00 0.00 C ATOM 782 CG1 VAL A 52 12.157 1.130 -3.625 1.00 0.00 C ATOM 783 CG2 VAL A 52 9.941 2.310 -4.118 1.00 0.00 C ATOM 0 H VAL A 52 10.343 -0.514 -1.831 1.00 0.00 H new ATOM 0 HA VAL A 52 9.148 -0.063 -4.540 1.00 0.00 H new ATOM 0 HB VAL A 52 10.476 1.243 -2.385 1.00 0.00 H new ATOM 0 HG11 VAL A 52 12.552 2.100 -3.324 1.00 0.00 H new ATOM 0 HG12 VAL A 52 12.596 0.350 -3.002 1.00 0.00 H new ATOM 0 HG13 VAL A 52 12.408 0.944 -4.669 1.00 0.00 H new ATOM 0 HG21 VAL A 52 10.421 3.237 -3.804 1.00 0.00 H new ATOM 0 HG22 VAL A 52 10.010 2.215 -5.202 1.00 0.00 H new ATOM 0 HG23 VAL A 52 8.892 2.326 -3.821 1.00 0.00 H new ATOM 793 N ARG A 53 10.694 -1.048 -6.130 1.00 0.00 N ATOM 794 CA ARG A 53 11.405 -1.933 -7.097 1.00 0.00 C ATOM 795 C ARG A 53 12.412 -1.096 -7.920 1.00 0.00 C ATOM 796 O ARG A 53 12.038 -0.453 -8.906 1.00 0.00 O ATOM 797 CB ARG A 53 10.405 -2.715 -7.997 1.00 0.00 C ATOM 798 CG ARG A 53 10.997 -3.865 -8.845 1.00 0.00 C ATOM 799 CD ARG A 53 11.508 -5.085 -8.048 1.00 0.00 C ATOM 800 NE ARG A 53 12.130 -6.109 -8.926 1.00 0.00 N ATOM 801 CZ ARG A 53 13.417 -6.102 -9.334 1.00 0.00 C ATOM 802 NH1 ARG A 53 14.299 -5.160 -9.002 1.00 0.00 N ATOM 803 NH2 ARG A 53 13.827 -7.087 -10.112 1.00 0.00 N ATOM 0 H ARG A 53 10.157 -0.297 -6.563 1.00 0.00 H new ATOM 0 HA ARG A 53 11.964 -2.688 -6.545 1.00 0.00 H new ATOM 0 HB2 ARG A 53 9.623 -3.128 -7.360 1.00 0.00 H new ATOM 0 HB3 ARG A 53 9.925 -2.005 -8.671 1.00 0.00 H new ATOM 0 HG2 ARG A 53 10.235 -4.205 -9.547 1.00 0.00 H new ATOM 0 HG3 ARG A 53 11.822 -3.469 -9.437 1.00 0.00 H new ATOM 0 HD2 ARG A 53 12.236 -4.754 -7.307 1.00 0.00 H new ATOM 0 HD3 ARG A 53 10.678 -5.533 -7.502 1.00 0.00 H new ATOM 0 HE ARG A 53 11.539 -6.877 -9.245 1.00 0.00 H new ATOM 0 HH11 ARG A 53 14.015 -4.384 -8.404 1.00 0.00 H new ATOM 0 HH12 ARG A 53 15.258 -5.215 -9.345 1.00 0.00 H new ATOM 0 HH21 ARG A 53 13.177 -7.824 -10.387 1.00 0.00 H new ATOM 0 HH22 ARG A 53 14.793 -7.111 -10.438 1.00 0.00 H new ATOM 1134 N LYS A 75 13.322 3.575 -8.991 1.00 0.00 N ATOM 1135 CA LYS A 75 12.544 2.900 -7.911 1.00 0.00 C ATOM 1136 C LYS A 75 11.023 3.065 -8.170 1.00 0.00 C ATOM 1137 O LYS A 75 10.545 4.185 -8.375 1.00 0.00 O ATOM 1138 CB LYS A 75 12.926 3.323 -6.465 1.00 0.00 C ATOM 1139 CG LYS A 75 14.389 3.769 -6.214 1.00 0.00 C ATOM 1140 CD LYS A 75 14.738 3.969 -4.724 1.00 0.00 C ATOM 1141 CE LYS A 75 16.201 4.375 -4.458 1.00 0.00 C ATOM 1142 NZ LYS A 75 16.514 5.753 -4.886 1.00 0.00 N ATOM 0 HA LYS A 75 12.815 1.845 -7.961 1.00 0.00 H new ATOM 0 HB2 LYS A 75 12.269 4.141 -6.169 1.00 0.00 H new ATOM 0 HB3 LYS A 75 12.711 2.485 -5.801 1.00 0.00 H new ATOM 0 HG2 LYS A 75 15.063 3.024 -6.637 1.00 0.00 H new ATOM 0 HG3 LYS A 75 14.570 4.702 -6.747 1.00 0.00 H new ATOM 0 HD2 LYS A 75 14.081 4.734 -4.310 1.00 0.00 H new ATOM 0 HD3 LYS A 75 14.528 3.044 -4.188 1.00 0.00 H new ATOM 0 HE2 LYS A 75 16.410 4.277 -3.393 1.00 0.00 H new ATOM 0 HE3 LYS A 75 16.863 3.682 -4.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 17.507 5.968 -4.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 16.361 5.841 -5.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 15.894 6.421 -4.385 1.00 0.00 H new ATOM 1155 N VAL A 76 10.266 1.954 -8.136 1.00 0.00 N ATOM 1156 CA VAL A 76 8.850 1.909 -8.496 1.00 0.00 C ATOM 1157 C VAL A 76 8.050 1.608 -7.188 1.00 0.00 C ATOM 1158 O VAL A 76 8.430 0.688 -6.464 1.00 0.00 O ATOM 1159 CB VAL A 76 8.830 0.800 -9.604 1.00 0.00 C ATOM 1160 CG1 VAL A 76 7.966 -0.417 -9.316 1.00 0.00 C ATOM 1161 CG2 VAL A 76 8.523 1.380 -10.973 1.00 0.00 C ATOM 0 H VAL A 76 10.635 1.047 -7.851 1.00 0.00 H new ATOM 0 HA VAL A 76 8.387 2.815 -8.888 1.00 0.00 H new ATOM 0 HB VAL A 76 9.849 0.412 -9.597 1.00 0.00 H new ATOM 0 HG11 VAL A 76 8.030 -1.115 -10.151 1.00 0.00 H new ATOM 0 HG12 VAL A 76 8.317 -0.905 -8.407 1.00 0.00 H new ATOM 0 HG13 VAL A 76 6.930 -0.105 -9.183 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.518 0.581 -11.714 1.00 0.00 H new ATOM 0 HG22 VAL A 76 7.546 1.862 -10.953 1.00 0.00 H new ATOM 0 HG23 VAL A 76 9.285 2.114 -11.236 1.00 0.00 H new ATOM 1171 N PRO A 77 6.913 2.253 -6.872 1.00 0.00 N ATOM 1172 CA PRO A 77 6.181 1.995 -5.616 1.00 0.00 C ATOM 1173 C PRO A 77 5.118 0.886 -5.719 1.00 0.00 C ATOM 1174 O PRO A 77 4.405 0.723 -6.716 1.00 0.00 O ATOM 1175 CB PRO A 77 5.569 3.376 -5.363 1.00 0.00 C ATOM 1176 CG PRO A 77 5.290 3.927 -6.767 1.00 0.00 C ATOM 1177 CD PRO A 77 6.335 3.308 -7.703 1.00 0.00 C ATOM 0 HA PRO A 77 6.814 1.615 -4.814 1.00 0.00 H new ATOM 0 HB2 PRO A 77 4.654 3.304 -4.774 1.00 0.00 H new ATOM 0 HB3 PRO A 77 6.254 4.020 -4.811 1.00 0.00 H new ATOM 0 HG2 PRO A 77 4.281 3.669 -7.090 1.00 0.00 H new ATOM 0 HG3 PRO A 77 5.359 5.015 -6.776 1.00 0.00 H new ATOM 0 HD2 PRO A 77 5.882 2.908 -8.610 1.00 0.00 H new ATOM 0 HD3 PRO A 77 7.084 4.036 -8.015 1.00 0.00 H new ATOM 1185 N ALA A 78 5.057 0.148 -4.610 1.00 0.00 N ATOM 1186 CA ALA A 78 4.201 -1.034 -4.478 1.00 0.00 C ATOM 1187 C ALA A 78 3.764 -1.222 -3.005 1.00 0.00 C ATOM 1188 O ALA A 78 4.387 -0.746 -2.052 1.00 0.00 O ATOM 1189 CB ALA A 78 5.054 -2.202 -4.994 1.00 0.00 C ATOM 0 H ALA A 78 5.603 0.354 -3.773 1.00 0.00 H new ATOM 0 HA ALA A 78 3.274 -0.952 -5.046 1.00 0.00 H new ATOM 0 HB1 ALA A 78 4.482 -3.127 -4.928 1.00 0.00 H new ATOM 0 HB2 ALA A 78 5.330 -2.020 -6.032 1.00 0.00 H new ATOM 0 HB3 ALA A 78 5.956 -2.289 -4.388 1.00 0.00 H new ATOM 1195 N PHE A 79 2.655 -1.949 -2.881 1.00 0.00 N ATOM 1196 CA PHE A 79 2.007 -2.300 -1.590 1.00 0.00 C ATOM 1197 C PHE A 79 1.608 -3.797 -1.738 1.00 0.00 C ATOM 1198 O PHE A 79 0.834 -4.208 -2.611 1.00 0.00 O ATOM 1199 CB PHE A 79 0.811 -1.377 -1.281 1.00 0.00 C ATOM 1200 CG PHE A 79 -0.228 -1.855 -0.237 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -0.033 -1.630 1.128 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -1.352 -2.583 -0.656 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -0.941 -2.127 2.059 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -2.241 -3.107 0.278 1.00 0.00 C ATOM 1205 CZ PHE A 79 -2.029 -2.887 1.635 1.00 0.00 C ATOM 0 H PHE A 79 2.159 -2.326 -3.688 1.00 0.00 H new ATOM 0 HA PHE A 79 2.672 -2.158 -0.738 1.00 0.00 H new ATOM 0 HB2 PHE A 79 1.207 -0.420 -0.943 1.00 0.00 H new ATOM 0 HB3 PHE A 79 0.283 -1.191 -2.216 1.00 0.00 H new ATOM 0 HD1 PHE A 79 0.826 -1.068 1.463 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -1.528 -2.738 -1.710 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.802 -1.923 3.110 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -3.094 -3.683 -0.050 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.709 -3.306 2.362 1.00 0.00 H new ATOM 1215 N LYS A 80 2.136 -4.566 -0.798 1.00 0.00 N ATOM 1216 CA LYS A 80 1.712 -5.975 -0.542 1.00 0.00 C ATOM 1217 C LYS A 80 0.462 -5.927 0.371 1.00 0.00 C ATOM 1218 O LYS A 80 0.405 -5.048 1.236 1.00 0.00 O ATOM 1219 CB LYS A 80 2.819 -6.791 0.169 1.00 0.00 C ATOM 1220 CG LYS A 80 3.996 -7.186 -0.752 1.00 0.00 C ATOM 1221 CD LYS A 80 5.081 -8.002 -0.024 1.00 0.00 C ATOM 1222 CE LYS A 80 6.195 -8.480 -0.971 1.00 0.00 C ATOM 1223 NZ LYS A 80 7.212 -9.266 -0.252 1.00 0.00 N ATOM 0 H LYS A 80 2.878 -4.247 -0.175 1.00 0.00 H new ATOM 0 HA LYS A 80 1.504 -6.461 -1.495 1.00 0.00 H new ATOM 0 HB2 LYS A 80 3.205 -6.209 1.006 1.00 0.00 H new ATOM 0 HB3 LYS A 80 2.378 -7.696 0.587 1.00 0.00 H new ATOM 0 HG2 LYS A 80 3.614 -7.767 -1.592 1.00 0.00 H new ATOM 0 HG3 LYS A 80 4.445 -6.283 -1.167 1.00 0.00 H new ATOM 0 HD2 LYS A 80 5.518 -7.394 0.768 1.00 0.00 H new ATOM 0 HD3 LYS A 80 4.621 -8.866 0.455 1.00 0.00 H new ATOM 0 HE2 LYS A 80 5.762 -9.085 -1.768 1.00 0.00 H new ATOM 0 HE3 LYS A 80 6.666 -7.619 -1.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 7.949 -9.573 -0.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 7.641 -8.680 0.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 6.765 -10.101 0.179 1.00 0.00 H new ATOM 1236 N PRO A 81 -0.550 -6.829 0.260 1.00 0.00 N ATOM 1237 CA PRO A 81 -1.633 -6.912 1.276 1.00 0.00 C ATOM 1238 C PRO A 81 -1.200 -7.694 2.567 1.00 0.00 C ATOM 1239 O PRO A 81 -2.020 -8.390 3.166 1.00 0.00 O ATOM 1240 CB PRO A 81 -2.711 -7.613 0.426 1.00 0.00 C ATOM 1241 CG PRO A 81 -1.957 -8.556 -0.513 1.00 0.00 C ATOM 1242 CD PRO A 81 -0.697 -7.777 -0.865 1.00 0.00 C ATOM 0 HA PRO A 81 -1.954 -5.966 1.711 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -3.408 -8.165 1.057 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -3.297 -6.887 -0.137 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -1.721 -9.502 -0.026 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -2.544 -8.792 -1.401 1.00 0.00 H new ATOM 0 HD2 PRO A 81 0.169 -8.433 -0.952 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -0.800 -7.257 -1.817 1.00 0.00 H new ATOM 1250 N GLY A 82 0.081 -7.577 2.999 1.00 0.00 N ATOM 1251 CA GLY A 82 0.683 -8.341 4.116 1.00 0.00 C ATOM 1252 C GLY A 82 0.404 -9.856 4.226 1.00 0.00 C ATOM 1253 O GLY A 82 0.610 -10.385 5.320 1.00 0.00 O ATOM 0 H GLY A 82 0.740 -6.930 2.566 1.00 0.00 H new ATOM 0 HA2 GLY A 82 1.764 -8.209 4.060 1.00 0.00 H new ATOM 0 HA3 GLY A 82 0.354 -7.878 5.046 1.00 0.00 H new ATOM 1257 N LYS A 83 -0.068 -10.515 3.130 1.00 0.00 N ATOM 1258 CA LYS A 83 -0.639 -11.911 3.155 1.00 0.00 C ATOM 1259 C LYS A 83 -2.048 -12.037 3.840 1.00 0.00 C ATOM 1260 O LYS A 83 -2.986 -12.654 3.336 1.00 0.00 O ATOM 1261 CB LYS A 83 0.331 -12.992 3.722 1.00 0.00 C ATOM 1262 CG LYS A 83 1.059 -13.847 2.663 1.00 0.00 C ATOM 1263 CD LYS A 83 2.092 -13.072 1.810 1.00 0.00 C ATOM 1264 CE LYS A 83 2.866 -13.928 0.789 1.00 0.00 C ATOM 1265 NZ LYS A 83 2.032 -14.385 -0.340 1.00 0.00 N ATOM 0 H LYS A 83 -0.067 -10.100 2.198 1.00 0.00 H new ATOM 0 HA LYS A 83 -0.780 -12.117 2.094 1.00 0.00 H new ATOM 0 HB2 LYS A 83 1.079 -12.496 4.341 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -0.234 -13.657 4.375 1.00 0.00 H new ATOM 0 HG2 LYS A 83 1.567 -14.670 3.166 1.00 0.00 H new ATOM 0 HG3 LYS A 83 0.317 -14.289 1.998 1.00 0.00 H new ATOM 0 HD2 LYS A 83 1.575 -12.275 1.276 1.00 0.00 H new ATOM 0 HD3 LYS A 83 2.808 -12.595 2.479 1.00 0.00 H new ATOM 0 HE2 LYS A 83 3.705 -13.349 0.402 1.00 0.00 H new ATOM 0 HE3 LYS A 83 3.285 -14.796 1.