USER MOD reduce.3.24.130724 H: found=0, std=0, add=1215, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1236 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 128 CYS SG : rot -83:sc= 0.015 USER MOD Set 1.2: A 129 GLN : amide:sc= -6.48! C(o=-6.5!,f=-9.5!) USER MOD Set 2.1: A 37 SER OG : rot -1:sc= 0.336! USER MOD Set 2.2: A 117 GLN :FLIP amide:sc= 0 F(o=-1.9!,f=0.34) USER MOD Set 3.1: A 19 CYS SG : rot 62:sc= 0.522 USER MOD Set 3.2: A 23 LYS NZ :NH3+ -165:sc= -1.17 (180deg=-1.52!) USER MOD Set 3.3: A 106 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 47 LYS NZ :NH3+ 166:sc= 0.551 (180deg=-0.052) USER MOD Set 4.2: A 87 TYR OH : rot -130:sc= -3.99! USER MOD Set 5.1: A 86 ASN :FLIP amide:sc= -4.49! C(o=-11!,f=-4.5!) USER MOD Set 5.2: A 95 THR OG1 : rot -142:sc= 0.00122 USER MOD Single : A 1 GLY N :NH3+ -123:sc= -2.09! (180deg=-5.28!) USER MOD Single : A 5 SER OG : rot 180:sc= 0.00469 USER MOD Single : A 6 MET CE :methyl 145:sc= -0.222 (180deg=-1.37!) USER MOD Single : A 11 CYS SG : rot -98:sc= -12.2! USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 27 ASN : amide:sc= -0.986 X(o=-0.99,f=-0.54) USER MOD Single : A 35 GLN : amide:sc= -0.354 K(o=-0.35,f=-1.4!) USER MOD Single : A 41 HIS :FLIP no HD1:sc= -4.69! C(o=-7.8!,f=-4.7!) USER MOD Single : A 42 HIS : no HD1:sc= -10.6! C(o=-11!,f=-17!) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.29 USER MOD Single : A 49 HIS :FLIP no HD1:sc= -8.45! C(o=-11!,f=-8.5!) USER MOD Single : A 59 THR OG1 : rot -60:sc= -3.32! USER MOD Single : A 64 THR OG1 : rot 70:sc= -4.89! USER MOD Single : A 65 GLN : amide:sc= -0.066 K(o=-0.066,f=-2!) USER MOD Single : A 74 GLN :FLIP amide:sc= -7.68! C(o=-12!,f=-7.7!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN :FLIP amide:sc= -0.188 F(o=-2.2!,f=-0.19) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot -177:sc= -2.04! USER MOD Single : A 104 LYS NZ :NH3+ -176:sc= 1.17 (180deg=1.02) USER MOD Single : A 113 SER OG : rot 77:sc= 0.631 USER MOD Single : A 114 HIS : no HD1:sc= -2.01! C(o=-2!,f=-1.5!) USER MOD Single : A 116 HIS : no HD1:sc= -12.1! C(o=-12!,f=-14!) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 GLN : amide:sc= -4.81! C(o=-4.8!,f=-5!) USER MOD Single : A 134 LYS NZ :NH3+ -165:sc= -0.129 (180deg=-0.721) USER MOD Single : A 136 MET CE :methyl 150:sc= -3.18! (180deg=-5.73!) USER MOD Single : A 137 LYS NZ :NH3+ 159:sc= -0.502 (180deg=-1.23) USER MOD Single : A 141 GLN :FLIP amide:sc=-0.00185 F(o=-1.4!,f=-0.0019) USER MOD Single : A 144 HIS : no HE2:sc= -15.5! C(o=-15!,f=-23!) USER MOD Single : A 145 GLN : amide:sc=-0.00531 K(o=-0.0053,f=-1.6!) USER MOD Single : A 148 CYS SG : rot 11:sc= -2.55! USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 9.243 -19.770 -11.340 1.00 0.00 N ATOM 2 CA GLY A 1 8.071 -19.183 -10.722 1.00 0.00 C ATOM 3 C GLY A 1 8.355 -17.745 -10.312 1.00 0.00 C ATOM 4 O GLY A 1 7.730 -16.817 -10.819 1.00 0.00 O ATOM 0 H1 GLY A 1 9.000 -20.108 -12.293 1.00 0.00 H new ATOM 0 H2 GLY A 1 9.995 -19.055 -11.407 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.576 -20.569 -10.764 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.232 -19.211 -11.417 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.781 -19.767 -9.849 1.00 0.00 H new ATOM 8 N PRO A 2 9.303 -17.563 -9.390 1.00 0.00 N ATOM 9 CA PRO A 2 9.711 -16.271 -8.883 1.00 0.00 C ATOM 10 C PRO A 2 10.507 -15.532 -9.949 1.00 0.00 C ATOM 11 O PRO A 2 11.262 -16.146 -10.699 1.00 0.00 O ATOM 12 CB PRO A 2 10.581 -16.583 -7.668 1.00 0.00 C ATOM 13 CG PRO A 2 11.195 -17.935 -8.030 1.00 0.00 C ATOM 14 CD PRO A 2 10.056 -18.632 -8.770 1.00 0.00 C ATOM 0 HA PRO A 2 8.867 -15.634 -8.618 1.00 0.00 H new ATOM 0 HB2 PRO A 2 11.344 -15.821 -7.511 1.00 0.00 H new ATOM 0 HB3 PRO A 2 9.992 -16.638 -6.752 1.00 0.00 H new ATOM 0 HG2 PRO A 2 12.078 -17.823 -8.659 1.00 0.00 H new ATOM 0 HG3 PRO A 2 11.502 -18.491 -7.144 1.00 0.00 H new ATOM 0 HD2 