USER MOD reduce.3.24.130724 H: found=0, std=0, add=1111, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1106 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 65 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 1.2: A 77 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.1: A 16 THR OG1 : rot -78:sc= 0.47 USER MOD Set 2.2: A 128 THR OG1 : rot 180:sc= 0.423 USER MOD Single : A 1 GLY N :NH3+ -126:sc= 0.0828 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 166:sc= 1.69 USER MOD Single : A 12 GLN : amide:sc= 0.224 K(o=0.22,f=-3.2!) USER MOD Single : A 14 GLN : amide:sc= -1.88 K(o=-1.9,f=-2.9!) USER MOD Single : A 19 HIS : no HD1:sc= -1.12 K(o=-1.1,f=-8.1!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= -0.0114 USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 ASN : amide:sc= -0.513 K(o=-0.51,f=-1.4) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 33 CYS SG : rot 180:sc= -0.467 USER MOD Single : A 35 ASN : amide:sc= -0.038 K(o=-0.038,f=-1.1) USER MOD Single : A 40 SER OG : rot -128:sc= 1.22 USER MOD Single : A 44 SER OG : rot 180:sc= -0.0428 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 MET CE :methyl -111:sc= -4.97! (180deg=-5.45!) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ -109:sc= 0.729 (180deg=-1.28) USER MOD Single : A 64 THR OG1 : rot 126:sc= 0.606 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.931 K(o=-0.93,f=0.85) USER MOD Single : A 78 SER OG : rot 180:sc= -0.452 USER MOD Single : A 82 SER OG : rot 47:sc= 0.574 USER MOD Single : A 84 SER OG : rot 180:sc= 0.00684 USER MOD Single : A 89 GLN : amide:sc= -4.93! C(o=-4.9!,f=-5!) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 147:sc= -4.52! (180deg=-7.4!) USER MOD Single : A 99 ASN : amide:sc= -0.0812 K(o=-0.081,f=0.68) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.178) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 GLN : amide:sc= -1.2 X(o=-1.2,f=-1.2) USER MOD Single : A 131 TYR OH : rot 130:sc= 0.14 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 27.756 8.017 7.761 1.00 0.00 N ATOM 2 CA GLY A 1 26.612 7.685 6.932 1.00 0.00 C ATOM 3 C GLY A 1 26.469 8.615 5.743 1.00 0.00 C ATOM 4 O GLY A 1 27.292 9.508 5.542 1.00 0.00 O ATOM 0 H1 GLY A 1 28.355 7.175 7.879 1.00 0.00 H new ATOM 0 H2 GLY A 1 28.306 8.773 7.306 1.00 0.00 H new ATOM 0 H3 GLY A 1 27.427 8.341 8.693 1.00 0.00 H new ATOM 0 HA2 GLY A 1 26.710 6.659 6.577 1.00 0.00 H new ATOM 0 HA3 GLY A 1 25.705 7.729 7.535 1.00 0.00 H new ATOM 8 N SER A 2 25.423 8.404 4.951 1.00 0.00 N ATOM 9 CA SER A 2 25.178 9.226 3.772 1.00 0.00 C ATOM 10 C SER A 2 24.300 10.425 4.119 1.00 0.00 C ATOM 11 O SER A 2 23.390 10.779 3.369 1.00 0.00 O ATOM 12 CB SER A 2 24.515 8.395 2.672 1.00 0.00 C ATOM 13 OG SER A 2 25.437 7.489 2.091 1.00 0.00 O ATOM 0 H SER A 2 24.731 7.670 5.104 1.00 0.00 H new ATOM 0 HA SER A 2 26.138 9.593 3.410 1.00 0.00 H new ATOM 0 HB2 SER A 2 23.671 7.844 3.087 1.00 0.00 H new ATOM 0 HB3 SER A 2 24.116 9.056 1.903 1.00 0.00 H new ATOM 0 HG SER A 2 24.988 6.969 1.392 1.00 0.00 H new ATOM 19 N SER A 3 24.579 11.045 5.261 1.00 0.00 N ATOM 20 CA SER A 3 23.813 12.201 5.710 1.00 0.00 C ATOM 21 C SER A 3 23.533 13.151 4.550 1.00 0.00 C ATOM 22 O SER A 3 24.444 13.779 4.013 1.00 0.00 O ATOM 23 CB SER A 3 24.567 12.939 6.818 1.00 0.00 C ATOM 24 OG SER A 3 24.395 12.295 8.069 1.00 0.00 O ATOM 0 H SER A 3 25.330 10.766 5.892 1.00 0.00 H new ATOM 0 HA SER A 3 22.861 11.845 6.103 1.00 0.00 H new ATOM 0 HB2 SER A 3 25.628 12.985 6.572 1.00 0.00 H new ATOM 0 HB3 SER A 3 24.210 13.967 6.883 1.00 0.00 H new ATOM 0 HG SER A 3 24.888 12.785 8.760 1.00 0.00 H new ATOM 30 N GLY A 4 22.263 13.251 4.168 1.00 0.00 N ATOM 31 CA GLY A 4 21.884 14.126 3.074 1.00 0.00 C ATOM 32 C GLY A 4 20.409 14.475 3.096 1.00 0.00 C ATOM 33 O GLY A 4 19.820 14.646 4.163 1.00 0.00 O ATOM 0 H GLY A 4 21.490 12.742 4.597 1.00 0.00 H new ATOM 0 HA2 GLY A 4 22.472 15.042 3.125 1.00 0.00 H new ATOM 0 HA3 GLY A 4 22.126 13.644 2.127 1.00 0.00 H new ATOM 37 N SER A 5 19.811 14.583 1.914 1.00 0.00 N ATOM 38 CA SER A 5 18.396 14.920 1.801 1.00 0.00 C ATOM 39 C SER A 5 17.523 13.751 2.245 1.00 0.00 C ATOM 40 O SER A 5 17.220 12.854 1.458 1.00 0.00 O ATOM 41 CB SER A 5 18.056 15.307 0.360 1.00 0.00 C ATOM 42 OG SER A 5 16.684 15.637 0.231 1.00 0.00 O ATOM 0 H SER A 5 20.284 14.442 1.021 1.00 0.00 H new ATOM 0 HA SER A 5 18.196 15.769 2.455 1.00 0.00 H new ATOM 0 HB2 SER A 5 18.668 16.156 0.054 1.00 0.00 H new ATOM 0 HB3 SER A 5 18.299 14.481 -0.309 1.00 0.00 H new ATOM 0 HG SER A 5 16.492 15.882 -0.698 1.00 0.00 H new ATOM 48 N SER A 6 17.120 13.769 3.512 1.00 0.00 N ATOM 49 CA SER A 6 16.284 12.709 4.063 1.00 0.00 C ATOM 50 C SER A 6 14.822 13.141 4.111 1.00 0.00 C ATOM 51 O SER A 6 14.354 13.678 5.114 1.00 0.00 O ATOM 52 CB SER A 6 16.763 12.331 5.466 1.00 0.00 C ATOM 53 OG SER A 6 16.423 10.991 5.777 1.00 0.00 O ATOM 0 H SER A 6 17.359 14.506 4.176 1.00 0.00 H new ATOM 0 HA SER A 6 16.366 11.839 3.412 1.00 0.00 H new ATOM 0 HB2 SER A 6 17.843 12.460 5.532 1.00 0.00 H new ATOM 0 HB3 SER A 6 16.316 13.002 6.199 1.00 0.00 H new ATOM 0 HG SER A 6 16.741 10.773 6.678 1.00 0.00 H new ATOM 59 N GLY A 7 14.104 12.900 3.018 1.00 0.00 N ATOM 60 CA GLY A 7 12.702 13.270 2.955 1.00 0.00 C ATOM 61 C GLY A 7 12.130 13.139 1.557 1.00 0.00 C ATOM 62 O GLY A 7 12.456 13.926 0.669 1.00 0.00 O ATOM 0 H GLY A 7 14.468 12.455 2.175 1.00 0.00 H new ATOM 0 HA2 GLY A 7 12.132 12.640 3.638 1.00 0.00 H new ATOM 0 HA3 GLY A 7 12.585 14.298 3.297 1.00 0.00 H new ATOM 66 N SER A 8 11.276 12.139 1.360 1.00 0.00 N ATOM 67 CA SER A 8 10.662 11.904 0.059 1.00 0.00 C ATOM 68 C SER A 8 10.270 13.222 -0.603 1.00 0.00 C ATOM 69 O SER A 8 9.387 13.942 -0.136 1.00 0.00 O ATOM 70 CB SER A 8 9.430 11.009 0.207 1.00 0.00 C ATOM 71 OG SER A 8 8.938 10.605 -1.059 1.00 0.00 O ATOM 0 H SER A 8 10.994 11.479 2.085 1.00 0.00 H new ATOM 0 HA SER A 8 11.393 11.402 -0.575 1.00 0.00 H new ATOM 0 HB2 SER A 8 9.684 10.130 0.799 1.00 0.00 H new ATOM 0 HB3 SER A 8 8.651 11.544 0.750 1.00 0.00 H new ATOM 0 HG SER A 8 8.307 9.864 -0.944 1.00 0.00 H new ATOM 77 N PRO A 9 10.942 13.546 -1.718 1.00 0.00 N ATOM 78 CA PRO A 9 10.682 14.778 -2.469 1.00 0.00 C ATOM 79 C PRO A 9 9.330 14.752 -3.174 1.00 0.00 C ATOM 80 O PRO A 9 8.758 15.799 -3.481 1.00 0.00 O ATOM 81 CB PRO A 9 11.818 14.815 -3.494 1.00 0.00 C ATOM 82 CG PRO A 9 12.218 13.390 -3.668 1.00 0.00 C ATOM 83 CD PRO A 9 12.007 12.735 -2.331 1.00 0.00 C ATOM 0 HA PRO A 9 10.647 15.652 -1.819 1.00 0.00 H new ATOM 0 HB2 PRO A 9 11.487 15.251 -4.436 1.00 0.00 H new ATOM 0 HB3 PRO A 9 12.652 15.420 -3.139 1.00 0.00 H new ATOM 0 HG2 PRO A 9 11.617 12.907 -4.438 1.00 0.00 H new ATOM 0 HG3 PRO A 9 13.259 13.312 -3.981 1.00 0.00 H new ATOM 0 HD2 PRO A 9 11.707 11.692 -2.437 1.00 0.00 H new ATOM 0 HD3 PRO A 9 12.916 12.746 -1.730 1.00 0.00 H new ATOM 91 N LEU A 10 8.823 13.551 -3.428 1.00 0.00 N ATOM 92 CA LEU A 10 7.536 13.389 -4.096 1.00 0.00 C ATOM 93 C LEU A 10 6.437 13.063 -3.090 1.00 0.00 C ATOM 94 O LEU A 10 5.327 13.588 -3.176 1.00 0.00 O ATOM 95 CB LEU A 10 7.623 12.284 -5.150 1.00 0.00 C ATOM 96 CG LEU A 10 8.658 12.491 -6.257 1.00 0.00 C ATOM 97 CD1 LEU A 10 8.816 11.224 -7.083 1.00 0.00 C ATOM 98 CD2 LEU A 10 8.264 13.663 -7.143 1.00 0.00 C ATOM 0 H LEU A 10 9.283 12.675 -3.182 1.00 0.00 H new ATOM 0 HA LEU A 10 7.287 14.331 -4.585 1.00 0.00 H new ATOM 0 HB2 LEU A 10 7.845 11.344 -4.644 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.642 12.173 -5.613 1.00 0.00 H new ATOM 0 HG LEU A 10 9.618 12.719 -5.793 1.00 0.00 H new ATOM 0 HD11 LEU A 10 9.556 11.390 -7.866 1.00 0.00 H new ATOM 0 HD12 LEU A 10 9.145 10.409 -6.439 1.00 0.00 H new ATOM 0 HD13 LEU A 10 7.860 10.964 -7.537 1.00 0.00 H new ATOM 0 HD21 LEU A 10 9.012 13.796 -7.925 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.294 13.465 -7.599 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.204 14.570 -6.541 1.00 0.00 H new ATOM 110 N GLY A 11 6.754 12.195 -2.135 1.00 0.00 N ATOM 111 CA GLY A 11 5.783 11.816 -1.125 1.00 0.00 C ATOM 112 C GLY A 11 5.885 10.352 -0.744 1.00 0.00 C ATOM 113 O GLY A 11 6.672 9.606 -1.325 1.00 0.00 O ATOM 0 H GLY A 11 7.666 11.747 -2.042 1.00 0.00 H new ATOM 0 HA2 GLY A 11 5.929 12.431 -0.237 1.00 0.00 H new ATOM 0 HA3 GLY A 11 4.779 12.023 -1.495 1.00 0.00 H new ATOM 117 N GLN A 12 5.087 9.941 0.236 1.00 0.00 N ATOM 118 CA GLN A 12 5.092 8.557 0.695 1.00 0.00 C ATOM 119 C GLN A 12 3.675 7.997 0.753 1.00 0.00 C ATOM 120 O GLN A 12 2.701 8.727 0.569 1.00 0.00 O ATOM 121 CB GLN A 12 5.750 8.457 2.073 1.00 0.00 C ATOM 122 CG GLN A 12 7.164 9.012 2.113 1.00 0.00 C ATOM 123 CD GLN A 12 7.845 8.778 3.447 1.00 0.00 C ATOM 124 OE1 GLN A 12 7.221 8.317 4.404 1.00 0.00 O ATOM 125 NE2 GLN A 12 9.133 9.094 3.519 1.00 0.00 N ATOM 0 H GLN A 12 4.429 10.546 0.727 1.00 0.00 H new ATOM 0 HA GLN A 12 5.667 7.966 -0.018 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.138 8.992 2.799 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.770 7.412 2.382 1.00 0.00 H new ATOM 0 HG2 GLN A 12 7.754 8.550 1.322 1.00 0.00 H new ATOM 0 HG3 GLN A 12 7.136 10.082 1.906 1.00 0.00 H new ATOM 0 HE21 GLN A 12 9.612 9.473 2.702 1.00 0.00 H new ATOM 0 HE22 GLN A 12 9.644 8.957 4.391 1.00 0.00 H new ATOM 134 N ILE A 13 3.567 6.697 1.010 1.00 0.00 N ATOM 135 CA ILE A 13 2.269 6.040 1.093 1.00 0.00 C ATOM 136 C ILE A 13 2.382 4.685 1.782 1.00 0.00 C ATOM 137 O ILE A 13 3.233 3.868 1.430 1.00 0.00 O ATOM 138 CB ILE A 13 1.647 5.845 -0.302 1.00 0.00 C ATOM 139 CG1 ILE A 13 0.321 5.090 -0.191 1.00 0.00 C ATOM 140 CG2 ILE A 13 2.612 5.101 -1.213 1.00 0.00 C ATOM 141 CD1 ILE A 13 -0.480 5.084 -1.475 1.00 0.00 C ATOM 0 H ILE A 13 4.363 6.079 1.164 1.00 0.00 H new ATOM 0 HA ILE A 13 1.623 6.691 1.682 1.00 0.00 H new ATOM 0 HB ILE A 13 1.451 6.825 -0.737 1.00 0.00 H new ATOM 0 HG12 ILE A 13 0.522 4.061 0.107 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.279 5.540 0.600 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.158 4.971 -2.195 1.00 0.00 H new ATOM 0 HG22 ILE A 13 3.534 5.674 -1.312 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.837 4.124 -0.785 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -1.407 4.531 -1.323 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -0.712 6.109 -1.764 1.00 0.00 H new ATOM 0 HD13 ILE A 13 0.101 4.607 -2.264 1.00 0.00 H new ATOM 153 N GLN A 14 1.517 4.452 2.764 1.00 0.00 N ATOM 154 CA GLN A 14 1.519 3.194 3.501 1.00 0.00 C ATOM 155 C GLN A 14 0.436 2.255 2.980 1.00 0.00 C ATOM 156 O GLN A 14 -0.747 2.601 2.968 1.00 0.00 O ATOM 157 CB GLN A 14 1.311 3.453 4.994 1.00 0.00 C ATOM 158 CG GLN A 14 1.811 2.326 5.883 1.00 0.00 C ATOM 159 CD GLN A 14 1.828 2.703 7.351 1.00 0.00 C ATOM 160 OE1 GLN A 14 2.728 2.311 8.094 1.00 0.00 O ATOM 161 NE2 GLN A 14 0.832 3.470 7.777 1.00 0.00 N ATOM 0 H GLN A 14 0.806 5.118 3.067 1.00 0.00 H new ATOM 0 HA GLN A 14 2.488 2.718 3.353 1.00 0.00 H new ATOM 0 HB2 GLN A 14 1.823 4.375 5.269 1.00 0.00 H new ATOM 0 HB3 GLN A 14 0.249 3.609 5.183 1.00 0.00 H new ATOM 0 HG2 GLN A 14 1.177 1.451 5.744 1.00 0.00 H new ATOM 0 HG3 GLN A 14 2.817 2.043 5.573 1.00 0.00 H new ATOM 0 HE21 GLN A 14 0.107 3.772 7.126 1.00 0.00 H new ATOM 0 HE22 GLN A 14 0.792 3.757 8.755 1.00 0.00 H new ATOM 170 N LEU A 15 0.846 1.068 2.549 1.00 0.00 N ATOM 171 CA LEU A 15 -0.090 0.079 2.025 1.00 0.00 C ATOM 172 C LEU A 15 0.210 -1.307 2.589 1.00 0.00 C ATOM 173 O LEU A 15 1.283 -1.864 2.359 1.00 0.00 O ATOM 174 CB LEU A 15 -0.025 0.044 0.498 1.00 0.00 C ATOM 175 CG LEU A 15 -0.119 1.398 -0.209 1.00 0.00 C ATOM 176 CD1 LEU A 15 0.036 1.227 -1.712 1.00 0.00 C ATOM 177 CD2 LEU A 15 -1.439 2.080 0.119 1.00 0.00 C ATOM 0 H LEU A 15 1.820 0.766 2.552 1.00 0.00 H new ATOM 0 HA LEU A 15 -1.095 0.368 2.333 1.00 0.00 H new ATOM 0 HB2 LEU A 15 0.911 -0.432 0.205 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.833 -0.590 0.134 1.00 0.00 H new ATOM 0 HG LEU A 15 0.693 2.031 0.149 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -0.034 2.200 -2.198 1.00 0.00 H new ATOM 0 HD12 LEU A 15 1.007 0.781 -1.929 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -0.754 0.577 -2.088 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.489 3.041 -0.392 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.266 1.451 -0.211 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -1.510 2.237 1.195 1.00 0.00 H new ATOM 189 N THR A 16 -0.747 -1.859 3.329 1.00 0.00 N ATOM 190 CA THR A 16 -0.586 -3.179 3.925 1.00 0.00 C ATOM 191 C THR A 16 -0.845 -4.279 2.903 1.00 0.00 C ATOM 192 O THR A 16 -1.995 -4.588 2.587 1.00 0.00 O ATOM 193 CB THR A 16 -1.535 -3.373 5.123 1.00 0.00 C ATOM 194 OG1 THR A 16 -1.390 -2.287 6.044 1.00 0.00 O ATOM 195 CG2 THR A 16 -1.247 -4.688 5.833 1.00 0.00 C ATOM 0 H THR A 16 -1.642 -1.412 3.530 1.00 0.00 H new ATOM 0 HA THR A 16 0.445 -3.246 4.272 1.00 0.00 H new ATOM 0 HB THR A 16 -2.558 -3.396 4.748 1.00 0.00 H new ATOM 0 HG1 THR A 16 -0.582 -2.420 6.582 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.929 -4.804 6.675 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.386 -5.515 5.137 1.00 0.00 H new ATOM 0 HG23 THR A 16 -0.219 -4.688 6.196 1.00 0.00 H new ATOM 203 N ILE A 17 0.229 -4.868 2.389 1.00 0.00 N ATOM 204 CA ILE A 17 0.117 -5.935 1.403 1.00 0.00 C ATOM 205 C ILE A 17 0.216 -7.306 2.063 1.00 0.00 C ATOM 206 O ILE A 17 1.274 -7.691 2.561 1.00 0.00 O ATOM 207 CB ILE A 17 1.206 -5.819 0.320 1.00 0.00 C ATOM 208 CG1 ILE A 17 1.215 -4.410 -0.276 1.00 0.00 C ATOM 209 CG2 ILE A 17 0.985 -6.860 -0.767 1.00 0.00 C ATOM 210 CD1 ILE A 17 2.457 -4.103 -1.083 1.00 0.00 C ATOM 0 H ILE A 17 1.187 -4.624 2.639 1.00 0.00 H new ATOM 0 HA ILE A 17 -0.862 -5.829 0.935 1.00 0.00 H new ATOM 0 HB ILE A 17 2.177 -6.004 0.780 1.00 0.00 H new ATOM 0 HG12 ILE A 17 0.339 -4.288 -0.913 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.127 -3.682 0.531 1.00 0.00 H new ATOM 0 HG21 ILE A 17 1.763 -6.765 -1.525 1.00 0.00 H new ATOM 0 HG22 ILE A 17 1.025 -7.857 -0.329 1.00 0.00 H new ATOM 0 HG23 ILE A 17 0.009 -6.704 -1.227 1.00 0.00 H new ATOM 0 HD11 ILE A 17 2.395 -3.088 -1.475 1.00 0.00 H new ATOM 0 HD12 ILE A 17 3.337 -4.192 -0.445 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.536 -4.807 -1.911 1.00 0.00 H new ATOM 222 N ARG A 18 -0.892 -8.039 2.062 1.00 0.00 N ATOM 223 CA ARG A 18 -0.930 -9.368 2.660 1.00 0.00 C ATOM 224 C ARG A 18 -1.821 -10.304 1.849 1.00 0.00 C ATOM 225 O ARG A 18 -2.987 -10.002 1.594 1.00 0.00 O ATOM 226 CB ARG A 18 -1.435 -9.287 4.102 1.00 0.00 C ATOM 227 CG ARG A 18 -1.651 -10.646 4.749 1.00 0.00 C ATOM 228 CD ARG A 18 -2.634 -10.562 5.906 1.00 0.00 C ATOM 229 NE ARG A 18 -2.114 -9.755 7.008 1.00 0.00 N ATOM 230 CZ ARG A 18 -2.877 -9.239 7.964 1.00 0.00 C ATOM 231 NH1 ARG A 18 -4.187 -9.443 7.955 1.00 0.00 N ATOM 232 NH2 ARG A 18 -2.330 -8.516 8.933 1.00 0.00 N ATOM 0 H ARG A 18 -1.776 -7.735 1.654 1.00 0.00 H new ATOM 0 HA ARG A 18 0.084 -9.769 2.659 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -0.719 -8.720 4.697 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -2.373 -8.733 4.119 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -2.023 -11.350 4.004 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -0.698 -11.035 5.107 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -3.572 -10.134 5.554 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -2.857 -11.566 6.266 1.00 0.00 H new ATOM 0 HE ARG A 18 -1.110 -9.579 7.045 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -4.612 -9.998 7.212 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -4.770 -9.045 8.691 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -1.323 -8.356 8.944 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -2.917 -8.120 9.667 1.00 0.00 H new ATOM 246 N HIS A 19 -1.264 -11.442 1.447 1.00 0.00 N ATOM 247 CA HIS A 19 -2.008 -12.423 0.665 1.00 0.00 C ATOM 248 C HIS A 19 -2.441 -13.598 1.537 1.00 0.00 C ATOM 249 O HIS A 19 -1.642 -14.480 1.848 1.00 0.00 O ATOM 250 CB HIS A 19 -1.159 -12.926 -0.503 1.00 0.00 C ATOM 251 CG HIS A 19 -1.821 -14.003 -1.305 1.00 0.00 C ATOM 252 ND1 HIS A 19 -1.828 -15.328 -0.925 1.00 0.00 N ATOM 253 CD2 HIS A 19 -2.503 -13.945 -2.473 1.00 0.00 C ATOM 254 CE1 HIS A 19 -2.484 -16.039 -1.825 1.00 0.00 C ATOM 255 NE2 HIS A 19 -2.905 -15.223 -2.774 1.00 0.00 N ATOM 0 H HIS A 19 -0.300 -11.708 1.650 1.00 0.00 H new ATOM 0 HA HIS A 19 -2.901 -11.936 0.272 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -0.925 -12.087 -1.159 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -0.212 -13.302 -0.117 