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 2.610 -14.955 -0.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 1.246 -14.962 0.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 1.652 -13.560 -0.847 1.00 0.00 H new ATOM 1278 N ALA A 84 -2.089 -11.479 5.043 1.00 0.00 N ATOM 1279 CA ALA A 84 -3.226 -11.344 5.964 1.00 0.00 C ATOM 1280 C ALA A 84 -4.480 -10.638 5.410 1.00 0.00 C ATOM 1281 O ALA A 84 -5.575 -11.188 5.561 1.00 0.00 O ATOM 1282 CB ALA A 84 -2.595 -10.507 7.076 1.00 0.00 C ATOM 0 H ALA A 84 -1.247 -11.067 5.444 1.00 0.00 H new ATOM 0 HA ALA A 84 -3.625 -12.320 6.240 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -3.335 -10.319 7.854 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.749 -11.047 7.502 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.250 -9.558 6.666 1.00 0.00 H new ATOM 1288 N LEU A 85 -4.340 -9.440 4.785 1.00 0.00 N ATOM 1289 CA LEU A 85 -5.431 -8.828 4.008 1.00 0.00 C ATOM 1290 C LEU A 85 -5.820 -9.769 2.813 1.00 0.00 C ATOM 1291 O LEU A 85 -7.014 -9.934 2.582 1.00 0.00 O ATOM 1292 CB LEU A 85 -5.067 -7.378 3.572 1.00 0.00 C ATOM 1293 CG LEU A 85 -6.175 -6.722 2.733 1.00 0.00 C ATOM 1294 CD1 LEU A 85 -7.393 -6.266 3.546 1.00 0.00 C ATOM 1295 CD2 LEU A 85 -5.631 -5.572 1.870 1.00 0.00 C ATOM 0 H LEU A 85 -3.483 -8.887 4.808 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.317 -8.726 4.634 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -4.879 -6.772 4.458 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -4.142 -7.396 2.996 1.00 0.00 H new ATOM 0 HG LEU A 85 -6.534 -7.513 2.075 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -8.127 -5.814 2.879 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -7.838 -7.125 4.047 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -7.080 -5.534 4.290 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -6.445 -5.134 1.292 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -5.193 -4.810 2.514 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -4.869 -5.955 1.191 1.00 0.00 H new ATOM 1307 N LYS A 86 -4.859 -10.376 2.082 1.00 0.00 N ATOM 1308 CA LYS A 86 -5.158 -11.401 1.035 1.00 0.00 C ATOM 1309 C LYS A 86 -6.067 -12.598 1.494 1.00 0.00 C ATOM 1310 O LYS A 86 -6.755 -13.182 0.656 1.00 0.00 O ATOM 1311 CB LYS A 86 -3.859 -11.874 0.328 1.00 0.00 C ATOM 1312 CG LYS A 86 -4.039 -12.155 -1.180 1.00 0.00 C ATOM 1313 CD LYS A 86 -2.716 -12.502 -1.896 1.00 0.00 C ATOM 1314 CE LYS A 86 -2.849 -12.729 -3.415 1.00 0.00 C ATOM 1315 NZ LYS A 86 -3.137 -11.491 -4.168 1.00 0.00 N ATOM 0 H LYS A 86 -3.864 -10.179 2.192 1.00 0.00 H new ATOM 0 HA LYS A 86 -5.781 -10.883 0.305 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -3.088 -11.114 0.457 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -3.499 -12.779 0.817 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -4.741 -12.979 -1.308 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -4.483 -11.281 -1.655 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -2.003 -11.696 -1.723 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -2.298 -13.401 -1.443 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -1.926 -13.169 -3.792 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -3.644 -13.451 -3.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -3.214 -11.711 -5.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -4.032 -11.081 -3.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -2.367 -10.808 -4.020 1.00 0.00 H new ATOM 1328 N ASP A 87 -6.085 -12.929 2.802 1.00 0.00 N ATOM 1329 CA ASP A 87 -7.032 -13.882 3.422 1.00 0.00 C ATOM 1330 C ASP A 87 -8.406 -13.239 3.796 1.00 0.00 C ATOM 1331 O ASP A 87 -9.438 -13.884 3.594 1.00 0.00 O ATOM 1332 CB ASP A 87 -6.292 -14.475 4.650 1.00 0.00 C ATOM 1333 CG ASP A 87 -6.343 -16.004 4.706 1.00 0.00 C ATOM 1334 OD1 ASP A 87 -5.493 -16.730 4.191 1.00 0.00 O ATOM 1335 OD2 ASP A 87 -7.443 -16.460 5.385 1.00 0.00 O ATOM 0 H ASP A 87 -5.427 -12.532 3.473 1.00 0.00 H new ATOM 0 HA ASP A 87 -7.307 -14.663 2.713 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.251 -14.153 4.628 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -6.732 -14.070 5.561 1.00 0.00 H new ATOM 1341 N ALA A 88 -8.427 -11.998 4.340 1.00 0.00 N ATOM 1342 CA ALA A 88 -9.674 -11.204 4.550 1.00 0.00 C ATOM 1343 C ALA A 88 -10.589 -11.021 3.302 1.00 0.00 C ATOM 1344 O ALA A 88 -11.816 -11.078 3.395 1.00 0.00 O ATOM 1345 CB ALA A 88 -9.279 -9.755 4.958 1.00 0.00 C ATOM 0 H ALA A 88 -7.583 -11.515 4.647 1.00 0.00 H new ATOM 0 HA ALA A 88 -10.226 -11.773 5.298 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -10.180 -9.163 5.115 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -8.698 -9.782 5.880 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -8.682 -9.304 4.166 1.00 0.00 H new ATOM 1351 N VAL A 89 -9.940 -10.794 2.152 1.00 0.00 N ATOM 1352 CA VAL A 89 -10.540 -10.336 0.898 1.00 0.00 C ATOM 1353 C VAL A 89 -10.877 -11.429 -0.172 1.00 0.00 C ATOM 1354 O VAL A 89 -11.556 -11.113 -1.154 1.00 0.00 O ATOM 1355 CB VAL A 89 -9.394 -9.323 0.527 1.00 0.00 C ATOM 1356 CG1 VAL A 89 -8.228 -9.967 -0.231 1.00 0.00 C ATOM 1357 CG2 VAL A 89 -9.901 -8.134 -0.235 1.00 0.00 C ATOM 0 H VAL A 89 -8.933 -10.933 2.070 1.00 0.00 H new ATOM 0 HA VAL A 89 -11.551 -9.934 0.966 1.00 0.00 H new ATOM 0 HB VAL A 89 -9.011 -8.982 1.489 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -7.476 -9.210 -0.453 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.784 -10.750 0.383 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -8.594 -10.399 -1.162 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -9.070 -7.468 -0.465 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -10.366 -8.468 -1.163 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -10.636 -7.602 0.368 1.00 0.00 H new ATOM 1367 N LYS A 90 -10.392 -12.677 0.011 1.00 0.00 N ATOM 1368 CA LYS A 90 -10.509 -13.772 -0.973 1.00 0.00 C ATOM 1369 C LYS A 90 -11.951 -14.238 -1.254 1.00 0.00 C ATOM 1370 O LYS A 90 -12.516 -13.934 -2.305 1.00 0.00 O ATOM 1371 CB LYS A 90 -9.563 -14.907 -0.509 1.00 0.00 C ATOM 1372 CG LYS A 90 -10.001 -15.785 0.689 1.00 0.00 C ATOM 1373 CD LYS A 90 -8.932 -16.817 1.098 1.00 0.00 C ATOM 1374 CE LYS A 90 -9.317 -17.596 2.368 1.00 0.00 C ATOM 1375 NZ LYS A 90 -8.287 -18.587 2.725 1.00 0.00 N ATOM 0 H LYS A 90 -9.901 -12.954 0.861 1.00 0.00 H new ATOM 0 HA LYS A 90 -10.202 -13.405 -1.952 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.393 -15.567 -1.360 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -8.602 -14.457 -0.258 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -10.224 -15.143 1.541 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -10.923 -16.307 0.433 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -8.778 -17.519 0.278 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -7.983 -16.306 1.263 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -9.456 -16.900 3.195 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -10.271 -18.100 2.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -8.577 -19.095 3.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -8.172 -19.265 1.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -7.383 -18.102 2.898 1.00 0.00 H new ATOM 1389 N MET B 1 9.565 -0.949 8.399 1.00 0.00 N ATOM 1390 CA MET B 1 8.891 -0.543 9.639 1.00 0.00 C ATOM 1391 C MET B 1 8.554 -1.834 10.447 1.00 0.00 C ATOM 1392 O MET B 1 9.469 -2.493 10.946 1.00 0.00 O ATOM 1393 CB MET B 1 7.736 0.471 9.343 1.00 0.00 C ATOM 1394 CG MET B 1 8.122 1.848 8.781 1.00 0.00 C ATOM 1395 SD MET B 1 6.613 2.832 8.643 1.00 0.00 S ATOM 1396 CE MET B 1 7.176 4.228 7.651 1.00 0.00 C ATOM 0 H1 MET B 1 9.801 -0.105 7.840 1.00 0.00 H new ATOM 0 H2 MET B 1 10.437 -1.466 8.631 1.00 0.00 H new ATOM 0 H3 MET B 1 8.934 -1.565 7.847 1.00 0.00 H new ATOM 0 HA MET B 1 9.527 0.044 10.302 1.00 0.00 H new ATOM 0 HB2 MET B 1 7.050 0.001 8.638 1.00 0.00 H new ATOM 0 HB3 MET B 1 7.183 0.629 10.269 1.00 0.00 H new ATOM 0 HG2 MET B 1 8.840 2.340 9.437 1.00 0.00 H new ATOM 0 HG3 MET B 1 8.600 1.743 7.807 1.00 0.00 H new ATOM 0 HE1 MET B 1 6.343 4.619 7.068 1.00 0.00 H new ATOM 0 HE2 MET B 1 7.559 5.010 8.307 1.00 0.00 H new ATOM 0 HE3 MET B 1 7.968 3.900 6.978 1.00 0.00 H new ATOM 1407 N ASN B 2 7.255 -2.154 10.567 1.00 0.00 N ATOM 1408 CA ASN B 2 6.650 -3.372 11.193 1.00 0.00 C ATOM 1409 C ASN B 2 5.148 -3.186 11.570 1.00 0.00 C ATOM 1410 O ASN B 2 4.399 -4.160 11.521 1.00 0.00 O ATOM 1411 CB ASN B 2 7.378 -4.139 12.331 1.00 0.00 C ATOM 1412 CG ASN B 2 7.518 -3.448 13.700 1.00 0.00 C ATOM 1413 OD1 ASN B 2 8.461 -2.707 13.969 1.00 0.00 O ATOM 1414 ND2 ASN B 2 6.580 -3.717 14.590 1.00 0.00 N ATOM 0 H ASN B 2 6.534 -1.529 10.206 1.00 0.00 H new ATOM 0 HA ASN B 2 6.788 -4.042 10.344 1.00 0.00 H new ATOM 0 HB2 ASN B 2 6.853 -5.082 12.486 1.00 0.00 H new ATOM 0 HB3 ASN B 2 8.379 -4.386 11.979 1.00 0.00 H new ATOM 0 HD21 ASN B 2 6.629 -3.307 15.523 1.00 0.00 H new ATOM 0 HD22 ASN B 2 5.806 -4.335 14.345 1.00 0.00 H new ATOM 1421 N LYS B 3 4.791 -1.949 11.962 1.00 0.00 N ATOM 1422 CA LYS B 3 3.474 -1.456 12.478 1.00 0.00 C ATOM 1423 C LYS B 3 3.692 -0.542 13.728 1.00 0.00 C ATOM 1424 O LYS B 3 2.848 0.312 13.990 1.00 0.00 O ATOM 1425 CB LYS B 3 2.344 -2.493 12.738 1.00 0.00 C ATOM 1426 CG LYS B 3 0.916 -1.921 12.910 1.00 0.00 C ATOM 1427 CD LYS B 3 -0.174 -3.010 12.945 1.00 0.00 C ATOM 1428 CE LYS B 3 -1.601 -2.438 13.005 1.00 0.00 C ATOM 1429 NZ LYS B 3 -2.613 -3.509 13.037 1.00 0.00 N ATOM 0 H LYS B 3 5.471 -1.189 11.927 1.00 0.00 H new