PRO A 2 10.438 -19.330 -9.515 1.00 0.00 H new ATOM 0 HD3 PRO A 2 9.434 -19.207 -8.085 1.00 0.00 H new ATOM 22 N LEU A 3 10.373 -14.245 -10.052 1.00 0.00 N ATOM 23 CA LEU A 3 11.133 -13.486 -11.087 1.00 0.00 C ATOM 24 C LEU A 3 12.507 -13.112 -10.528 1.00 0.00 C ATOM 25 O LEU A 3 12.619 -12.604 -9.432 1.00 0.00 O ATOM 26 CB LEU A 3 10.366 -12.214 -11.453 1.00 0.00 C ATOM 27 CG LEU A 3 9.056 -12.592 -12.151 1.00 0.00 C ATOM 28 CD1 LEU A 3 8.092 -13.224 -11.143 1.00 0.00 C ATOM 29 CD2 LEU A 3 8.414 -11.337 -12.747 1.00 0.00 C ATOM 0 H LEU A 3 9.766 -13.677 -9.461 1.00 0.00 H new ATOM 0 HA LEU A 3 11.255 -14.102 -11.978 1.00 0.00 H new ATOM 0 HB2 LEU A 3 10.158 -11.631 -10.556 1.00 0.00 H new ATOM 0 HB3 LEU A 3 10.971 -11.587 -12.107 1.00 0.00 H new ATOM 0 HG LEU A 3 9.268 -13.308 -12.945 1.00 0.00 H new ATOM 0 HD11 LEU A 3 7.163 -13.490 -11.646 1.00 0.00 H new ATOM 0 HD12 LEU A 3 8.545 -14.120 -10.719 1.00 0.00 H new ATOM 0 HD13 LEU A 3 7.881 -12.512 -10.345 1.00 0.00 H new ATOM 0 HD21 LEU A 3 7.482 -11.606 -13.244 1.00 0.00 H new ATOM 0 HD22 LEU A 3 8.208 -10.621 -11.951 1.00 0.00 H new ATOM 0 HD23 LEU A 3 9.095 -10.889 -13.471 1.00 0.00 H new ATOM 41 N GLY A 4 13.552 -13.363 -11.273 1.00 0.00 N ATOM 42 CA GLY A 4 14.917 -13.026 -10.776 1.00 0.00 C ATOM 43 C GLY A 4 14.975 -13.264 -9.267 1.00 0.00 C ATOM 44 O GLY A 4 14.268 -14.099 -8.737 1.00 0.00 O ATOM 0 H GLY A 4 13.519 -13.785 -12.201 1.00 0.00 H new ATOM 0 HA2 GLY A 4 15.663 -13.639 -11.282 1.00 0.00 H new ATOM 0 HA3 GLY A 4 15.153 -11.986 -11.002 1.00 0.00 H new ATOM 48 N SER A 5 15.798 -12.534 -8.569 1.00 0.00 N ATOM 49 CA SER A 5 15.883 -12.715 -7.093 1.00 0.00 C ATOM 50 C SER A 5 14.657 -12.081 -6.438 1.00 0.00 C ATOM 51 O SER A 5 13.628 -11.908 -7.062 1.00 0.00 O ATOM 52 CB SER A 5 17.142 -12.035 -6.562 1.00 0.00 C ATOM 53 OG SER A 5 18.195 -12.206 -7.499 1.00 0.00 O ATOM 0 H SER A 5 16.415 -11.820 -8.956 1.00 0.00 H new ATOM 0 HA SER A 5 15.921 -13.779 -6.861 1.00 0.00 H new ATOM 0 HB2 SER A 5 16.955 -10.974 -6.397 1.00 0.00 H new ATOM 0 HB3 SER A 5 17.422 -12.463 -5.599 1.00 0.00 H new ATOM 0 HG SER A 5 19.006 -11.769 -7.163 1.00 0.00 H new ATOM 59 N MET A 6 14.757 -11.729 -5.189 1.00 0.00 N ATOM 60 CA MET A 6 13.594 -11.101 -4.501 1.00 0.00 C ATOM 61 C MET A 6 13.107 -9.916 -5.327 1.00 0.00 C ATOM 62 O MET A 6 13.630 -9.624 -6.384 1.00 0.00 O ATOM 63 CB MET A 6 14.022 -10.603 -3.124 1.00 0.00 C ATOM 64 CG MET A 6 14.544 -11.775 -2.291 1.00 0.00 C ATOM 65 SD MET A 6 14.903 -11.206 -0.611 1.00 0.00 S ATOM 66 CE MET A 6 13.192 -10.895 -0.103 1.00 0.00 C ATOM 0 H MET A 6 15.591 -11.848 -4.614 1.00 0.00 H new ATOM 0 HA MET A 6 12.796 -11.835 -4.392 1.00 0.00 H new ATOM 0 HB2 MET A 6 14.797 -9.843 -3.226 1.00 0.00 H new ATOM 0 HB3 MET A 6 13.179 -10.132 -2.619 1.00 0.00 H new ATOM 0 HG2 MET A 6 13.804 -12.575 -2.265 1.00 0.00 H new ATOM 0 HG3 MET A 6 15.444 -12.187 -2.747 1.00 0.00 H new ATOM 0 HE1 MET A 6 13.076 -11.138 0.953 1.00 0.00 H new ATOM 0 HE2 MET A 6 12.951 -9.844 -0.262 1.00 0.00 H new ATOM 0 HE3 MET A 6 12.518 -11.515 -0.694 1.00 0.00 H new ATOM 76 N ALA A 7 12.107 -9.231 -4.854 1.00 0.00 N ATOM 77 CA ALA A 7 11.589 -8.068 -5.617 1.00 0.00 C ATOM 78 C ALA A 7 12.283 -6.793 -5.147 1.00 0.00 C ATOM 79 O ALA A 7 12.223 -6.419 -3.993 1.00 0.00 O ATOM 80 CB ALA A 7 10.080 -7.946 -5.407 1.00 0.00 C ATOM 0 H ALA A 7 11.628 -9.426 -3.975 1.00 0.00 H new ATOM 0 HA ALA A 7 11.792 -8.214 -6.678 1.00 0.00 H new ATOM 0 HB1 ALA A 7 9.702 -7.091 -5.968 1.00 0.00 H new ATOM 0 HB2 ALA A 7 9.589 -8.855 -5.756 1.00 0.00 H new ATOM 0 HB3 ALA A 7 9.870 -7.805 -4.347 1.00 0.00 H new ATOM 86 N LEU A 8 12.931 -6.122 -6.052 1.00 0.00 N ATOM 87 CA LEU A 8 13.631 -4.856 -5.712 1.00 0.00 C ATOM 88 C LEU A 8 12.645 -3.718 -5.928 1.00 0.00 C ATOM 89 O LEU A 8 12.093 -3.161 -4.999 1.00 0.00 O ATOM 90 CB LEU A 8 14.827 -4.677 -6.656 1.00 0.00 C ATOM 91 CG LEU A 8 15.037 -5.969 -7.455 