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -2.695 -13.058 -3.059 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -2.648 -17.106 -1.790 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -3.442 -15.497 -3.597 1.00 0.00 H new ATOM 263 N SER A 20 -3.711 -13.601 1.928 1.00 0.00 N ATOM 264 CA SER A 20 -4.250 -14.664 2.768 1.00 0.00 C ATOM 265 C SER A 20 -4.267 -15.993 2.018 1.00 0.00 C ATOM 266 O SER A 20 -4.877 -16.110 0.956 1.00 0.00 O ATOM 267 CB SER A 20 -5.663 -14.310 3.234 1.00 0.00 C ATOM 268 OG SER A 20 -5.635 -13.301 4.229 1.00 0.00 O ATOM 0 H SER A 20 -4.386 -12.879 1.677 1.00 0.00 H new ATOM 0 HA SER A 20 -3.604 -14.766 3.640 1.00 0.00 H new ATOM 0 HB2 SER A 20 -6.255 -13.970 2.384 1.00 0.00 H new ATOM 0 HB3 SER A 20 -6.153 -15.200 3.628 1.00 0.00 H new ATOM 0 HG SER A 20 -6.551 -13.092 4.509 1.00 0.00 H new ATOM 274 N SER A 21 -3.593 -16.991 2.580 1.00 0.00 N ATOM 275 CA SER A 21 -3.527 -18.311 1.963 1.00 0.00 C ATOM 276 C SER A 21 -4.881 -19.011 2.032 1.00 0.00 C ATOM 277 O SER A 21 -5.350 -19.575 1.043 1.00 0.00 O ATOM 278 CB SER A 21 -2.463 -19.167 2.653 1.00 0.00 C ATOM 279 OG SER A 21 -2.731 -19.296 4.038 1.00 0.00 O ATOM 0 H SER A 21 -3.085 -16.911 3.461 1.00 0.00 H new ATOM 0 HA SER A 21 -3.257 -18.182 0.915 1.00 0.00 H new ATOM 0 HB2 SER A 21 -2.431 -20.154 2.192 1.00 0.00 H new ATOM 0 HB3 SER A 21 -1.481 -18.717 2.510 1.00 0.00 H new ATOM 0 HG SER A 21 -2.038 -19.849 4.455 1.00 0.00 H new ATOM 285 N GLN A 22 -5.503 -18.969 3.205 1.00 0.00 N ATOM 286 CA GLN A 22 -6.803 -19.600 3.404 1.00 0.00 C ATOM 287 C GLN A 22 -7.864 -18.947 2.524 1.00 0.00 C ATOM 288 O GLN A 22 -8.634 -19.633 1.851 1.00 0.00 O ATOM 289 CB GLN A 22 -7.217 -19.512 4.873 1.00 0.00 C ATOM 290 CG GLN A 22 -8.240 -20.560 5.281 1.00 0.00 C ATOM 291 CD GLN A 22 -8.905 -20.242 6.605 1.00 0.00 C ATOM 292 OE1 GLN A 22 -8.485 -20.727 7.656 1.00 0.00 O ATOM 293 NE2 GLN A 22 -9.950 -19.423 6.562 1.00 0.00 N ATOM 0 H GLN A 22 -5.128 -18.505 4.032 1.00 0.00 H new ATOM 0 HA GLN A 22 -6.717 -20.649 3.121 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -6.331 -19.619 5.499 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -7.627 -18.521 5.067 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -9.002 -20.639 4.506 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -7.752 -21.532 5.348 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -10.264 -19.044 5.669 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -10.438 -19.173 7.422 1.00 0.00 H new ATOM 302 N ARG A 23 -7.899 -17.619 2.534 1.00 0.00 N ATOM 303 CA ARG A 23 -8.867 -16.874 1.738 1.00 0.00 C ATOM 304 C ARG A 23 -8.427 -16.797 0.279 1.00 0.00 C ATOM 305 O ARG A 23 -9.246 -16.594 -0.616 1.00 0.00 O ATOM 306 CB ARG A 23 -9.045 -15.463 2.303 1.00 0.00 C ATOM 307 CG ARG A 23 -10.111 -15.369 3.383 1.00 0.00 C ATOM 308 CD ARG A 23 -10.827 -14.028 3.344 1.00 0.00 C ATOM 309 NE ARG A 23 -11.951 -14.035 2.412 1.00 0.00 N ATOM 310 CZ ARG A 23 -13.126 -14.595 2.681 1.00 0.00 C ATOM 311 NH1 ARG A 23 -13.328 -15.190 3.849 1.00 0.00 N ATOM 312 NH2 ARG A 23 -14.101 -14.560 1.782 1.00 0.00 N ATOM 0 H ARG A 23 -7.268 -17.036 3.085 1.00 0.00 H new ATOM 0 HA ARG A 23 -9.820 -17.400 1.785 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -8.094 -15.122 2.712 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -9.303 -14.785 1.490 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -10.835 -16.173 3.252 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -9.652 -15.509 4.362 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -11.186 -13.779 4.343 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -10.122 -13.249 3.056 1.00 0.00 H new ATOM 0 HE ARG A 23 -11.828 -13.585 1.505 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -12.581 -15.218 4.543 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -14.230 -15.619 4.053 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -13.949 -14.103 0.883 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -15.002 -14.990 1.990 1.00 0.00 H new ATOM 326 N ASN A 24 -7.129 -16.961 0.048 1.00 0.00 N ATOM 327 CA ASN A 24 -6.580 -16.910 -1.302 1.00 0.00 C ATOM 328 C ASN A 24 -6.929 -15.589 -1.981 1.00 0.00 C ATOM 329 O ASN A 24 -7.372 -15.566 -3.130 1.00 0.00 O ATOM 330 CB ASN A 24 -7.109 -18.079 -2.135 1.00 0.00 C ATOM 331 CG ASN A 24 -6.868 -19.420 -1.468 1.00 0.00 C ATOM 332 OD1 ASN A 24 -7.625 -19.835 -0.591 1.00 0.00 O ATOM 333 ND2 ASN A 24 -5.807 -20.103 -1.882 1.00 0.00 N ATOM 0 H ASN A 24 -6.437 -17.130 0.778 1.00 0.00 H new ATOM 0 HA ASN A 24 -5.495 -16.986 -1.229 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -8.178 -17.947 -2.304 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -6.628 -18.071 -3.113 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -5.592 -21.011 -1.470 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -5.207 -19.720 -2.612 1.00 0.00 H new ATOM 340 N LYS A 25 -6.726 -14.489 -1.263 1.00 0.00 N ATOM 341 CA LYS A 25 -7.016 -13.163 -1.795 1.00 0.00 C ATOM 342 C LYS A 25 -5.936 -12.165 -1.389 1.00 0.00 C ATOM 343 O LYS A 25 -5.254 -12.350 -0.380 1.00 0.00 O ATOM 344 CB LYS A 25 -8.382 -12.681 -1.302 1.00 0.00 C ATOM 345 CG LYS A 25 -9.539 -13.541 -1.779 1.00 0.00 C ATOM 346 CD LYS A 25 -10.814 -12.727 -1.928 1.00 0.00 C ATOM 347 CE LYS A 25 -12.051 -13.582 -1.699 1.00 0.00 C ATOM 348 NZ LYS A 25 -13.292 -12.896 -2.156 1.00 0.00 N ATOM 0 H LYS A 25 -6.361 -14.490 -0.310 1.00 0.00 H new ATOM 0 HA LYS A 25 -7.032 -13.231 -2.883 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.380 -12.662 -0.212 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.539 -11.656 -1.638 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.284 -13.998 -2.735 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.705 -14.354 -1.072 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.805 -11.901 -1.217 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.853 -12.289 -2.925 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.942 -14.528 -2.230 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.137 -13.820 -0.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -14.113 -13.511 -1.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.410 -12.006 -1.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -13.221 -12.692 -3.173 1.00 0.00 H new ATOM 362 N LEU A 26 -5.786 -11.109 -2.180 1.00 0.00 N ATOM 363 CA LEU A 26 -4.789 -10.080 -1.902 1.00 0.00 C ATOM 364 C LEU A 26 -5.436 -8.853 -1.267 1.00 0.00 C ATOM 365 O LEU A 26 -6.085 -8.059 -1.949 1.00 0.00 O ATOM 366 CB LEU A 26 -4.066 -9.682 -3.189 1.00 0.00 C ATOM 367 CG LEU A 26 -3.038 -8.557 -3.061 1.00 0.00 C ATOM 368 CD1 LEU A 26 -1.757 -9.075 -2.424 1.00 0.00 C ATOM 369 CD2 LEU A 26 -2.747 -7.942 -4.422 1.00 0.00 C ATOM 0 H LEU A 26 -6.342 -10.942 -3.019 1.00 0.00 H new ATOM 0 HA LEU A 26 -4.065 -10.491 -1.199 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.563 -10.563 -3.587 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -4.813 -9.383 -3.924 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.454 -7.783 -2.416 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.037 -8.261 -2.341 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.977 -9.467 -1.431 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.338 -9.868 -3.043 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.013 -7.143 -4.311 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -2.352 -8.707 -5.090 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.667 -7.534 -4.841 1.00 0.00 H new ATOM 381 N ILE A 27 -5.252 -8.703 0.040 1.00 0.00 N ATOM 382 CA ILE A 27 -5.814 -7.571 0.765 1.00 0.00 C ATOM 383 C ILE A 27 -4.830 -6.408 0.818 1.00 0.00 C ATOM 384 O ILE A 27 -3.696 -6.560 1.273 1.00 0.00 O ATOM 385 CB ILE A 27 -6.208 -7.961 2.202 1.00 0.00 C ATOM 386 CG1 ILE A 27 -7.348 -8.981 2.183 1.00 0.00 C ATOM 387 CG2 ILE A 27 -6.607 -6.727 2.996 1.00 0.00 C ATOM 388 CD1 ILE A 27 -6.875 -10.417 2.138 1.00 0.00 C ATOM 0 H ILE A 27 -4.718 -9.351 0.619 1.00 0.00 H new ATOM 0 HA ILE A 27 -6.708 -7.263 0.223 1.00 0.00 H new ATOM 0 HB ILE A 27 -5.346 -8.418 2.688 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -7.967 -8.839 3.069 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -7.982 -8.789 1.317 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -6.883 -7.020 4.009 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -5.768 -6.032 3.035 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -7.457 -6.243 2.514 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -7.737 -11.084 2.127 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -6.281 -10.576 1.238 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -6.265 -10.627 3.017 1.00 0.00 H new ATOM 400 N VAL A 28 -5.271 -5.244 0.351 1.00 0.00 N ATOM 401 CA VAL A 28 -4.430 -4.053 0.348 1.00 0.00 C ATOM 402 C VAL A 28 -5.140 -2.876 1.007 1.00 0.00 C ATOM 403 O VAL A 28 -6.085 -2.317 0.450 1.00 0.00 O ATOM 404 CB VAL A 28 -4.024 -3.657 -1.084 1.00 0.00 C ATOM 405 CG1 VAL A 28 -3.179 -2.392 -1.069 1.00 0.00 C ATOM 406 CG2 VAL A 28 -3.279 -4.797 -1.761 1.00 0.00 C ATOM 0 H VAL A 28 -6.206 -5.101 -0.030 1.00 0.00 H new ATOM 0 HA VAL A 28 -3.534 -4.297 0.918 1.00 0.00 H new ATOM 0 HB VAL A 28 -4.929 -3.454 -1.657 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -2.902 -2.128 -2.089 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -3.752 -1.577 -0.626 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.277 -2.564 -0.481 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -3.000 -4.500 -2.772 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.380 -5.034 -1.191 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -3.922 -5.676 -1.806 1.00 0.00 H new ATOM 416 N VAL A 29 -4.679 -2.505 2.197 1.00 0.00 N ATOM 417 CA VAL A 29 -5.269 -1.393 2.933 1.00 0.00 C ATOM 418 C VAL A 29 -4.496 -0.101 2.690 1.00 0.00 C ATOM 419 O VAL A 29 -3.264 -0.093 2.689 1.00 0.00 O ATOM 420 CB VAL A 29 -5.309 -1.678 4.446 1.00 0.00 C ATOM 421 CG1 VAL A 29 -6.037 -0.564 5.181 1.00 0.00 C ATOM 422 CG2 VAL A 29 -5.964 -3.024 4.716 1.00 0.00 C ATOM 0 H VAL A 29 -3.899 -2.958 2.672 1.00 0.00 H new ATOM 0 HA VAL A 29 -6.289 -1.277 2.566 1.00 0.00 H new ATOM 0 HB VAL A 29 -4.285 -1.716 4.818 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.055 -0.783 6.249 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.520 0.381 5.013 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -7.059 -0.490 4.809 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -5.984 -3.210 5.790 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -6.983 -3.017 4.330 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -5.395 -3.811 4.222 1.00 0.00 H new ATOM 432 N VAL A 30 -5.226 0.990 2.486 1.00 0.00 N ATOM 433 CA VAL A 30 -4.609 2.289 2.244 1.00 0.00 C ATOM 434 C VAL A 30 -4.957 3.277 3.351 1.00 0.00 C ATOM 435 O VAL A 30 -5.976 3.966 3.286 1.00 0.00 O ATOM 436 CB VAL A 30 -5.049 2.876 0.890 1.00 0.00 C ATOM 437 CG1 VAL A 30 -4.369 4.213 0.641 1.00 0.00 C ATOM 438 CG2 VAL A 30 -4.750 1.898 -0.237 1.00 0.00 C ATOM 0 H VAL A 30 -6.246 1.001 2.483 1.00 0.00 H new ATOM 0 HA VAL A 30 -3.531 2.129 2.229 1.00 0.00 H new ATOM 0 HB VAL A 30 -6.126 3.043 0.919 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -4.692 4.612 -0.320 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -4.639 4.911 1.433 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -3.288 4.075 0.631 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -5.067 2.329 -1.187 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.679 1.697 -0.270 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.289 0.967 -0.063 1.00 0.00 H new ATOM 448 N HIS A 31 -4.104 3.343 4.368 1.00 0.00 N ATOM 449 CA HIS A 31 -4.321 4.249 5.491 1.00 0.00 C ATOM 450 C HIS A 31 -4.443 5.691 5.009 1.00 0.00 C ATOM 451 O HIS A 31 -5.530 6.268 5.017 1.00 0.00 O ATOM 452 CB HIS A 31 -3.175 4.131 6.497 1.00 0.00 C ATOM 453 CG HIS A 31 -3.057 2.771 7.113 1.00 0.00 C ATOM 454 ND1 HIS A 31 -3.833 2.356 8.174 1.00 0.00 N ATOM 455 CD2 HIS A 31 -2.248 1.729 6.810 1.00 0.00 C ATOM 456 CE1 HIS A 31 -3.505 1.117 8.499 1.00 0.00 C ATOM 457 NE2 HIS A 31 -2.546 0.714 7.685 1.00 0.00 N ATOM 0 H HIS A 31 -3.256 2.780 4.438 1.00 0.00 H new ATOM 0 HA HIS A 31 -5.254 3.967 5.979 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -2.238 4.378 5.998 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -3.319 4.868 7.287 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -1.506 1.701 6.026 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -3.946 0.534 9.294 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -2.099 -0.203 7.704 1.00 0.00 H new ATOM 465 N ALA A 32 -3.322 6.268 4.590 1.00 0.00 N ATOM 466 CA ALA A 32 -3.304 7.642 4.104 1.00 0.00 C ATOM 467 C ALA A 32 -1.945 7.997 3.511 1.00 0.00 C ATOM 468 O ALA A 32 -0.946 7.329 3.780 1.00 0.00 O ATOM 469 CB ALA A 32 -3.659 8.604 5.228 1.00 0.00 C ATOM 0 H ALA A 32 -2.413 5.805 4.577 1.00 0.00 H new ATOM 0 HA ALA A 32 -4.050 7.732 3.314 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -3.642 9.627 4.851 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -4.656 8.373 5.604 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -2.934 8.503 6.036 1.00 0.00 H new ATOM 475 N CYS A 33 -1.915 9.051 2.702 1.00 0.00 N ATOM 476 CA CYS A 33 -0.678 9.493 2.069 1.00 0.00 C ATOM 477 C CYS A 33 -0.257 10.862 2.595 1.00 0.00 C ATOM 478 O CYS A 33 -1.090 11.644 3.054 1.00 0.00 O ATOM 479 CB CYS A 33 -0.849 9.548 0.550 1.00 0.00 C ATOM 480 SG CYS A 33 -1.693 8.110 -0.149 1.00 0.00 S ATOM 0 H CYS A 33 -2.733 9.615 2.469 1.00 0.00 H new ATOM 0 HA CYS A 33 0.103 8.773 2.314 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -1.409 10.446 0.290 1.00 0.00 H new ATOM 0 HB3 CYS A 33 0.134 9.640 0.087 1.00 0.00 H new ATOM 0 HG CYS A 33 -1.792 8.249 -1.438 1.00 0.00 H new ATOM 486 N ARG A 34 1.040 11.143 2.527 1.00 0.00 N ATOM 487 CA ARG A 34 1.571 12.416 2.999 1.00 0.00 C ATOM 488 C ARG A 34 2.699 12.904 2.095 1.00 0.00 C ATOM 489 O ARG A 34 3.123 12.199 1.180 1.00 0.00 O ATOM 490 CB ARG A 34 2.078 12.280 4.436 1.00 0.00 C ATOM 491 CG ARG A 34 3.423 11.580 4.544 1.00 0.00 C ATOM 492 CD ARG A 34 3.653 11.027 5.941 1.00 0.00 C ATOM 493 NE ARG A 34 4.551 9.875 5.933 1.00 0.00 N ATOM 494 CZ ARG A 34 5.179 9.426 7.014 1.00 0.00 C ATOM 495 NH1 ARG A 34 5.009 10.028 8.183 1.00 0.00 N ATOM 496 NH2 ARG A 34 5.980 8.372 6.927 1.00 0.00 N ATOM 0 H ARG A 34 1.742 10.507 2.150 1.00 0.00 H new ATOM 0 HA ARG A 34 0.765 13.149 2.973 1.00 0.00 H new ATOM 0 HB2 ARG A 34 2.158 13.272 4.879 1.00 0.00 H new ATOM 0 HB3 ARG A 34 1.343 11.728 5.021 1.00 0.00 H new ATOM 0 HG2 ARG A 34 3.471 10.768 3.818 1.00 0.00 H new ATOM 0 HG3 ARG A 34 4.220 12.280 4.293 1.00 0.00 H new ATOM 0 HD2 ARG A 34 4.071 11.808 6.576 1.00 0.00 H new ATOM 0 HD3 ARG A 34 2.697 10.739 6.379 1.00 0.00 H new ATOM 0 HE ARG A 34 4.704 9.389 5.049 1.00 0.00 H new ATOM 0 HH11 ARG A 34 4.394 10.839 8.254 1.00 0.00 H new ATOM 0 HH12 ARG A 34 5.493 9.680 9.011 1.00 0.00 H new ATOM 0 HH21 ARG A 34 6.114 7.906 6.030 1.00 0.00 H new ATOM 0 HH22 ARG A 34 6.462 8.028 7.757 1.00 0.00 H new ATOM 510 N ASN A 35 3.180 14.115 2.357 1.00 0.00 N ATOM 511 CA ASN A 35 4.257 14.697 1.566 1.00 0.00 C ATOM 512 C ASN A 35 3.929 14.645 0.077 1.00 0.00 C ATOM 513 O ASN A 35 4.747 14.211 -0.736 1.00 0.00 O ATOM 514 CB ASN A 35 5.571 13.961 1.836 1.00 0.00 C ATOM 515 CG ASN A 35 6.054 14.144 3.262 1.00 0.00 C ATOM 516 OD1 ASN A 35 5.723 15.131 3.919 1.00 0.00 O ATOM 517 ND2 ASN A 35 6.840 13.190 3.747 1.00 0.00 N ATOM 0 H ASN A 35 2.841 14.712 3.111 1.00 0.00 H new ATOM 0 HA ASN A 35 4.366 15.741 1.859 1.00 0.00 H new ATOM 0 HB2 ASN A 35 5.437 12.898 1.634 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.335 14.322 1.147 1.00 0.00 H new ATOM 0 HD21 ASN A 35 7.195 13.258 4.701 1.00 0.00 H new ATOM 0 HD22 ASN A 35 7.088 12.389 3.166 1.00 0.00 H new ATOM 524 N LEU A 36 2.728 15.090 -0.274 1.00 0.00 N ATOM 525 CA LEU A 36 2.290 15.095 -1.666 1.00 0.00 C ATOM 526 C LEU A 36 2.227 16.518 -2.212 1.00 0.00 C ATOM 527 O LEU A 36 1.189 17.177 -2.134 1.00 0.00 O ATOM 528 CB LEU A 36 0.920 14.426 -1.793 1.00 0.00 C ATOM 529 CG LEU A 36 0.879 12.922 -1.520 1.00 0.00 C ATOM 530 CD1 LEU A 36 -0.558 12.436 -1.421 1.00 0.00 C ATOM 531 CD2 LEU A 36 1.627 12.163 -2.606 1.00 0.00 C ATOM 0 H LEU A 36 2.040 15.452 0.386 1.00 0.00 H new ATOM 0 HA LEU A 36 3.017 14.533 -2.252 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.232 14.919 -1.105 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.544 14.602 -2.801 1.00 0.00 H new ATOM 