ATOM 0 HA LYS B 3 3.076 -0.896 11.631 1.00 0.00 H new ATOM 0 HB2 LYS B 3 2.332 -3.201 11.909 1.00 0.00 H new ATOM 0 HB3 LYS B 3 2.597 -3.057 13.636 1.00 0.00 H new ATOM 0 HG2 LYS B 3 0.872 -1.342 13.833 1.00 0.00 H new ATOM 0 HG3 LYS B 3 0.706 -1.232 12.092 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -0.079 -3.639 12.060 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -0.010 -3.651 13.811 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -1.706 -1.811 13.891 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -1.774 -1.799 12.139 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -3.563 -3.088 13.077 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -2.529 -4.092 12.180 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -2.462 -4.104 13.877 1.00 0.00 H new ATOM 1442 N THR B 4 4.786 -0.714 14.491 1.00 0.00 N ATOM 1443 CA THR B 4 5.197 0.076 15.637 1.00 0.00 C ATOM 1444 C THR B 4 6.210 1.189 15.242 1.00 0.00 C ATOM 1445 O THR B 4 6.142 2.267 15.841 1.00 0.00 O ATOM 1446 CB THR B 4 5.779 -0.981 16.593 1.00 0.00 C ATOM 1447 OG1 THR B 4 4.811 -1.961 16.978 1.00 0.00 O ATOM 1448 CG2 THR B 4 6.251 -0.300 17.841 1.00 0.00 C ATOM 0 H THR B 4 5.446 -1.467 14.298 1.00 0.00 H new ATOM 0 HA THR B 4 4.384 0.638 16.097 1.00 0.00 H new ATOM 0 HB THR B 4 6.591 -1.481 16.065 1.00 0.00 H new ATOM 0 HG1 THR B 4 5.226 -2.611 17.583 1.00 0.00 H new ATOM 0 HG21 THR B 4 6.665 -1.041 18.525 1.00 0.00 H new ATOM 0 HG22 THR B 4 7.019 0.431 17.588 1.00 0.00 H new ATOM 0 HG23 THR B 4 5.412 0.206 18.319 1.00 0.00 H new ATOM 1456 N GLU B 5 7.156 0.953 14.294 1.00 0.00 N ATOM 1457 CA GLU B 5 7.909 2.089 13.664 1.00 0.00 C ATOM 1458 C GLU B 5 6.925 3.093 12.937 1.00 0.00 C ATOM 1459 O GLU B 5 7.247 4.272 12.772 1.00 0.00 O ATOM 1460 CB GLU B 5 9.049 1.639 12.714 1.00 0.00 C ATOM 1461 CG GLU B 5 9.943 0.449 13.126 1.00 0.00 C ATOM 1462 CD GLU B 5 10.718 0.645 14.431 1.00 0.00 C ATOM 1463 OE1 GLU B 5 10.327 0.223 15.519 1.00 0.00 O ATOM 1464 OE2 GLU B 5 11.884 1.342 14.244 1.00 0.00 O ATOM 0 H GLU B 5 7.414 0.026 13.954 1.00 0.00 H new ATOM 0 HA GLU B 5 8.399 2.609 14.487 1.00 0.00 H new ATOM 0 HB2 GLU B 5 8.598 1.394 11.752 1.00 0.00 H new ATOM 0 HB3 GLU B 5 9.700 2.498 12.551 1.00 0.00 H new ATOM 0 HG2 GLU B 5 9.319 -0.439 13.221 1.00 0.00 H new ATOM 0 HG3 GLU B 5 10.655 0.254 12.324 1.00 0.00 H new ATOM 1472 N LEU B 6 5.721 2.592 12.553 1.00 0.00 N ATOM 1473 CA LEU B 6 4.547 3.398 12.185 1.00 0.00 C ATOM 1474 C LEU B 6 4.076 4.322 13.341 1.00 0.00 C ATOM 1475 O LEU B 6 4.015 5.523 13.128 1.00 0.00 O ATOM 1476 CB LEU B 6 3.385 2.428 11.782 1.00 0.00 C ATOM 1477 CG LEU B 6 2.649 2.771 10.478 1.00 0.00 C ATOM 1478 CD1 LEU B 6 1.596 1.703 10.137 1.00 0.00 C ATOM 1479 CD2 LEU B 6 2.061 4.192 10.510 1.00 0.00 C ATOM 0 H LEU B 6 5.545 1.589 12.492 1.00 0.00 H new ATOM 0 HA LEU B 6 4.826 4.044 11.353 1.00 0.00 H new ATOM 0 HB2 LEU B 6 3.792 1.421 11.693 1.00 0.00 H new ATOM 0 HB3 LEU B 6 2.657 2.407 12.593 1.00 0.00 H new ATOM 0 HG LEU B 6 3.381 2.763 9.671 1.00 0.00 H new ATOM 0 HD11 LEU B 6 1.091 1.973 9.209 1.00 0.00 H new ATOM 0 HD12 LEU B 6 2.084 0.736 10.017 1.00 0.00 H new ATOM 0 HD13 LEU B 6 0.865 1.642 10.943 1.00 0.00 H new ATOM 0 HD21 LEU B 6 1.549 4.395 9.569 1.00 0.00 H new ATOM 0 HD22 LEU B 6 1.352 4.274 11.334 1.00 0.00 H new ATOM 0 HD23 LEU B 6 2.865 4.915 10.649 1.00 0.00 H new ATOM 1491 N ILE B 7 3.786 3.779 14.541 1.00 0.00 N ATOM 1492 CA ILE B 7 3.305 4.531 15.742 1.00 0.00 C ATOM 1493 C ILE B 7 4.250 5.700 16.130 1.00 0.00 C ATOM 1494 O ILE B 7 3.782 6.828 16.296 1.00 0.00 O ATOM 1495 CB ILE B 7 3.052 3.563 16.954 1.00 0.00 C ATOM 1496 CG1 ILE B 7 2.161 2.349 16.576 1.00 0.00 C ATOM 1497 CG2 ILE B 7 2.437 4.287 18.170 1.00 0.00 C ATOM 1498 CD1 ILE B 7 2.193 1.153 17.526 1.00 0.00 C ATOM 0 H ILE B 7 3.879 2.779 14.717 1.00 0.00 H new ATOM 0 HA ILE B 7 2.351 4.984 15.471 1.00 0.00 H new ATOM 0 HB ILE B 7 4.040 3.194 17.230 1.00 0.00 H new ATOM 0 HG12 ILE B 7 1.130 2.694 16.498 1.00 0.00 H new ATOM 0 HG13 ILE B 7 2.457 2.005 15.585 1.00 0.00 H new ATOM 0 HG21 ILE B 7 2.283 3.573 18.979 1.00 0.00 H new ATOM 0 HG22 ILE B 7 3.113 5.074 18.505 1.00 0.00 H new ATOM 0 HG23 ILE B 7 1.481 4.726 17.886 1.00 0.00 H new ATOM 0 HD11 ILE B 7 1.530 0.373 17.152 1.00 0.00 H new ATOM 0 HD12 ILE B 7 3.210 0.765 17.589 1.00 0.00 H new ATOM 0 HD13 ILE B 7 1.862 1.466 18.516 1.00 0.00 H new ATOM 1510 N ASN B 8 5.561 5.416 16.250 1.00 0.00 N ATOM 1511 CA ASN B 8 6.581 6.473 16.488 1.00 0.00 C ATOM 1512 C ASN B 8 6.765 7.492 15.315 1.00 0.00 C ATOM 1513 O ASN B 8 7.271 8.584 15.575 1.00 0.00 O ATOM 1514 CB ASN B 8 7.934 5.846 16.925 1.00 0.00 C ATOM 1515 CG ASN B 8 7.904 5.074 18.263 1.00 0.00 C ATOM 1516 OD1 ASN B 8 7.770 5.661 19.337 1.00 0.00 O ATOM 1517 ND2 ASN B 8 8.019 3.755 18.225 1.00 0.00 N ATOM 0 H ASN B 8 5.944 4.473 16.188 1.00 0.00 H new ATOM 0 HA ASN B 8 6.187 7.075 17.306 1.00 0.00 H new ATOM 0 HB2 ASN B 8 8.271 5.168 16.141 1.00 0.00 H new ATOM 0 HB3 ASN B 8 8.676 6.641 17.000 1.00 0.00 H new ATOM 0 HD21 ASN B 8 7.997 3.216 19.091 1.00 0.00 H new ATOM 0 HD22 ASN B 8 8.130 3.278 17.330 1.00 0.00 H new ATOM 1524 N ALA B 9 6.356 7.177 14.063 1.00 0.00 N ATOM 1525 CA ALA B 9 6.272 8.176 12.965 1.00 0.00 C ATOM 1526 C ALA B 9 5.168 9.229 13.161 1.00 0.00 C ATOM 1527 O ALA B 9 5.396 10.415 12.941 1.00 0.00 O ATOM 1528 CB ALA B 9 5.882 7.478 11.637 1.00 0.00 C ATOM 0 H ALA B 9 6.078 6.236 13.785 1.00 0.00 H new ATOM 0 HA ALA B 9 7.255 8.647 12.955 1.00 0.00 H new ATOM 0 HB1 ALA B 9 5.823 8.219 10.840 1.00 0.00 H new ATOM 0 HB2 ALA B 9 6.635 6.731 11.384 1.00 0.00 H new ATOM 0 HB3 ALA B 9 4.913 6.992 11.752 1.00 0.00 H new ATOM 1534 N VAL B 10 3.971 8.757 13.537 1.00 0.00 N ATOM 1535 CA VAL B 10 2.744 9.547 13.694 1.00 0.00 C ATOM 1536 C VAL B 10 2.854 10.480 14.870 1.00 0.00 C ATOM 1537 O VAL B 10 2.701 11.691 14.731 1.00 0.00 O ATOM 1538 CB VAL B 10 1.454 8.674 13.772 1.00 0.00 C ATOM 1539 CG1 VAL B 10 0.203 9.386 13.284 1.00 0.00 C ATOM 1540 CG2 VAL B 10 1.608 7.373 13.008 1.00 0.00 C ATOM 0 H VAL B 10 3.826 7.770 13.749 1.00 0.00 H new ATOM 0 HA VAL B 10 2.642 10.145 12.788 1.00 0.00 H new ATOM 0 HB VAL B 10 1.326 8.467 14.834 1.00 0.00 H new ATOM 0 HG11 VAL B 10 -0.653 8.716 13.368 1.00 0.00 H new ATOM 0 HG12 VAL B 10 0.030 10.275 13.891 1.00 0.00 H new ATOM 0 HG13 VAL B 10 0.334 9.678 12.242 1.00 0.00 H new ATOM 0 HG21 VAL B 10 0.688 6.794 13.087 1.00 0.00 H new ATOM 0 HG22 VAL B 10 1.812 7.589 11.959 1.00 0.00 H new ATOM 0 HG23 VAL B 10 2.435 6.800 13.428 1.00 0.00 H new ATOM 1550 N ALA B 11 3.166 9.867 16.012 1.00 0.00 N ATOM 1551 CA ALA B 11 3.406 10.601 17.235 1.00 0.00 C ATOM 1552 C ALA B 11 4.631 11.552 17.228 1.00 0.00 C ATOM 1553 O ALA B 11 4.597 12.536 17.973 1.00 0.00 O ATOM 1554 CB ALA B 11 3.408 9.566 18.369 1.00 0.00 C ATOM 0 H ALA B 11 3.257 8.855 16.106 1.00 0.00 H new ATOM 0 HA ALA B 11 2.606 11.328 17.378 1.00 0.00 H new ATOM 0 HB1 ALA B 11 3.586 10.068 19.320 1.00 0.00 H new ATOM 0 HB2 ALA B 11 2.443 9.060 18.401 1.00 0.00 H new ATOM 0 HB3 ALA B 11 4.196 8.834 18.192 1.00 0.00 H new ATOM 1560 N GLU B 12 5.671 11.302 16.389 1.00 0.00 N ATOM 1561 CA GLU B 12 6.760 12.285 16.188 1.00 0.00 C ATOM 1562 C GLU B 12 6.338 13.415 15.207 1.00 0.00 C ATOM 1563 O GLU B 12 6.532 14.582 15.563 1.00 0.00 O ATOM 1564 CB GLU B 12 8.082 11.572 15.789 1.00 0.00 C ATOM 1565 CG GLU B 12 9.345 12.452 15.647 1.00 0.00 C ATOM 1566 CD GLU B 12 9.811 13.110 16.951 1.00 0.00 C ATOM 1567 OE1 GLU B 12 9.499 14.254 17.280 1.00 0.00 O ATOM 1568 OE2 GLU B 12 10.604 12.277 17.699 1.00 0.00 O ATOM 0 H GLU B 12 5.775 10.442 15.851 1.00 0.00 H new ATOM 0 HA GLU B 12 6.957 12.784 17.137 1.00 0.00 H new ATOM 0 HB2 GLU B 12 8.288 10.803 16.533 1.00 0.00 H new ATOM 0 HB3 GLU B 12 7.917 11.062 14.840 1.00 0.00 H new ATOM 0 HG2 GLU B 12 10.157 11.840 15.253 1.00 0.00 H new ATOM 0 HG3 GLU B 12 9.148 13.232 14.911 1.00 0.00 H new ATOM 1576 N THR B 13 5.769 13.107 14.016 1.00 0.00 N ATOM 1577 CA THR B 13 5.363 14.167 13.029 1.00 0.00 C ATOM 1578 C THR B 13 3.944 14.806 13.127 1.00 0.00 C ATOM 1579 O THR B 13 3.531 15.577 12.255 1.00 0.00 O ATOM 1580 CB THR B 13 5.806 13.714 11.617 1.00 0.00 C ATOM 1581 OG1 THR B 13 6.214 14.839 10.846 1.00 0.00 O ATOM 1582 CG2 THR B 13 4.809 12.903 10.791 1.00 0.00 C ATOM 0 H THR B 13 5.579 12.153 13.708 1.00 0.00 H new ATOM 0 HA THR B 13 5.904 15.066 13.325 1.00 0.00 H new ATOM 0 HB THR B 13 6.622 13.023 11.830 1.00 0.00 H new ATOM 0 HG1 THR B 13 6.494 14.541 9.955 1.00 0.00 H new ATOM 0 HG21 THR B 13 5.252 12.655 9.827 1.00 0.00 H new ATOM 0 HG22 THR B 13 4.558 11.985 11.322 1.00 0.00 H new ATOM 0 HG23 THR B 13 3.904 13.490 10.634 1.00 0.00 H new ATOM 1590 N SER B 14 3.259 14.507 14.226 1.00 0.00 N ATOM 1591 CA SER B 14 1.908 15.052 14.552 1.00 0.00 C ATOM 1592 C SER B 14 1.779 15.576 16.012 1.00 0.00 C ATOM 1593 O SER B 14 1.049 16.552 16.218 1.00 0.00 O ATOM 1594 CB SER B 14 0.768 14.039 14.281 1.00 0.00 C ATOM 1595 OG SER B 14 0.831 13.506 12.965 1.00 0.00 O ATOM 0 H SER B 14 3.616 13.871 14.939 1.00 0.00 H new ATOM 0 HA SER B 14 1.801 15.900 13.875 1.00 0.00 H new ATOM 0 HB2 SER B 14 0.826 13.226 15.005 1.00 0.00 H new ATOM 0 HB3 SER B 14 -0.195 14.529 14.428 1.00 0.00 H new ATOM 0 HG SER B 14 0.097 12.870 12.834 1.00 0.00 H new ATOM 1601 N GLY B 15 2.424 14.942 17.019 1.00 0.00 N ATOM 1602 CA GLY B 15 2.259 15.327 18.444 1.00 0.00 C ATOM 1603 C GLY B 15 0.897 15.000 19.087 1.00 0.00 C ATOM 1604 O GLY B 15 0.221 15.865 19.647 1.00 0.00 O ATOM 0 H GLY B 15 3.064 14.161 16.873 1.00 0.00 H new ATOM 0 HA2 GLY B 15 3.038 14.833 19.024 1.00 0.00 H new ATOM 0 HA3 GLY B 15 2.429 16.400 18.530 1.00 0.00 H new ATOM 1608 N LEU B 16 0.559 13.714 19.010 1.00 0.00 N ATOM 1609 CA LEU B 16 -0.651 13.110 19.606 1.00 0.00 C ATOM 1610 C LEU B 16 -0.149 12.378 20.892 1.00 0.00 C ATOM 1611 O