1.00 0.00 C ATOM 92 CD1 LEU A 8 16.014 -5.724 -8.606 1.00 0.00 C ATOM 93 CD2 LEU A 8 15.592 -7.054 -6.533 1.00 0.00 C ATOM 0 H LEU A 8 13.007 -6.402 -7.030 1.00 0.00 H new ATOM 0 HA LEU A 8 13.986 -4.869 -4.681 1.00 0.00 H new ATOM 0 HB2 LEU A 8 14.649 -3.841 -7.333 1.00 0.00 H new ATOM 0 HB3 LEU A 8 15.724 -4.439 -6.085 1.00 0.00 H new ATOM 0 HG LEU A 8 14.081 -6.293 -7.866 1.00 0.00 H new ATOM 0 HD11 LEU A 8 16.155 -6.648 -9.166 1.00 0.00 H new ATOM 0 HD12 LEU A 8 15.612 -4.957 -9.267 1.00 0.00 H new ATOM 0 HD13 LEU A 8 16.972 -5.392 -8.206 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.741 -7.972 -7.101 1.00 0.00 H new ATOM 0 HD22 LEU A 8 16.544 -6.726 -6.117 1.00 0.00 H new ATOM 0 HD23 LEU A 8 14.887 -7.239 -5.723 1.00 0.00 H new ATOM 105 N ARG A 9 12.397 -3.402 -7.164 1.00 0.00 N ATOM 106 CA ARG A 9 11.423 -2.336 -7.488 1.00 0.00 C ATOM 107 C ARG A 9 10.380 -2.938 -8.425 1.00 0.00 C ATOM 108 O ARG A 9 10.712 -3.521 -9.437 1.00 0.00 O ATOM 109 CB ARG A 9 12.129 -1.163 -8.179 1.00 0.00 C ATOM 110 CG ARG A 9 12.331 -1.474 -9.664 1.00 0.00 C ATOM 111 CD ARG A 9 13.128 -0.342 -10.310 1.00 0.00 C ATOM 112 NE ARG A 9 13.252 -0.594 -11.773 1.00 0.00 N ATOM 113 CZ ARG A 9 14.217 -1.346 -12.225 1.00 0.00 C ATOM 114 NH1 ARG A 9 15.079 -1.866 -11.396 1.00 0.00 N ATOM 115 NH2 ARG A 9 14.324 -1.575 -13.506 1.00 0.00 N ATOM 0 H ARG A 9 12.835 -3.844 -7.972 1.00 0.00 H new ATOM 0 HA ARG A 9 10.955 -1.960 -6.578 1.00 0.00 H new ATOM 0 HB2 ARG A 9 11.537 -0.255 -8.067 1.00 0.00 H new ATOM 0 HB3 ARG A 9 13.092 -0.977 -7.704 1.00 0.00 H new ATOM 0 HG2 ARG A 9 12.860 -2.420 -9.781 1.00 0.00 H new ATOM 0 HG3 ARG A 9 11.366 -1.584 -10.159 1.00 0.00 H new ATOM 0 HD2 ARG A 9 12.631 0.612 -10.135 1.00 0.00 H new ATOM 0 HD3 ARG A 9 14.117 -0.274 -9.857 1.00 0.00 H new ATOM 0 HE ARG A 9 12.583 -0.179 -12.421 1.00 0.00 H new ATOM 0 HH11 ARG A 9 14.998 -1.684 -10.396 1.00 0.00 H new ATOM 0 HH12 ARG A 9 15.834 -2.454 -11.748 1.00 0.00 H new ATOM 0 HH21 ARG A 9 13.652 -1.165 -14.155 1.00 0.00 H new ATOM 0 HH22 ARG A 9 15.079 -2.163 -13.858 1.00 0.00 H new ATOM 129 N ALA A 10 9.127 -2.811 -8.105 1.00 0.00 N ATOM 130 CA ALA A 10 8.080 -3.384 -8.992 1.00 0.00 C ATOM 131 C ALA A 10 7.339 -2.236 -9.670 1.00 0.00 C ATOM 132 O ALA A 10 7.477 -1.090 -9.292 1.00 0.00 O ATOM 133 CB ALA A 10 7.099 -4.218 -8.166 1.00 0.00 C ATOM 0 H ALA A 10 8.781 -2.337 -7.271 1.00 0.00 H new ATOM 0 HA ALA A 10 8.539 -4.027 -9.743 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.334 -4.635 -8.821 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.636 -5.028 -7.673 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.627 -3.585 -7.414 1.00 0.00 H new ATOM 139 N CYS A 11 6.571 -2.521 -10.677 1.00 0.00 N ATOM 140 CA CYS A 11 5.842 -1.432 -11.370 1.00 0.00 C ATOM 141 C CYS A 11 4.407 -1.874 -11.642 1.00 0.00 C ATOM 142 O CYS A 11 4.151 -3.015 -11.972 1.00 0.00 O ATOM 143 CB CYS A 11 6.559 -1.108 -12.673 1.00 0.00 C ATOM 144 SG CYS A 11 8.160 -1.950 -12.687 1.00 0.00 S ATOM 0 H CYS A 11 6.417 -3.458 -11.050 1.00 0.00 H new ATOM 0 HA CYS A 11 5.817 -0.539 -10.746 1.00 0.00 H new ATOM 0 HB2 CYS A 11 5.957 -1.428 -13.524 1.00 0.00 H new ATOM 0 HB3 CYS A 11 6.699 -0.031 -12.769 1.00 0.00 H new ATOM 0 HG CYS A 11 9.091 -1.119 -12.323 1.00 0.00 H new ATOM 150 N GLY A 12 3.468 -0.982 -11.491 1.00 0.00 N ATOM 151 CA GLY A 12 2.048 -1.354 -11.721 1.00 0.00 C ATOM 152 C GLY A 12 1.409 -0.402 -12.720 1.00 0.00 C ATOM 153 O GLY A 12 1.998 0.577 -13.132 1.00 0.00 O ATOM 0 H GLY A 12 3.625 -0.012 -11.218 1.00 0.00 H new ATOM 0 HA2 GLY A 12 1.988 -2.377 -12.093 1.00 0.00 H new ATOM 0 HA3 GLY A 12 1.500 -1.325 -10.779 1.00 0.00 H new ATOM 157 N LEU A 13 0.200 -0.688 -13.112 1.00 0.00 N ATOM 158 CA LEU A 13 -0.489 0.193 -14.088 1.00 0.00 C ATOM 159 C LEU A 13 -1.799 0.690 -13.480 1.00 0.00 C ATOM 160 O LEU A 13 -2.718 -0.078 -13.274 1.00 0.00 O ATOM 161 CB LEU A 13 -0.830 -0.617 -15.351 1.00 0.00 C ATOM 162 CG LEU A 13 -0.145 -0.057 -16.618 1.00 0.00 C ATOM 163 CD1 LEU A 13 -1.012 -0.343 -17.847 1.00 0.00 C ATOM 164 CD2 LEU A 13 0.057 1.455 -16.523 1.00 0.00 C ATOM 0 H LEU A 13 -0.339 -1.495 -12.797 1.00 0.00 H new ATOM 0 HA LEU A 13 0.161 1.032 -14.336 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.526 -1.654 -15.206 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.910 -0.618 -15.497 1.00 0.00 H new ATOM 0 HG LEU A 13 0.826 -0.544 -16.706 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -0.524 0.054 -18.737 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.145 -1.419 -17.956 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.985 0.132 -17.724 1.00 0.00 H new ATOM 0 HD21 LEU A 13 0.541 1.815 -17.431 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -0.910 1.945 -16.409 1.00 0.00 H new ATOM 0 HD23 LEU A 13 0.684 1.685 -15.662 1.00 0.00 H new ATOM 176 N ILE A 14 -1.920 1.962 -13.225 1.00 0.00 N ATOM 177 CA ILE A 14 -3.209 2.456 -12.679 1.00 0.00 C ATOM 178 C ILE A 14 -4.233 2.344 -13.797 1.00 0.00 C ATOM 179 O ILE A 14 -4.409 3.252 -14.587 1.00 0.00 O ATOM 180 CB ILE A 14 -3.078 3.916 -12.246 1.00 0.00 C ATOM 181 CG1 ILE A 14 -2.123 4.014 -11.056 1.00 0.00 C ATOM 182 CG2 ILE A 14 -4.450 4.472 -11.861 1.00 0.00 C ATOM 183 CD1 ILE A 14 -2.737 3.331 -9.829 1.00 0.00 C ATOM 0 H ILE A 14 -1.197 2.667 -13.368 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.507 1.873 -11.808 1.00 0.00 H new ATOM 0 HB ILE A 14 -2.681 4.502 -13.075 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -1.171 3.545 -11.304 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -1.914 5.060 -10.833 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -4.348 5.513 -11.554 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -5.121 4.411 -12.718 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -4.861 3.889 -11.037 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.048 3.407 -8.988 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.677 3.819 -9.573 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -2.923 2.280 -10.052 1.00 0.00 H new ATOM 195 N ILE A 15 -4.895 1.227 -13.891 1.00 0.00 N ATOM 196 CA ILE A 15 -5.883 1.059 -14.983 1.00 0.00 C ATOM 197 C ILE A 15 -7.216 1.646 -14.553 1.00 0.00 C ATOM 198 O ILE A 15 -7.671 1.451 -13.443 1.00 0.00 O ATOM 199 CB ILE A 15 -6.077 -0.421 -15.295 1.00 0.00 C ATOM 200 CG1 ILE A 15 -4.738 -1.062 -15.648 1.00 0.00 C ATOM 201 CG2 ILE A 15 -7.027 -0.569 -16.488 1.00 0.00 C ATOM 202 CD1 ILE A 15 -5.003 -2.456 -16.211 1.00 0.00 C ATOM 0 H ILE A 15 -4.794 0.430 -13.263 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.514 1.572 -15.871 1.00 0.00 H new ATOM 0 HB ILE A 15 -6.496 -0.915 -14.418 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.207 -0.453 -16.379 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -4.103 -1.125 -14.764 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.167 -1.626 -16.713 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -7.990 -0.119 -16.245 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -6.601 -0.067 -17.357 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -4.056 -2.930 -16.469 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -5.518 -3.059 -15.463 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -5.624 -2.376 -17.103 1.00 0.00 H new ATOM 214 N PHE A 16 -7.847 2.356 -15.433 1.00 0.00 N ATOM 215 CA PHE A 16 -9.158 2.950 -15.096 1.00 0.00 C ATOM 216 C PHE A 16 -9.963 3.118 -16.383 1.00 0.00 C ATOM 217 O PHE A 16 -9.414 3.228 -17.459 1.00 0.00 O ATOM 218 CB PHE A 16 -8.950 4.313 -14.442 1.00 0.00 C ATOM 219 CG PHE A 16 -8.472 5.294 -15.475 1.00 0.00 C ATOM 220 CD1 PHE A 16 -9.393 5.904 -16.331 1.00 0.00 C ATOM 221 CD2 PHE A 16 -7.109 5.593 -15.580 1.00 0.00 C ATOM 222 CE1 PHE A 16 -8.956 6.816 -17.292 1.00 0.00 C ATOM 223 CE2 PHE A 16 -6.668 6.507 -16.540 1.00 0.00 C ATOM 224 CZ PHE A 16 -7.592 