0 HG LEU A 36 1.371 12.732 -0.566 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -0.567 11.364 -1.227 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.063 12.957 -0.607 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.076 12.639 -2.358 1.00 0.00 H new ATOM 0 HD21 LEU A 36 1.588 11.094 -2.396 1.00 0.00 H new ATOM 0 HD22 LEU A 36 1.164 12.360 -3.573 1.00 0.00 H new ATOM 0 HD23 LEU A 36 2.666 12.490 -2.629 1.00 0.00 H new ATOM 543 N ILE A 37 3.341 16.984 -2.765 1.00 0.00 N ATOM 544 CA ILE A 37 3.410 18.327 -3.327 1.00 0.00 C ATOM 545 C ILE A 37 2.203 18.615 -4.213 1.00 0.00 C ATOM 546 O ILE A 37 1.595 17.701 -4.768 1.00 0.00 O ATOM 547 CB ILE A 37 4.697 18.527 -4.151 1.00 0.00 C ATOM 548 CG1 ILE A 37 4.747 17.529 -5.309 1.00 0.00 C ATOM 549 CG2 ILE A 37 5.923 18.378 -3.262 1.00 0.00 C ATOM 550 CD1 ILE A 37 4.109 18.045 -6.580 1.00 0.00 C ATOM 0 H ILE A 37 4.208 16.452 -2.836 1.00 0.00 H new ATOM 0 HA ILE A 37 3.414 19.021 -2.486 1.00 0.00 H new ATOM 0 HB ILE A 37 4.693 19.535 -4.565 1.00 0.00 H new ATOM 0 HG12 ILE A 37 5.787 17.273 -5.512 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.245 16.610 -5.007 1.00 0.00 H new ATOM 0 HG21 ILE A 37 6.824 18.522 -3.858 1.00 0.00 H new ATOM 0 HG22 ILE A 37 5.890 19.124 -2.468 1.00 0.00 H new ATOM 0 HG23 ILE A 37 5.934 17.381 -2.822 1.00 0.00 H new ATOM 0 HD11 ILE A 37 4.181 17.285 -7.358 1.00 0.00 H new ATOM 0 HD12 ILE A 37 3.060 18.275 -6.393 1.00 0.00 H new ATOM 0 HD13 ILE A 37 4.626 18.948 -6.906 1.00 0.00 H new ATOM 562 N ALA A 38 1.863 19.893 -4.342 1.00 0.00 N ATOM 563 CA ALA A 38 0.730 20.303 -5.163 1.00 0.00 C ATOM 564 C ALA A 38 1.198 21.028 -6.421 1.00 0.00 C ATOM 565 O ALA A 38 2.113 21.851 -6.371 1.00 0.00 O ATOM 566 CB ALA A 38 -0.211 21.189 -4.361 1.00 0.00 C ATOM 0 H ALA A 38 2.356 20.662 -3.889 1.00 0.00 H new ATOM 0 HA ALA A 38 0.192 19.406 -5.470 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -1.052 21.487 -4.987 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -0.580 20.638 -3.496 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.324 22.077 -4.025 1.00 0.00 H new ATOM 572 N PHE A 39 0.567 20.716 -7.547 1.00 0.00 N ATOM 573 CA PHE A 39 0.920 21.337 -8.819 1.00 0.00 C ATOM 574 C PHE A 39 0.682 22.843 -8.774 1.00 0.00 C ATOM 575 O PHE A 39 1.265 23.598 -9.552 1.00 0.00 O ATOM 576 CB PHE A 39 0.108 20.715 -9.957 1.00 0.00 C ATOM 577 CG PHE A 39 0.825 20.720 -11.277 1.00 0.00 C ATOM 578 CD1 PHE A 39 0.965 21.894 -11.999 1.00 0.00 C ATOM 579 CD2 PHE A 39 1.358 19.551 -11.795 1.00 0.00 C ATOM 580 CE1 PHE A 39 1.623 21.902 -13.215 1.00 0.00 C ATOM 581 CE2 PHE A 39 2.018 19.553 -13.010 1.00 0.00 C ATOM 582 CZ PHE A 39 2.152 20.730 -13.720 1.00 0.00 C ATOM 0 H PHE A 39 -0.192 20.037 -7.606 1.00 0.00 H new ATOM 0 HA PHE A 39 1.980 21.160 -8.999 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -0.144 19.688 -9.693 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -0.832 21.257 -10.061 1.00 0.00 H new ATOM 0 HD1 PHE A 39 0.555 22.813 -11.608 1.00 0.00 H new ATOM 0 HD2 PHE A 39 1.257 18.628 -11.244 1.00 0.00 H new ATOM 0 HE1 PHE A 39 1.723 22.823 -13.769 1.00 0.00 H new ATOM 0 HE2 PHE A 39 2.428 18.635 -13.404 1.00 0.00 H new ATOM 0 HZ PHE A 39 2.669 20.734 -14.668 1.00 0.00 H new ATOM 592 N SER A 40 -0.179 23.273 -7.857 1.00 0.00 N ATOM 593 CA SER A 40 -0.498 24.688 -7.712 1.00 0.00 C ATOM 594 C SER A 40 -1.045 24.982 -6.318 1.00 0.00 C ATOM 595 O SER A 40 -2.039 24.395 -5.894 1.00 0.00 O ATOM 596 CB SER A 40 -1.516 25.115 -8.771 1.00 0.00 C ATOM 597 OG SER A 40 -1.480 26.516 -8.979 1.00 0.00 O ATOM 0 H SER A 40 -0.668 22.661 -7.203 1.00 0.00 H new ATOM 0 HA SER A 40 0.421 25.257 -7.851 1.00 0.00 H new ATOM 0 HB2 SER A 40 -1.307 24.600 -9.709 1.00 0.00 H new ATOM 0 HB3 SER A 40 -2.517 24.816 -8.459 1.00 0.00 H new ATOM 0 HG SER A 40 -2.386 26.882 -8.899 1.00 0.00 H new ATOM 603 N GLU A 41 -0.386 25.895 -5.611 1.00 0.00 N ATOM 604 CA GLU A 41 -0.805 26.266 -4.264 1.00 0.00 C ATOM 605 C GLU A 41 -2.326 26.249 -4.144 1.00 0.00 C ATOM 606 O GLU A 41 -2.875 25.755 -3.159 1.00 0.00 O ATOM 607 CB GLU A 41 -0.270 27.654 -3.904 1.00 0.00 C ATOM 608 CG GLU A 41 -0.362 27.976 -2.422 1.00 0.00 C ATOM 609 CD GLU A 41 0.110 26.832 -1.546 1.00 0.00 C ATOM 610 OE1 GLU A 41 1.294 26.450 -1.656 1.00 0.00 O ATOM 611 OE2 GLU A 41 -0.704 26.321 -0.749 1.00 0.00 O ATOM 0 H GLU A 41 0.439 26.391 -5.948 1.00 0.00 H new ATOM 0 HA GLU A 41 -0.394 25.534 -3.568 1.00 0.00 H new ATOM 0 HB2 GLU A 41 0.771 27.726 -4.219 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -0.825 28.405 -4.466 1.00 0.00 H new ATOM 0 HG2 GLU A 41 0.236 28.862 -2.209 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -1.394 28.219 -2.170 1.00 0.00 H new ATOM 618 N ASP A 42 -3.000 26.791 -5.152 1.00 0.00 N ATOM 619 CA ASP A 42 -4.457 26.838 -5.160 1.00 0.00 C ATOM 620 C ASP A 42 -5.044 25.589 -4.509 1.00 0.00 C ATOM 621 O ASP A 42 -5.923 25.678 -3.653 1.00 0.00 O ATOM 622 CB ASP A 42 -4.976 26.974 -6.592 1.00 0.00 C ATOM 623 CG ASP A 42 -4.327 28.124 -7.337 1.00 0.00 C ATOM 624 OD1 ASP A 42 -4.355 29.258 -6.815 1.00 0.00 O ATOM 625 OD2 ASP A 42 -3.792 27.890 -8.441 1.00 0.00 O ATOM 0 H ASP A 42 -2.560 27.204 -5.974 1.00 0.00 H new ATOM 0 HA ASP A 42 -4.772 27.708 -4.584 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -4.792 26.045 -7.132 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -6.056 27.122 -6.571 1.00 0.00 H new ATOM 630 N GLY A 43 -4.553 24.425 -4.924 1.00 0.00 N ATOM 631 CA GLY A 43 -5.042 23.175 -4.372 1.00 0.00 C ATOM 632 C GLY A 43 -5.008 22.043 -5.380 1.00 0.00 C ATOM 633 O GLY A 43 -5.371 22.227 -6.542 1.00 0.00 O ATOM 0 H GLY A 43 -3.826 24.325 -5.632 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -4.439 22.904 -3.505 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -6.064 23.312 -4.019 1.00 0.00 H new ATOM 637 N SER A 44 -4.569 20.870 -4.935 1.00 0.00 N ATOM 638 CA SER A 44 -4.483 19.705 -5.809 1.00 0.00 C ATOM 639 C SER A 44 -5.438 18.609 -5.347 1.00 0.00 C ATOM 640 O SER A 44 -5.813 18.550 -4.176 1.00 0.00 O ATOM 641 CB SER A 44 -3.051 19.170 -5.840 1.00 0.00 C ATOM 642 OG SER A 44 -2.816 18.276 -4.766 1.00 0.00 O ATOM 0 H SER A 44 -4.268 20.701 -3.975 1.00 0.00 H new ATOM 0 HA SER A 44 -4.770 20.013 -6.815 1.00 0.00 H new ATOM 0 HB2 SER A 44 -2.870 18.661 -6.787 1.00 0.00 H new ATOM 0 HB3 SER A 44 -2.348 20.001 -5.786 1.00 0.00 H new ATOM 0 HG SER A 44 -1.894 17.947 -4.810 1.00 0.00 H new ATOM 648 N ASP A 45 -5.827 17.742 -6.276 1.00 0.00 N ATOM 649 CA ASP A 45 -6.738 16.646 -5.965 1.00 0.00 C ATOM 650 C ASP A 45 -6.025 15.302 -6.070 1.00 0.00 C ATOM 651 O ASP A 45 -6.125 14.595 -7.073 1.00 0.00 O ATOM 652 CB ASP A 45 -7.942 16.674 -6.907 1.00 0.00 C ATOM 653 CG ASP A 45 -8.361 18.084 -7.271 1.00 0.00 C ATOM 654 OD1 ASP A 45 -8.147 18.998 -6.447 1.00 0.00 O ATOM 655 OD2 ASP A 45 -8.901 18.275 -8.380 1.00 0.00 O ATOM 0 H ASP A 45 -5.526 17.777 -7.250 1.00 0.00 H new ATOM 0 HA ASP A 45 -7.086 16.773 -4.940 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -7.701 16.124 -7.817 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -8.780 16.160 -6.436 1.00 0.00 H new ATOM 660 N PRO A 46 -5.286 14.939 -5.011 1.00 0.00 N ATOM 661 CA PRO A 46 -4.542 13.677 -4.960 1.00 0.00 C ATOM 662 C PRO A 46 -5.461 12.465 -4.858 1.00 0.00 C ATOM 663 O PRO A 46 -6.434 12.474 -4.103 1.00 0.00 O ATOM 664 CB PRO A 46 -3.696 13.815 -3.692 1.00 0.00 C ATOM 665 CG PRO A 46 -4.449 14.775 -2.837 1.00 0.00 C ATOM 666 CD PRO A 46 -5.122 15.732 -3.781 1.00 0.00 C ATOM 0 HA PRO A 46 -3.956 13.513 -5.864 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -3.571 12.854 -3.193 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -2.698 14.188 -3.921 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -5.182 14.256 -2.220 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -3.778 15.303 -2.159 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -6.081 16.073 -3.392 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -4.514 16.620 -3.954 1.00 0.00 H new ATOM 674 N TYR A 47 -5.147 11.424 -5.620 1.00 0.00 N ATOM 675 CA TYR A 47 -5.946 10.205 -5.616 1.00 0.00 C ATOM 676 C TYR A 47 -5.069 8.977 -5.844 1.00 0.00 C ATOM 677 O TYR A 47 -4.199 8.974 -6.714 1.00 0.00 O ATOM 678 CB TYR A 47 -7.031 10.277 -6.693 1.00 0.00 C ATOM 679 CG TYR A 47 -6.534 9.924 -8.077 1.00 0.00 C ATOM 680 CD1 TYR A 47 -5.934 10.881 -8.886 1.00 0.00 C ATOM 681 CD2 TYR A 47 -6.664 8.633 -8.575 1.00 0.00 C ATOM 682 CE1 TYR A 47 -5.480 10.562 -10.151 1.00 0.00 C ATOM 683 CE2 TYR A 47 -6.212 8.306 -9.838 1.00 0.00 C ATOM 684 CZ TYR A 47 -5.621 9.274 -10.623 1.00 0.00 C ATOM 685 OH TYR A 47 -5.168 8.953 -11.882 1.00 0.00 O ATOM 0 H TYR A 47 -4.344 11.400 -6.249 1.00 0.00 H new ATOM 0 HA TYR A 47 -6.419 10.115 -4.638 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.843 9.602 -6.424 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -7.447 11.284 -6.711 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -5.821 11.891 -8.520 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -7.127 7.872 -7.963 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -5.017 11.318 -10.768 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -6.321 7.298 -10.209 1.00 0.00 H new ATOM 0 HH TYR A 47 -5.343 8.005 -12.061 1.00 0.00 H new ATOM 695 N VAL A 48 -5.306 7.934 -5.054 1.00 0.00 N ATOM 696 CA VAL A 48 -4.540 6.699 -5.169 1.00 0.00 C ATOM 697 C VAL A 48 -5.169 5.755 -6.188 1.00 0.00 C ATOM 698 O VAL A 48 -6.392 5.643 -6.274 1.00 0.00 O ATOM 699 CB VAL A 48 -4.435 5.976 -3.813 1.00 0.00 C ATOM 700 CG1 VAL A 48 -3.673 4.668 -3.963 1.00 0.00 C ATOM 701 CG2 VAL A 48 -3.770 6.874 -2.781 1.00 0.00 C ATOM 0 H VAL A 48 -6.022 7.920 -4.328 1.00 0.00 H new ATOM 0 HA VAL A 48 -3.540 6.976 -5.503 1.00 0.00 H new ATOM 0 HB VAL A 48 -5.442 5.745 -3.465 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.609 4.171 -2.995 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -4.195 4.022 -4.669 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -2.668 4.873 -4.333 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.704 6.347 -1.829 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.768 7.138 -3.120 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.361 7.781 -2.654 1.00 0.00 H new ATOM 711 N ARG A 49 -4.324 5.078 -6.959 1.00 0.00 N ATOM 712 CA ARG A 49 -4.797 4.144 -7.974 1.00 0.00 C ATOM 713 C ARG A 49 -4.060 2.812 -7.872 1.00 0.00 C ATOM 714 O ARG A 49 -2.831 2.774 -7.816 1.00 0.00 O ATOM 715 CB ARG A 49 -4.609 4.737 -9.371 1.00 0.00 C ATOM 716 CG ARG A 49 -4.889 3.752 -10.494 1.00 0.00 C ATOM 717 CD ARG A 49 -4.098 4.096 -11.747 1.00 0.00 C ATOM 718 NE ARG A 49 -4.726 5.170 -12.512 1.00 0.00 N ATOM 719 CZ ARG A 49 -4.474 5.402 -13.796 1.00 0.00 C ATOM 720 NH1 ARG A 49 -3.611 4.639 -14.454 1.00 0.00 N ATOM 721 NH2 ARG A 49 -5.085 6.398 -14.424 1.00 0.00 N ATOM 0 H ARG A 49 -3.309 5.159 -6.900 1.00 0.00 H new ATOM 0 HA ARG A 49 -5.859 3.967 -7.802 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -5.267 5.598 -9.482 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -3.587 5.103 -9.467 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -4.634 2.744 -10.167 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -5.955 3.753 -10.723 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -3.087 4.393 -11.468 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -4.008 3.209 -12.374 1.00 0.00 H new ATOM 0 HE ARG A 49 -5.394 5.775 -12.035 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -3.139 3.872 -13.974 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -3.419 4.819 -15.440 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -5.749 6.987 -13.921 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -4.891 6.575 -15.410 1.00 0.00 H new ATOM 735 N MET A 50 -4.819 1.721 -7.848 1.00 0.00 N ATOM 736 CA MET A 50 -4.238 0.388 -7.754 1.00 0.00 C ATOM 737 C MET A 50 -4.486 -0.406 -9.033 1.00 0.00 C ATOM 738 O MET A 50 -5.477 -0.183 -9.730 1.00 0.00 O ATOM 739 CB MET A 50 -4.819 -0.362 -6.554 1.00 0.00 C ATOM 740 CG MET A 50 -4.318 0.153 -5.214 1.00 0.00 C ATOM 741 SD MET A 50 -4.650 -0.992 -3.861 1.00 0.00 S ATOM 742 CE MET A 50 -6.348 -0.575 -3.474 1.00 0.00 C ATOM 0 H MET A 50 -5.838 1.735 -7.892 1.00 0.00 H new ATOM 0 HA MET A 50 -3.162 0.498 -7.619 1.00 0.00 H new ATOM 0 HB2 MET A 50 -5.906 -0.285 -6.580 1.00 0.00 H new ATOM 0 HB3 MET A 50 -4.572 -1.420 -6.643 1.00 0.00 H new ATOM 0 HG2 MET A 50 -3.245 0.334 -5.277 1.00 0.00 H new ATOM 0 HG3 MET A 50 -4.790 1.111 -4.998 1.00 0.00 H new ATOM 0 HE1 MET A 50 -6.390 -0.089 -2.499 1.00 0.00 H new ATOM 0 HE2 MET A 50 -6.739 0.101 -4.234 1.00 0.00 H new ATOM 0 HE3 MET A 50 -6.950 -1.483 -3.452 1.00 0.00 H new ATOM 752 N TYR A 51 -3.583 -1.331 -9.335 1.00 0.00 N ATOM 753 CA TYR A 51 -3.703 -2.155 -10.532 1.00 0.00 C ATOM 754 C TYR A 51 -2.902 -3.446 -10.387 1.00 0.00 C ATOM 755 O TYR A 51 -1.706 -3.419 -10.095 1.00 0.00 O ATOM 756 CB TYR A 51 -3.225 -1.380 -11.761 1.00 0.00 C ATOM 757 CG TYR A 51 -4.323 -0.604 -12.452 1.00 0.00 C ATOM 758 CD1 TYR A 51 -4.670 0.673 -12.029 1.00 0.00 C ATOM 759 CD2 TYR A 51 -5.014 -1.148 -13.527 1.00 0.00 C ATOM 760 CE1 TYR A 51 -5.674 1.386 -12.657 1.00 0.00 C ATOM 761 CE2 TYR A 51 -6.018 -0.442 -14.162 1.00 0.00 C ATOM 762 CZ TYR A 51 -6.344 0.824 -13.723 1.00 0.00 C ATOM 763 OH TYR A 51 -7.344 1.530 -14.352 1.00 0.00 O ATOM 0 H TYR A 51 -2.759 -1.530 -8.767 1.00 0.00 H new ATOM 0 HA TYR A 51 -4.754 -2.413 -10.660 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -2.437 -0.689 -11.461 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -2.783 -2.079 -12.471 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -4.146 1.116 -11.195 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -4.762 -2.140 -13.873 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -5.932 2.377 -12.315 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -6.544 -0.879 -14.997 1.00 0.00 H new ATOM 0 HH TYR A 51 -7.714 0.993 -15.083 1.00 0.00 H new ATOM 773 N LEU A 52 -3.570 -4.575 -10.595 1.00 0.00 N ATOM 774 CA LEU A 52 -2.922 -5.877 -10.490 1.00 0.00 C ATOM 775 C LEU A 52 -2.245 -6.257 -11.803 1.00 0.00 C ATOM 776 O LEU A 52 -2.791 -7.026 -12.595 1.00 0.00 O ATOM 777 CB LEU A 52 -3.944 -6.947 -10.101 1.00 0.00 C ATOM 778 CG LEU A 52 -3.371 -8.299 -9.674 1.00 0.00 C ATOM 779 CD1 LEU A 52 -2.584 -8.161 -8.380 1.00 0.00 C ATOM 780 CD2 LEU A 52 -4.484 -9.325 -9.517 1.00 0.00 C ATOM 0 H LEU A 52 -4.560 -4.615 -10.837 1.00 0.00 H new ATOM 0 HA LEU A 52 -2.158 -5.814 -9.715 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -4.553 -6.559 -9.285 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -4.611 -7.109 -10.948 1.00 0.00 H new ATOM 0 HG LEU A 52 -2.692 -8.646 -10.453 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -2.184 -9.133 -8.092 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -1.763 -7.460 -8.527 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -3.241 -7.791 -7.593 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -4.057 -10.281 -9.213 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -5.189 -8.984 -8.758 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.004 -9.446 -10.467 1.00 0.00 H new ATOM 792 N LEU A 53 -1.053 -5.715 -12.026 1.00 0.00 N ATOM 793 CA LEU A 53 -0.299 -5.999 -13.243 1.00 0.00 C ATOM 794 C LEU A 53 0.036 -7.484 -13.342 1.00 0.00 C ATOM 795 O LEU A 53 0.121 -8.194 -12.340 1.00 0.00 O ATOM 796 CB LEU A 53 0.986 -5.171 -13.274 1.00 0.00 C ATOM 797 CG LEU A 53 0.815 -3.676 -13.546 1.00 0.00 C ATOM 798 CD1 LEU A 53 0.539 -3.429 -15.021 1.00 0.00 C ATOM 799 CD2 LEU A 53 -0.303 -3.103 -12.688 1.00 0.00 C ATOM 0 H LEU A 53 -0.588 -5.077 -11.381 1.00 0.00 H new ATOM 0 HA LEU A 53 -0.919 -5.728 -14.097 1.00 0.00 H new ATOM 0 HB2 LEU A 53 1.494 -5.290 -12.317 1.00 0.00 H new ATOM 0 HB3 LEU A 53 1.644 -5.586 -14.038 1.00 0.00 H new ATOM 0 HG LEU A 53 1.744 -3.170 -13.283 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.420 -2.360 -15.195 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.373 -3.803 -15.615 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.375 -3.948 -15.312 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.411 -2.038 -12.894 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -1.238 -3.614 -12.919 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -0.063 -3.246 -11.634 1.00 0.00 H new ATOM 811 N PRO A 54 0.232 -7.965 -14.578 1.00 0.00 N ATOM 812 CA PRO A 54 0.133 -7.129 -15.778 1.00 0.00 C ATOM 813 C PRO A 54 -1.302 -6.699 -16.068 1.00 0.00 C ATOM 814 O PRO A 54 -1.578 -5.515 -16.261 