LEU B 16 0.466 12.970 21.787 1.00 0.00 O ATOM 1612 CB LEU B 16 -1.592 12.527 18.484 1.00 0.00 C ATOM 1613 CG LEU B 16 -0.896 11.643 17.438 1.00 0.00 C ATOM 1614 CD1 LEU B 16 0.052 10.618 17.951 1.00 0.00 C ATOM 1615 CD2 LEU B 16 -1.476 11.224 16.078 1.00 0.00 C ATOM 0 H LEU B 16 1.135 13.032 18.515 1.00 0.00 H new ATOM 0 HA LEU B 16 -1.439 13.733 20.030 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -2.381 11.945 18.961 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -2.075 13.358 17.970 1.00 0.00 H new ATOM 0 HG LEU B 16 -0.433 12.570 17.100 1.00 0.00 H new ATOM 0 HD11 LEU B 16 0.475 10.062 17.114 1.00 0.00 H new ATOM 0 HD12 LEU B 16 0.854 11.108 18.503 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -0.477 9.932 18.612 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -0.755 10.597 15.553 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -2.399 10.664 16.233 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -1.686 12.113 15.483 1.00 0.00 H new ATOM 1627 N SER B 17 -0.454 11.100 20.954 1.00 0.00 N ATOM 1628 CA SER B 17 0.074 10.138 21.949 1.00 0.00 C ATOM 1629 C SER B 17 0.565 8.862 21.214 1.00 0.00 C ATOM 1630 O SER B 17 0.071 8.487 20.156 1.00 0.00 O ATOM 1631 CB SER B 17 -0.964 9.778 23.025 1.00 0.00 C ATOM 1632 OG SER B 17 -1.482 10.929 23.684 1.00 0.00 O ATOM 0 H SER B 17 -1.101 10.667 20.295 1.00 0.00 H new ATOM 0 HA SER B 17 0.907 10.612 22.468 1.00 0.00 H new ATOM 0 HB2 SER B 17 -1.784 9.226 22.565 1.00 0.00 H new ATOM 0 HB3 SER B 17 -0.507 9.116 23.761 1.00 0.00 H new ATOM 0 HG SER B 17 -2.138 10.653 24.357 1.00 0.00 H new ATOM 1638 N LYS B 18 1.527 8.142 21.798 1.00 0.00 N ATOM 1639 CA LYS B 18 1.967 6.794 21.306 1.00 0.00 C ATOM 1640 C LYS B 18 0.768 5.783 21.307 1.00 0.00 C ATOM 1641 O LYS B 18 0.543 5.118 20.299 1.00 0.00 O ATOM 1642 CB LYS B 18 3.235 6.392 22.117 1.00 0.00 C ATOM 1643 CG LYS B 18 4.231 5.437 21.426 1.00 0.00 C ATOM 1644 CD LYS B 18 3.829 3.956 21.486 1.00 0.00 C ATOM 1645 CE LYS B 18 4.818 3.038 20.746 1.00 0.00 C ATOM 1646 NZ LYS B 18 4.369 1.636 20.769 1.00 0.00 N ATOM 0 H LYS B 18 2.034 8.459 22.624 1.00 0.00 H new ATOM 0 HA LYS B 18 2.268 6.800 20.258 1.00 0.00 H new ATOM 0 HB2 LYS B 18 3.769 7.303 22.385 1.00 0.00 H new ATOM 0 HB3 LYS B 18 2.909 5.927 23.048 1.00 0.00 H new ATOM 0 HG2 LYS B 18 4.334 5.732 20.382 1.00 0.00 H new ATOM 0 HG3 LYS B 18 5.211 5.555 21.889 1.00 0.00 H new ATOM 0 HD2 LYS B 18 3.762 3.645 22.528 1.00 0.00 H new ATOM 0 HD3 LYS B 18 2.836 3.836 21.053 1.00 0.00 H new ATOM 0 HE2 LYS B 18 4.923 3.371 19.714 1.00 0.00 H new ATOM 0 HE3 LYS B 18 5.803 3.114 21.207 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 5.073 1.038 20.292 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 4.260 1.323 21.755 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 3.456 1.556 20.277 1.00 0.00 H new ATOM 1659 N LYS B 19 -0.057 5.755 22.372 1.00 0.00 N ATOM 1660 CA LYS B 19 -1.370 5.048 22.383 1.00 0.00 C ATOM 1661 C LYS B 19 -2.389 5.617 21.333 1.00 0.00 C ATOM 1662 O LYS B 19 -3.079 4.803 20.712 1.00 0.00 O ATOM 1663 CB LYS B 19 -2.000 5.042 23.803 1.00 0.00 C ATOM 1664 CG LYS B 19 -1.223 4.273 24.903 1.00 0.00 C ATOM 1665 CD LYS B 19 -1.005 2.759 24.684 1.00 0.00 C ATOM 1666 CE LYS B 19 -2.298 1.922 24.621 1.00 0.00 C ATOM 1667 NZ LYS B 19 -2.006 0.487 24.460 1.00 0.00 N ATOM 0 H LYS B 19 0.161 6.220 23.253 1.00 0.00 H new ATOM 0 HA LYS B 19 -1.155 4.021 22.089 1.00 0.00 H new ATOM 0 HB2 LYS B 19 -2.118 6.076 24.128 1.00 0.00 H new ATOM 0 HB3 LYS B 19 -3.000 4.615 23.730 1.00 0.00 H new ATOM 0 HG2 LYS B 19 -0.246 4.742 25.017 1.00 0.00 H new ATOM 0 HG3 LYS B 19 -1.753 4.405 25.846 1.00 0.00 H new ATOM 0 HD2 LYS B 19 -0.451 2.616 23.756 1.00 0.00 H new ATOM 0 HD3 LYS B 19 -0.380 2.376 25.490 1.00 0.00 H new ATOM 0 HE2 LYS B 19 -2.877 2.076 25.531 1.00 0.00 H new ATOM 0 HE3 LYS B 19 -2.914 2.264 23.789 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 -2.898 -0.047 24.421 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 -1.475 0.338 23.579 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 -1.439 0.155 25.266 1.00 0.00 H new ATOM 1680 N ASP B 20 -2.493 6.958 21.106 1.00 0.00 N ATOM 1681 CA ASP B 20 -3.359 7.517 20.011 1.00 0.00 C ATOM 1682 C ASP B 20 -2.870 7.198 18.560 1.00 0.00 C ATOM 1683 O ASP B 20 -3.708 7.052 17.670 1.00 0.00 O ATOM 1684 CB ASP B 20 -3.584 9.048 20.179 1.00 0.00 C ATOM 1685 CG ASP B 20 -4.740 9.399 21.125 1.00 0.00 C ATOM 1686 OD1 ASP B 20 -5.921 9.399 20.776 1.00 0.00 O ATOM 1687 OD2 ASP B 20 -4.308 9.707 22.389 1.00 0.00 O ATOM 0 H ASP B 20 -2.000 7.665 21.652 1.00 0.00 H new ATOM 0 HA ASP B 20 -4.309 6.996 20.128 1.00 0.00 H new ATOM 0 HB2 ASP B 20 -2.667 9.502 20.555 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -3.780 9.487 19.201 1.00 0.00 H new ATOM 1693 N ALA B 21 -1.550 7.102 18.323 1.00 0.00 N ATOM 1694 CA ALA B 21 -0.956 6.673 17.034 1.00 0.00 C ATOM 1695 C ALA B 21 -1.160 5.159 16.723 1.00 0.00 C ATOM 1696 O ALA B 21 -1.399 4.825 15.563 1.00 0.00 O ATOM 1697 CB ALA B 21 0.513 7.118 17.027 1.00 0.00 C ATOM 0 H ALA B 21 -0.850 7.323 19.031 1.00 0.00 H new ATOM 0 HA ALA B 21 -1.482 7.157 16.211 1.00 0.00 H new ATOM 0 HB1 ALA B 21 0.980 6.817 16.089 1.00 0.00 H new ATOM 0 HB2 ALA B 21 0.565 8.202 17.126 1.00 0.00 H new ATOM 0 HB3 ALA B 21 1.038 6.652 17.860 1.00 0.00 H new ATOM 1703 N THR B 22 -1.110 4.261 17.735 1.00 0.00 N ATOM 1704 CA THR B 22 -1.468 2.817 17.609 1.00 0.00 C ATOM 1705 C THR B 22 -2.921 2.598 17.076 1.00 0.00 C ATOM 1706 O THR B 22 -3.152 1.865 16.106 1.00 0.00 O ATOM 1707 CB THR B 22 -1.240 2.125 18.992 1.00 0.00 C ATOM 1708 OG1 THR B 22 -0.047 2.544 19.645 1.00 0.00 O ATOM 1709 CG2 THR B 22 -1.135 0.612 18.846 1.00 0.00 C ATOM 0 H THR B 22 -0.816 4.517 18.678 1.00 0.00 H new ATOM 0 HA THR B 22 -0.820 2.359 16.861 1.00 0.00 H new ATOM 0 HB THR B 22 -2.106 2.416 19.586 1.00 0.00 H new ATOM 0 HG1 THR B 22 -0.133 3.483 19.912 1.00 0.00 H new ATOM 0 HG21 THR B 22 -0.977 0.162 19.826 1.00 0.00 H new ATOM 0 HG22 THR B 22 -2.057 0.223 18.413 1.00 0.00 H new ATOM 0 HG23 THR B 22 -0.296 0.367 18.194 1.00 0.00 H new ATOM 1717 N LYS B 23 -3.869 3.292 17.725 1.00 0.00 N ATOM 1718 CA LYS B 23 -5.284 3.379 17.302 1.00 0.00 C ATOM 1719 C LYS B 23 -5.468 3.919 15.867 1.00 0.00 C ATOM 1720 O LYS B 23 -6.054 3.225 15.050 1.00 0.00 O ATOM 1721 CB LYS B 23 -6.015 4.367 18.258 1.00 0.00 C ATOM 1722 CG LYS B 23 -6.269 3.865 19.695 1.00 0.00 C ATOM 1723 CD LYS B 23 -6.950 4.936 20.576 1.00 0.00 C ATOM 1724 CE LYS B 23 -7.164 4.525 22.046 1.00 0.00 C ATOM 1725 NZ LYS B 23 -5.908 4.462 22.818 1.00 0.00 N ATOM 0 H LYS B 23 -3.674 3.820 18.576 1.00 0.00 H new ATOM 0 HA LYS B 23 -5.686 2.367 17.334 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -5.430 5.285 18.315 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -6.975 4.628 17.812 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -6.895 2.973 19.661 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -5.322 3.573 20.149 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -6.347 5.843 20.552 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -7.917 5.184 20.139 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -7.840 5.236 22.521 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -7.652 3.551 22.077 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -6.116 4.181 23.797 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -5.269 3.764 22.386 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -5.452 5.397 22.816 1.00 0.00 H new ATOM 1738 N ALA B 24 -4.955 5.131 15.611 1.00 0.00 N ATOM 1739 CA ALA B 24 -5.011 5.845 14.319 1.00 0.00 C ATOM 1740 C ALA B 24 -4.497 5.104 13.064 1.00 0.00 C ATOM 1741 O ALA B 24 -5.046 5.263 11.976 1.00 0.00 O ATOM 1742 CB ALA B 24 -4.296 7.165 14.551 1.00 0.00 C ATOM 0 H ALA B 24 -4.467 5.668 16.328 1.00 0.00 H new ATOM 0 HA ALA B 24 -6.061 5.962 14.050 1.00 0.00 H new ATOM 0 HB1 ALA B 24 -4.300 7.748 13.630 1.00 0.00 H new ATOM 0 HB2 ALA B 24 -4.807 7.723 15.336 1.00 0.00 H new ATOM 0 HB3 ALA B 24 -3.267 6.973 14.854 1.00 0.00 H new ATOM 1748 N VAL B 25 -3.464 4.276 13.240 1.00 0.00 N ATOM 1749 CA VAL B 25 -3.012 3.260 12.254 1.00 0.00 C ATOM 1750 C VAL B 25 -4.172 2.246 12.019 1.00 0.00 C ATOM 1751 O VAL B 25 -4.657 2.170 10.890 1.00 0.00 O ATOM 1752 CB VAL B 25 -1.738 2.648 12.943 1.00 0.00 C ATOM 1753 CG1 VAL B 25 -1.432 1.189 12.537 1.00 0.00 C ATOM 1754 CG2 VAL B 25 -0.520 3.543 12.700 1.00 0.00 C ATOM 0 H VAL B 25 -2.898 4.284 14.088 1.00 0.00 H new ATOM 0 HA VAL B 25 -2.763 3.632 11.260 1.00 0.00 H new ATOM 0 HB VAL B 25 -1.965 2.611 14.008 1.00 0.00 H new ATOM 0 HG11 VAL B 25 -0.538 0.846 13.058 1.00 0.00 H new ATOM 0 HG12 VAL B 25 -2.275 0.552 12.805 1.00 0.00 H new ATOM 0 HG13 VAL B 25 -1.267 1.138 11.461 1.00 0.00 H new ATOM 0 HG21 VAL B 25 0.354 3.107 13.183 1.00 0.00 H new ATOM 0 HG22 VAL B 25 -0.338 3.627 11.629 1.00 0.00 H new ATOM 0 HG23 VAL B 25 -0.707 4.533 13.115 1.00 0.00 H new ATOM 1764 N ASP B 26 -4.644 1.521 13.064 1.00 0.00 N ATOM 1765 CA ASP B 26 -5.869 0.657 12.929 1.00 0.00 C ATOM 1766 C ASP B 26 -7.253 1.426 12.955 1.00 0.00 C ATOM 1767 O ASP B 26 -8.289 0.973 13.448 1.00 0.00 O ATOM 1768 CB ASP B 26 -5.763 -0.414 14.031 1.00 0.00 C ATOM 1769 CG ASP B 26 -6.620 -1.669 13.797 1.00 0.00 C ATOM 1770 OD1 ASP B 26 -6.381 -2.497 12.918 1.00 0.00 O ATOM 1771 OD2 ASP B 26 -7.674 -1.751 14.670 1.00 0.00 O ATOM 0 H ASP B 26 -4.217 1.508 13.990 1.00 0.00 H new ATOM 0 HA ASP B 26 -5.880 0.215 11.933 1.00 0.00 H new ATOM 0 HB2 ASP B 26 -4.720 -0.716 14.125 1.00 0.00 H new ATOM 0 HB3 ASP B 26 -6.052 0.034 14.982 1.00 0.00 H new ATOM 1777 N ALA B 27 -7.179 2.630 12.405 1.00 0.00 N ATOM 1778 CA ALA B 27 -8.270 3.587 12.149 1.00 0.00 C ATOM 1779 C ALA B 27 -8.321 3.921 10.634 1.00 0.00 C ATOM 1780 O ALA B 27 -9.392 3.859 10.022 1.00 0.00 O ATOM 1781 CB