7.120 -17.397 1.00 0.00 C ATOM 0 H PHE A 16 -7.510 2.551 -16.376 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.693 2.301 -14.403 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -9.882 4.661 -13.997 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -8.222 4.234 -13.635 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -10.444 5.669 -16.248 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.399 5.118 -14.920 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.668 7.287 -17.954 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.617 6.741 -16.622 1.00 0.00 H new ATOM 0 HZ PHE A 16 -7.253 7.827 -18.139 1.00 0.00 H new ATOM 234 N ARG A 17 -11.257 3.137 -16.282 1.00 0.00 N ATOM 235 CA ARG A 17 -12.096 3.295 -17.500 1.00 0.00 C ATOM 236 C ARG A 17 -13.070 4.456 -17.301 1.00 0.00 C ATOM 237 O ARG A 17 -13.753 4.540 -16.300 1.00 0.00 O ATOM 238 CB ARG A 17 -12.875 2.003 -17.743 1.00 0.00 C ATOM 239 CG ARG A 17 -13.867 2.198 -18.892 1.00 0.00 C ATOM 240 CD ARG A 17 -14.579 0.876 -19.171 1.00 0.00 C ATOM 241 NE ARG A 17 -15.090 0.311 -17.894 1.00 0.00 N ATOM 242 CZ ARG A 17 -16.069 0.900 -17.265 1.00 0.00 C ATOM 243 NH1 ARG A 17 -16.610 1.979 -17.760 1.00 0.00 N ATOM 244 NH2 ARG A 17 -16.510 0.403 -16.143 1.00 0.00 N ATOM 0 H ARG A 17 -11.774 3.050 -15.407 1.00 0.00 H new ATOM 0 HA ARG A 17 -11.461 3.504 -18.361 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -12.186 1.192 -17.980 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -13.408 1.714 -16.837 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -14.593 2.969 -18.634 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -13.344 2.539 -19.786 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -15.403 1.034 -19.867 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -13.893 0.173 -19.644 1.00 0.00 H new ATOM 0 HE ARG A 17 -14.675 -0.538 -17.510 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -16.267 2.363 -18.640 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -17.376 2.438 -17.267 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -16.089 -0.444 -15.760 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -17.275 0.861 -15.648 1.00 0.00 H new ATOM 258 N ARG A 18 -13.139 5.353 -18.245 1.00 0.00 N ATOM 259 CA ARG A 18 -14.070 6.506 -18.107 1.00 0.00 C ATOM 260 C ARG A 18 -15.285 6.305 -19.010 1.00 0.00 C ATOM 261 O ARG A 18 -15.162 5.947 -20.166 1.00 0.00 O ATOM 262 CB ARG A 18 -13.339 7.795 -18.468 1.00 0.00 C ATOM 263 CG ARG A 18 -12.907 7.762 -19.933 1.00 0.00 C ATOM 264 CD ARG A 18 -11.795 8.790 -20.138 1.00 0.00 C ATOM 265 NE ARG A 18 -11.601 9.033 -21.596 1.00 0.00 N ATOM 266 CZ ARG A 18 -11.314 10.232 -22.029 1.00 0.00 C ATOM 267 NH1 ARG A 18 -11.176 11.216 -21.184 1.00 0.00 N ATOM 268 NH2 ARG A 18 -11.161 10.443 -23.305 1.00 0.00 N ATOM 0 H ARG A 18 -12.591 5.337 -19.105 1.00 0.00 H new ATOM 0 HA ARG A 18 -14.416 6.575 -17.076 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -13.989 8.652 -18.292 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -12.467 7.919 -17.826 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -12.555 6.766 -20.201 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -13.754 7.986 -20.582 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -12.051 9.722 -19.635 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -10.867 8.431 -19.692 1.00 0.00 H new ATOM 0 HE ARG A 18 -11.692 8.262 -22.257 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -11.292 11.050 -20.184 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -10.952 12.152 -21.523 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -11.265 9.673 -23.965 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -10.937 11.379 -23.644 1.00 0.00 H new ATOM 282 N CYS A 19 -16.460 6.522 -18.487 1.00 0.00 N ATOM 283 CA CYS A 19 -17.689 6.334 -19.306 1.00 0.00 C ATOM 284 C CYS A 19 -18.097 7.657 -19.944 1.00 0.00 C ATOM 285 O CYS A 19 -17.460 