1.00 0.00 O ATOM 815 CB PRO A 54 0.652 -8.042 -16.892 1.00 0.00 C ATOM 816 CG PRO A 54 0.404 -9.424 -16.394 1.00 0.00 C ATOM 817 CD PRO A 54 0.567 -9.362 -14.901 1.00 0.00 C ATOM 0 HA PRO A 54 0.694 -6.200 -15.674 1.00 0.00 H new ATOM 0 HB2 PRO A 54 0.128 -7.859 -17.830 1.00 0.00 H new ATOM 0 HB3 PRO A 54 1.712 -7.873 -17.081 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -0.597 -9.762 -16.664 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.108 -10.130 -16.834 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -0.098 -10.062 -14.395 1.00 0.00 H new ATOM 0 HD3 PRO A 54 1.584 -9.612 -14.597 1.00 0.00 H new ATOM 825 N ASP A 55 -2.210 -7.667 -16.096 1.00 0.00 N ATOM 826 CA ASP A 55 -3.617 -7.389 -16.360 1.00 0.00 C ATOM 827 C ASP A 55 -4.065 -6.121 -15.639 1.00 0.00 C ATOM 828 O ASP A 55 -3.663 -5.864 -14.504 1.00 0.00 O ATOM 829 CB ASP A 55 -4.484 -8.571 -15.924 1.00 0.00 C ATOM 830 CG ASP A 55 -5.767 -8.674 -16.725 1.00 0.00 C ATOM 831 OD1 ASP A 55 -5.780 -8.217 -17.887 1.00 0.00 O ATOM 832 OD2 ASP A 55 -6.759 -9.211 -16.189 1.00 0.00 O ATOM 0 H ASP A 55 -1.997 -8.652 -15.939 1.00 0.00 H new ATOM 0 HA ASP A 55 -3.736 -7.238 -17.433 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.916 -9.495 -16.033 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -4.727 -8.469 -14.866 1.00 0.00 H new ATOM 837 N LYS A 56 -4.899 -5.330 -16.305 1.00 0.00 N ATOM 838 CA LYS A 56 -5.402 -4.089 -15.729 1.00 0.00 C ATOM 839 C LYS A 56 -6.921 -4.010 -15.850 1.00 0.00 C ATOM 840 O LYS A 56 -7.499 -2.924 -15.818 1.00 0.00 O ATOM 841 CB LYS A 56 -4.761 -2.885 -16.422 1.00 0.00 C ATOM 842 CG LYS A 56 -3.253 -2.996 -16.564 1.00 0.00 C ATOM 843 CD LYS A 56 -2.863 -3.615 -17.896 1.00 0.00 C ATOM 844 CE LYS A 56 -1.467 -3.185 -18.323 1.00 0.00 C ATOM 845 NZ LYS A 56 -0.907 -4.081 -19.372 1.00 0.00 N ATOM 0 H LYS A 56 -5.241 -5.527 -17.246 1.00 0.00 H new ATOM 0 HA LYS A 56 -5.138 -4.075 -14.672 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -5.203 -2.768 -17.412 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -4.999 -1.983 -15.858 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -2.804 -2.006 -16.476 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -2.853 -3.600 -15.750 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -2.903 -4.702 -17.819 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -3.584 -3.323 -18.659 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -1.501 -2.163 -18.699 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -0.806 -3.184 -17.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 0.045 -3.754 -19.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -0.850 -5.052 -19.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -1.524 -4.063 -20.209 1.00 0.00 H new ATOM 859 N ARG A 57 -7.560 -5.167 -15.988 1.00 0.00 N ATOM 860 CA ARG A 57 -9.011 -5.228 -16.113 1.00 0.00 C ATOM 861 C ARG A 57 -9.675 -4.136 -15.278 1.00 0.00 C ATOM 862 O ARG A 57 -9.151 -3.729 -14.241 1.00 0.00 O ATOM 863 CB ARG A 57 -9.525 -6.601 -15.677 1.00 0.00 C ATOM 864 CG ARG A 57 -9.468 -7.650 -16.776 1.00 0.00 C ATOM 865 CD ARG A 57 -10.754 -7.677 -17.587 1.00 0.00 C ATOM 866 NE ARG A 57 -10.909 -8.927 -18.325 1.00 0.00 N ATOM 867 CZ ARG A 57 -12.079 -9.388 -18.753 1.00 0.00 C ATOM 868 NH1 ARG A 57 -13.191 -8.704 -18.518 1.00 0.00 N ATOM 869 NH2 ARG A 57 -12.139 -10.534 -19.419 1.00 0.00 N ATOM 0 H ARG A 57 -7.096 -6.075 -16.016 1.00 0.00 H new ATOM 0 HA ARG A 57 -9.267 -5.068 -17.160 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -8.938 -6.946 -14.826 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -10.555 -6.502 -15.334 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -8.625 -7.443 -17.435 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -9.294 -8.632 -16.335 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -11.606 -7.541 -16.921 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -10.760 -6.840 -18.286 1.00 0.00 H new ATOM 0 HE ARG A 57 -10.073 -9.477 -18.523 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -13.149 -7.822 -18.008 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -14.088 -9.060 -18.848 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -11.286 -11.062 -19.603 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -13.038 -10.887 -19.747 1.00 0.00 H new ATOM 883 N ARG A 58 -10.830 -3.666 -15.739 1.00 0.00 N ATOM 884 CA ARG A 58 -11.564 -2.621 -15.036 1.00 0.00 C ATOM 885 C ARG A 58 -12.138 -3.148 -13.724 1.00 0.00 C ATOM 886 O ARG A 58 -11.868 -2.603 -12.654 1.00 0.00 O ATOM 887 CB ARG A 58 -12.691 -2.080 -15.917 1.00 0.00 C ATOM 888 CG ARG A 58 -12.217 -1.106 -16.984 1.00 0.00 C ATOM 889 CD ARG A 58 -13.386 -0.429 -17.680 1.00 0.00 C ATOM 890 NE ARG A 58 -13.037 0.019 -19.026 1.00 0.00 N ATOM 891 CZ ARG A 58 -13.833 0.770 -19.780 1.00 0.00 C ATOM 892 NH1 ARG A 58 -15.016 1.155 -19.322 1.00 0.00 N ATOM 893 NH2 ARG A 58 -13.445 1.138 -20.994 1.00 0.00 N ATOM 0 H ARG A 58 -11.277 -3.992 -16.596 1.00 0.00 H new ATOM 0 HA ARG A 58 -10.869 -1.813 -14.810 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -13.197 -2.916 -16.400 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -13.428 -1.584 -15.286 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -11.576 -0.351 -16.529 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -11.612 -1.637 -17.719 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -14.226 -1.122 -17.735 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -13.715 0.425 -17.088 1.00 0.00 H new ATOM 0 HE ARG A 58 -12.133 -0.260 -19.408 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -15.317 0.875 -18.389 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -15.625 1.731 -19.903 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -12.535 0.845 -21.349 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -14.057 1.714 -21.572 1.00 0.00 H new ATOM 907 N SER A 59 -12.932 -4.210 -13.815 1.00 0.00 N ATOM 908 CA SER A 59 -13.547 -4.808 -12.636 1.00 0.00 C ATOM 909 C SER A 59 -12.527 -4.972 -11.515 1.00 0.00 C ATOM 910 O SER A 59 -12.886 -5.065 -10.342 1.00 0.00 O ATOM 911 CB SER A 59 -14.159 -6.166 -12.988 1.00 0.00 C ATOM 912 OG SER A 59 -13.267 -6.940 -13.770 1.00 0.00 O ATOM 0 H SER A 59 -13.164 -4.674 -14.693 1.00 0.00 H new ATOM 0 HA SER A 59 -14.336 -4.140 -12.290 1.00 0.00 H new ATOM 0 HB2 SER A 59 -14.407 -6.705 -12.073 1.00 0.00 H new ATOM 0 HB3 SER A 59 -15.091 -6.018 -13.533 1.00 0.00 H new ATOM 0 HG SER A 59 -13.681 -7.803 -13.980 1.00 0.00 H new ATOM 918 N GLY A 60 -11.250 -5.008 -11.885 1.00 0.00 N ATOM 919 CA GLY A 60 -10.196 -5.161 -10.900 1.00 0.00 C ATOM 920 C GLY A 60 -9.645 -3.830 -10.428 1.00 0.00 C ATOM 921 O GLY A 60 -9.135 -3.722 -9.313 1.00 0.00 O ATOM 0 H GLY A 60 -10.927 -4.934 -12.850 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -10.581 -5.715 -10.044 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -9.388 -5.754 -11.327 1.00 0.00 H new ATOM 925 N ARG A 61 -9.747 -2.814 -11.279 1.00 0.00 N ATOM 926 CA ARG A 61 -9.252 -1.484 -10.944 1.00 0.00 C ATOM 927 C ARG A 61 -9.964 -0.934 -9.712 1.00 0.00 C ATOM 928 O ARG A 61 -11.122 -0.524 -9.783 1.00 0.00 O ATOM 929 CB ARG A 61 -9.446 -0.532 -12.126 1.00 0.00 C ATOM 930 CG ARG A 61 -9.131 0.918 -11.797 1.00 0.00 C ATOM 931 CD ARG A 61 -9.945 1.873 -12.656 1.00 0.00 C ATOM 932 NE ARG A 61 -9.404 3.229 -12.630 1.00 0.00 N ATOM 933 CZ ARG A 61 -9.815 4.200 -13.438 1.00 0.00 C ATOM 934 NH1 ARG A 61 -10.766 3.965 -14.332 1.00 0.00 N ATOM 935 NH2 ARG A 61 -9.274 5.409 -13.354 1.00 0.00 N ATOM 0 H ARG A 61 -10.168 -2.887 -12.205 1.00 0.00 H new ATOM 0 HA ARG A 61 -8.188 -1.565 -10.722 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -8.810 -0.855 -12.950 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -10.477 -0.602 -12.472 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -9.339 1.107 -10.744 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -8.068 1.105 -11.951 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -9.964 1.510 -13.684 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -10.977 1.887 -12.304 1.00 0.00 H new ATOM 0 HE ARG A 61 -8.670 3.442 -11.954 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -11.184 3.037 -14.400 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -11.080 4.712 -14.951 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -8.542 5.594 -12.668 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -9.591 6.154 -13.975 1.00 0.00 H new ATOM 949 N ARG A 62 -9.262 -0.929 -8.583 1.00 0.00 N ATOM 950 CA ARG A 62 -9.828 -0.431 -7.335 1.00 0.00 C ATOM 951 C ARG A 62 -9.034 0.766 -6.818 1.00 0.00 C ATOM 952 O ARG A 62 -7.899 0.623 -6.364 1.00 0.00 O ATOM 953 CB ARG A 62 -9.845 -1.539 -6.280 1.00 0.00 C ATOM 954 CG ARG A 62 -10.755 -2.703 -6.635 1.00 0.00 C ATOM 955 CD ARG A 62 -12.210 -2.270 -6.713 1.00 0.00 C ATOM 956 NE ARG A 62 -13.110 -3.405 -6.899 1.00 0.00 N ATOM 957 CZ ARG A 62 -13.377 -4.295 -5.950 1.00 0.00 C ATOM 958 NH1 ARG A 62 -12.816 -4.182 -4.754 1.00 0.00 N ATOM 959 NH2 ARG A 62 -14.207 -5.301 -6.197 1.00 0.00 N ATOM 0 H ARG A 62 -8.302 -1.264 -8.507 1.00 0.00 H new ATOM 0 HA ARG A 62 -10.851 -0.110 -7.531 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.830 -1.912 -6.140 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -10.164 -1.117 -5.327 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -10.449 -3.127 -7.591 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -10.648 -3.490 -5.889 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -12.480 -1.739 -5.800 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -12.336 -1.569 -7.538 1.00 0.00 H new ATOM 0 HE ARG A 62 -13.558 -3.521 -7.808 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -12.178 -3.410 -4.561 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -13.023 -4.867 -4.027 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -14.640 -5.391 -7.116 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -14.412 -5.984 -5.468 1.00 0.00 H new ATOM 973 N LYS A 63 -9.640 1.946 -6.891 1.00 0.00 N ATOM 974 CA LYS A 63 -8.992 3.169 -6.430 1.00 0.00 C ATOM 975 C LYS A 63 -9.774 3.800 -5.283 1.00 0.00 C ATOM 976 O LYS A 63 -10.909 3.412 -5.003 1.00 0.00 O ATOM 977 CB LYS A 63 -8.862 4.167 -7.583 1.00 0.00 C ATOM 978 CG LYS A 63 -10.197 4.658 -8.116 1.00 0.00 C ATOM 979 CD LYS A 63 -10.026 5.867 -9.020 1.00 0.00 C ATOM 980 CE LYS A 63 -10.063 7.165 -8.228 1.00 0.00 C ATOM 981 NZ LYS A 63 -9.872 8.355 -9.103 1.00 0.00 N ATOM 0 H LYS A 63 -10.579 2.082 -7.265 1.00 0.00 H new ATOM 0 HA LYS A 63 -7.997 2.909 -6.068 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -8.277 5.023 -7.247 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -8.305 3.700 -8.396 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -10.686 3.856 -8.668 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -10.850 4.915 -7.282 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -9.079 5.792 -9.554 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -10.816 5.875 -9.771 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -11.018 7.246 -7.708 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -9.285 7.147 -7.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -8.936 8.771 -8.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -9.938 8.067 -10.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -10.609 9.059 -8.897 1.00 0.00 H new ATOM 995 N THR A 64 -9.160 4.776 -4.621 1.00 0.00 N ATOM 996 CA THR A 64 -9.799 5.462 -3.504 1.00 0.00 C ATOM 997 C THR A 64 -10.371 6.806 -3.939 1.00 0.00 C ATOM 998 O THR A 64 -9.985 7.351 -4.973 1.00 0.00 O ATOM 999 CB THR A 64 -8.810 5.688 -2.345 1.00 0.00 C ATOM 1000 OG1 THR A 64 -7.778 6.593 -2.751 1.00 0.00 O ATOM 1001 CG2 THR A 64 -8.191 4.373 -1.897 1.00 0.00 C ATOM 0 H THR A 64 -8.221 5.109 -4.839 1.00 0.00 H new ATOM 0 HA THR A 64 -10.610 4.820 -3.160 1.00 0.00 H new ATOM 0 HB THR A 64 -9.359 6.117 -1.507 1.00 0.00 H new ATOM 0 HG1 THR A 64 -7.729 7.339 -2.117 1.00 0.00 H new ATOM 0 HG21 THR A 64 -7.496 4.558 -1.078 1.00 0.00 H new ATOM 0 HG22 THR A 64 -8.977 3.697 -1.560 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.656 3.920 -2.731 1.00 0.00 H new ATOM 1009 N HIS A 65 -11.294 7.336 -3.143 1.00 0.00 N ATOM 1010 CA HIS A 65 -11.919 8.619 -3.445 1.00 0.00 C ATOM 1011 C HIS A 65 -10.864 9.692 -3.696 1.00 0.00 C ATOM 1012 O HIS A 65 -9.738 9.597 -3.206 1.00 0.00 O ATOM 1013 CB HIS A 65 -12.835 9.047 -2.299 1.00 0.00 C ATOM 1014 CG HIS A 65 -14.196 8.424 -2.355 1.00 0.00 C ATOM 1015 ND1 HIS A 65 -14.516 7.254 -1.700 1.00 0.00 N ATOM 1016 CD2 HIS A 65 -15.324 8.817 -2.993 1.00 0.00 C ATOM 1017 CE1 HIS A 65 -15.781 6.953 -1.934 1.00 0.00 C ATOM 1018 NE2 HIS A 65 -16.294 7.886 -2.716 1.00 0.00 N ATOM 0 H HIS A 65 -11.626 6.897 -2.284 1.00 0.00 H new ATOM 0 HA HIS A 65 -12.514 8.500 -4.351 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -12.364 8.786 -1.351 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -12.940 10.132 -2.315 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -15.439 9.699 -3.606 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -16.306 6.091 -1.551 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -17.255 7.911 -3.058 1.00 0.00 H new ATOM 1026 N VAL A 66 -11.235 10.712 -4.463 1.00 0.00 N ATOM 1027 CA VAL A 66 -10.320 11.803 -4.779 1.00 0.00 C ATOM 1028 C VAL A 66 -10.574 13.010 -3.882 1.00 0.00 C ATOM 1029 O VAL A 66 -11.598 13.683 -4.005 1.00 0.00 O ATOM 1030 CB VAL A 66 -10.450 12.236 -6.251 1.00 0.00 C ATOM 1031 CG1 VAL A 66 -9.459 13.344 -6.572 1.00 0.00 C ATOM 1032 CG2 VAL A 66 -10.247 11.045 -7.176 1.00 0.00 C ATOM 0 H VAL A 66 -12.162 10.806 -4.877 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.311 11.430 -4.605 1.00 0.00 H new ATOM 0 HB VAL A 66 -11.456 12.624 -6.409 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -9.566 13.637 -7.617 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -9.655 14.204 -5.932 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -8.444 12.986 -6.398 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -10.342 11.369 -8.212 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -9.254 10.626 -7.017 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -11.000 10.286 -6.962 1.00 0.00 H new ATOM 1042 N SER A 67 -9.635 13.278 -2.980 1.00 0.00 N ATOM 1043 CA SER A 67 -9.759 14.403 -2.060 1.00 0.00 C ATOM 1044 C SER A 67 -9.237 15.687 -2.698 1.00 0.00 C ATOM 1045 O SER A 67 -8.250 15.672 -3.434 1.00 0.00 O ATOM 1046 CB SER A 67 -8.994 14.116 -0.766 1.00 0.00 C ATOM 1047 OG SER A 67 -9.668 13.147 0.020 1.00 0.00 O ATOM 0 H SER A 67 -8.781 12.732 -2.867 1.00 0.00 H new ATOM 0 HA SER A 67 -10.816 14.537 -1.828 1.00 0.00 H new ATOM 0 HB2 SER A 67 -7.991 13.762 -1.004 1.00 0.00 H new ATOM 0 HB3 SER A 67 -8.880 15.037 -0.195 1.00 0.00 H new ATOM 0 HG SER A 67 -9.159 12.980 0.840 1.00 0.00 H new ATOM 1053 N LYS A 68 -9.907 16.797 -2.410 1.00 0.00 N ATOM 1054 CA LYS A 68 -9.513 18.092 -2.953 1.00 0.00 C ATOM 1055 C LYS A 68 -9.199 19.078 -1.833 1.00 0.00 C ATOM 1056 O LYS A 68 -9.632 18.901 -0.694 1.00 0.00 O ATOM 1057 CB LYS A 68 -10.622 18.653 -3.845 1.00 0.00 C ATOM 1058 CG LYS A 68 -11.082 17.687 -4.923 1.00 0.00 C ATOM 1059 CD LYS A 68 -12.060 18.346 -5.882 1.00 0.00 C ATOM 1060 CE LYS A 68 -12.319 17.475 -7.101 1.00 0.00 C ATOM 1061 NZ LYS A 68 -13.488 17.955 -7.888 1.00 0.00 N ATOM 0 H LYS A 68 -10.726 16.826 -1.803 1.00 0.00 H new ATOM 0 HA LYS A 68 -8.613 17.949 -3.551 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -11.475 18.923 -3.223 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -10.268 19.570 -4.317 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -10.218 17.321 -5.478 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -11.554 16.821 -4.459 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -13.000 18.541 -5.367 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -11.665 19.311 -6.200 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -11.433 17.466 -7.736 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -12.493 16.447 -6.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -13.631 17.335 -8.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -14.339 17.939 -7.