ALA B 27 -8.124 4.790 13.079 1.00 0.00 C ATOM 0 H ALA B 27 -6.281 3.003 12.097 1.00 0.00 H new ATOM 0 HA ALA B 27 -9.244 3.158 12.384 1.00 0.00 H new ATOM 0 HB1 ALA B 27 -8.931 5.497 12.889 1.00 0.00 H new ATOM 0 HB2 ALA B 27 -8.171 4.456 14.116 1.00 0.00 H new ATOM 0 HB3 ALA B 27 -7.166 5.276 12.897 1.00 0.00 H new ATOM 1787 N VAL B 28 -7.147 4.235 10.033 1.00 0.00 N ATOM 1788 CA VAL B 28 -6.934 4.278 8.563 1.00 0.00 C ATOM 1789 C VAL B 28 -7.172 2.836 8.035 1.00 0.00 C ATOM 1790 O VAL B 28 -8.246 2.555 7.509 1.00 0.00 O ATOM 1791 CB VAL B 28 -5.474 4.761 8.215 1.00 0.00 C ATOM 1792 CG1 VAL B 28 -5.135 4.794 6.720 1.00 0.00 C ATOM 1793 CG2 VAL B 28 -5.178 6.150 8.679 1.00 0.00 C ATOM 0 H VAL B 28 -6.308 4.469 10.563 1.00 0.00 H new ATOM 0 HA VAL B 28 -7.619 4.986 8.096 1.00 0.00 H new ATOM 0 HB VAL B 28 -4.882 4.007 8.734 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -4.110 5.139 6.587 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -5.238 3.793 6.301 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -5.816 5.473 6.207 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -4.157 6.415 8.405 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -5.872 6.846 8.209 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -5.289 6.203 9.762 1.00 0.00 H new ATOM 1803 N PHE B 29 -6.182 1.970 8.324 1.00 0.00 N ATOM 1804 CA PHE B 29 -6.066 0.556 7.869 1.00 0.00 C ATOM 1805 C PHE B 29 -7.227 -0.390 8.247 1.00 0.00 C ATOM 1806 O PHE B 29 -7.361 -1.410 7.570 1.00 0.00 O ATOM 1807 CB PHE B 29 -4.655 -0.014 8.229 1.00 0.00 C ATOM 1808 CG PHE B 29 -3.471 0.829 7.707 1.00 0.00 C ATOM 1809 CD1 PHE B 29 -3.352 1.098 6.339 1.00 0.00 C ATOM 1810 CD2 PHE B 29 -2.650 1.510 8.608 1.00 0.00 C ATOM 1811 CE1 PHE B 29 -2.490 2.086 5.886 1.00 0.00 C ATOM 1812 CE2 PHE B 29 -1.806 2.520 8.162 1.00 0.00 C ATOM 1813 CZ PHE B 29 -1.747 2.818 6.803 1.00 0.00 C ATOM 0 H PHE B 29 -5.395 2.245 8.912 1.00 0.00 H new ATOM 0 HA PHE B 29 -6.167 0.595 6.784 1.00 0.00 H new ATOM 0 HB2 PHE B 29 -4.576 -0.096 9.313 1.00 0.00 H new ATOM 0 HB3 PHE B 29 -4.571 -1.023 7.826 1.00 0.00 H new ATOM 0 HD1 PHE B 29 -3.937 0.531 5.629 1.00 0.00 H new ATOM 0 HD2 PHE B 29 -2.671 1.251 9.656 1.00 0.00 H new ATOM 0 HE1 PHE B 29 -2.397 2.284 4.828 1.00 0.00 H new ATOM 0 HE2 PHE B 29 -1.199 3.071 8.865 1.00 0.00 H new ATOM 0 HZ PHE B 29 -1.118 3.626 6.459 1.00 0.00 H new ATOM 1823 N ASP B 30 -8.056 -0.069 9.269 1.00 0.00 N ATOM 1824 CA ASP B 30 -9.302 -0.839 9.562 1.00 0.00 C ATOM 1825 C ASP B 30 -10.499 -0.481 8.628 1.00 0.00 C ATOM 1826 O ASP B 30 -11.267 -1.360 8.227 1.00 0.00 O ATOM 1827 CB ASP B 30 -9.677 -0.635 11.045 1.00 0.00 C ATOM 1828 CG ASP B 30 -10.536 -1.756 11.642 1.00 0.00 C ATOM 1829 OD1 ASP B 30 -11.765 -1.767 11.593 1.00 0.00 O ATOM 1830 OD2 ASP B 30 -9.774 -2.733 12.230 1.00 0.00 O ATOM 0 H ASP B 30 -7.891 0.712 9.904 1.00 0.00 H new ATOM 0 HA ASP B 30 -9.091 -1.890 9.363 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -8.761 -0.545 11.629 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -10.213 0.309 11.145 1.00 0.00 H new ATOM 1836 N SER B 31 -10.652 0.815 8.322 1.00 0.00 N ATOM 1837 CA SER B 31 -11.631 1.311 7.311 1.00 0.00 C ATOM 1838 C SER B 31 -11.280 0.916 5.835 1.00 0.00 C ATOM 1839 O SER B 31 -12.200 0.728 5.037 1.00 0.00 O ATOM 1840 CB SER B 31 -11.831 2.833 7.468 1.00 0.00 C ATOM 1841 OG SER B 31 -12.381 3.130 8.747 1.00 0.00 O ATOM 0 H SER B 31 -10.107 1.558 8.761 1.00 0.00 H new ATOM 0 HA SER B 31 -12.575 0.805 7.515 1.00 0.00 H new ATOM 0 HB2 SER B 31 -10.877 3.346 7.347 1.00 0.00 H new ATOM 0 HB3 SER B 31 -12.493 3.202 6.685 1.00 0.00 H new ATOM 0 HG SER B 31 -11.662 3.391 9.360 1.00 0.00 H new ATOM 1847 N ILE B 32 -9.985 0.749 5.479 1.00 0.00 N ATOM 1848 CA ILE B 32 -9.492 0.269 4.159 1.00 0.00 C ATOM 1849 C ILE B 32 -9.851 -1.202 3.983 1.00 0.00 C ATOM 1850 O ILE B 32 -10.537 -1.511 3.023 1.00 0.00 O ATOM 1851 CB ILE B 32 -7.963 0.491 3.973 1.00 0.00 C ATOM 1852 CG1 ILE B 32 -7.577 1.849 4.575 1.00 0.00 C ATOM 1853 CG2 ILE B 32 -7.619 0.336 2.484 1.00 0.00 C ATOM 1854 CD1 ILE B 32 -6.313 2.572 4.248 1.00 0.00 C ATOM 0 H ILE B 32 -9.223 0.952 6.126 1.00 0.00 H new ATOM 0 HA ILE B 32 -9.984 0.861 3.387 1.00 0.00 H new ATOM 0 HB ILE B 32 -7.373 -0.255 4.505 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -8.391 2.533 4.334 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -7.582 1.716 5.657 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -6.550 0.489 2.340 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -7.890 -0.666 2.150 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -8.173 1.074 1.904 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -6.276 3.509 4.803 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -5.459 1.953 4.522 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -6.280 2.782 3.179 1.00 0.00 H new ATOM 1866 N THR B 33 -9.419 -2.093 4.884 1.00 0.00 N ATOM 1867 CA THR B 33 -9.856 -3.523 4.828 1.00 0.00 C ATOM 1868 C THR B 33 -11.402 -3.728 4.815 1.00 0.00 C ATOM 1869 O THR B 33 -11.841 -4.679 4.183 1.00 0.00 O ATOM 1870 CB THR B 33 -9.206 -4.363 5.962 1.00 0.00 C ATOM 1871 OG1 THR B 33 -9.593 -5.733 5.897 1.00 0.00 O ATOM 1872 CG2 THR B 33 -9.474 -3.829 7.375 1.00 0.00 C ATOM 0 H THR B 33 -8.782 -1.872 5.649 1.00 0.00 H new ATOM 0 HA THR B 33 -9.499 -3.883 3.863 1.00 0.00 H new ATOM 0 HB THR B 33 -8.135 -4.273 5.782 1.00 0.00 H new ATOM 0 HG1 THR B 33 -9.163 -6.229 6.625 1.00 0.00 H new ATOM 0 HG21 THR B 33 -8.985 -4.473 8.106 1.00 0.00 H new ATOM 0 HG22 THR B 33 -9.080 -2.817 7.462 1.00 0.00 H new ATOM 0 HG23 THR B 33 -10.548 -3.818 7.562 1.00 0.00 H new ATOM 1880 N GLU B 34 -12.210 -2.871 5.478 1.00 0.00 N ATOM 1881 CA GLU B 34 -13.688 -2.869 5.294 1.00 0.00 C ATOM 1882 C GLU B 34 -14.096 -2.397 3.859 1.00 0.00 C ATOM 1883 O GLU B 34 -15.057 -2.947 3.325 1.00 0.00 O ATOM 1884 CB GLU B 34 -14.351 -2.056 6.435 1.00 0.00 C ATOM 1885 CG GLU B 34 -15.888 -2.183 6.512 1.00 0.00 C ATOM 1886 CD GLU B 34 -16.490 -1.354 7.647 1.00 0.00 C ATOM 1887 OE1 GLU B 34 -16.706 -1.801 8.773 1.00 0.00 O ATOM 1888 OE2 GLU B 34 -16.757 -0.064 7.263 1.00 0.00 O ATOM 0 H GLU B 34 -11.872 -2.174 6.142 1.00 0.00 H new ATOM 0 HA GLU B 34 -14.064 -3.890 5.365 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -13.926 -2.378 7.386 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -14.093 -1.004 6.310 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -16.323 -1.865 5.564 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -16.156 -3.230 6.650 1.00 0.00 H new ATOM 1896 N ALA B 35 -13.384 -1.433 3.227 1.00 0.00 N ATOM 1897 CA ALA B 35 -13.546 -1.112 1.785 1.00 0.00 C ATOM 1898 C ALA B 35 -13.236 -2.334 0.875 1.00 0.00 C ATOM 1899 O ALA B 35 -14.109 -2.807 0.153 1.00 0.00 O ATOM 1900 CB ALA B 35 -12.652 0.099 1.353 1.00 0.00 C ATOM 0 H ALA B 35 -12.685 -0.858 3.698 1.00 0.00 H new ATOM 0 HA ALA B 35 -14.593 -0.840 1.655 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -12.800 0.301 0.292 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -12.929 0.980 1.932 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -11.604 -0.140 1.534 1.00 0.00 H new ATOM 1906 N LEU B 36 -12.024 -2.892 0.981 1.00 0.00 N ATOM 1907 CA LEU B 36 -11.519 -4.021 0.165 1.00 0.00 C ATOM 1908 C LEU B 36 -12.342 -5.300 0.360 1.00 0.00 C ATOM 1909 O LEU B 36 -12.860 -5.848 -0.616 1.00 0.00 O ATOM 1910 CB LEU B 36 -10.004 -4.157 0.415 1.00 0.00 C ATOM 1911 CG LEU B 36 -9.228 -2.788 0.292 1.00 0.00 C ATOM 1912 CD1 LEU B 36 -7.725 -2.898 0.306 1.00 0.00 C ATOM 1913 CD2 LEU B 36 -9.583 -1.962 -0.955 1.00 0.00 C ATOM 0 H LEU B 36 -11.337 -2.563 1.660 1.00 0.00 H new ATOM 0 HA LEU B 36 -11.652 -3.818 -0.898 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -9.842 -4.571 1.410 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -9.587 -4.869 -0.298 1.00 0.00 H new ATOM 0 HG LEU B 36 -9.571 -2.285 1.196 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -7.287 -1.904 0.216 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -7.402 -3.354 1.242 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -7.398 -3.516 -0.530 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -9.003 -1.039 -0.957 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -9.352 -2.538 -1.851 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -10.646 -1.722 -0.942 1.00 0.00 H new ATOM 1925 N ARG B 37 -12.547 -5.717 1.623 1.00 0.00 N ATOM 1926 CA ARG B 37 -13.417 -6.858 1.933 1.00 0.00 C ATOM 1927 C ARG B 37 -14.903 -6.690 1.468 1.00 0.00 C ATOM 1928 O ARG B 37 -15.516 -7.708 1.135 1.00 0.00 O ATOM 1929 CB ARG B 37 -13.346 -7.127 3.458 1.00 0.00 C ATOM 1930 CG ARG B 37 -14.042 -8.394 3.995 1.00 0.00 C ATOM 1931 CD ARG B 37 -14.106 -8.372 5.532 1.00 0.00 C ATOM 1932 NE ARG B 37 -14.645 -9.643 6.079 1.00 0.00 N ATOM 1933 CZ ARG B 37 -13.910 -10.625 6.637 1.00 0.00 C ATOM 1934 NH1 ARG B 37 -12.587 -10.579 6.780 1.00 0.00 N ATOM 1935 NH2 ARG B 37 -14.540 -11.701 7.070 1.00 0.00 N ATOM 0 H ARG B 37 -12.122 -5.280 2.441 1.00 0.00 H new ATOM 0 HA ARG B 37 -13.045 -7.710 1.363 1.00 0.00 H new ATOM 0 HB2 ARG B 37 -12.295 -7.176 3.741 1.00 0.00 H new ATOM 0 HB3 ARG B 37 -13.774 -6.266 3.971 1.00 0.00 H new ATOM 0 HG2 ARG B 37 -15.050 -8.462 3.585 1.00 0.00 H new ATOM 0 HG3 ARG B 37 -13.502 -9.280 3.662 1.00 0.00 H new ATOM 0 HD2 ARG B 37 -13.109 -8.197 5.935 1.00 0.00 H new ATOM 0 HD3 ARG B 37 -14.732 -7.541 5.858 1.00 0.00 H new ATOM 0 HE ARG B 37 -15.654 -9.784 6.028 1.00 0.00 H new ATOM 0 HH11 ARG B 37 -12.067 -9.763 6.457 1.00 0.00 H new ATOM 0 HH12 ARG B 37 -12.093 -11.360 7.212 1.00 0.00 H new ATOM 0 HH21 ARG B 37 -15.553 -11.771 6.977 1.00 0.00 H new ATOM 0 HH22 ARG B 37 -14.013 -12.463 7.497 1.00 0.00 H new ATOM 1948 N LYS B 38 -15.473 -5.454 1.446 1.00 0.00 N ATOM 1949 CA LYS B 38 -16.903 -5.256 1.058 1.00 0.00 C ATOM 1950 C LYS