8.675 -19.764 1.00 0.00 O ATOM 286 CB CYS A 19 -18.828 5.840 -18.418 1.00 0.00 C ATOM 287 SG CYS A 19 -18.237 4.479 -17.384 1.00 0.00 S ATOM 0 H CYS A 19 -16.622 6.822 -17.526 1.00 0.00 H new ATOM 0 HA CYS A 19 -17.483 5.601 -20.086 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -19.195 6.654 -17.792 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -19.665 5.508 -19.032 1.00 0.00 H new ATOM 0 HG CYS A 19 -17.287 4.906 -16.606 1.00 0.00 H new ATOM 293 N LEU A 20 -19.165 7.642 -20.686 1.00 0.00 N ATOM 294 CA LEU A 20 -19.642 8.886 -21.347 1.00 0.00 C ATOM 295 C LEU A 20 -19.878 9.959 -20.288 1.00 0.00 C ATOM 296 O LEU A 20 -19.580 11.122 -20.483 1.00 0.00 O ATOM 297 CB LEU A 20 -20.960 8.590 -22.058 1.00 0.00 C ATOM 298 CG LEU A 20 -20.802 7.335 -22.915 1.00 0.00 C ATOM 299 CD1 LEU A 20 -22.164 6.913 -23.462 1.00 0.00 C ATOM 300 CD2 LEU A 20 -19.856 7.629 -24.078 1.00 0.00 C ATOM 0 H LEU A 20 -19.733 6.814 -20.865 1.00 0.00 H new ATOM 0 HA LEU A 20 -18.899 9.235 -22.064 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -21.756 8.447 -21.327 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -21.248 9.436 -22.682 1.00 0.00 H new ATOM 0 HG LEU A 20 -20.392 6.530 -22.305 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -22.049 6.018 -24.073 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -22.840 6.702 -22.633 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -22.577 7.717 -24.071 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -19.743 6.734 -24.690 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -20.267 8.435 -24.686 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -18.883 7.928 -23.689 1.00 0.00 H new ATOM 312 N ILE A 21 -20.417 9.573 -19.169 1.00 0.00 N ATOM 313 CA ILE A 21 -20.686 10.557 -18.088 1.00 0.00 C ATOM 314 C ILE A 21 -21.001 9.797 -16.790 1.00 0.00 C ATOM 315 O ILE A 21 -21.264 8.613 -16.811 1.00 0.00 O ATOM 316 CB ILE A 21 -21.880 11.428 -18.499 1.00 0.00 C ATOM 317 CG1 ILE A 21 -21.569 12.914 -18.264 1.00 0.00 C ATOM 318 CG2 ILE A 21 -23.122 11.038 -17.692 1.00 0.00 C ATOM 319 CD1 ILE A 21 -21.619 13.667 -19.595 1.00 0.00 C ATOM 0 H ILE A 21 -20.685 8.612 -18.955 1.00 0.00 H new ATOM 0 HA ILE A 21 -19.817 11.195 -17.925 1.00 0.00 H new ATOM 0 HB ILE A 21 -22.070 11.266 -19.560 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -22.290 13.341 -17.566 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -20.584 13.022 -17.810 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -23.963 11.663 -17.993 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -23.363 9.992 -17.878 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -22.925 11.181 -16.630 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -21.398 14.721 -19.425 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -20.881 13.247 -20.279 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -22.614 13.570 -20.031 1.00 0.00 H new ATOM 331 N PRO A 22 -20.975 10.471 -15.670 1.00 0.00 N ATOM 332 CA PRO A 22 -21.268 9.843 -14.347 1.00 0.00 C ATOM 333 C PRO A 22 -22.690 9.275 -14.280 1.00 0.00 C ATOM 334 O PRO A 22 -23.639 9.909 -14.699 1.00 0.00 O ATOM 335 CB PRO A 22 -21.109 10.992 -13.340 1.00 0.00 C ATOM 336 CG PRO A 22 -20.328 12.049 -14.053 1.00 0.00 C ATOM 337 CD PRO A 22 -20.663 11.899 -15.533 1.00 0.00 C ATOM 0 HA PRO A 22 -20.605 9.001 -14.150 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -22.080 11.371 -13.021 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -20.587 10.657 -12.443 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -20.596 13.042 -13.692 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -19.259 11.926 -13.881 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -21.509 12.524 -15.818 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -19.824 12.189 -16.166 1.00 0.00 H new ATOM 345 N LYS A 23 -22.848 8.089 -13.755 1.00 0.00 N ATOM 346 CA LYS A 23 -24.211 7.489 -13.663 1.00 