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -13.312 18.927 -8.214 1.00 0.00 H new ATOM 1075 N LYS A 69 -8.443 20.120 -2.163 1.00 0.00 N ATOM 1076 CA LYS A 69 -8.073 21.138 -1.187 1.00 0.00 C ATOM 1077 C LYS A 69 -7.345 20.514 0.000 1.00 0.00 C ATOM 1078 O LYS A 69 -7.625 20.839 1.154 1.00 0.00 O ATOM 1079 CB LYS A 69 -9.317 21.884 -0.700 1.00 0.00 C ATOM 1080 CG LYS A 69 -9.772 22.986 -1.642 1.00 0.00 C ATOM 1081 CD LYS A 69 -10.390 22.417 -2.909 1.00 0.00 C ATOM 1082 CE LYS A 69 -11.097 23.495 -3.716 1.00 0.00 C ATOM 1083 NZ LYS A 69 -11.441 23.024 -5.087 1.00 0.00 N ATOM 0 H LYS A 69 -8.074 20.282 -3.100 1.00 0.00 H new ATOM 0 HA LYS A 69 -7.401 21.845 -1.674 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -10.130 21.170 -0.569 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -9.111 22.316 0.279 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -10.498 23.622 -1.136 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -8.922 23.617 -1.902 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -9.613 21.955 -3.518 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -11.100 21.632 -2.648 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -12.006 23.800 -3.198 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -10.458 24.376 -3.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -11.921 23.787 -5.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -10.571 22.757 -5.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -12.071 22.199 -5.023 1.00 0.00 H new ATOM 1097 N THR A 70 -6.409 19.616 -0.291 1.00 0.00 N ATOM 1098 CA THR A 70 -5.641 18.947 0.752 1.00 0.00 C ATOM 1099 C THR A 70 -4.451 18.198 0.163 1.00 0.00 C ATOM 1100 O THR A 70 -4.569 17.540 -0.872 1.00 0.00 O ATOM 1101 CB THR A 70 -6.515 17.958 1.546 1.00 0.00 C ATOM 1102 OG1 THR A 70 -5.709 17.234 2.482 1.00 0.00 O ATOM 1103 CG2 THR A 70 -7.214 16.982 0.611 1.00 0.00 C ATOM 0 H THR A 70 -6.164 19.335 -1.241 1.00 0.00 H new ATOM 0 HA THR A 70 -5.280 19.723 1.427 1.00 0.00 H new ATOM 0 HB THR A 70 -7.273 18.528 2.084 1.00 0.00 H new ATOM 0 HG1 THR A 70 -6.272 16.609 2.984 1.00 0.00 H new ATOM 0 HG21 THR A 70 -7.825 16.294 1.194 1.00 0.00 H new ATOM 0 HG22 THR A 70 -7.849 17.534 -0.082 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.469 16.419 0.050 1.00 0.00 H new ATOM 1111 N LEU A 71 -3.306 18.300 0.829 1.00 0.00 N ATOM 1112 CA LEU A 71 -2.093 17.630 0.372 1.00 0.00 C ATOM 1113 C LEU A 71 -1.956 16.254 1.015 1.00 0.00 C ATOM 1114 O LEU A 71 -1.302 15.366 0.470 1.00 0.00 O ATOM 1115 CB LEU A 71 -0.864 18.482 0.694 1.00 0.00 C ATOM 1116 CG LEU A 71 -0.759 19.816 -0.046 1.00 0.00 C ATOM 1117 CD1 LEU A 71 0.516 20.545 0.347 1.00 0.00 C ATOM 1118 CD2 LEU A 71 -0.809 19.596 -1.551 1.00 0.00 C ATOM 0 H LEU A 71 -3.192 18.840 1.687 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.164 17.500 -0.708 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -0.856 18.682 1.765 1.00 0.00 H new ATOM 0 HB3 LEU A 71 0.028 17.896 0.473 1.00 0.00 H new ATOM 0 HG LEU A 71 -1.609 20.436 0.238 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.574 21.492 -0.189 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.510 20.736 1.420 1.00 0.00 H new ATOM 0 HD13 LEU A 71 1.380 19.931 0.092 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -0.733 20.556 -2.062 1.00 0.00 H new ATOM 0 HD22 LEU A 71 0.021 18.957 -1.853 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.751 19.117 -1.818 1.00 0.00 H new ATOM 1130 N ASN A 72 -2.578 16.085 2.177 1.00 0.00 N ATOM 1131 CA ASN A 72 -2.527 14.816 2.894 1.00 0.00 C ATOM 1132 C ASN A 72 -3.909 14.175 2.966 1.00 0.00 C ATOM 1133 O ASN A 72 -4.649 14.342 3.936 1.00 0.00 O ATOM 1134 CB ASN A 72 -1.976 15.026 4.306 1.00 0.00 C ATOM 1135 CG ASN A 72 -2.553 16.259 4.974 1.00 0.00 C ATOM 1136 OD1 ASN A 72 -3.770 16.394 5.108 1.00 0.00 O ATOM 1137 ND2 ASN A 72 -1.681 17.166 5.397 1.00 0.00 N ATOM 0 H ASN A 72 -3.123 16.811 2.642 1.00 0.00 H new ATOM 0 HA ASN A 72 -1.863 14.146 2.348 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -2.198 14.149 4.914 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -0.891 15.115 4.260 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -2.011 18.016 5.854 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -0.681 17.013 5.265 1.00 0.00 H new ATOM 1144 N PRO A 73 -4.267 13.422 1.916 1.00 0.00 N ATOM 1145 CA PRO A 73 -5.562 12.739 1.836 1.00 0.00 C ATOM 1146 C PRO A 73 -5.671 11.584 2.825 1.00 0.00 C ATOM 1147 O PRO A 73 -4.662 11.013 3.241 1.00 0.00 O ATOM 1148 CB PRO A 73 -5.600 12.216 0.398 1.00 0.00 C ATOM 1149 CG PRO A 73 -4.168 12.078 0.007 1.00 0.00 C ATOM 1150 CD PRO A 73 -3.436 13.178 0.725 1.00 0.00 C ATOM 0 HA PRO A 73 -6.389 13.405 2.084 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -6.121 11.260 0.338 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.125 12.907 -0.261 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -3.778 11.100 0.290 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -4.048 12.169 -1.073 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -2.424 12.877 0.996 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -3.348 14.072 0.107 1.00 0.00 H new ATOM 1158 N VAL A 74 -6.900 11.244 3.199 1.00 0.00 N ATOM 1159 CA VAL A 74 -7.140 10.155 4.138 1.00 0.00 C ATOM 1160 C VAL A 74 -8.323 9.300 3.699 1.00 0.00 C ATOM 1161 O VAL A 74 -9.449 9.787 3.590 1.00 0.00 O ATOM 1162 CB VAL A 74 -7.406 10.689 5.559 1.00 0.00 C ATOM 1163 CG1 VAL A 74 -7.683 9.540 6.517 1.00 0.00 C ATOM 1164 CG2 VAL A 74 -6.232 11.526 6.042 1.00 0.00 C ATOM 0 H VAL A 74 -7.745 11.707 2.866 1.00 0.00 H new ATOM 0 HA VAL A 74 -6.238 9.543 4.150 1.00 0.00 H new ATOM 0 HB VAL A 74 -8.289 11.327 5.530 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -7.869 9.936 7.516 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -8.558 8.986 6.178 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -6.821 8.874 6.545 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -6.437 11.895 7.047 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -5.330 10.914 6.057 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -6.086 12.370 5.368 1.00 0.00 H new ATOM 1174 N PHE A 75 -8.061 8.022 3.447 1.00 0.00 N ATOM 1175 CA PHE A 75 -9.104 7.098 3.018 1.00 0.00 C ATOM 1176 C PHE A 75 -9.300 5.985 4.043 1.00 0.00 C ATOM 1177 O PHE A 75 -10.414 5.740 4.504 1.00 0.00 O ATOM 1178 CB PHE A 75 -8.754 6.497 1.655 1.00 0.00 C ATOM 1179 CG PHE A 75 -7.965 7.424 0.776 1.00 0.00 C ATOM 1180 CD1 PHE A 75 -8.596 8.437 0.072 1.00 0.00 C ATOM 1181 CD2 PHE A 75 -6.592 7.282 0.652 1.00 0.00 C ATOM 1182 CE1 PHE A 75 -7.873 9.292 -0.738 1.00 0.00 C ATOM 1183 CE2 PHE A 75 -5.864 8.135 -0.156 1.00 0.00 C ATOM 1184 CZ PHE A 75 -6.505 9.140 -0.853 1.00 0.00 C ATOM 0 H PHE A 75 -7.135 7.603 3.532 1.00 0.00 H new ATOM 0 HA PHE A 75 -10.036 7.656 2.932 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -8.184 5.580 1.807 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -9.675 6.219 1.142 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -9.666 8.560 0.157 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -6.085 6.496 1.193 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -8.377 10.078 -1.280 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -4.794 8.015 -0.242 1.00 0.00 H new ATOM 0 HZ PHE A 75 -5.938 9.806 -1.487 1.00 0.00 H new ATOM 1194 N ASP A 76 -8.208 5.313 4.393 1.00 0.00 N ATOM 1195 CA ASP A 76 -8.258 4.226 5.363 1.00 0.00 C ATOM 1196 C ASP A 76 -9.180 3.110 4.882 1.00 0.00 C ATOM 1197 O ASP A 76 -9.840 2.449 5.683 1.00 0.00 O ATOM 1198 CB ASP A 76 -8.732 4.746 6.721 1.00 0.00 C ATOM 1199 CG ASP A 76 -8.711 3.674 7.792 1.00 0.00 C ATOM 1200 OD1 ASP A 76 -7.608 3.189 8.125 1.00 0.00 O ATOM 1201 OD2 ASP A 76 -9.796 3.319 8.298 1.00 0.00 O ATOM 0 H ASP A 76 -7.278 5.502 4.019 1.00 0.00 H new ATOM 0 HA ASP A 76 -7.252 3.821 5.469 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.097 5.576 7.030 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.744 5.138 6.623 1.00 0.00 H new ATOM 1206 N GLN A 77 -9.221 2.908 3.569 1.00 0.00 N ATOM 1207 CA GLN A 77 -10.064 1.873 2.982 1.00 0.00 C ATOM 1208 C GLN A 77 -9.280 0.581 2.781 1.00 0.00 C ATOM 1209 O GLN A 77 -8.049 0.587 2.758 1.00 0.00 O ATOM 1210 CB GLN A 77 -10.637 2.349 1.646 1.00 0.00 C ATOM 1211 CG GLN A 77 -11.972 3.064 1.776 1.00 0.00 C ATOM 1212 CD GLN A 77 -12.300 3.913 0.564 1.00 0.00 C ATOM 1213 OE1 GLN A 77 -12.272 5.143 0.627 1.00 0.00 O ATOM 1214 NE2 GLN A 77 -12.613 3.260 -0.549 1.00 0.00 N ATOM 0 H GLN A 77 -8.681 3.447 2.892 1.00 0.00 H new ATOM 0 HA GLN A 77 -10.885 1.675 3.671 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -9.920 3.019 1.171 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -10.757 1.490 0.985 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -12.762 2.327 1.923 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -11.956 3.696 2.664 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -12.624 2.240 -0.556 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -12.843 3.778 -1.397 1.00 0.00 H new ATOM 1223 N SER A 78 -10.000 -0.527 2.635 1.00 0.00 N ATOM 1224 CA SER A 78 -9.371 -1.828 2.439 1.00 0.00 C ATOM 1225 C SER A 78 -9.992 -2.559 1.252 1.00 0.00 C ATOM 1226 O SER A 78 -11.197 -2.806 1.223 1.00 0.00 O ATOM 1227 CB SER A 78 -9.507 -2.678 3.704 1.00 0.00 C ATOM 1228 OG SER A 78 -8.951 -3.968 3.513 1.00 0.00 O ATOM 0 H SER A 78 -11.020 -0.550 2.649 1.00 0.00 H new ATOM 0 HA SER A 78 -8.314 -1.666 2.230 1.00 0.00 H new ATOM 0 HB2 SER A 78 -9.006 -2.182 4.535 1.00 0.00 H new ATOM 0 HB3 SER A 78 -10.559 -2.768 3.974 1.00 0.00 H new ATOM 0 HG SER A 78 -9.049 -4.491 4.336 1.00 0.00 H new ATOM 1234 N PHE A 79 -9.159 -2.901 0.275 1.00 0.00 N ATOM 1235 CA PHE A 79 -9.624 -3.602 -0.915 1.00 0.00 C ATOM 1236 C PHE A 79 -9.202 -5.068 -0.883 1.00 0.00 C ATOM 1237 O PHE A 79 -8.406 -5.478 -0.037 1.00 0.00 O ATOM 1238 CB PHE A 79 -9.077 -2.930 -2.176 1.00 0.00 C ATOM 1239 CG PHE A 79 -9.312 -1.447 -2.215 1.00 0.00 C ATOM 1240 CD1 PHE A 79 -8.511 -0.586 -1.482 1.00 0.00 C ATOM 1241 CD2 PHE A 79 -10.334 -0.914 -2.984 1.00 0.00 C ATOM 1242 CE1 PHE A 79 -8.726 0.779 -1.515 1.00 0.00 C ATOM 1243 CE2 PHE A 79 -10.553 0.450 -3.021 1.00 0.00 C ATOM 1244 CZ PHE A 79 -9.747 1.298 -2.287 1.00 0.00 C ATOM 0 H PHE A 79 -8.158 -2.704 0.284 1.00 0.00 H new ATOM 0 HA PHE A 79 -10.713 -3.556 -0.930 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -8.006 -3.122 -2.245 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -9.540 -3.386 -3.051 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -7.710 -0.986 -0.878 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -10.967 -1.572 -3.561 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -8.096 1.439 -0.937 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -11.354 0.853 -3.623 1.00 0.00 H new ATOM 0 HZ PHE A 79 -9.915 2.364 -2.317 1.00 0.00 H new ATOM 1254 N ASP A 80 -9.740 -5.853 -1.809 1.00 0.00 N ATOM 1255 CA ASP A 80 -9.419 -7.274 -1.888 1.00 0.00 C ATOM 1256 C ASP A 80 -9.463 -7.761 -3.333 1.00 0.00 C ATOM 1257 O ASP A 80 -10.147 -7.179 -4.175 1.00 0.00 O ATOM 1258 CB ASP A 80 -10.393 -8.087 -1.033 1.00 0.00 C ATOM 1259 CG ASP A 80 -11.768 -7.453 -0.961 1.00 0.00 C ATOM 1260 OD1 ASP A 80 -12.295 -7.056 -2.022 1.00 0.00 O ATOM 1261 OD2 ASP A 80 -12.319 -7.356 0.155 1.00 0.00 O ATOM 0 H ASP A 80 -10.401 -5.530 -2.516 1.00 0.00 H new ATOM 0 HA ASP A 80 -8.408 -7.415 -1.506 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -10.481 -9.093 -1.444 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -9.990 -8.189 -0.025 1.00 0.00 H new ATOM 1266 N PHE A 81 -8.728 -8.832 -3.614 1.00 0.00 N ATOM 1267 CA PHE A 81 -8.681 -9.397 -4.957 1.00 0.00 C ATOM 1268 C PHE A 81 -8.483 -10.909 -4.905 1.00 0.00 C ATOM 1269 O PHE A 81 -7.589 -11.406 -4.221 1.00 0.00 O ATOM 1270 CB PHE A 81 -7.554 -8.752 -5.766 1.00 0.00 C ATOM 1271 CG PHE A 81 -7.481 -7.260 -5.606 1.00 0.00 C ATOM 1272 CD1 PHE A 81 -8.398 -6.436 -6.239 1.00 0.00 C ATOM 1273 CD2 PHE A 81 -6.494 -6.681 -4.824 1.00 0.00 C ATOM 1274 CE1 PHE A 81 -8.333 -5.063 -6.094 1.00 0.00 C ATOM 1275 CE2 PHE A 81 -6.425 -5.309 -4.675 1.00 0.00 C ATOM 1276 CZ PHE A 81 -7.344 -4.499 -5.312 1.00 0.00 C ATOM 0 H PHE A 81 -8.156 -9.326 -2.929 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.634 -9.189 -5.444 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -6.603 -9.189 -5.462 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -7.692 -8.990 -6.821 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.172 -6.872 -6.853 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -5.771 -7.309 -4.325 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -9.055 -4.432 -6.592 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -5.653 -4.870 -4.061 1.00 0.00 H new ATOM 0 HZ PHE A 81 -7.290 -3.426 -5.199 1.00 0.00 H new ATOM 1286 N SER A 82 -9.326 -11.636 -5.633 1.00 0.00 N ATOM 1287 CA SER A 82 -9.247 -13.092 -5.667 1.00 0.00 C ATOM 1288 C SER A 82 -8.095 -13.553 -6.554 1.00 0.00 C ATOM 1289 O SER A 82 -8.262 -13.741 -7.760 1.00 0.00 O ATOM 1290 CB SER A 82 -10.564 -13.683 -6.173 1.00 0.00 C ATOM 1291 OG SER A 82 -10.915 -13.141 -7.434 1.00 0.00 O ATOM 0 H SER A 82 -10.071 -11.240 -6.207 1.00 0.00 H new ATOM 0 HA SER A 82 -9.065 -13.445 -4.652 1.00 0.00 H new ATOM 0 HB2 SER A 82 -10.474 -14.766 -6.252 1.00 0.00 H new ATOM 0 HB3 SER A 82 -11.357 -13.481 -5.453 1.00 0.00 H new ATOM 0 HG SER A 82 -10.134 -13.157 -8.026 1.00 0.00 H new ATOM 1297 N VAL A 83 -6.925 -13.733 -5.949 1.00 0.00 N ATOM 1298 CA VAL A 83 -5.745 -14.173 -6.683 1.00 0.00 C ATOM 1299 C VAL A 83 -4.893 -15.115 -5.839 1.00 0.00 C ATOM 1300 O VAL A 83 -4.647 -14.859 -4.661 1.00 0.00 O ATOM 1301 CB VAL A 83 -4.882 -12.977 -7.127 1.00 0.00 C ATOM 1302 CG1 VAL A 83 -4.619 -12.044 -5.955 1.00 0.00 C ATOM 1303 CG2 VAL A 83 -3.574 -13.462 -7.736 1.00 0.00 C ATOM 0 H VAL A 83 -6.769 -13.581 -4.952 1.00 0.00 H new ATOM 0 HA VAL A 83 -6.101 -14.703 -7.567 1.00 0.00 H new ATOM 0 HB VAL A 83 -5.428 -12.420 -7.889 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.008 -11.205 -6.288 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.567 -11.671 -5.567 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -4.094 -12.586 -5.169 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -2.976 -12.604 -8.044 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -3.022 -14.042 -6.997 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -3.786 -14.087 -8.603 1.00 0.00 H new ATOM 1313 N SER A 84 -4.445 -16.207 -6.451 1.00 0.00 N ATOM 1314 CA SER A 84 -3.623 -17.191 -5.755 1.00 0.00 C ATOM 1315 C SER A 84 -2.198 -16.677 -5.574 1.00 0.00 C ATOM 1316 O SER A 84 -1.693 -15.910 -6.395 1.00 0.00 O ATOM 1317 CB SER A 84 -3.607 -18.511 -6.528 1.00 0.00 C ATOM 1318 OG SER A 84 -4.846 -18.737 -7.178 1.00 0.00 O ATOM 0 H SER A 84 -4.637 -16.433 -7.427 1.00 0.00 H new ATOM 0 HA SER A 84 -4.058 -17.360 -4.770 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.804 -18.495 -7.265 1.00 0.00 H new ATOM 0 HB3 SER A 84 -3.396 -19.334 -5.845 1.00 0.00 H new ATOM 0 HG SER A 84 -4.809 -19.586 -7.666 1.00 0.00 H new ATOM 1324 N LEU A 85 -1.555 -17.104 -4.493 1.00 0.00 N ATOM 1325 CA LEU A 85 -0.187 -16.688 -4.202 1.00 0.00 C ATOM 1326 C LEU A 85 0.726 -16.945 -5.397 1.00 0.00 C ATOM 1327 O LEU A 85 1.540 -16.105 -5.779 1.00 0.00 O ATOM 1328 CB LEU A 85 0.341 -17.430 -2.973 1.00 0.00 C ATOM 1329 CG LEU A 85 1.863 -17.498 -2.834 1.00 0.00 C ATOM 1330 CD1 LEU A 85 2.450 -18.450 -3.864 1.00 0.00 C ATOM 1331 CD2 LEU A 85 2.474 -16.112 -2.975 1.00 0.00 C ATOM 0 H LEU A 85 -1.959 -17.738 -3.803 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.194 -15.617 -3.998 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -0.064 -16.951 -2.082 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -0.048 -18.448 -2.993 1.00 0.00 H new ATOM 0 HG LEU A 85 2.102 -17.878 -1.841 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.533 -18.486 -3.750 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.036 -19.447 -3.715 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.202 -18.100 -4.866 1.00 0.00 H new ATOM 0 HD21 LEU A 85 3.557 -16.180 -2.873 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.226 -15.703 -3.955 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.077 -15.459 -2.198 1.00 0.00 H new ATOM 1343 N PRO A 86 0.587 -18.134 -6.003 1.00 0.00 N ATOM 1344 CA PRO A 86 1.389 -18.528 -7.166 1.00 0.00 C ATOM 1345 C PRO A 86 1.431 -17.443 -8.236 1.00 0.00 C ATOM 1346 O PRO A 86 2.478 -17.181 -8.826 1.00 0.00 O ATOM 1347 CB PRO A 86 0.665 -19.770 -7.691 1.00 0.00 C ATOM 1348 CG PRO A 86 -0.031 -20.334 -6.501 1.00 0.00 C ATOM 1349 CD PRO A 86 -0.364 -19.184 -5.602 1.00 0.00 C ATOM 0 HA PRO A 86 2.431 -18.705 -6.901 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -0.043 -19.512 -8.478 1.00 0.00 H new ATOM 0 HB3 PRO A 86 1.367 -20.487 -8.116 