B 38 -17.150 -4.852 -0.437 1.00 0.00 C ATOM 1951 O LYS B 38 -18.274 -4.470 -0.776 1.00 0.00 O ATOM 1952 CB LYS B 38 -17.490 -4.233 2.077 1.00 0.00 C ATOM 1953 CG LYS B 38 -19.030 -4.144 2.200 1.00 0.00 C ATOM 1954 CD LYS B 38 -19.522 -3.284 3.385 1.00 0.00 C ATOM 1955 CE LYS B 38 -19.203 -1.778 3.269 1.00 0.00 C ATOM 1956 NZ LYS B 38 -19.717 -1.027 4.427 1.00 0.00 N ATOM 0 H LYS B 38 -14.979 -4.595 1.686 1.00 0.00 H new ATOM 0 HA LYS B 38 -17.421 -6.214 1.107 1.00 0.00 H new ATOM 0 HB2 LYS B 38 -17.088 -4.472 3.062 1.00 0.00 H new ATOM 0 HB3 LYS B 38 -17.117 -3.244 1.812 1.00 0.00 H new ATOM 0 HG2 LYS B 38 -19.434 -3.733 1.275 1.00 0.00 H new ATOM 0 HG3 LYS B 38 -19.434 -5.151 2.304 1.00 0.00 H new ATOM 0 HD2 LYS B 38 -20.601 -3.406 3.481 1.00 0.00 H new ATOM 0 HD3 LYS B 38 -19.075 -3.666 4.303 1.00 0.00 H new ATOM 0 HE2 LYS B 38 -18.125 -1.638 3.193 1.00 0.00 H new ATOM 0 HE3 LYS B 38 -19.641 -1.382 2.353 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 -19.486 -0.019 4.317 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 -20.749 -1.141 4.484 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 -19.280 -1.390 5.298 1.00 0.00 H new ATOM 1969 N GLY B 39 -16.157 -4.956 -1.349 1.00 0.00 N ATOM 1970 CA GLY B 39 -16.296 -4.450 -2.745 1.00 0.00 C ATOM 1971 C GLY B 39 -16.444 -2.904 -2.859 1.00 0.00 C ATOM 1972 O GLY B 39 -17.346 -2.411 -3.540 1.00 0.00 O ATOM 0 H GLY B 39 -15.252 -5.383 -1.150 1.00 0.00 H new ATOM 0 HA2 GLY B 39 -15.424 -4.762 -3.320 1.00 0.00 H new ATOM 0 HA3 GLY B 39 -17.166 -4.921 -3.204 1.00 0.00 H new ATOM 1976 N ASP B 40 -15.547 -2.177 -2.174 1.00 0.00 N ATOM 1977 CA ASP B 40 -15.578 -0.697 -2.036 1.00 0.00 C ATOM 1978 C ASP B 40 -14.176 -0.078 -2.267 1.00 0.00 C ATOM 1979 O ASP B 40 -13.134 -0.642 -1.914 1.00 0.00 O ATOM 1980 CB ASP B 40 -16.251 -0.279 -0.699 1.00 0.00 C ATOM 1981 CG ASP B 40 -17.787 -0.294 -0.717 1.00 0.00 C ATOM 1982 OD1 ASP B 40 -18.467 0.644 -1.130 1.00 0.00 O ATOM 1983 OD2 ASP B 40 -18.303 -1.467 -0.228 1.00 0.00 O ATOM 0 H ASP B 40 -14.759 -2.604 -1.687 1.00 0.00 H new ATOM 0 HA ASP B 40 -16.205 -0.280 -2.824 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -15.905 -0.947 0.090 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -15.915 0.724 -0.438 1.00 0.00 H new ATOM 1989 N LYS B 41 -14.198 1.116 -2.890 1.00 0.00 N ATOM 1990 CA LYS B 41 -12.982 1.900 -3.204 1.00 0.00 C ATOM 1991 C LYS B 41 -12.715 2.899 -2.048 1.00 0.00 C ATOM 1992 O LYS B 41 -13.623 3.511 -1.472 1.00 0.00 O ATOM 1993 CB LYS B 41 -13.095 2.706 -4.529 1.00 0.00 C ATOM 1994 CG LYS B 41 -13.517 1.907 -5.783 1.00 0.00 C ATOM 1995 CD LYS B 41 -13.350 2.704 -7.095 1.00 0.00 C ATOM 1996 CE LYS B 41 -13.665 1.909 -8.378 1.00 0.00 C ATOM 1997 NZ LYS B 41 -15.100 1.603 -8.540 1.00 0.00 N ATOM 0 H LYS B 41 -15.061 1.568 -3.192 1.00 0.00 H new ATOM 0 HA LYS B 41 -12.167 1.186 -3.323 1.00 0.00 H new ATOM 0 HB2 LYS B 41 -13.814 3.512 -4.379 1.00 0.00 H new ATOM 0 HB3 LYS B 41 -12.130 3.172 -4.729 1.00 0.00 H new ATOM 0 HG2 LYS B 41 -12.924 0.994 -5.841 1.00 0.00 H new ATOM 0 HG3 LYS B 41 -14.559 1.604 -5.679 1.00 0.00 H new ATOM 0 HD2 LYS B 41 -13.999 3.579 -7.058 1.00 0.00 H new ATOM 0 HD3 LYS B 41 -12.325 3.070 -7.153 1.00 0.00 H new ATOM 0 HE2 LYS B 41 -13.322 2.478 -9.242 1.00 0.00 H new ATOM 0 HE3 LYS B 41 -13.101 0.976 -8.366 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 -15.244 1.068 -9.420 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 -15.427 1.035 -7.733 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 -15.642 2.490 -8.581 1.00 0.00 H new ATOM 2010 N VAL B 42 -11.424 3.110 -1.792 1.00 0.00 N ATOM 2011 CA VAL B 42 -10.905 3.998 -0.750 1.00 0.00 C ATOM 2012 C VAL B 42 -10.650 5.359 -1.485 1.00 0.00 C ATOM 2013 O VAL B 42 -11.443 5.785 -2.334 1.00 0.00 O ATOM 2014 CB VAL B 42 -9.687 3.156 -0.219 1.00 0.00 C ATOM 2015 CG1 VAL B 42 -9.050 3.722 1.037 1.00 0.00 C ATOM 2016 CG2 VAL B 42 -10.007 1.713 0.254 1.00 0.00 C ATOM 0 H VAL B 42 -10.684 2.651 -2.323 1.00 0.00 H new ATOM 0 HA VAL B 42 -11.504 4.279 0.116 1.00 0.00 H new ATOM 0 HB VAL B 42 -9.059 3.180 -1.109 1.00 0.00 H new ATOM 0 HG11 VAL B 42 -8.218 3.087 1.341 1.00 0.00 H new ATOM 0 HG12 VAL B 42 -8.683 4.729 0.837 1.00 0.00 H new ATOM 0 HG13 VAL B 42 -9.790 3.758 1.836 1.00 0.00 H new ATOM 0 HG21 VAL B 42 -9.092 1.231 0.597 1.00 0.00 H new ATOM 0 HG22 VAL B 42 -10.727 1.749 1.072 1.00 0.00 H new ATOM 0 HG23 VAL B 42 -10.428 1.143 -0.575 1.00 0.00 H new ATOM 2026 N GLN B 43 -9.638 6.093 -1.026 1.00 0.00 N ATOM 2027 CA GLN B 43 -9.000 7.245 -1.710 1.00 0.00 C ATOM 2028 C GLN B 43 -8.059 8.066 -0.782 1.00 0.00 C ATOM 2029 O GLN B 43 -8.340 8.245 0.405 1.00 0.00 O ATOM 2030 CB GLN B 43 -9.639 7.923 -2.962 1.00 0.00 C ATOM 2031 CG GLN B 43 -9.481 7.081 -4.244 1.00 0.00 C ATOM 2032 CD GLN B 43 -10.177 7.641 -5.495 1.00 0.00 C ATOM 2033 OE1 GLN B 43 -10.112 8.832 -5.798 1.00 0.00 O ATOM 2034 NE2 GLN B 43 -10.833 6.782 -6.261 1.00 0.00 N ATOM 0 H GLN B 43 -9.210 5.900 -0.121 1.00 0.00 H new ATOM 0 HA GLN B 43 -8.350 6.730 -2.417 1.00 0.00 H new ATOM 0 HB2 GLN B 43 -10.699 8.096 -2.775 1.00 0.00 H new ATOM 0 HB3 GLN B 43 -9.179 8.899 -3.115 1.00 0.00 H new ATOM 0 HG2 GLN B 43 -8.418 6.974 -4.459 1.00 0.00 H new ATOM 0 HG3 GLN B 43 -9.869 6.081 -4.051 1.00 0.00 H new ATOM 0 HE21 GLN B 43 -10.880 5.797 -5.999 1.00 0.00 H new ATOM 0 HE22 GLN B 43 -11.291 7.105 -7.113 1.00 0.00 H new ATOM 2043 N LEU B 44 -6.925 8.538 -1.340 1.00 0.00 N ATOM 2044 CA LEU B 44 -5.895 9.347 -0.637 1.00 0.00 C ATOM 2045 C LEU B 44 -5.292 10.237 -1.761 1.00 0.00 C ATOM 2046 O LEU B 44 -4.630 9.723 -2.673 1.00 0.00 O ATOM 2047 CB LEU B 44 -4.745 8.526 0.033 1.00 0.00 C ATOM 2048 CG LEU B 44 -5.127 7.493 1.130 1.00 0.00 C ATOM 2049 CD1 LEU B 44 -4.006 6.453 1.312 1.00 0.00 C ATOM 2050 CD2 LEU B 44 -5.458 8.163 2.476 1.00 0.00 C ATOM 0 H LEU B 44 -6.690 8.365 -2.317 1.00 0.00 H new ATOM 0 HA LEU B 44 -6.359 9.883 0.191 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -4.212 7.994 -0.755 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -4.042 9.234 0.472 1.00 0.00 H new ATOM 0 HG LEU B 44 -6.030 6.988 0.789 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -4.294 5.739 2.084 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -3.844 5.925 0.372 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -3.086 6.957 1.608 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -5.718 7.399 3.208 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -4.591 8.722 2.827 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -6.300 8.843 2.347 1.00 0.00 H new ATOM 2062 N ILE B 45 -5.507 11.568 -1.719 1.00 0.00 N ATOM 2063 CA ILE B 45 -4.972 12.499 -2.754 1.00 0.00 C ATOM 2064 C ILE B 45 -3.449 12.757 -2.511 1.00 0.00 C ATOM 2065 O ILE B 45 -2.979 12.866 -1.372 1.00 0.00 O ATOM 2066 CB ILE B 45 -5.879 13.765 -2.922 1.00 0.00 C ATOM 2067 CG1 ILE B 45 -5.671 14.550 -4.251 1.00 0.00 C ATOM 2068 CG2 ILE B 45 -5.754 14.734 -1.734 1.00 0.00 C ATOM 2069 CD1 ILE B 45 -6.055 13.798 -5.535 1.00 0.00 C ATOM 0 H ILE B 45 -6.045 12.029 -0.985 1.00 0.00 H new ATOM 0 HA ILE B 45 -5.020 12.036 -3.739 1.00 0.00 H new ATOM 0 HB ILE B 45 -6.887 13.351 -2.955 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -6.253 15.470 -4.203 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -4.622 14.839 -4.321 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -6.402 15.595 -1.897 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -6.051 14.225 -0.817 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -4.721 15.069 -1.645 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -5.870 14.436 -6.399 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -5.456 12.891 -5.619 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -7.112 13.533 -5.499 1.00 0.00 H new ATOM 2081 N GLY B 46 -2.702 12.822 -3.618 1.00 0.00 N ATOM 2082 CA GLY B 46 -1.221 12.949 -3.584 1.00 0.00 C ATOM 2083 C GLY B 46 -0.372 11.709 -3.157 1.00 0.00 C ATOM 2084 O GLY B 46 0.844 11.854 -3.009 1.00 0.00 O ATOM 0 H GLY B 46 -3.092 12.789 -4.560 1.00 0.00 H new ATOM 0 HA2 GLY B 46 -0.892 13.248 -4.579 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -0.975 13.767 -2.907 1.00 0.00 H new ATOM 2088 N PHE B 47 -0.984 10.518 -2.980 1.00 0.00 N ATOM 2089 CA PHE B 47 -0.318 9.306 -2.465 1.00 0.00 C ATOM 2090 C PHE B 47 -0.912 7.968 -2.995 1.00 0.00 C ATOM 2091 O PHE B 47 -0.102 7.092 -3.315 1.00 0.00 O ATOM 2092 CB PHE B 47 -0.386 9.333 -0.909 1.00 0.00 C ATOM 2093 CG PHE B 47 0.582 8.319 -0.267 1.00 0.00 C ATOM 2094 CD1 PHE B 47 1.936 8.633 -0.103 1.00 0.00 C ATOM 2095 CD2 PHE B 47 0.153 7.002 -0.051 1.00 0.00 C ATOM 2096 CE1 PHE B 47 2.846 7.630 0.218 1.00 0.00 C ATOM 2097 CE2 PHE B 47 1.077 6.003 0.233 1.00 0.00 C ATOM 2098 CZ PHE B 47 2.426 6.316 0.340 1.00 0.00 C ATOM 0 H PHE B 47 -1.970 10.371 -3.195 1.00 0.00 H new ATOM 0 HA PHE B 47 0.710 9.330 -2.828 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -0.148 10.336 -0.554 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -1.404 9.115 -0.587 1.00 0.00 H new ATOM 0 HD1 PHE B 47 2.274 9.651 -0.225 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -0.899 6.763 -0.105 1.00 0.00 H new ATOM 0 HE1 PHE B 47 3.886 7.878 0.373 1.00 0.00 H new ATOM 0 HE2 PHE B 47 0.746 4.984 0.370 1.00 0.00 H new ATOM 0 HZ PHE B 47 3.149 5.533 0.519 1.00 0.00 H new ATOM 2108 N GLY B 48 -2.248 7.741 -2.991 1.00 0.00 N ATOM 2109 CA GLY B 48 -2.791 6.435 -3.403 1.00 0.00 C ATOM 2110 C GLY B 48 -4.304 6.232 -3.471 1.00 0.00 C ATOM 2111 O GLY B 48 -5.070 6.796 -2.696 1.00 0.00 O ATOM 0 H GLY B 48 -2.949 8.428 -2.714 1.00 0.00 H new ATOM 0 HA2 GLY B 48 -2.388 6.211 -4.391 1.00 0.00 H new ATOM 0 HA3 GLY B 48 -2.392 5.686 -2.719 1.00 0.00 H new ATOM 2115 N ASN B 49 -4.712 5.354 -4.398 1.00 0.00 N ATOM 2116 CA ASN B 49 -6.137 5.008 -4.623 1.00 0.00 C ATOM 2117 C ASN