0.00 C ATOM 347 C LYS A 23 -24.959 8.090 -12.471 1.00 0.00 C ATOM 348 O LYS A 23 -25.476 9.190 -12.533 1.00 0.00 O ATOM 349 CB LYS A 23 -24.089 5.972 -13.472 1.00 0.00 C ATOM 350 CG LYS A 23 -23.225 5.377 -14.588 1.00 0.00 C ATOM 351 CD LYS A 23 -23.904 5.596 -15.941 1.00 0.00 C ATOM 352 CE LYS A 23 -23.215 4.743 -17.006 1.00 0.00 C ATOM 353 NZ LYS A 23 -21.966 4.155 -16.444 1.00 0.00 N ATOM 0 H LYS A 23 -22.093 7.510 -13.386 1.00 0.00 H new ATOM 0 HA LYS A 23 -24.760 7.701 -14.580 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -23.646 5.753 -12.500 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -25.078 5.514 -13.482 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -22.240 5.843 -14.585 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -23.074 4.312 -14.415 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -24.960 5.332 -15.876 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -23.855 6.649 -16.217 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -23.884 3.950 -17.340 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -22.981 5.352 -17.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -21.374 3.793 -17.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -21.443 4.886 -15.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -22.209 3.375 -15.800 1.00 0.00 H new ATOM 367 N VAL A 24 -25.017 7.373 -11.386 1.00 0.00 N ATOM 368 CA VAL A 24 -25.728 7.884 -10.179 1.00 0.00 C ATOM 369 C VAL A 24 -24.720 8.552 -9.244 1.00 0.00 C ATOM 370 O VAL A 24 -24.986 9.572 -8.641 1.00 0.00 O ATOM 371 CB VAL A 24 -26.385 6.709 -9.452 1.00 0.00 C ATOM 372 CG1 VAL A 24 -25.305 5.701 -9.047 1.00 0.00 C ATOM 373 CG2 VAL A 24 -27.108 7.217 -8.201 1.00 0.00 C ATOM 0 H VAL A 24 -24.600 6.448 -11.281 1.00 0.00 H new ATOM 0 HA VAL A 24 -26.487 8.607 -10.477 1.00 0.00 H new ATOM 0 HB VAL A 24 -27.107 6.228 -10.112 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -25.767 4.861 -8.528 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -24.792 5.339 -9.938 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -24.586 6.184 -8.386 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -27.575 6.378 -7.685 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -26.391 7.698 -7.536 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -27.874 7.937 -8.490 1.00 0.00 H new ATOM 383 N ASP A 25 -23.562 7.972 -9.131 1.00 0.00 N ATOM 384 CA ASP A 25 -22.509 8.540 -8.248 1.00 0.00 C ATOM 385 C ASP A 25 -21.258 7.680 -8.400 1.00 0.00 C ATOM 386 O ASP A 25 -20.302 7.807 -7.663 1.00 0.00 O ATOM 387 CB ASP A 25 -22.984 8.512 -6.792 1.00 0.00 C ATOM 388 CG ASP A 25 -21.924 9.147 -5.890 1.00 0.00 C ATOM 389 OD1 ASP A 25 -20.938 9.639 -6.415 1.00 0.00 O ATOM 390 OD2 ASP A 25 -22.117 9.135 -4.686 1.00 0.00 O ATOM 0 H ASP A 25 -23.296 7.117 -9.619 1.00 0.00 H new ATOM 0 HA ASP A 25 -22.297 9.573 -8.523 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -23.926 9.051 -6.697 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -23.172 7.484 -6.481 1.00 0.00 H new ATOM 396 N ASN A 26 -21.271 6.800 -9.361 1.00 0.00 N ATOM 397 CA ASN A 26 -20.100 5.915 -9.585 1.00 0.00 C ATOM 398 C ASN A 26 -19.057 6.666 -10.411 1.00 0.00 C ATOM 399 O ASN A 26 -17.967 6.182 -10.646 1.00 0.00 O ATOM 400 CB ASN A 26 -20.557 4.674 -10.352 1.00 0.00 C ATOM 401 CG ASN A 26 -21.645 3.948 -9.557 1.00 0.00 C ATOM 402 OD1 ASN A 26 -21.547 3.813 -8.354 1.00 0.00 O ATOM 403 ND2 ASN A 26 -22.688 3.475 -10.184 1.00 0.00 N ATOM 0 H ASN A 26 -22.049 6.656 -10.004 1.00 0.00 H new ATOM 0 HA ASN A 26 -19.666 5.619 -8.630 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -20.939 4.960 -11.332 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -19.711 4.008 -10.522 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -23.420 2.992 -9.663 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -22.770 3.588 -11.194 1.00 0.00 H new ATOM 410 N ASN A 27 -19.387 7.847 -10.847 1.00 