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -0.935 -20.865 -6.799 1.00 0.00 H new ATOM 0 HG3 PRO A 86 0.606 -21.053 -5.987 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -1.396 -18.860 -5.734 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -0.245 -19.451 -4.552 1.00 0.00 H new ATOM 1357 N GLU A 87 0.285 -16.815 -8.481 1.00 0.00 N ATOM 1358 CA GLU A 87 0.192 -15.758 -9.482 1.00 0.00 C ATOM 1359 C GLU A 87 0.691 -14.431 -8.919 1.00 0.00 C ATOM 1360 O GLU A 87 1.644 -13.845 -9.433 1.00 0.00 O ATOM 1361 CB GLU A 87 -1.252 -15.609 -9.966 1.00 0.00 C ATOM 1362 CG GLU A 87 -1.672 -16.674 -10.965 1.00 0.00 C ATOM 1363 CD GLU A 87 -1.259 -18.069 -10.539 1.00 0.00 C ATOM 1364 OE1 GLU A 87 -1.917 -18.635 -9.641 1.00 0.00 O ATOM 1365 OE2 GLU A 87 -0.277 -18.595 -11.104 1.00 0.00 O ATOM 0 H GLU A 87 -0.591 -17.020 -8.001 1.00 0.00 H new ATOM 0 HA GLU A 87 0.823 -16.035 -10.326 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -1.920 -15.646 -9.106 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -1.374 -14.627 -10.422 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -2.754 -16.642 -11.091 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -1.231 -16.449 -11.936 1.00 0.00 H new ATOM 1372 N VAL A 88 0.040 -13.962 -7.859 1.00 0.00 N ATOM 1373 CA VAL A 88 0.416 -12.704 -7.225 1.00 0.00 C ATOM 1374 C VAL A 88 1.931 -12.531 -7.204 1.00 0.00 C ATOM 1375 O VAL A 88 2.437 -11.410 -7.182 1.00 0.00 O ATOM 1376 CB VAL A 88 -0.119 -12.620 -5.783 1.00 0.00 C ATOM 1377 CG1 VAL A 88 0.882 -13.217 -4.806 1.00 0.00 C ATOM 1378 CG2 VAL A 88 -0.438 -11.178 -5.417 1.00 0.00 C ATOM 0 H VAL A 88 -0.751 -14.435 -7.421 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.030 -11.905 -7.817 1.00 0.00 H new ATOM 0 HB VAL A 88 -1.040 -13.199 -5.721 1.00 0.00 H new ATOM 0 HG11 VAL A 88 0.486 -13.149 -3.793 1.00 0.00 H new ATOM 0 HG12 VAL A 88 1.056 -14.263 -5.058 1.00 0.00 H new ATOM 0 HG13 VAL A 88 1.822 -12.668 -4.867 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -0.815 -11.137 -4.395 1.00 0.00 H new ATOM 0 HG22 VAL A 88 0.466 -10.574 -5.495 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -1.194 -10.788 -6.098 1.00 0.00 H new ATOM 1388 N GLN A 89 2.649 -13.650 -7.212 1.00 0.00 N ATOM 1389 CA GLN A 89 4.107 -13.622 -7.193 1.00 0.00 C ATOM 1390 C GLN A 89 4.653 -12.936 -8.441 1.00 0.00 C ATOM 1391 O GLN A 89 5.433 -11.988 -8.349 1.00 0.00 O ATOM 1392 CB GLN A 89 4.664 -15.042 -7.091 1.00 0.00 C ATOM 1393 CG GLN A 89 4.626 -15.611 -5.682 1.00 0.00 C ATOM 1394 CD GLN A 89 4.870 -17.107 -5.649 1.00 0.00 C ATOM 1395 OE1 GLN A 89 4.815 -17.779 -6.680 1.00 0.00 O ATOM 1396 NE2 GLN A 89 5.141 -17.637 -4.463 1.00 0.00 N ATOM 0 H GLN A 89 2.245 -14.586 -7.231 1.00 0.00 H new ATOM 0 HA GLN A 89 4.424 -13.053 -6.319 1.00 0.00 H new ATOM 0 HB2 GLN A 89 4.095 -15.695 -7.753 1.00 0.00 H new ATOM 0 HB3 GLN A 89 5.694 -15.046 -7.448 1.00 0.00 H new ATOM 0 HG2 GLN A 89 5.378 -15.111 -5.072 1.00 0.00 H new ATOM 0 HG3 GLN A 89 3.656 -15.395 -5.233 1.00 0.00 H new ATOM 0 HE21 GLN A 89 5.176 -17.043 -3.635 1.00 0.00 H new ATOM 0 HE22 GLN A 89 5.314 -18.639 -4.380 1.00 0.00 H new ATOM 1405 N ARG A 90 4.240 -13.423 -9.607 1.00 0.00 N ATOM 1406 CA ARG A 90 4.690 -12.859 -10.873 1.00 0.00 C ATOM 1407 C ARG A 90 3.993 -11.531 -11.155 1.00 0.00 C ATOM 1408 O ARG A 90 4.452 -10.740 -11.979 1.00 0.00 O ATOM 1409 CB ARG A 90 4.424 -13.840 -12.017 1.00 0.00 C ATOM 1410 CG ARG A 90 5.030 -15.216 -11.792 1.00 0.00 C ATOM 1411 CD ARG A 90 4.647 -16.181 -12.904 1.00 0.00 C ATOM 1412 NE ARG A 90 5.279 -17.487 -12.735 1.00 0.00 N ATOM 1413 CZ ARG A 90 5.373 -18.388 -13.707 1.00 0.00 C ATOM 1414 NH1 ARG A 90 4.880 -18.126 -14.909 1.00 0.00 N ATOM 1415 NH2 ARG A 90 5.962 -19.555 -13.476 1.00 0.00 N ATOM 0 H ARG A 90 3.594 -14.207 -9.700 1.00 0.00 H new ATOM 0 HA ARG A 90 5.763 -12.679 -10.800 1.00 0.00 H new ATOM 0 HB2 ARG A 90 3.347 -13.944 -12.152 1.00 0.00 H new ATOM 0 HB3 ARG A 90 4.823 -13.423 -12.942 1.00 0.00 H new ATOM 0 HG2 ARG A 90 6.115 -15.133 -11.739 1.00 0.00 H new ATOM 0 HG3 ARG A 90 4.693 -15.611 -10.834 1.00 0.00 H new ATOM 0 HD2 ARG A 90 3.564 -16.302 -12.922 1.00 0.00 H new ATOM 0 HD3 ARG A 90 4.937 -15.759 -13.866 1.00 0.00 H new ATOM 0 HE ARG A 90 5.669 -17.720 -11.822 1.00 0.00 H new ATOM 0 HH11 ARG A 90 4.427 -17.230 -15.090 1.00 0.00 H new ATOM 0 HH12 ARG A 90 4.954 -18.820 -15.653 1.00 0.00 H new ATOM 0 HH21 ARG A 90 6.343 -19.760 -12.552 1.00 0.00 H new ATOM 0 HH22 ARG A 90 6.034 -20.247 -14.222 1.00 0.00 H new ATOM 1429 N ARG A 91 2.881 -11.295 -10.466 1.00 0.00 N ATOM 1430 CA ARG A 91 2.119 -10.064 -10.644 1.00 0.00 C ATOM 1431 C ARG A 91 2.769 -8.909 -9.888 1.00 0.00 C ATOM 1432 O ARG A 91 3.704 -9.108 -9.111 1.00 0.00 O ATOM 1433 CB ARG A 91 0.680 -10.257 -10.163 1.00 0.00 C ATOM 1434 CG ARG A 91 -0.118 -11.238 -11.006 1.00 0.00 C ATOM 1435 CD ARG A 91 -1.481 -11.518 -10.394 1.00 0.00 C ATOM 1436 NE ARG A 91 -2.323 -12.322 -11.277 1.00 0.00 N ATOM 1437 CZ ARG A 91 -2.840 -11.868 -12.413 1.00 0.00 C ATOM 1438 NH1 ARG A 91 -2.602 -10.623 -12.803 1.00 0.00 N ATOM 1439 NH2 ARG A 91 -3.596 -12.660 -13.163 1.00 0.00 N ATOM 0 H ARG A 91 2.488 -11.939 -9.780 1.00 0.00 H new ATOM 0 HA ARG A 91 2.110 -9.821 -11.707 1.00 0.00 H new ATOM 0 HB2 ARG A 91 0.695 -10.607 -9.131 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.173 -9.292 -10.166 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -0.245 -10.836 -12.011 1.00 0.00 H new ATOM 0 HG3 ARG A 91 0.437 -12.171 -11.103 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -1.352 -12.037 -9.444 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -1.981 -10.574 -10.176 1.00 0.00 H new ATOM 0 HE ARG A 91 -2.525 -13.284 -11.006 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -2.021 -10.011 -12.230 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -3.000 -10.277 -13.676 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -3.781 -13.619 -12.867 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -3.992 -12.310 -14.035 1.00 0.00 H new ATOM 1453 N THR A 92 2.269 -7.700 -10.122 1.00 0.00 N ATOM 1454 CA THR A 92 2.801 -6.512 -9.466 1.00 0.00 C ATOM 1455 C THR A 92 1.685 -5.543 -9.094 1.00 0.00 C ATOM 1456 O THR A 92 0.699 -5.407 -9.819 1.00 0.00 O ATOM 1457 CB THR A 92 3.821 -5.784 -10.362 1.00 0.00 C ATOM 1458 OG1 THR A 92 4.692 -6.734 -10.985 1.00 0.00 O ATOM 1459 CG2 THR A 92 4.641 -4.791 -9.553 1.00 0.00 C ATOM 0 H THR A 92 1.496 -7.518 -10.762 1.00 0.00 H new ATOM 0 HA THR A 92 3.302 -6.850 -8.559 1.00 0.00 H new ATOM 0 HB THR A 92 3.272 -5.238 -11.129 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.336 -6.263 -11.554 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.354 -4.290 -10.207 1.00 0.00 H new ATOM 0 HG22 THR A 92 3.978 -4.051 -9.105 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.180 -5.319 -8.766 1.00 0.00 H new ATOM 1467 N LEU A 93 1.846 -4.870 -7.960 1.00 0.00 N ATOM 1468 CA LEU A 93 0.852 -3.911 -7.491 1.00 0.00 C ATOM 1469 C LEU A 93 1.221 -2.493 -7.915 1.00 0.00 C ATOM 1470 O LEU A 93 2.003 -1.818 -7.245 1.00 0.00 O ATOM 1471 CB LEU A 93 0.722 -3.983 -5.969 1.00 0.00 C ATOM 1472 CG LEU A 93 -0.651 -3.634 -5.395 1.00 0.00 C ATOM 1473 CD1 LEU A 93 -1.584 -4.832 -5.474 1.00 0.00 C ATOM 1474 CD2 LEU A 93 -0.521 -3.151 -3.958 1.00 0.00 C ATOM 0 H LEU A 93 2.656 -4.971 -7.348 1.00 0.00 H new ATOM 0 HA LEU A 93 -0.106 -4.168 -7.943 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.981 -4.993 -5.650 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.459 -3.311 -5.529 1.00 0.00 H new ATOM 0 HG LEU A 93 -1.078 -2.828 -5.991 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.556 -4.564 -5.061 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -1.703 -5.133 -6.515 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.163 -5.659 -4.903 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.508 -2.907 -3.565 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -0.072 -3.936 -3.349 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.111 -2.263 -3.928 1.00 0.00 H new ATOM 1486 N ASP A 94 0.652 -2.046 -9.029 1.00 0.00 N ATOM 1487 CA ASP A 94 0.918 -0.707 -9.540 1.00 0.00 C ATOM 1488 C ASP A 94 0.299 0.354 -8.635 1.00 0.00 C ATOM 1489 O ASP A 94 -0.901 0.622 -8.705 1.00 0.00 O ATOM 1490 CB ASP A 94 0.373 -0.562 -10.962 1.00 0.00 C ATOM 1491 CG ASP A 94 0.013 0.871 -11.301 1.00 0.00 C ATOM 1492 OD1 ASP A 94 0.937 1.702 -11.422 1.00 0.00 O ATOM 1493 OD2 ASP A 94 -1.193 1.161 -11.447 1.00 0.00 O ATOM 0 H ASP A 94 0.003 -2.592 -9.596 1.00 0.00 H new ATOM 0 HA ASP A 94 1.998 -0.560 -9.556 1.00 0.00 H new ATOM 0 HB2 ASP A 94 1.117 -0.924 -11.672 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -0.509 -1.192 -11.076 1.00 0.00 H new ATOM 1498 N VAL A 95 1.125 0.953 -7.783 1.00 0.00 N ATOM 1499 CA VAL A 95 0.659 1.984 -6.863 1.00 0.00 C ATOM 1500 C VAL A 95 1.176 3.359 -7.271 1.00 0.00 C ATOM 1501 O VAL A 95 2.330 3.701 -7.013 1.00 0.00 O ATOM 1502 CB VAL A 95 1.102 1.689 -5.418 1.00 0.00 C ATOM 1503 CG1 VAL A 95 0.501 2.704 -4.457 1.00 0.00 C ATOM 1504 CG2 VAL A 95 0.714 0.272 -5.021 1.00 0.00 C ATOM 0 H VAL A 95 2.120 0.742 -7.711 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.430 1.980 -6.909 1.00 0.00 H new ATOM 0 HB VAL A 95 2.187 1.773 -5.365 1.00 0.00 H new ATOM 0 HG11 VAL A 95 0.825 2.479 -3.441 1.00 0.00 H new ATOM 0 HG12 VAL A 95 0.833 3.705 -4.731 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -0.587 2.655 -4.510 1.00 0.00 H new ATOM 0 HG21 VAL A 95 1.035 0.080 -3.997 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -0.368 0.158 -5.090 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.197 -0.439 -5.691 1.00 0.00 H new ATOM 1514 N ALA A 96 0.314 4.144 -7.909 1.00 0.00 N ATOM 1515 CA ALA A 96 0.683 5.483 -8.351 1.00 0.00 C ATOM 1516 C ALA A 96 -0.203 6.539 -7.700 1.00 0.00 C ATOM 1517 O ALA A 96 -1.429 6.483 -7.800 1.00 0.00 O ATOM 1518 CB ALA A 96 0.598 5.581 -9.867 1.00 0.00 C ATOM 0 H ALA A 96 -0.645 3.876 -8.131 1.00 0.00 H new ATOM 0 HA ALA A 96 1.712 5.670 -8.043 1.00 0.00 H new ATOM 0 HB1 ALA A 96 0.876 6.586 -10.183 1.00 0.00 H new ATOM 0 HB2 ALA A 96 1.278 4.858 -10.317 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -0.422 5.369 -10.189 1.00 0.00 H new ATOM 1524 N VAL A 97 0.424 7.503 -7.033 1.00 0.00 N ATOM 1525 CA VAL A 97 -0.308 8.573 -6.366 1.00 0.00 C ATOM 1526 C VAL A 97 -0.145 9.895 -7.107 1.00 0.00 C ATOM 1527 O VAL A 97 0.887 10.559 -6.995 1.00 0.00 O ATOM 1528 CB VAL A 97 0.161 8.751 -4.910 1.00 0.00 C ATOM 1529 CG1 VAL A 97 -0.604 9.880 -4.237 1.00 0.00 C ATOM 1530 CG2 VAL A 97 0.000 7.451 -4.136 1.00 0.00 C ATOM 0 H VAL A 97 1.438 7.565 -6.940 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.360 8.286 -6.368 1.00 0.00 H new ATOM 0 HB VAL A 97 1.219 9.015 -4.917 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.259 9.991 -3.209 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.433 10.810 -4.780 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -1.669 9.650 -4.239 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.336 7.595 -3.109 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.049 7.155 -4.136 1.00 0.00 H new ATOM 0 HG23 VAL A 97 0.597 6.671 -4.607 1.00 0.00 H new ATOM 1540 N LYS A 98 -1.169 10.274 -7.863 1.00 0.00 N ATOM 1541 CA LYS A 98 -1.141 11.519 -8.622 1.00 0.00 C ATOM 1542 C LYS A 98 -2.457 12.276 -8.473 1.00 0.00 C ATOM 1543 O LYS A 98 -3.394 11.792 -7.839 1.00 0.00 O ATOM 1544 CB LYS A 98 -0.869 11.233 -10.100 1.00 0.00 C ATOM 1545 CG LYS A 98 -1.977 10.450 -10.783 1.00 0.00 C ATOM 1546 CD LYS A 98 -1.741 8.952 -10.688 1.00 0.00 C ATOM 1547 CE LYS A 98 -0.944 8.437 -11.877 1.00 0.00 C ATOM 1548 NZ LYS A 98 0.524 8.516 -11.637 1.00 0.00 N ATOM 0 H LYS A 98 -2.030 9.737 -7.967 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.338 12.140 -8.225 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -0.728 12.178 -10.624 1.00 0.00 H new ATOM 0 HB3 LYS A 98 0.064 10.677 -10.188 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -2.935 10.698 -10.325 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -2.039 10.744 -11.831 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -1.208 8.724 -9.765 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -2.699 8.434 -10.639 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -1.223 7.403 -12.081 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -1.199 9.017 -12.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 0.998 7.725 -12.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 0.889 9.416 -12.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 0.712 8.462 -10.616 1.00 0.00 H new ATOM 1562 N ASN A 99 -2.521 13.465 -9.064 1.00 0.00 N ATOM 1563 CA ASN A 99 -3.723 14.288 -8.998 1.00 0.00 C ATOM 1564 C ASN A 99 -4.700 13.913 -10.108 1.00 0.00 C ATOM 1565 O ASN A 99 -4.293 13.536 -11.207 1.00 0.00 O ATOM 1566 CB ASN A 99 -3.358 15.770 -9.103 1.00 0.00 C ATOM 1567 CG ASN A 99 -3.294 16.249 -10.541 1.00 0.00 C ATOM 1568 OD1 ASN A 99 -4.224 16.886 -11.036 1.00 0.00 O ATOM 1569 ND2 ASN A 99 -2.194 15.943 -11.218 1.00 0.00 N ATOM 0 H ASN A 99 -1.755 13.880 -9.594 1.00 0.00 H new ATOM 0 HA ASN A 99 -4.205 14.107 -8.037 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -4.093 16.362 -8.558 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -2.394 15.939 -8.623 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -2.094 16.238 -12.189 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -1.448 15.413 -10.767 1.00 0.00 H new ATOM 1576 N SER A 100 -5.992 14.021 -9.813 1.00 0.00 N ATOM 1577 CA SER A 100 -7.028 13.691 -10.785 1.00 0.00 C ATOM 1578 C SER A 100 -7.163 14.793 -11.831 1.00 0.00 C ATOM 1579 O SER A 100 -7.700 15.865 -11.553 1.00 0.00 O ATOM 1580 CB SER A 100 -8.368 13.474 -10.079 1.00 0.00 C ATOM 1581 OG SER A 100 -9.385 13.140 -11.008 1.00 0.00 O ATOM 0 H SER A 100 -6.346 14.334 -8.909 1.00 0.00 H new ATOM 0 HA SER A 100 -6.738 12.770 -11.290 1.00 0.00 H new ATOM 0 HB2 SER A 100 -8.269 12.678 -9.341 1.00 0.00 H new ATOM 0 HB3 SER A 100 -8.648 14.378 -9.537 1.00 0.00 H new ATOM 0 HG SER A 100 -10.231 13.005 -10.532 1.00 0.00 H new ATOM 1587 N GLY A 101 -6.672 14.521 -13.036 1.00 0.00 N ATOM 1588 CA GLY A 101 -6.747 15.499 -14.106 1.00 0.00 C ATOM 1589 C GLY A 101 -5.516 16.381 -14.172 1.00 0.00 C ATOM 1590 O GLY A 101 -5.412 17.368 -13.445 1.00 0.00 O ATOM 0 H GLY A 101 -6.224 13.641 -13.291 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -6.872 14.983 -15.058 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -7.630 16.122 -13.963 1.00 0.00 H new ATOM 1594 N GLY A 102 -4.580 16.025 -15.046 1.00 0.00 N ATOM 1595 CA GLY A 102 -3.362 16.801 -15.187 1.00 0.00 C ATOM 1596 C GLY A 102 -3.619 18.187 -15.744 1.00 0.00 C ATOM 1597 O GLY A 102 -4.016 19.095 -15.011 1.00 0.00 O ATOM 0 H GLY A 102 -4.644 15.212 -15.659 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -2.876 16.888 -14.215 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -2.671 16.271 -15.843 1.00 0.00 H new ATOM 1601 N PHE A 103 -3.392 18.353 -17.042 1.00 0.00 N ATOM 1602 CA PHE A 103 -3.600 19.640 -17.696 1.00 0.00 C ATOM 1603 C PHE A 103 -3.917 19.453 -19.177 1.00 0.00 C ATOM 1604 O PHE A 103 -3.688 18.382 -19.742 1.00 0.00 O ATOM 1605 CB PHE A 103 -2.360 20.523 -17.536 1.00 0.00 C ATOM 1606 CG PHE A 103 -2.562 21.932 -18.015 1.00 0.00 C ATOM 1607 CD1 PHE A 103 -3.521 22.745 -17.433 1.00 0.00 C ATOM 1608 CD2 PHE A 103 -1.792 22.444 -19.047 1.00 0.00 C ATOM 1609 CE1 PHE A 103 -3.709 24.042 -17.873 1.00 0.00 C ATOM 1610 CE2 PHE A 103 -1.975 23.740 -19.491 1.00 0.00 C ATOM 1611 CZ PHE A 103 -2.934 24.540 -18.902 1.00 0.00 C ATOM 0 H PHE A 103 -3.064 17.613 -17.662 1.00 0.00 H new ATOM 0 HA PHE A 103 -4.450 20.128 -17.220 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -2.071 20.543 -16.485 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -1.532 20.076 -18.086 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -4.128 22.361 -16.627 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -1.040 21.823 -19.510 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -4.461 24.665 -17.412 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -1.369 24.126 -20.297 1.00 0.00 H new ATOM 0 HZ PHE A 103 -3.078 25.554 -19.245 1.00 0.00 H new ATOM 1621 N LEU A 104 -4.445 20.501 -19.800 1.00 0.00 N ATOM 1622 CA LEU A 104 -4.794 20.453 -21.215 1.00 0.00 C ATOM 1623 C LEU A 104 -3.764 19.651 -22.004 1.00 0.00 C ATOM 1624 O LEU A 104 -4.100 18.661 -22.655 1.00 0.00 O ATOM 1625 CB LEU A 104 -4.898 21.870 -21.783 1.00 0.00 C ATOM 1626 CG LEU A 104 -5.945 22.777 -21.137 1.00 0.00 C ATOM 1627 CD1 LEU A 104 -5.871 24.179 -21.722 1.00 0.00 C ATOM 1628 CD2 LEU A 104 -7.340 22.195 -21.317 1.00 0.00 C ATOM 0 H LEU A 104 -4.641 21.394 -19.347 1.00 0.00 H new ATOM 0 HA LEU A 104 -5.761 19.958 -21.309 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -3.924 22.350 -21.690 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -5.117 21.798 -22.848 1.00 0.00 H new ATOM 0 HG LEU A 104 -5.734 22.839 -20.069 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -6.624 24.810 -21.250 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -4.881 24.597 -21.540 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -6.055 24.136 -22.795 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -8.072 22.854 -20.851 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -7.561 22.102 -22.380 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.387 21.212 -20.849 1.00 0.00 H new ATOM 1640 N SER A 105 -2.509 20.083 -21.939 1.00 0.00 N ATOM 1641 CA SER A 105 -1.430 19.406 -22.649 1.00 0.00 C ATOM 1642 C SER A 105 -1.597 17.892 -22.574 1.00 0.00 C ATOM 1643 O SER A 105 -1.938 17.243 -23.564 1.00 0.00 O ATOM 1644 CB SER A 105 -0.075 19.811 -22.065 1.00 0.00 C ATOM 1645 OG SER A 105 0.414 20.990 -22.681 1.00 0.00 O ATOM 0 H SER A 105 -2.214 20.899 -21.402 1.00 0.00 H new ATOM 0 HA SER A 105 -1.471 19.707 -23.696 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.172 19.971 -20.991 1.00 0.00 H new ATOM 0 HB3 SER A 105 0.641 19.001 -22.203 1.00 0.00 H new ATOM 0 HG SER A 105 1.280 21.229 -22.289 1.00 0.00 H new ATOM 1651 N LYS A 106 -1.354 17.334 -21.393 1.00 0.00 N ATOM 1652 CA LYS A 106 -1.478 15.896 -21.186 1.00 0.00 C ATOM 1653 C LYS A 106 -1.993 15.591 -19.783 1.00 0.00 C ATOM 1654 O LYS A 106 -1.676 16.299 -18.827 1.00 0.00 O ATOM 1655 CB LYS A 106 -0.128 15.210 -21.405 1.00 0.00 C ATOM 1656 CG LYS A 106 0.399 15.343 -22.823 1.00 0.00 C ATOM 1657 CD LYS A 106 1.918 15.349 -22.855 1.00 0.00 C ATOM 1658 CE LYS A 106 2.479 16.708 -22.464 1.00 0.00 C ATOM 1659 NZ LYS A 106 2.607 17.614 -23.638 1.00 0.00 N ATOM 0 H LYS A 106 -1.070 17.856 -20.564 1.00 0.00 H new ATOM 0 HA LYS A 106 -2.196 15.511 -21.910 1.00 0.00 H new ATOM 0 HB2 LYS A 106 0.601 15.633 -20.714 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -0.223 14.152 -21.160 1.00 0.00 H new ATOM 0 HG2 LYS A 106 0.025 14.519 -23.430 1.00 0.00 H new ATOM 0 HG3 LYS A 106 0.021 16.264 -23.268 1.00 0.00 H new ATOM 0 HD2 LYS A 106 2.300 14.587 -22.175 1.00 0.00 H new ATOM 0 HD3 LYS A 106 2.263 15.086 -23.855 1.00 0.00 H new ATOM 0 HE2 LYS A 106 1.830 17.168 -21.719 1.00 0.00 H new ATOM 0 HE3 LYS A 106 3.456 16.577 -21.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 2.993 18.529 -23.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 3.247 17.187 -24.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 1.671 17.760 -24.068 1.00 0.00 H new ATOM 1673 N ASP A 107 -2.788 14.532 -19.666 1.00 0.00 N ATOM 1674 CA ASP A 107 -3.344 14.132 -18.379 1.00 0.00 C ATOM 1675 C ASP A 107 -2.447 13.106 -17.694 1.00 0.00 C ATOM 1676 O ASP A 107 -2.888 12.372 -16.810 1.00 0.00 O ATOM 1677 CB ASP A 107 -4.749 13.556 -18.564 1.00 0.00 C ATOM 1678 CG ASP A 107 -5.827 14.618 -18.471 1.00 0.00 C ATOM 1679 OD1 ASP A 107 -5.740 15.618 -19.214 1.00 0.00 O ATOM 1680 OD2 ASP A 107 -6.758 14.449 -17.655 1.00 0.00 O ATOM 0 H ASP A 107 -3.061 13.936 -20.447 1.00 0.00 H new ATOM 0 HA ASP A 107 -3.402 15.017 -17.745 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -4.812 13.063 -19.534 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -4.928 12.793 -17.807 1.00 0.00 H new ATOM 1685 N LYS A 108 -1.186 13.061 -18.109 1.00 0.00 N ATOM 1686 CA LYS A 108 -0.225 12.126 -17.536 1.00 0.00 C ATOM 1687 C LYS A 108 0.440 12.719 -16.298 1.00 0.00 C ATOM 1688 O LYS A 108 1.355 12.126 -15.729 1.00 0.00 O ATOM 1689 CB LYS A 108 0.840 11.758 -18.572 1.00 0.00 C ATOM 1690 CG LYS A 108 1.847 12.866 -18.829 1.00 0.00 C ATOM 1691 CD LYS A 108 3.207 12.306 -19.212 1.00 0.00 C ATOM 1692 CE LYS A 108 3.314 12.080 -20.712 1.00 0.00 C ATOM 1693 NZ LYS A 108 2.692 10.791 -21.125 1.00 0.00 N ATOM 0 H LYS A 108 -0.805 13.661 -18.840 1.00 0.00 H new ATOM 0 HA LYS A 108 -0.764 11.226 -17.242 1.00 0.00 H new ATOM 0 HB2 LYS A 108 1.370 10.867 -18.235 1.00 0.00 H new ATOM 0 HB3 LYS A 108 0.349 11.500 -19.510 1.00 0.00 H new ATOM 0 HG2 LYS A 108 1.481 13.513 -19.626 1.00 0.00 H new ATOM 0 HG3 LYS A 108 1.945 13.484 -17.936 1.00 0.00 H new ATOM 0 HD2 LYS A 108 3.989 12.994 -18.890 1.00 0.00 H new ATOM 0 HD3 LYS A 108 3.375 11.365 -18.688 1.00 0.00 H new ATOM 0 HE2 LYS A 108 2.829 12.902 -21.239 1.00 0.00 H new ATOM 0 HE3 LYS A 108 4.363 12.088 -21.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 3.026 10.533 -22.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 2.958 10.045 -20.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 1.657 10.893 -21.138 1.00 0.00 H new ATOM 1707 N GLY A 109 -0.030 13.892 -15.885 1.00 0.00 N ATOM 1708 CA GLY A 109 0.530 14.545 -14.715 1.00 0.00 C ATOM 1709 C GLY A 109 0.694 13.596 -13.545 1.00 0.00 C ATOM 1710 O GLY A 109 -0.259 13.333 -12.810 1.00 0.00 O ATOM 0 H GLY A 109 -0.788 14.402 -16.339 1.00 0.00 H new ATOM 0 HA2 GLY A 109 1.499 14.973 -14.971 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -0.116 15.372 -14.420 1.00 0.00 H new ATOM 1714 N LEU A 110 1.904 13.077 -13.370 1.00 0.00 N ATOM 1715 CA LEU A 110 2.190 12.150 -12.281 1.00 0.00 C ATOM 1716 C LEU A 110 2.934 12.851 -11.149 1.00 0.00 C ATOM 1717 O LEU A 110 3.899 13.581 -11.385 1.00 0.00 O ATOM 1718 CB LEU A 110 3.016 10.969 -12.794 1.00 0.00 C ATOM 1719 CG LEU A 110 3.949 10.310 -11.778 1.00 0.00 C ATOM 1720 CD1 LEU A 110 3.150 9.514 -10.757 1.00 0.00 C ATOM 1721 CD2 LEU A 110 4.959 9.416 -12.482 1.00 0.00 C ATOM 0 H LEU A 110 2.704 13.283 -13.969 1.00 0.00 H new ATOM 0 HA LEU A 110 1.241 11.781 -11.893 1.00 0.00 H new ATOM 0 HB2 LEU A 110 2.331 10.211 -13.174 1.00 0.00 H new ATOM 0 HB3 LEU A 110 3.614 11.310 -13.639 1.00 0.00 H new ATOM 0 HG LEU A 110 4.493 11.094 -11.252 1.00 0.00 H new ATOM 0 HD11 LEU A 110 3.831 9.052 -10.042 1.00 0.00 H new ATOM 0 HD12 LEU A 110 2.467 10.180 -10.230 1.00 0.00 H new ATOM 0 HD13 LEU A 110 2.578 8.738 -11.267 1.00 0.00 H new ATOM 0 HD21 LEU A 110 5.615 8.955 -11.743 1.00 0.00 H new ATOM 0 HD22 LEU A 110 4.433 8.638 -13.035 1.00 0.00 H new ATOM 0 HD23 LEU A 110 5.554 10.013 -13.173 1.00 0.00 H new ATOM 1733 N LEU A 111 2.482 12.625 -9.921 1.00 0.00 N ATOM 1734 CA LEU A 111 3.106 13.233 -8.751 1.00 0.00 C ATOM 1735 C LEU A 111 4.142 12.296 -8.137 1.00 0.00 C ATOM 1736 O LEU A 111 5.229 12.723 -7.753 1.00 0.00 O ATOM 1737 CB LEU A 111 2.044 13.591 -7.710 1.00 0.00 C ATOM 1738 CG LEU A 111 1.003 14.625 -8.142 1.00 0.00 C ATOM 1739 CD1 LEU A 111 -0.061 14.791 -7.068 1.00 0.00 C ATOM 1740 CD2 LEU A 111 1.669 15.958 -8.446 1.00 0.00 C ATOM 0 H LEU A 111 1.685 12.025 -9.709 1.00 0.00 H new ATOM 0 HA LEU A 111 3.612 14.143 -9.072 1.00 0.00 H new ATOM 0 HB2 LEU A 111 1.523 12.678 -7.423 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.549 13.963 -6.818 1.00 0.00 H new ATOM 0 HG LEU A 111 0.520 14.268 -9.052 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.793 15.530 -7.392 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -0.560 13.837 -6.899 1.00 0.00 H new ATOM 0 HD13 LEU A 111 0.406 15.125 -6.142 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.913 16.681 -8.752 1.00 0.00 H new ATOM 0 HD22 LEU A 111 2.179 16.322 -7.554 1.00 0.00 H new ATOM 0 HD23 LEU A 111 2.393 15.828 -9.250 1.00 0.00 H new ATOM 1752 N GLY A 112 3.795 11.015 -8.050 1.00 0.00 N ATOM 1753 CA GLY A 112 4.706 10.038 -7.484 1.00 0.00 C ATOM 1754 C GLY A 112 4.166 8.624 -7.572 1.00 0.00 C ATOM 1755 O GLY A 112 3.012 8.368 -7.226 1.00 0.00 O ATOM 0 H GLY A 112 2.900 10.637 -8.361 1.00 0.00 H new ATOM 0 HA2 GLY A 112 5.662 10.092 -8.005 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.898 10.286 -6.440 1.00 0.00 H new ATOM 1759 N LYS A 113 5.002 7.701 -8.038 1.00 0.00 N ATOM 1760 CA LYS A 113 4.603 6.305 -8.171 1.00 0.00 C ATOM 1761 C LYS A 113 5.685 5.376 -7.629 1.00 0.00 C ATOM 1762 O LYS A 113 6.862 5.735 -7.588 1.00 0.00 O ATOM 1763 CB LYS A 113 4.319 5.972 -9.638 1.00 0.00 C ATOM 1764 CG LYS A 113 5.539 6.087 -10.535 1.00 0.00 C ATOM 1765 CD LYS A 113 5.180 5.870 -11.995 1.00 0.00 C ATOM 1766 CE LYS A 113 5.170 4.392 -12.353 1.00 0.00 C ATOM 1767 NZ LYS A 113 5.460 4.168 -13.796 1.00 0.00 N ATOM 0 H LYS A 113 5.960 7.895 -8.330 1.00 0.00 H new ATOM 0 HA LYS A 113 3.694 6.156 -7.588 1.00 0.00 H new ATOM 0 HB2 LYS A 113 3.926 4.957 -9.702 1.00 0.00 H new ATOM 0 HB3 LYS A 113 3.541 6.639 -10.009 1.00 0.00 H new ATOM 0 HG2 LYS A 113 5.990 7.072 -10.413 1.00 0.00 H new ATOM 0 HG3 LYS A 113 6.286 5.354 -10.230 1.00 0.00 H new ATOM 0 HD2 LYS A 113 4.200 6.301 -12.198 1.00 0.00 H new ATOM 0 HD3 LYS A 113 5.896 6.394 -12.628 1.00 0.00 H new ATOM 0 HE2 LYS A 113 5.910 3.867 -11.748 1.00 0.00 H new ATOM 0 HE3 LYS A 113 4.197 3.966 -12.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 5.444 3.148 -13.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 4.740 4.647 -14.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 6.399 4.552 -14.025 1.00 0.00 H new ATOM 1781 N VAL A 114 5.279 4.180 -7.214 1.00 0.00 N ATOM 1782 CA VAL A 114 6.213 3.199 -6.677 1.00 0.00 C ATOM 1783 C VAL A 114 5.688 1.780 -6.862 1.00 0.00 C ATOM 1784 O VAL A 114 4.587 1.451 -6.419 1.00 0.00 O ATOM 1785 CB VAL A 114 6.485 3.443 -5.181 1.00 0.00 C ATOM 1786 CG1 VAL A 114 5.202 3.301 -4.375 1.00 0.00 C ATOM 1787 CG2 VAL A 114 7.553 2.488 -4.670 1.00 0.00 C ATOM 0 H VAL A 114 4.308 3.868 -7.240 1.00 0.00 H new ATOM 0 HA VAL A 114 7.144 3.313 -7.232 1.00 0.00 H new ATOM 0 HB VAL A 114 6.853 4.462 -5.058 1.00 0.00 H new ATOM 0 HG11 VAL A 114 5.414 3.477 -3.320 1.00 0.00 H new ATOM 0 HG12 VAL A 114 4.470 4.029 -4.725 1.00 0.00 H new ATOM 0 HG13 VAL A 114 4.802 2.295 -4.502 1.00 0.00 H new ATOM 0 HG21 VAL A 114 7.732 2.675 -3.611 1.00 0.00 H new ATOM 0 HG22 VAL A 114 7.217 1.460 -4.805 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.477 2.644 -5.227 1.00 0.00 H new ATOM 1797 N LEU A 115 6.482 0.942 -7.520 1.00 0.00 N ATOM 1798 CA LEU A 115 6.097 -0.443 -7.764 1.00 0.00 C ATOM 1799 C LEU A 115 6.580 -1.350 -6.636 1.00 0.00 C ATOM 1800 O LEU A 115 7.655 -1.139 -6.073 1.00 0.00 O ATOM 1801 CB LEU A 115 6.668 -0.924 -9.099 1.00 0.00 C ATOM 1802 CG LEU A 115 5.886 -0.516 -10.349 1.00 0.00 C ATOM 1803 CD1 LEU A 115 4.545 -1.231 -10.397 1.00 0.00 C ATOM 1804 CD2 LEU A 115 5.690 0.993 -10.385 1.00 0.00 C ATOM 0 H LEU A 115 7.396 1.198 -7.894 1.00 0.00 H new ATOM 0 HA LEU A 115 5.009 -0.490 -7.803 1.00 0.00 H new ATOM 0 HB2 LEU A 115 7.686 -0.547 -9.193 1.00 0.00 H new ATOM 0 HB3 LEU A 115 6.732 -2.012 -9.073 1.00 0.00 H new ATOM 0 HG LEU A 115 6.462 -0.809 -11.227 1.00 0.00 H new ATOM 0 HD11 LEU A 115 4.003 -0.928 -11.293 1.00 0.00 H new ATOM 0 HD12 LEU A 115 4.708 -2.309 -10.418 1.00 0.00 H new ATOM 0 HD13 LEU A 115 3.961 -0.970 -9.514 1.00 0.00 H new ATOM 0 HD21 LEU A 115 5.132 1.266 -11.281 1.00 0.00 H new ATOM 0 HD22 LEU A 115 5.135 1.309 -9.501 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.662 1.486 -10.399 1.00 0.00 H new ATOM 1816 N VAL A 116 5.781 -2.361 -6.312 1.00 0.00 N ATOM 1817 CA VAL A 116 6.128 -3.301 -5.254 1.00 0.00 C ATOM 1818 C VAL A 116 6.019 -4.742 -5.741 1.00 0.00 C ATOM 1819 O VAL A 116 4.933 -5.213 -6.078 1.00 0.00 O ATOM 1820 CB VAL A 116 5.223 -3.118 -4.021 1.00 0.00 C ATOM 1821 CG1 VAL A 116 5.558 -4.150 -2.955 1.00 0.00 C ATOM 1822 CG2 VAL A 116 5.355 -1.707 -3.468 1.00 0.00 C ATOM 0 H VAL A 116 4.888 -2.550 -6.768 1.00 0.00 H new ATOM 0 HA VAL A 116 7.160 -3.093 -4.972 1.00 0.00 H new ATOM 0 HB VAL A 116 4.188 -3.269 -4.326 1.00 0.00 H new ATOM 0 HG11 VAL A 116 4.909 -4.005 -2.092 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.408 -5.151 -3.358 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.598 -4.034 -2.650 1.00 0.00 H new ATOM 0 HG21 VAL A 116 4.709 -1.595 -2.597 1.00 0.00 H new ATOM 0 HG22 VAL A 116 6.390 -1.525 -3.178 1.00 0.00 H new ATOM 0 HG23 VAL A 116 5.061 -0.988 -4.232 1.00 0.00 H new ATOM 1832 N ALA A 117 7.151 -5.436 -5.776 1.00 0.00 N ATOM 1833 CA ALA A 117 7.183 -6.824 -6.220 1.00 0.00 C ATOM 1834 C ALA A 117 6.587 -7.752 -5.166 1.00 0.00 C ATOM 1835 O ALA A 117 7.158 -7.935 -4.090 1.00 0.00 O ATOM 1836 CB ALA A 117 8.609 -7.242 -6.546 1.00 0.00 C ATOM 0 H ALA A 117 8.059 -5.060 -5.502 1.00 0.00 H new ATOM 0 HA ALA A 117 6.577 -6.904 -7.122 1.00 0.00 H new ATOM 0 HB1 ALA A 117 8.617 -8.281 -6.876 1.00 0.00 H new ATOM 0 HB2 ALA A 117 9.002 -6.606 -7.339 1.00 0.00 H new ATOM 0 HB3 ALA A 117 9.231 -7.139 -5.657 1.00 0.00 H new ATOM 1842 N LEU A 118 5.435 -8.333 -5.481 1.00 0.00 N ATOM 1843 CA LEU A 118 4.760 -9.242 -4.560 1.00 0.00 C ATOM 1844 C LEU A 118 5.313 -10.657 -4.688 1.00 0.00 C ATOM 1845 O LEU A 118 4.619 -11.634 -4.407 1.00 0.00 O ATOM 1846 CB LEU A 118 3.254 -9.244 -4.828 1.00 0.00 C ATOM 1847 CG LEU A 118 2.621 -7.883 -5.115 1.00 0.00 C ATOM 1848 CD1 LEU A 118 1.178 -8.049 -5.568 1.00 0.00 C ATOM 1849 CD2 LEU A 118 2.696 -6.989 -3.886 1.00 0.00 C ATOM 0 H LEU A 118 4.949 -8.191 -6.366 1.00 0.00 H new ATOM 0 HA LEU A 118 4.942 -8.892 -3.544 1.00 0.00 H new ATOM 0 HB2 LEU A 118 3.057 -9.900 -5.676 1.00 0.00 H new ATOM 0 HB3 LEU A 118 2.752 -9.681 -3.964 1.00 0.00 H new ATOM 0 HG LEU A 118 3.181 -7.407 -5.920 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.744 -7.069 -5.768 1.00 0.00 H new ATOM 0 HD12 LEU A 118 1.149 -8.651 -6.476 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.606 -8.546 -4.785 1.00 0.00 H new ATOM 0 HD21 LEU A 118 2.240 -6.024 -4.109 1.00 0.00 H new ATOM 0 HD22 LEU A 118 2.162 -7.460 -3.060 1.00 0.00 H new ATOM 0 HD23 LEU A 118 3.739 -6.842 -3.606 1.00 0.00 H new ATOM 1861 N ALA A 119 6.568 -10.760 -5.113 1.00 0.00 N ATOM 1862 CA ALA A 119 7.216 -12.056 -5.274 1.00 0.00 C ATOM 1863 C ALA A 119 7.941 -12.470 -3.998 1.00 0.00 C ATOM 1864 O ALA A 119 8.825 -13.326 -4.024 1.00 0.00 O ATOM 1865 CB ALA A 119 8.187 -12.018 -6.445 1.00 0.00 C ATOM 0 H ALA A 119 7.156 -9.962 -5.352 1.00 0.00 H new ATOM 0 HA ALA A 119 6.444 -12.797 -5.479 1.00 0.00 H new ATOM 0 HB1 ALA A 119 8.664 -12.992 -6.554 1.00 0.00 H new ATOM 0 HB2 ALA A 119 7.645 -11.775 -7.359 1.00 0.00 H new ATOM 0 HB3 ALA A 119 8.948 -11.260 -6.262 1.00 0.00 H new ATOM 1871 N SER A 120 7.561 -11.856 -2.881 1.00 0.00 N ATOM 1872 CA SER A 120 8.178 -12.158 -1.595 1.00 0.00 C ATOM 1873 C SER A 120 7.434 -13.287 -0.888 1.00 0.00 C ATOM 1874 O SER A 120 6.245 -13.501 -1.120 1.00 0.00 O ATOM 1875 CB SER A 120 8.197 -10.911 -0.710 1.00 0.00 C ATOM 1876 OG SER A 120 9.256 -10.042 -1.075 1.00 0.00 O ATOM 0 H SER A 120 6.829 -11.147 -2.841 1.00 0.00 H new ATOM 0 HA SER A 120 9.203 -12.480 -1.778 1.00 0.00 H new ATOM 0 HB2 SER A 120 7.246 -10.386 -0.796 1.00 0.00 H new ATOM 0 HB3 SER A 120 8.306 -11.204 0.334 1.00 0.00 H new ATOM 0 HG SER A 120 9.245 -9.252 -0.495 1.00 0.00 H new ATOM 1882 N GLU A 121 8.144 -14.004 -0.022 1.00 0.00 N ATOM 1883 CA GLU A 121 7.552 -15.111 0.719 1.00 0.00 C ATOM 1884 C GLU A 121 7.116 -14.663 2.111 1.00 0.00 C ATOM 1885 O GLU A 121 7.021 -15.472 3.033 1.00 0.00 O ATOM 1886 CB GLU A 121 8.546 -16.269 0.832 1.00 0.00 C ATOM 1887 CG GLU A 121 7.901 -17.590 1.215 1.00 0.00 C ATOM 1888 CD GLU A 121 8.879 -18.549 1.865 1.00 0.00 C ATOM 1889 OE1 GLU A 121 9.562 -18.138 2.826 1.00 0.00 O ATOM 1890 OE2 GLU A 121 8.961 -19.710 1.413 1.00 0.00 O ATOM 0 H GLU A 121 9.129 -13.838 0.183 1.00 0.00 H new ATOM 0 HA GLU A 121 6.672 -15.450 0.173 1.00 0.00 H new ATOM 0 HB2 GLU A 121 9.061 -16.389 -0.121 1.00 0.00 H new ATOM 0 HB3 GLU A 121 9.303 -16.016 1.574 1.00 0.00 H new ATOM 0 HG2 GLU A 121 7.074 -17.401 1.899 1.00 0.00 H new ATOM 0 HG3 GLU A 121 7.479 -18.056 0.325 1.00 0.00 H new ATOM 1897 N GLU A 122 6.855 -13.367 2.254 1.00 0.00 N ATOM 1898 CA GLU A 122 6.431 -12.811 3.534 1.00 0.00 C ATOM 1899 C GLU A 122 4.938 -12.498 3.523 1.00 0.00 C ATOM 1900 O GLU A 122 4.343 -12.219 4.565 1.00 0.00 O ATOM 1901 CB GLU A 122 7.227 -11.543 3.853 1.00 0.00 C ATOM 1902 CG GLU A 122 8.731 -11.757 3.867 1.00 0.00 C ATOM 1903 CD GLU A 122 9.501 -10.468 4.080 1.00 0.00 C ATOM 1904 OE1 GLU A 122 9.654 -9.700 3.107 1.00 0.00 O ATOM 1905 OE2 GLU A 122 9.951 -10.227 5.220 1.00 0.00 O ATOM 0 H GLU A 122 6.930 -12.684 1.501 1.00 0.00 H new ATOM 0 HA GLU A 122 6.623 -13.556 4.306 1.00 0.00 H new ATOM 0 HB2 GLU A 122 6.984 -10.777 3.117 1.00 0.00 H new ATOM 0 HB3 