B 49 -6.245 3.467 -4.487 1.00 0.00 C ATOM 2118 O ASN B 49 -5.910 2.740 -5.429 1.00 0.00 O ATOM 2119 CB ASN B 49 -6.640 5.492 -6.020 1.00 0.00 C ATOM 2120 CG ASN B 49 -6.546 6.998 -6.371 1.00 0.00 C ATOM 2121 OD1 ASN B 49 -6.178 7.855 -5.566 1.00 0.00 O ATOM 2122 ND2 ASN B 49 -6.910 7.347 -7.594 1.00 0.00 N ATOM 0 H ASN B 49 -4.069 4.860 -5.017 1.00 0.00 H new ATOM 0 HA ASN B 49 -6.771 5.510 -3.893 1.00 0.00 H new ATOM 0 HB2 ASN B 49 -6.084 4.942 -6.779 1.00 0.00 H new ATOM 0 HB3 ASN B 49 -7.685 5.197 -6.114 1.00 0.00 H new ATOM 0 HD21 ASN B 49 -6.886 8.328 -7.873 1.00 0.00 H new ATOM 0 HD22 ASN B 49 -7.214 6.635 -8.258 1.00 0.00 H new ATOM 2129 N PHE B 50 -6.693 2.957 -3.320 1.00 0.00 N ATOM 2130 CA PHE B 50 -6.880 1.491 -3.133 1.00 0.00 C ATOM 2131 C PHE B 50 -8.266 1.075 -3.667 1.00 0.00 C ATOM 2132 O PHE B 50 -9.265 1.785 -3.502 1.00 0.00 O ATOM 2133 CB PHE B 50 -6.862 0.932 -1.683 1.00 0.00 C ATOM 2134 CG PHE B 50 -5.673 1.144 -0.778 1.00 0.00 C ATOM 2135 CD1 PHE B 50 -5.492 2.402 -0.197 1.00 0.00 C ATOM 2136 CD2 PHE B 50 -4.948 0.045 -0.301 1.00 0.00 C ATOM 2137 CE1 PHE B 50 -4.533 2.580 0.789 1.00 0.00 C ATOM 2138 CE2 PHE B 50 -3.991 0.228 0.690 1.00 0.00 C ATOM 2139 CZ PHE B 50 -3.766 1.501 1.199 1.00 0.00 C ATOM 0 H PHE B 50 -6.930 3.521 -2.504 1.00 0.00 H new ATOM 0 HA PHE B 50 -6.014 1.088 -3.658 1.00 0.00 H new ATOM 0 HB2 PHE B 50 -7.730 1.348 -1.171 1.00 0.00 H new ATOM 0 HB3 PHE B 50 -7.019 -0.144 -1.755 1.00 0.00 H new ATOM 0 HD1 PHE B 50 -6.099 3.236 -0.516 1.00 0.00 H new ATOM 0 HD2 PHE B 50 -5.132 -0.941 -0.702 1.00 0.00 H new ATOM 0 HE1 PHE B 50 -4.385 3.553 1.234 1.00 0.00 H new ATOM 0 HE2 PHE B 50 -3.426 -0.614 1.062 1.00 0.00 H new ATOM 0 HZ PHE B 50 -2.981 1.652 1.925 1.00 0.00 H new ATOM 2149 N GLU B 51 -8.306 -0.124 -4.259 1.00 0.00 N ATOM 2150 CA GLU B 51 -9.573 -0.728 -4.718 1.00 0.00 C ATOM 2151 C GLU B 51 -9.384 -2.223 -5.020 1.00 0.00 C ATOM 2152 O GLU B 51 -8.316 -2.675 -5.438 1.00 0.00 O ATOM 2153 CB GLU B 51 -10.243 0.031 -5.912 1.00 0.00 C ATOM 2154 CG GLU B 51 -9.498 0.107 -7.270 1.00 0.00 C ATOM 2155 CD GLU B 51 -8.287 1.051 -7.300 1.00 0.00 C ATOM 2156 OE1 GLU B 51 -8.384 2.278 -7.335 1.00 0.00 O ATOM 2157 OE2 GLU B 51 -7.095 0.370 -7.272 1.00 0.00 O ATOM 0 H GLU B 51 -7.481 -0.698 -4.434 1.00 0.00 H new ATOM 0 HA GLU B 51 -10.277 -0.628 -3.892 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -11.212 -0.433 -6.094 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -10.436 1.053 -5.585 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -9.164 -0.895 -7.539 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -10.205 0.424 -8.037 1.00 0.00 H new ATOM 2165 N VAL B 52 -10.462 -2.997 -4.839 1.00 0.00 N ATOM 2166 CA VAL B 52 -10.443 -4.452 -5.008 1.00 0.00 C ATOM 2167 C VAL B 52 -10.832 -4.852 -6.473 1.00 0.00 C ATOM 2168 O VAL B 52 -11.497 -4.085 -7.183 1.00 0.00 O ATOM 2169 CB VAL B 52 -11.319 -4.935 -3.796 1.00 0.00 C ATOM 2170 CG1 VAL B 52 -12.720 -5.364 -4.215 1.00 0.00 C ATOM 2171 CG2 VAL B 52 -10.562 -5.964 -2.949 1.00 0.00 C ATOM 0 H VAL B 52 -11.374 -2.628 -4.570 1.00 0.00 H new ATOM 0 HA VAL B 52 -9.480 -4.959 -4.952 1.00 0.00 H new ATOM 0 HB VAL B 52 -11.494 -4.080 -3.142 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -13.279 -5.688 -3.337 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -13.233 -4.524 -4.683 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -12.651 -6.188 -4.925 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -11.190 -6.283 -2.117 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -10.310 -6.827 -3.565 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -9.647 -5.515 -2.562 1.00 0.00 H new ATOM 2181 N ARG B 53 -10.447 -6.070 -6.900 1.00 0.00 N ATOM 2182 CA ARG B 53 -10.761 -6.563 -8.272 1.00 0.00 C ATOM 2183 C ARG B 53 -11.501 -7.918 -8.155 1.00 0.00 C ATOM 2184 O ARG B 53 -10.861 -8.962 -8.003 1.00 0.00 O ATOM 2185 CB ARG B 53 -9.454 -6.652 -9.104 1.00 0.00 C ATOM 2186 CG ARG B 53 -9.648 -6.875 -10.620 1.00 0.00 C ATOM 2187 CD ARG B 53 -8.337 -6.988 -11.425 1.00 0.00 C ATOM 2188 NE ARG B 53 -7.590 -5.706 -11.491 1.00 0.00 N ATOM 2189 CZ ARG B 53 -6.361 -5.562 -12.021 1.00 0.00 C ATOM 2190 NH1 ARG B 53 -5.663 -6.558 -12.565 1.00 0.00 N ATOM 2191 NH2 ARG B 53 -5.814 -4.360 -12.002 1.00 0.00 N ATOM 0 H ARG B 53 -9.923 -6.732 -6.327 1.00 0.00 H new ATOM 0 HA ARG B 53 -11.420 -5.873 -8.799 1.00 0.00 H new ATOM 0 HB2 ARG B 53 -8.888 -5.732 -8.959 1.00 0.00 H new ATOM 0 HB3 ARG B 53 -8.847 -7.466 -8.709 1.00 0.00 H new ATOM 0 HG2 ARG B 53 -10.230 -7.785 -10.769 1.00 0.00 H new ATOM 0 HG3 ARG B 53 -10.237 -6.051 -11.023 1.00 0.00 H new ATOM 0 HD2 ARG B 53 -7.703 -7.750 -10.972 1.00 0.00 H new ATOM 0 HD3 ARG B 53 -8.565 -7.323 -12.437 1.00 0.00 H new ATOM 0 HE ARG B 53 -8.040 -4.875 -11.107 1.00 0.00 H new ATOM 0 HH11 ARG B 53 -6.056 -7.499 -12.597 1.00 0.00 H new ATOM 0 HH12 ARG B 53 -4.735 -6.380 -12.950 1.00 0.00 H new ATOM 0 HH21 ARG B 53 -6.322 -3.575 -11.594 1.00 0.00 H new ATOM 0 HH22 ARG B 53 -4.884 -4.217 -12.395 1.00 0.00 H new ATOM 2522 N LYS B 75 -12.028 -11.282 -4.887 1.00 0.00 N ATOM 2523 CA LYS B 75 -11.650 -9.842 -4.767 1.00 0.00 C ATOM 2524 C LYS B 75 -10.134 -9.726 -4.452 1.00 0.00 C ATOM 2525 O LYS B 75 -9.662 -10.310 -3.472 1.00 0.00 O ATOM 2526 CB LYS B 75 -12.493 -8.985 -3.786 1.00 0.00 C ATOM 2527 CG LYS B 75 -13.943 -9.427 -3.477 1.00 0.00 C ATOM 2528 CD LYS B 75 -14.670 -8.471 -2.504 1.00 0.00 C ATOM 2529 CE LYS B 75 -16.100 -8.895 -2.118 1.00 0.00 C ATOM 2530 NZ LYS B 75 -17.066 -8.760 -3.225 1.00 0.00 N ATOM 0 HA LYS B 75 -11.882 -9.408 -5.739 1.00 0.00 H new ATOM 0 HB2 LYS B 75 -11.953 -8.936 -2.840 1.00 0.00 H new ATOM 0 HB3 LYS B 75 -12.533 -7.971 -4.183 1.00 0.00 H new ATOM 0 HG2 LYS B 75 -14.506 -9.486 -4.409 1.00 0.00 H new ATOM 0 HG3 LYS B 75 -13.928 -10.430 -3.050 1.00 0.00 H new ATOM 0 HD2 LYS B 75 -14.076 -8.382 -1.594 1.00 0.00 H new ATOM 0 HD3 LYS B 75 -14.711 -7.480 -2.956 1.00 0.00 H new ATOM 0 HE2 LYS B 75 -16.086 -9.932 -1.781 1.00 0.00 H new ATOM 0 HE3 LYS B 75 -16.436 -8.291 -1.276 1.00 0.00 H new ATOM 0 HZ1 LYS B 75 -18.008 -9.060 -2.902 1.00 0.00 H new ATOM 0 HZ2 LYS B 75 -17.106 -7.767 -3.532 1.00 0.00 H new ATOM 0 HZ3 LYS B 75 -16.766 -9.357 -4.022 1.00 0.00 H new ATOM 2543 N VAL B 76 -9.386 -8.957 -5.265 1.00 0.00 N ATOM 2544 CA VAL B 76 -7.928 -8.889 -5.219 1.00 0.00 C ATOM 2545 C VAL B 76 -7.570 -7.442 -4.749 1.00 0.00 C ATOM 2546 O VAL B 76 -7.930 -6.481 -5.431 1.00 0.00 O ATOM 2547 CB VAL B 76 -7.527 -9.316 -6.669 1.00 0.00 C ATOM 2548 CG1 VAL B 76 -6.699 -8.319 -7.459 1.00 0.00 C ATOM 2549 CG2 VAL B 76 -6.875 -10.690 -6.696 1.00 0.00 C ATOM 0 H VAL B 76 -9.793 -8.357 -5.983 1.00 0.00 H new ATOM 0 HA VAL B 76 -7.386 -9.530 -4.524 1.00 0.00 H new ATOM 0 HB VAL B 76 -8.485 -9.352 -7.188 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -6.484 -8.727 -8.447 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -7.255 -7.387 -7.564 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -5.763 -8.126 -6.934 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -6.612 -10.948 -7.722 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -5.974 -10.677 -6.083 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -7.571 -11.431 -6.303 1.00 0.00 H new ATOM 2559 N PRO B 77 -6.839 -7.229 -3.639 1.00 0.00 N ATOM 2560 CA PRO B 77 -6.545 -5.878 -3.127 1.00 0.00 C ATOM 2561 C PRO B 77 -5.342 -5.218 -3.822 1.00 0.00 C ATOM 2562 O PRO B 77 -4.280 -5.810 -4.044 1.00 0.00 O ATOM 2563 CB PRO B 77 -6.299 -6.174 -1.641 1.00 0.00 C ATOM 2564 CG PRO B 77 -5.686 -7.580 -1.630 1.00 0.00 C ATOM 2565 CD PRO B 77 -6.340 -8.318 -2.803 1.00 0.00 C ATOM 0 HA PRO B 77 -7.338 -5.152 -3.307 1.00 0.00 H new ATOM 0 HB2 PRO B 77 -5.624 -5.443 -1.196 1.00 0.00 H new ATOM 0 HB3 PRO B 77 -7.227 -6.140 -1.070 1.00 0.00 H new ATOM 0 HG2 PRO B 77 -4.603 -7.537 -1.747 1.00 0.00 H new ATOM 0 HG3 PRO B 77 -5.885 -8.088 -0.686 1.00 0.00 H new ATOM 0 HD2 PRO B 77 -5.623 -8.941 -3.338 1.00 0.00 H new ATOM 0 HD3 PRO B 77 -7.145 -8.972 -2.470 1.00 0.00 H new ATOM 2573 N ALA B 78 -5.594 -3.952 -4.145 1.00 0.00 N ATOM 2574 CA ALA B 78 -4.667 -3.115 -4.908 1.00 0.00 C ATOM 2575 C ALA B 78 -4.543 -1.718 -4.251 1.00 0.00 C ATOM 2576 O ALA B 78 -5.343 -1.285 -3.416 1.00 0.00 O ATOM 2577 CB ALA B 78 -5.244 -3.106 -6.335 1.00 0.00 C ATOM 0 H ALA B 78 -6.455 -3.472 -3.883 1.00 0.00 H new ATOM 0 HA ALA B 78 -3.642 -3.486 -4.928 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -4.609 -2.499 -6.980 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -5.282 -4.126 -6.719 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -6.250 -2.687 -6.318 1.00 0.00 H new ATOM 2583 N PHE B 79 -3.467 -1.051 -4.659 1.00 0.00 N ATOM 2584 CA PHE B 79 -3.062 0.297 -4.187 1.00 0.00 C ATOM 2585 C PHE B 79 -2.367 0.912 -5.441 1.00 0.00 C ATOM 2586 O PHE B 79 -1.351 0.432 -5.958 1.00 0.00 O ATOM 2587 CB PHE B 79 -2.149 0.216 -2.947 1.00 0.00 C ATOM 2588 CG PHE B 79 -1.257 1.442 -2.638 1.00 0.00 C ATOM 2589 CD1 PHE B 79 -1.742 2.511 -1.882 1.00 0.00 C ATOM 2590 CD2 PHE B 79 0.024 1.531 -3.204 1.00 0.00 C ATOM 2591 CE1 PHE B 79 -0.969 3.655 -1.710 1.00 0.00 C ATOM 2592 CE2 PHE B 79 0.783 2.687 -3.057 1.00 0.00 C ATOM 2593 CZ PHE B 79 0.278 3.756 -2.326 1.00 0.00 C ATOM 0 H PHE B 79 -2.823 -1.435 -5.350 1.00 0.00 H new ATOM 0 HA PHE B 79 -3.893 0.912 -3.842 1.00 0.00 H new ATOM 0 HB2 PHE B 79 -2.779 0.030 -2.077 1.00 0.00 H new ATOM 0 HB3 PHE B 79 -1.500 -0.652 -3.063 1.00 0.00 H new ATOM 0 HD1 PHE B 79 -2.721 2.450 -1.429 1.00 0.00 H new ATOM 0 HD2 PHE B 79 0.424 0.695 -3.758 1.00 0.00 H new ATOM 0 HE1 PHE B 79 -1.335 4.466 -1.098 1.00 0.00 H new ATOM 0 HE2 PHE B 79 1.761 2.754 -3.509 1.00 0.00 H new ATOM 0 HZ PHE B 79 0.852 4.666 -2.235 1.00 0.00 H new ATOM 2603 N LYS B 80 -2.945 2.026 -5.856 1.00 0.00 N ATOM 2604 CA LYS B 80 -2.345 2.949 -6.872 1.00 0.00 C ATOM 2605 C LYS B 80 -1.345 3.880 -6.135 1.00 0.00 C ATOM 2606 O LYS B 80 -1.580 4.181 -4.961 1.00 0.00 O ATOM 2607 CB LYS B 80 -3.429 3.787 -7.603 1.00 0.00 C ATOM 2608 CG LYS B 80 -4.466 2.996 -8.438 1.00 0.00 C ATOM 2609 CD LYS B 80 -3.900 2.278 -9.679 1.00 0.00 C ATOM 2610 CE LYS B 80 -4.991 1.531 -10.467 1.00 0.00 C ATOM 2611 NZ LYS B 80 -4.432 0.846 -11.647 1.00 0.00 N ATOM 0 H LYS B 80 -3.852 2.340 -5.510 1.00 0.00 H new ATOM 0 HA LYS B 80 -1.836 2.363 -7.637 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -3.967 4.374 -6.858 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -2.926 4.494 -8.263 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -4.938 2.255 -7.793 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -5.249 3.683 -8.761 1.00 0.00 H new ATOM 0 HD2 LYS B 80 -3.419 3.007 -10.331 1.00 0.00 H new ATOM 0 HD3 LYS B 80 -3.130 1.571 -9.368 1.00 0.00 H new ATOM 0 HE2 LYS B 80 -5.476 0.802 -9.818 1.00 0.00 H new ATOM 0 HE3 LYS B 80 -5.759 2.236 -10.784 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 -5.194 0.353 -12.155 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 -3.991 1.545 -12.278 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 -3.716 0.156 -11.341 1.00 0.00 H new ATOM 2624 N PRO B 81 -0.221 4.362 -6.730 1.00 0.00 N ATOM 2625 CA PRO B 81 0.598 5.424 -6.089 1.00 0.00 C ATOM 2626 C PRO B 81 0.034 6.867 -6.324 1.00 0.00 C ATOM 2627 O PRO B 81 0.798 7.831 -6.361 1.00 0.00 O ATOM 2628 CB PRO B 81 1.946 5.146 -6.775 1.00 0.00 C ATOM 2629 CG PRO B 81 1.605 4.682 -8.194 1.00 0.00 C ATOM 2630 CD PRO B 81 0.320 3.877 -8.017 1.00 0.00 C ATOM 0 HA PRO B 81 0.634 5.397 -5.000 1.00 0.00 H new ATOM 0 HB2 PRO B 81 2.566 6.042 -6.795 1.00 0.00 H new ATOM 0 HB3 PRO B 81 2.508 4.381 -6.238 1.00 0.00 H new ATOM 0 HG2 PRO B 81 1.458 5.527 -8.866 1.00 0.00 H new ATOM 0 HG3 PRO B 81 2.403 4.073 -8.618 1.00 0.00 H new ATOM 0 HD2 PRO B 81 -0.378 4.051 -8.836 1.00 0.00 H new ATOM 0 HD3 PRO B 81 0.519 2.806 -7.990 1.00 0.00 H new ATOM 2638 N GLY B 82 -1.302 7.020 -6.477 1.00 0.00 N ATOM 2639 CA GLY B 82 -1.974 8.287 -6.847 1.00 0.00 C ATOM 2640 C GLY B 82 -1.383 9.107 -8.018 1.00 0.00 C ATOM 2641 O GLY B 82 -1.721 10.290 -8.104 1.00 0.00 O ATOM 0 H GLY B 82 -1.957 6.249 -6.344 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -3.011 8.056 -7.091 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -1.989 8.927 -5.965 1.00 0.00 H new ATOM 2645 N LYS B 83 -0.511 8.491 -8.869 1.00 0.00 N ATOM 2646 CA LYS B 83 0.354 9.208 -9.876 1.00 0.00 C ATOM 2647 C LYS B 83 1.539 10.035 -9.261 1.00 0.00 C ATOM 2648 O LYS B 83 2.695 9.966 -9.680 1.00 0.00 O ATOM 2649 CB LYS B 83 -0.443 10.079 -10.894 1.00 0.00 C ATOM 2650 CG LYS B 83 -0.692 9.429 -12.276 1.00 0.00 C ATOM 2651 CD LYS B 83 -1.519 8.122 -12.293 1.00 0.00 C ATOM 2652 CE LYS B 83 -2.982 8.275 -11.831 1.00 0.00 C ATOM 2653 NZ LYS B 83 -3.700 6.988 -11.880 1.00 0.00 N ATOM 0 H LYS B 83 -0.382 7.479 -8.882 1.00 0.00 H new ATOM 0 HA LYS B 83 0.802 8.381 -10.427 1.00 0.00 H new ATOM 0 HB2 LYS B 83 -1.407 10.332 -10.452 1.00 0.00 H new ATOM 0 HB3 LYS B 83 0.095 11.015 -11.044 1.00 0.00 H new ATOM 0 HG2 LYS B 83 -1.197 10.159 -12.909 1.00 0.00 H new ATOM 0 HG3 LYS B 83 0.275 9.225 -12.735 1.00 0.00 H new ATOM 0 HD2 LYS B 83 -1.513 7.718 -13.305 1.00 0.00 H new ATOM 0 HD3 LYS B 83 -1.026 7.389 -11.655 1.00 0.00 H new ATOM 0 HE2 LYS B 83 -3.005 8.667 -10.814 1.00 0.00 H new ATOM 0 HE3 LYS B 83 -3.491 9.001 -12.465 1.00 0.00 H new ATOM 0 HZ1 LYS B 83 -4.681 7.125 -11.563 1.00 0.00 H new ATOM 0 HZ2 LYS B 83 -3.699 6.627 -12.855 1.00 0.00 H new ATOM 0 HZ3 LYS B 83 -3.228 6.303 -11.256 1.00 0.00 H new ATOM 2666 N ALA B 84 1.148 10.864 -8.302 1.00 0.00 N ATOM 2667 CA ALA B 84 1.962 11.748 -7.455 1.00 0.00 C ATOM 2668 C ALA B 84 3.120 11.088 -6.682 1.00 0.00 C ATOM 2669 O ALA B 84 4.235 11.616 -6.730 1.00 0.00 O ATOM 2670 CB ALA B 84 0.906 12.266 -6.479 1.00 0.00 C ATOM 0 H ALA B 84 0.158 10.948 -8.070 1.00 0.00 H new ATOM 0 HA ALA B 84 2.489 12.487 -8.058 1.00 0.00 H new ATOM 0 HB1 ALA B 84 1.371 12.951 -5.770 1.00 0.00 H new ATOM 0 HB2 ALA B 84 0.126 12.789 -7.031 1.00 0.00 H new ATOM 0 HB3 ALA B 84 0.468 11.427 -5.938 1.00 0.00 H new ATOM 2676 N LEU B 85 2.875 9.957 -5.972 1.00 0.00 N ATOM 2677 CA LEU B 85 3.959 9.137 -5.405 1.00 0.00 C ATOM 2678 C LEU B 85 4.891 8.592 -6.537 1.00 0.00 C ATOM 2679 O LEU B 85 6.103 8.619 -6.340 1.00 0.00 O ATOM 2680 CB LEU B 85 3.366 8.039 -4.484 1.00 0.00 C ATOM 2681 CG LEU B 85 4.437 7.132 -3.861 1.00 0.00 C ATOM 2682 CD1 LEU B 85 5.253 7.794 -2.746 1.00 0.00 C ATOM 2683 CD2 LEU B 85 3.833 5.800 -3.382 1.00 0.00 C ATOM 0 H LEU B 85 1.939 9.599 -5.783 1.00 0.00 H new ATOM 0 HA LEU B 85 4.601 9.751 -4.773 1.00 0.00 H new ATOM 0 HB2 LEU B 85 2.791 8.512 -3.688 1.00 0.00 H new ATOM 0 HB3 LEU B 85 2.670 7.428 -5.059 1.00 0.00 H new ATOM 0 HG LEU B 85 5.145 6.932 -4.665 1.00 0.00 H new ATOM 0 HD11 LEU B 85 5.986 7.085 -2.361 1.00 0.00 H new ATOM 0 HD12 LEU B 85 5.768 8.669 -3.142 1.00 0.00 H new ATOM 0 HD13 LEU B 85 4.586 8.100 -1.940 1.00 0.00 H new ATOM 0 HD21 LEU B 85 4.617 5.181 -2.946 1.00 0.00 H new ATOM 0 HD22 LEU B 85 3.067 5.997 -2.632 1.00 0.00 H new ATOM 0 HD23 LEU B 85 3.387 5.278 -4.228 1.00 0.00 H new ATOM 2695 N LYS B 86 4.364 8.125 -7.689 1.00 0.00 N ATOM 2696 CA LYS B 86 5.202 7.746 -8.867 1.00 0.00 C ATOM 2697 C LYS B 86 6.203 8.852 -9.370 1.00 0.00 C ATOM 2698 O LYS B 86 7.231 8.511 -9.960 1.00 0.00 O ATOM 2699 CB LYS B 86 4.321 7.132 -9.986 1.00 0.00 C ATOM 2700 CG LYS B 86 5.073 6.152 -10.910 1.00 0.00 C ATOM 2701 CD LYS B 86 4.157 5.478 -11.949 1.00 0.00 C ATOM 2702 CE LYS B 86 4.918 4.483 -12.844 1.00 0.00 C ATOM 2703 NZ LYS B 86 4.021 3.842 -13.821 1.00 0.00 N ATOM 0 H LYS B 86 3.363 7.998 -7.837 1.00 0.00 H new ATOM 0 HA LYS B 86 5.884 6.971 -8.517 1.00 0.00 H new ATOM 0 HB2 LYS B 86 3.481 6.611 -9.528 1.00 0.00 H new ATOM 0 HB3 LYS B 86 3.905 7.938 -10.590 1.00 0.00 H new ATOM 0 HG2 LYS B 86 5.868 6.688 -11.429 1.00 0.00 H new ATOM 0 HG3 LYS B 86 5.551 5.383 -10.303 1.00 0.00 H new ATOM 0 HD2 LYS B 86 3.350 4.956 -11.434 1.00 0.00 H new ATOM 0 HD3 LYS B 86 3.695 6.243 -12.572 1.00 0.00 H new ATOM 0 HE2 LYS B 86 5.718 5.003 -13.370 1.00 0.00 H new ATOM 0 HE3 LYS B 86 5.388 3.720 -12.224 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 4.565 3.178 -14.408 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 3.272 3.326 -13.318 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 3.592 4.569 -14.428 1.00 0.00 H new ATOM 2716 N ASP B 87 5.927 10.146 -9.097 1.00 0.00 N ATOM 2717 CA ASP B 87 6.869 11.270 -9.295 1.00 0.00 C ATOM 2718 C ASP B 87 7.909 11.407 -8.133 1.00 0.00 C ATOM 2719 O ASP B 87 9.098 11.570 -8.421 1.00 0.00 O ATOM 2720 CB ASP B 87 5.979 12.531 -9.464 1.00 0.00 C ATOM 2721 CG ASP B 87 6.327 13.358 -10.705 1.00 0.00 C ATOM 2722 OD1 ASP B 87 5.767 13.218 -11.792 1.00 0.00 O ATOM 2723 OD2 ASP B 87 7.332 14.258 -10.461 1.00 0.00 O ATOM 0 H ASP B 87 5.025 10.445 -8.725 1.00 0.00 H new ATOM 0 HA ASP B 87 7.494 11.110 -10.174 1.00 0.00 H new ATOM 0 HB2 ASP B 87 4.935 12.225 -9.522 1.00 0.00 H new ATOM 0 HB3 ASP B 87 6.079 13.159 -8.578 1.00 0.00 H new ATOM 2729 N ALA B 88 7.473 11.345 -6.847 1.00 0.00 N ATOM 2730 CA ALA B 88 8.374 11.290 -5.651 1.00 0.00 C ATOM 2731 C ALA B 88 9.526 10.241 -5.695 1.00 0.00 C ATOM 2732 O ALA B 88 10.664 10.504 -5.301 1.00 0.00 O ATOM 2733 CB ALA B 88 7.520 10.873 -4.418 1.00 0.00 C ATOM 0 H ALA B 88 6.483 11.331 -6.603 1.00 0.00 H new ATOM 0 HA ALA B 88 8.825 12.282 -5.613 1.00 0.00 H new ATOM 0 HB1 ALA B 88 8.156 10.826 -3.534 1.00 0.00 H new ATOM 0 HB2 ALA B 88 6.730 11.606 -4.258 1.00 0.00 H new ATOM 0 HB3 ALA B 88 7.076 9.894 -4.597 1.00 0.00 H new ATOM 2739 N VAL B 89 9.154 9.050 -6.177 1.00 0.00 N ATOM 2740 CA VAL B 89 9.944 7.817 -6.154 1.00 0.00 C ATOM 2741 C VAL B 89 10.817 7.510 -7.425 1.00 0.00 C ATOM 2742 O VAL B 89 11.672 6.623 -7.360 1.00 0.00 O ATOM 2743 CB VAL B 89 8.735 6.853 -5.860 1.00 0.00 C ATOM 2744 CG1 VAL B 89 8.016 6.382 -7.122 1.00 0.00 C ATOM 2745 CG2 VAL B 89 9.090 5.648 -5.038 1.00 0.00 C ATOM 0 H VAL B 89 8.244 8.915 -6.617 1.00 0.00 H new ATOM 0 HA VAL B 89 10.775 7.779 -5.450 1.00 0.00 H new ATOM 0 HB VAL B 89 8.063 7.480 -5.274 1.00 0.00 H new ATOM 0 HG11 VAL B 89 7.194 5.721 -6.847 1.00 0.00 H new ATOM 0 HG12 VAL B 89 7.624 7.245 -7.661 1.00 0.00 H new ATOM 0 HG13 VAL B 89 8.716 5.844 -7.760 1.00 0.00 H new ATOM 0 HG21 VAL B 89 8.200 5.038 -4.883 1.00 0.00 H new ATOM 0 HG22 VAL B 89 9.845 5.061 -5.560 1.00 0.00 H new ATOM 0 HG23 VAL B 89 9.483 5.969 -4.073 1.00 0.00 H new ATOM 2755 N LYS B 90 10.594 8.229 -8.551 1.00 0.00 N ATOM 2756 CA LYS B 90 11.230 7.985 -9.867 1.00 0.00 C ATOM 2757 C LYS B 90 12.761 8.153 -9.869 1.00 0.00 C ATOM 2758 O LYS B 90 13.501 7.169 -9.861 1.00 0.00 O ATOM 2759 CB LYS B 90 10.554 8.967 -10.872 1.00 0.00 C ATOM 2760 CG LYS B 90 10.240 8.370 -12.260 1.00 0.00 C ATOM 2761 CD LYS B 90 9.311 9.263 -13.120 1.00 0.00 C ATOM 2762 CE LYS B 90 9.912 10.580 -13.655 1.00 0.00 C ATOM 2763 NZ LYS B 90 10.979 10.372 -14.654 1.00 0.00 N ATOM 0 H LYS B 90 9.948 9.018 -8.569 1.00 0.00 H new ATOM 0 HA LYS B 90 11.078 6.942 -10.147 1.00 0.00 H new ATOM 0 HB2 LYS B 90 9.626 9.331 -10.432 1.00 0.00 H new ATOM 0 HB3 LYS B 90 11.204 9.832 -11.004 1.00 0.00 H new ATOM 0 HG2 LYS B 90 11.175 8.208 -12.797 1.00 0.00 H new ATOM 0 HG3 LYS B 90 9.774 7.393 -12.130 1.00 0.00 H new ATOM 0 HD2 LYS B 90 8.968 8.675 -13.972 1.00 0.00 H new ATOM 0 HD3 LYS B 90 8.430 9.508 -12.526 1.00 0.00 H new ATOM 0 HE2 LYS B 90 9.118 11.179 -14.101 1.00 0.00 H new ATOM 0 HE3 LYS B 90 10.313 11.154 -12.820 1.00 0.00 H new ATOM 0 HZ1 LYS B 90 11.340 11.294 -14.973 1.00 0.00 H new ATOM 0 HZ2 LYS B 90 11.754 9.826 -14.226 1.00 0.00 H new ATOM 0 HZ3 LYS B 90 10.596 9.850 -15.468 1.00 0.00 H new