GLU A 122 6.913 -11.162 4.825 1.00 0.00 H new ATOM 0 HG2 GLU A 122 8.987 -12.463 4.657 1.00 0.00 H new ATOM 0 HG3 GLU A 122 9.039 -12.208 2.924 1.00 0.00 H new ATOM 1912 N LEU A 123 4.338 -12.545 2.339 1.00 0.00 N ATOM 1913 CA LEU A 123 2.914 -12.266 2.191 1.00 0.00 C ATOM 1914 C LEU A 123 2.086 -13.150 3.120 1.00 0.00 C ATOM 1915 O LEU A 123 1.070 -12.717 3.661 1.00 0.00 O ATOM 1916 CB LEU A 123 2.479 -12.484 0.741 1.00 0.00 C ATOM 1917 CG LEU A 123 2.933 -11.423 -0.262 1.00 0.00 C ATOM 1918 CD1 LEU A 123 2.982 -12.003 -1.667 1.00 0.00 C ATOM 1919 CD2 LEU A 123 2.009 -10.214 -0.214 1.00 0.00 C ATOM 0 H LEU A 123 4.816 -12.774 1.467 1.00 0.00 H new ATOM 0 HA LEU A 123 2.743 -11.224 2.463 1.00 0.00 H new ATOM 0 HB2 LEU A 123 2.856 -13.452 0.411 1.00 0.00 H new ATOM 0 HB3 LEU A 123 1.391 -12.539 0.713 1.00 0.00 H new ATOM 0 HG LEU A 123 3.937 -11.099 0.010 1.00 0.00 H new ATOM 0 HD11 LEU A 123 3.307 -11.233 -2.367 1.00 0.00 H new ATOM 0 HD12 LEU A 123 3.684 -12.837 -1.692 1.00 0.00 H new ATOM 0 HD13 LEU A 123 1.990 -12.355 -1.950 1.00 0.00 H new ATOM 0 HD21 LEU A 123 2.347 -9.469 -0.934 1.00 0.00 H new ATOM 0 HD22 LEU A 123 0.993 -10.522 -0.461 1.00 0.00 H new ATOM 0 HD23 LEU A 123 2.024 -9.784 0.787 1.00 0.00 H new ATOM 1931 N ALA A 124 2.531 -14.389 3.301 1.00 0.00 N ATOM 1932 CA ALA A 124 1.835 -15.332 4.167 1.00 0.00 C ATOM 1933 C ALA A 124 1.388 -14.661 5.461 1.00 0.00 C ATOM 1934 O ALA A 124 0.384 -15.048 6.059 1.00 0.00 O ATOM 1935 CB ALA A 124 2.726 -16.527 4.470 1.00 0.00 C ATOM 0 H ALA A 124 3.371 -14.763 2.859 1.00 0.00 H new ATOM 0 HA ALA A 124 0.945 -15.680 3.643 1.00 0.00 H new ATOM 0 HB1 ALA A 124 2.193 -17.223 5.118 1.00 0.00 H new ATOM 0 HB2 ALA A 124 2.991 -17.028 3.539 1.00 0.00 H new ATOM 0 HB3 ALA A 124 3.633 -16.187 4.970 1.00 0.00 H new ATOM 1941 N LYS A 125 2.140 -13.653 5.890 1.00 0.00 N ATOM 1942 CA LYS A 125 1.822 -12.927 7.114 1.00 0.00 C ATOM 1943 C LYS A 125 1.384 -11.500 6.801 1.00 0.00 C ATOM 1944 O LYS A 125 0.291 -11.079 7.180 1.00 0.00 O ATOM 1945 CB LYS A 125 3.034 -12.906 8.049 1.00 0.00 C ATOM 1946 CG LYS A 125 3.126 -14.124 8.952 1.00 0.00 C ATOM 1947 CD LYS A 125 4.561 -14.403 9.367 1.00 0.00 C ATOM 1948 CE LYS A 125 4.960 -13.579 10.582 1.00 0.00 C ATOM 1949 NZ LYS A 125 6.423 -13.655 10.847 1.00 0.00 N ATOM 0 H LYS A 125 2.975 -13.320 5.408 1.00 0.00 H new ATOM 0 HA LYS A 125 0.998 -13.442 7.609 1.00 0.00 H new ATOM 0 HB2 LYS A 125 3.943 -12.838 7.451 1.00 0.00 H new ATOM 0 HB3 LYS A 125 2.991 -12.009 8.666 1.00 0.00 H new ATOM 0 HG2 LYS A 125 2.513 -13.967 9.840 1.00 0.00 H new ATOM 0 HG3 LYS A 125 2.720 -14.993 8.434 1.00 0.00 H new ATOM 0 HD2 LYS A 125 4.676 -15.463 9.591 1.00 0.00 H new ATOM 0 HD3 LYS A 125 5.231 -14.178 8.537 1.00 0.00 H new ATOM 0 HE2 LYS A 125 4.673 -12.539 10.426 1.00 0.00 H new ATOM 0 HE3 LYS A 125 4.414 -13.933 11.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 6.655 -13.081 11.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 6.693 -14.644 11.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 6.944 -13.294 10.023 1.00 0.00 H new ATOM 1963 N GLY A 126 2.243 -10.760 6.107 1.00 0.00 N ATOM 1964 CA GLY A 126 1.925 -9.389 5.754 1.00 0.00 C ATOM 1965 C GLY A 126 2.841 -8.388 6.431 1.00 0.00 C ATOM 1966 O GLY A 126 3.370 -8.653 7.511 1.00 0.00 O ATOM 0 H GLY A 126 3.154 -11.086 5.783 1.00 0.00 H new ATOM 0 HA2 GLY A 126 1.997 -9.269 4.673 1.00 0.00 H new ATOM 0 HA3 GLY A 126 0.892 -9.176 6.030 1.00 0.00 H new ATOM 1970 N TRP A 127 3.030 -7.238 5.796 1.00 0.00 N ATOM 1971 CA TRP A 127 3.891 -6.195 6.343 1.00 0.00 C ATOM 1972 C TRP A 127 3.355 -4.810 5.998 1.00 0.00 C ATOM 1973 O TRP A 127 2.616 -4.643 5.027 1.00 0.00 O ATOM 1974 CB TRP A 127 5.317 -6.351 5.812 1.00 0.00 C ATOM 1975 CG TRP A 127 5.451 -6.003 4.360 1.00 0.00 C ATOM 1976 CD1 TRP A 127 5.738 -4.776 3.835 1.00 0.00 C ATOM 1977 CD2 TRP A 127 5.301 -6.893 3.249 1.00 0.00 C ATOM 1978 NE1 TRP A 127 5.776 -4.849 2.463 1.00 0.00 N ATOM 1979 CE2 TRP A 127 5.512 -6.137 2.079 1.00 0.00 C ATOM 1980 CE3 TRP A 127 5.012 -8.255 3.127 1.00 0.00 C ATOM 1981 CZ2 TRP A 127 5.441 -6.699 0.807 1.00 0.00 C ATOM 1982 CZ3 TRP A 127 4.941 -8.811 1.864 1.00 0.00 C ATOM 1983 CH2 TRP A 127 5.156 -8.034 0.718 1.00 0.00 C ATOM 0 H TRP A 127 2.599 -7.003 4.902 1.00 0.00 H new ATOM 0 HA TRP A 127 3.902 -6.300 7.428 1.00 0.00 H new ATOM 0 HB2 TRP A 127 5.985 -5.716 6.394 1.00 0.00 H new ATOM 0 HB3 TRP A 127 5.643 -7.380 5.963 1.00 0.00 H new ATOM 0 HD1 TRP A 127 5.910 -3.880 4.413 1.00 0.00 H new ATOM 0 HE1 TRP A 127 5.969 -4.070 1.833 1.00 0.00 H new ATOM 0 HE3 TRP A 127 4.847 -8.862 4.005 1.00 0.00 H new ATOM 0 HZ2 TRP A 127 5.605 -6.102 -0.078 1.00 0.00 H new ATOM 0 HZ3 TRP A 127 4.716 -9.862 1.758 1.00 0.00 H new ATOM 0 HH2 TRP A 127 5.095 -8.498 -0.255 1.00 0.00 H new ATOM 1994 N THR A 128 3.732 -3.818 6.798 1.00 0.00 N ATOM 1995 CA THR A 128 3.288 -2.447 6.577 1.00 0.00 C ATOM 1996 C THR A 128 4.468 -1.482 6.570 1.00 0.00 C ATOM 1997 O THR A 128 5.327 -1.531 7.449 1.00 0.00 O ATOM 1998 CB THR A 128 2.282 -2.002 7.655 1.00 0.00 C ATOM 1999 OG1 THR A 128 1.115 -2.829 7.608 1.00 0.00 O ATOM 2000 CG2 THR A 128 1.887 -0.546 7.458 1.00 0.00 C ATOM 0 H THR A 128 4.344 -3.938 7.605 1.00 0.00 H new ATOM 0 HA THR A 128 2.799 -2.426 5.603 1.00 0.00 H new ATOM 0 HB THR A 128 2.759 -2.104 8.630 1.00 0.00 H new ATOM 0 HG1 THR A 128 0.481 -2.540 8.298 1.00 0.00 H new ATOM 0 HG21 THR A 128 1.176 -0.254 8.231 1.00 0.00 H new ATOM 0 HG22 THR A 128 2.774 0.084 7.525 1.00 0.00 H new ATOM 0 HG23 THR A 128 1.428 -0.423 6.477 1.00 0.00 H new ATOM 2008 N GLN A 129 4.502 -0.605 5.572 1.00 0.00 N ATOM 2009 CA GLN A 129 5.578 0.372 5.451 1.00 0.00 C ATOM 2010 C GLN A 129 5.201 1.478 4.470 1.00 0.00 C ATOM 2011 O GLN A 129 4.339 1.292 3.611 1.00 0.00 O ATOM 2012 CB GLN A 129 6.868 -0.312 4.996 1.00 0.00 C ATOM 2013 CG GLN A 129 6.873 -0.682 3.522 1.00 0.00 C ATOM 2014 CD GLN A 129 8.274 -0.869 2.972 1.00 0.00 C ATOM 2015 OE1 GLN A 129 8.778 -1.990 2.893 1.00 0.00 O ATOM 2016 NE2 GLN A 129 8.911 0.231 2.588 1.00 0.00 N ATOM 0 H GLN A 129 3.798 -0.551 4.836 1.00 0.00 H new ATOM 0 HA GLN A 129 5.740 0.820 6.431 1.00 0.00 H new ATOM 0 HB2 GLN A 129 7.711 0.349 5.199 1.00 0.00 H new ATOM 0 HB3 GLN A 129 7.020 -1.214 5.589 1.00 0.00 H new ATOM 0 HG2 GLN A 129 6.305 -1.602 3.380 1.00 0.00 H new ATOM 0 HG3 GLN A 129 6.365 0.097 2.954 1.00 0.00 H new ATOM 0 HE21 GLN A 129 8.455 1.140 2.671 1.00 0.00 H new ATOM 0 HE22 GLN A 129 9.856 0.167 2.210 1.00 0.00 H new ATOM 2025 N TRP A 130 5.853 2.627 4.603 1.00 0.00 N ATOM 2026 CA TRP A 130 5.586 3.763 3.728 1.00 0.00 C ATOM 2027 C TRP A 130 6.471 3.714 2.487 1.00 0.00 C ATOM 2028 O TRP A 130 7.646 4.079 2.536 1.00 0.00 O ATOM 2029 CB TRP A 130 5.812 5.076 4.479 1.00 0.00 C ATOM 2030 CG TRP A 130 4.798 5.328 5.554 1.00 0.00 C ATOM 2031 CD1 TRP A 130 4.683 4.666 6.743 1.00 0.00 C ATOM 2032 CD2 TRP A 130 3.756 6.309 5.536 1.00 0.00 C ATOM 2033 NE1 TRP A 130 3.632 5.177 7.466 1.00 0.00 N ATOM 2034 CE2 TRP A 130 3.048 6.187 6.748 1.00 0.00 C ATOM 2035 CE3 TRP A 130 3.353 7.280 4.616 1.00 0.00 C ATOM 2036 CZ2 TRP A 130 1.961 6.999 7.059 1.00 0.00 C ATOM 2037 CZ3 TRP A 130 2.274 8.085 4.926 1.00 0.00 C ATOM 2038 CH2 TRP A 130 1.588 7.941 6.140 1.00 0.00 C ATOM 0 H TRP A 130 6.570 2.797 5.308 1.00 0.00 H new ATOM 0 HA TRP A 130 4.544 3.709 3.411 1.00 0.00 H new ATOM 0 HB2 TRP A 130 6.807 5.065 4.924 1.00 0.00 H new ATOM 0 HB3 TRP A 130 5.790 5.902 3.768 1.00 0.00 H new ATOM 0 HD1 TRP A 130 5.324 3.859 7.067 1.00 0.00 H new ATOM 0 HE1 TRP A 130 3.335 4.856 8.388 1.00 0.00 H new ATOM 0 HE3 TRP A 130 3.876 7.399 3.679 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 1.431 6.889 7.993 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 1.954 8.838 4.221 1.00 0.00 H new ATOM 0 HH2 TRP A 130 0.749 8.586 6.354 1.00 0.00 H new ATOM 2049 N TYR A 131 5.900 3.261 1.376 1.00 0.00 N ATOM 2050 CA TYR A 131 6.638 3.163 0.123 1.00 0.00 C ATOM 2051 C TYR A 131 6.921 4.547 -0.453 1.00 0.00 C ATOM 2052 O TYR A 131 6.040 5.182 -1.033 1.00 0.00 O ATOM 2053 CB TYR A 131 5.855 2.326 -0.890 1.00 0.00 C ATOM 2054 CG TYR A 131 5.629 0.897 -0.451 1.00 0.00 C ATOM 2055 CD1 TYR A 131 6.679 0.122 0.027 1.00 0.00 C ATOM 2056 CD2 TYR A 131 4.366 0.322 -0.512 1.00 0.00 C ATOM 2057 CE1 TYR A 131 6.478 -1.184 0.429 1.00 0.00 C ATOM 2058 CE2 TYR A 131 4.155 -0.983 -0.110 1.00 0.00 C ATOM 2059 CZ TYR A 131 5.214 -1.732 0.358 1.00 0.00 C ATOM 2060 OH TYR A 131 5.009 -3.032 0.759 1.00 0.00 O ATOM 0 H TYR A 131 4.928 2.956 1.318 1.00 0.00 H new ATOM 0 HA TYR A 131 7.590 2.674 0.329 1.00 0.00 H new ATOM 0 HB2 TYR A 131 4.889 2.799 -1.070 1.00 0.00 H new ATOM 0 HB3 TYR A 131 6.391 2.325 -1.839 1.00 0.00 H new ATOM 0 HD1 TYR A 131 7.670 0.548 0.085 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.535 0.905 -0.880 1.00 0.00 H new ATOM 0 HE1 TYR A 131 7.305 -1.773 0.797 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.166 -1.414 -0.162 1.00 0.00 H new ATOM 0 HH TYR A 131 4.250 -3.068 1.378 1.00 0.00 H new ATOM 2070 N ASP A 132 8.156 5.007 -0.290 1.00 0.00 N ATOM 2071 CA ASP A 132 8.557 6.315 -0.794 1.00 0.00 C ATOM 2072 C ASP A 132 8.358 6.400 -2.305 1.00 0.00 C ATOM 2073 O ASP A 132 9.008 5.683 -3.068 1.00 0.00 O ATOM 2074 CB ASP A 132 10.020 6.594 -0.444 1.00 0.00 C ATOM 2075 CG ASP A 132 10.484 7.951 -0.936 1.00 0.00 C ATOM 2076 OD1 ASP A 132 10.198 8.288 -2.104 1.00 0.00 O ATOM 2077 OD2 ASP A 132 11.136 8.675 -0.154 1.00 0.00 O ATOM 0 H ASP A 132 8.897 4.494 0.187 1.00 0.00 H new ATOM 0 HA ASP A 132 7.928 7.068 -0.319 1.00 0.00 H new ATOM 0 HB2 ASP A 132 10.149 6.539 0.637 1.00 0.00 H new ATOM 0 HB3 ASP A 132 10.649 5.818 -0.880 1.00 0.00 H new ATOM 2082 N LEU A 133 7.457 7.277 -2.729 1.00 0.00 N ATOM 2083 CA LEU A 133 7.171 7.455 -4.149 1.00 0.00 C ATOM 2084 C LEU A 133 8.392 7.995 -4.887 1.00 0.00 C ATOM 2085 O LEU A 133 9.145 8.809 -4.351 1.00 0.00 O ATOM 2086 CB LEU A 133 5.986 8.404 -4.336 1.00 0.00 C ATOM 2087 CG LEU A 133 4.658 7.947 -3.732 1.00 0.00 C ATOM 2088 CD1 LEU A 133 3.639 9.076 -3.766 1.00 0.00 C ATOM 2089 CD2 LEU A 133 4.128 6.727 -4.472 1.00 0.00 C ATOM 0 H LEU A 133 6.911 7.877 -2.111 1.00 0.00 H new ATOM 0 HA LEU A 133 6.918 6.481 -4.568 1.00 0.00 H new ATOM 0 HB2 LEU A 133 6.247 9.369 -3.901 1.00 0.00 H new ATOM 0 HB3 LEU A 133 5.840 8.565 -5.404 1.00 0.00 H new ATOM 0 HG LEU A 133 4.830 7.671 -2.692 1.00 0.00 H new ATOM 0 HD11 LEU A 133 2.700 8.732 -3.332 1.00 0.00 H new ATOM 0 HD12 LEU A 133 4.015 9.923 -3.192 1.00 0.00 H new ATOM 0 HD13 LEU A 133 3.471 9.383 -4.798 1.00 0.00 H new ATOM 0 HD21 LEU A 133 3.182 6.415 -4.029 1.00 0.00 H new ATOM 0 HD22 LEU A 133 3.972 6.977 -5.521 1.00 0.00 H new ATOM 0 HD23 LEU A 133 4.850 5.914 -4.396 1.00 0.00 H new ATOM 2101 N THR A 134 8.581 7.539 -6.121 1.00 0.00 N ATOM 2102 CA THR A 134 9.709 7.977 -6.933 1.00 0.00 C ATOM 2103 C THR A 134 9.240 8.519 -8.279 1.00 0.00 C ATOM 2104 O THR A 134 8.056 8.452 -8.606 1.00 0.00 O ATOM 2105 CB THR A 134 10.707 6.829 -7.174 1.00 0.00 C ATOM 2106 OG1 THR A 134 10.066 5.765 -7.887 1.00 0.00 O ATOM 2107 CG2 THR A 134 11.257 6.304 -5.856 1.00 0.00 C ATOM 0 H THR A 134 7.967 6.866 -6.580 1.00 0.00 H new ATOM 0 HA THR A 134 10.208 8.772 -6.378 1.00 0.00 H new ATOM 0 HB THR A 134 11.536 7.216 -7.767 1.00 0.00 H new ATOM 0 HG1 THR A 134 10.707 5.039 -8.038 1.00 0.00 H new ATOM 0 HG21 THR A 134 11.960 5.494 -6.052 1.00 0.00 H new ATOM 0 HG22 THR A 134 11.769 7.109 -5.329 1.00 0.00 H new ATOM 0 HG23 THR A 134 10.437 5.932 -5.242 1.00 0.00 H new ATOM 2115 N GLU A 135 10.177 9.054 -9.055 1.00 0.00 N ATOM 2116 CA GLU A 135 9.858 9.607 -10.366 1.00 0.00 C ATOM 2117 C GLU A 135 9.699 8.497 -11.401 1.00 0.00 C ATOM 2118 O GLU A 135 10.017 7.337 -11.137 1.00 0.00 O ATOM 2119 CB GLU A 135 10.950 10.582 -10.812 1.00 0.00 C ATOM 2120 CG GLU A 135 11.072 11.807 -9.922 1.00 0.00 C ATOM 2121 CD GLU A 135 12.321 12.617 -10.213 1.00 0.00 C ATOM 2122 OE1 GLU A 135 13.408 12.012 -10.317 1.00 0.00 O ATOM 2123 OE2 GLU A 135 12.211 13.855 -10.336 1.00 0.00 O ATOM 0 H GLU A 135 11.162 9.116 -8.799 1.00 0.00 H new ATOM 0 HA GLU A 135 8.912 10.143 -10.285 1.00 0.00 H new ATOM 0 HB2 GLU A 135 11.907 10.060 -10.830 1.00 0.00 H new ATOM 0 HB3 GLU A 135 10.743 10.904 -11.833 1.00 0.00 H new ATOM 0 HG2 GLU A 135 10.194 12.439 -10.057 1.00 0.00 H new ATOM 0 HG3 GLU A 135 11.082 11.494 -8.878 1.00 0.00 H new ATOM 2130 N ASP A 136 9.203 8.861 -12.578 1.00 0.00 N ATOM 2131 CA ASP A 136 9.001 7.897 -13.654 1.00 0.00 C ATOM 2132 C ASP A 136 10.331 7.502 -14.287 1.00 0.00 C ATOM 2133 O ASP A 136 11.187 8.351 -14.536 1.00 0.00 O ATOM 2134 CB ASP A 136 8.067 8.476 -14.718 1.00 0.00 C ATOM 2135 CG ASP A 136 8.466 9.877 -15.138 1.00 0.00 C ATOM 2136 OD1 ASP A 136 9.455 10.012 -15.889 1.00 0.00 O ATOM 2137 OD2 ASP A 136 7.790 10.838 -14.716 1.00 0.00 O ATOM 0 H ASP A 136 8.933 9.817 -12.812 1.00 0.00 H new ATOM 0 HA ASP A 136 8.543 7.004 -13.227 1.00 0.00 H new ATOM 0 HB2 ASP A 136 8.068 7.824 -15.591 1.00 0.00 H new ATOM 0 HB3 ASP A 136 7.048 8.492 -14.333 1.00 0.00 H new ATOM 2142 N SER A 137 10.498 6.208 -14.543 1.00 0.00 N ATOM 2143 CA SER A 137 11.727 5.700 -15.142 1.00 0.00 C ATOM 2144 C SER A 137 11.449 5.081 -16.509 1.00 0.00 C ATOM 2145 O SER A 137 10.371 4.539 -16.750 1.00 0.00 O ATOM 2146 CB SER A 137 12.377 4.665 -14.223 1.00 0.00 C ATOM 2147 OG SER A 137 11.546 3.527 -14.068 1.00 0.00 O ATOM 0 H SER A 137 9.798 5.493 -14.345 1.00 0.00 H new ATOM 0 HA SER A 137 12.411 6.538 -15.274 1.00 0.00 H new ATOM 0 HB2 SER A 137 13.340 4.363 -14.634 1.00 0.00 H new ATOM 0 HB3 SER A 137 12.573 5.112 -13.248 1.00 0.00 H new ATOM 0 HG SER A 137 11.985 2.880 -13.478 1.00 0.00 H new ATOM 2153 N GLY A 138 12.431 5.166 -17.401 1.00 0.00 N ATOM 2154 CA GLY A 138 12.273 4.611 -18.733 1.00 0.00 C ATOM 2155 C GLY A 138 12.183 5.683 -19.801 1.00 0.00 C ATOM 2156 O GLY A 138 11.117 5.946 -20.358 1.00 0.00 O ATOM 0 H GLY A 138 13.333 5.609 -17.225 1.00 0.00 H new ATOM 0 HA2 GLY A 138 13.115 3.954 -18.952 1.00 0.00 H new ATOM 0 HA3 GLY A 138 11.373 3.996 -18.763 1.00 0.00 H new ATOM 2160 N PRO A 139 13.323 6.324 -20.100 1.00 0.00 N ATOM 2161 CA PRO A 139 13.393 7.384 -21.109 1.00 0.00 C ATOM 2162 C PRO A 139 13.207 6.850 -22.525 1.00 0.00 C ATOM 2163 O PRO A 139 13.698 5.772 -22.862 1.00 0.00 O ATOM 2164 CB PRO A 139 14.804 7.950 -20.932 1.00 0.00 C ATOM 2165 CG PRO A 139 15.590 6.830 -20.342 1.00 0.00 C ATOM 2166 CD PRO A 139 14.630 6.062 -19.475 1.00 0.00 C ATOM 0 HA PRO A 139 12.603 8.123 -20.978 1.00 0.00 H new ATOM 0 HB2 PRO A 139 15.225 8.270 -21.885 1.00 0.00 H new ATOM 0 HB3 PRO A 139 14.802 8.821 -20.276 1.00 0.00 H new ATOM 0 HG2 PRO A 139 16.007 6.193 -21.122 1.00 0.00 H new ATOM 0 HG3 PRO A 139 16.428 7.208 -19.757 1.00 0.00 H new ATOM 0 HD2 PRO A 139 14.863 4.997 -19.462 1.00 0.00 H new ATOM 0 HD3 PRO A 139 14.658 6.407 -18.441 1.00 0.00 H new ATOM 2174 N SER A 140 12.496 7.610 -23.352 1.00 0.00 N ATOM 2175 CA SER A 140 12.243 7.211 -24.731 1.00 0.00 C ATOM 2176 C SER A 140 11.799 8.406 -25.570 1.00 0.00 C ATOM 2177 O SER A 140 10.901 9.152 -25.180 1.00 0.00 O ATOM 2178 CB SER A 140 11.177 6.115 -24.780 1.00 0.00 C ATOM 2179 OG SER A 140 11.376 5.259 -25.892 1.00 0.00 O ATOM 0 H SER A 140 12.085 8.506 -23.090 1.00 0.00 H new ATOM 0 HA SER A 140 13.173 6.823 -25.147 1.00 0.00 H new ATOM 0 HB2 SER A 140 11.207 5.533 -23.859 1.00 0.00 H new ATOM 0 HB3 SER A 140 10.187 6.568 -24.839 1.00 0.00 H new ATOM 0 HG SER A 140 10.683 4.566 -25.900 1.00 0.00 H new ATOM 2185 N SER A 141 12.435 8.580 -26.724 1.00 0.00 N ATOM 2186 CA SER A 141 12.109 9.685 -27.617 1.00 0.00 C ATOM 2187 C SER A 141 11.258 9.204 -28.789 1.00 0.00 C ATOM 2188 O SER A 141 11.364 8.056 -29.217 1.00 0.00 O ATOM 2189 CB SER A 141 13.389 10.343 -28.137 1.00 0.00 C ATOM 2190 OG SER A 141 14.267 9.380 -28.693 1.00 0.00 O ATOM 0 H SER A 141 13.179 7.970 -27.062 1.00 0.00 H new ATOM 0 HA SER A 141 11.535 10.419 -27.052 1.00 0.00 H new ATOM 0 HB2 SER A 141 13.138 11.089 -28.891 1.00 0.00 H new ATOM 0 HB3 SER A 141 13.888 10.868 -27.323 1.00 0.00 H new ATOM 0 HG SER A 141 15.077 9.825 -29.020 1.00 0.00 H new ATOM 2196 N GLY A 142 10.414 10.093 -29.303 1.00 0.00 N ATOM 2197 CA GLY A 142 9.557 9.742 -30.420 1.00 0.00 C ATOM 2198 C GLY A 142 10.311 9.680 -31.733 1.00 0.00 C ATOM 2199 O GLY A 142 9.749 9.309 -32.763 1.00 0.00 O ATOM 0 H GLY A 142 10.308 11.050 -28.966 1.00 0.00 H new ATOM 0 HA2 GLY A 142 9.091 8.776 -30.227 1.00 0.00 H new ATOM 0 HA3 GLY A 142 8.753 10.473 -30.501 1.00 0.00 H new TER 2203 GLY A 142