0.00 N ATOM 411 CA ASN A 27 -18.422 8.642 -11.654 1.00 0.00 C ATOM 412 C ASN A 27 -18.113 7.904 -12.954 1.00 0.00 C ATOM 413 O ASN A 27 -18.004 6.694 -12.982 1.00 0.00 O ATOM 414 CB ASN A 27 -17.134 8.837 -10.857 1.00 0.00 C ATOM 415 CG ASN A 27 -17.475 9.065 -9.384 1.00 0.00 C ATOM 416 OD1 ASN A 27 -16.810 8.550 -8.509 1.00 0.00 O ATOM 417 ND2 ASN A 27 -18.495 9.817 -9.071 1.00 0.00 N ATOM 0 H ASN A 27 -20.286 8.298 -10.679 1.00 0.00 H new ATOM 0 HA ASN A 27 -18.856 9.614 -11.886 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -16.493 7.962 -10.962 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -16.577 9.688 -11.248 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -18.733 9.972 -8.091 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -19.054 10.250 -9.806 1.00 0.00 H new ATOM 424 N ALA A 28 -17.973 8.620 -14.034 1.00 0.00 N ATOM 425 CA ALA A 28 -17.671 7.953 -15.327 1.00 0.00 C ATOM 426 C ALA A 28 -16.327 7.236 -15.227 1.00 0.00 C ATOM 427 O ALA A 28 -16.092 6.245 -15.890 1.00 0.00 O ATOM 428 CB ALA A 28 -17.605 8.999 -16.443 1.00 0.00 C ATOM 0 H ALA A 28 -18.055 9.636 -14.076 1.00 0.00 H new ATOM 0 HA ALA A 28 -18.456 7.231 -15.552 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -17.383 8.507 -17.390 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -18.563 9.513 -16.517 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -16.821 9.722 -16.218 1.00 0.00 H new ATOM 434 N ILE A 29 -15.442 7.731 -14.406 1.00 0.00 N ATOM 435 CA ILE A 29 -14.104 7.089 -14.270 1.00 0.00 C ATOM 436 C ILE A 29 -14.151 5.994 -13.208 1.00 0.00 C ATOM 437 O ILE A 29 -14.686 6.177 -12.132 1.00 0.00 O ATOM 438 CB ILE A 29 -13.079 8.145 -13.863 1.00 0.00 C ATOM 439 CG1 ILE A 29 -13.092 9.287 -14.893 1.00 0.00 C ATOM 440 CG2 ILE A 29 -11.691 7.506 -13.791 1.00 0.00 C ATOM 441 CD1 ILE A 29 -11.753 9.356 -15.634 1.00 0.00 C ATOM 0 H ILE A 29 -15.588 8.554 -13.822 1.00 0.00 H new ATOM 0 HA ILE A 29 -13.822 6.645 -15.225 1.00 0.00 H new ATOM 0 HB ILE A 29 -13.330 8.549 -12.882 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -13.902 9.132 -15.606 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.286 10.235 -14.391 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -10.958 8.259 -13.501 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -11.698 6.703 -13.054 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -11.426 7.100 -14.767 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -11.780 10.170 -16.359 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -10.950 9.534 -14.919 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -11.575 8.414 -16.152 1.00 0.00 H new ATOM 453 N GLU A 30 -13.588 4.856 -13.506 1.00 0.00 N ATOM 454 CA GLU A 30 -13.590 3.744 -12.521 1.00 0.00 C ATOM 455 C GLU A 30 -12.204 3.100 -12.485 1.00 0.00 C ATOM 456 O GLU A 30 -11.468 3.154 -13.445 1.00 0.00 O ATOM 457 CB GLU A 30 -14.635 2.704 -12.934 1.00 0.00 C ATOM 458 CG GLU A 30 -16.022 3.344 -12.934 1.00 0.00 C ATOM 459 CD GLU A 30 -17.067 2.282 -13.279 1.00 0.00 C ATOM 460 OE1 GLU A 30 -18.243 2.555 -13.102 1.00 0.00 O ATOM 461 OE2 GLU A 30 -16.673 1.215 -13.718 1.00 0.00 O ATOM 0 H GLU A 30 -13.126 4.650 -14.392 1.00 0.00 H new ATOM 0 HA GLU A 30 -13.836 4.127 -11.531 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -14.403 2.314 -13.925 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.613 1.859 -12.246 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -16.236 3.777 -11.957 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -16.060 4.157 -13.659 1.00 0.00 H new ATOM 469 N PHE A 31 -11.840 2.487 -11.388 1.00 0.00 N ATOM 470 CA PHE A 31 -10.496 1.842 -11.311 1.00 0.00 C ATOM 471 C PHE A 31 -10.649 0.328 -11.356 1.00 0.00 C ATOM 472 O PHE A 31 -11.570 -0.236 -10.798 1.00 0.00 O ATOM 473 CB PHE A 31 -9.794 2.227 -10.009 1.00 0.00 C ATOM 474 CG PHE A 31 -9.481 3.702 -10.009 1.00 0.00 C ATOM 475 CD1 PHE A 31 -8.583 4.226 -10.946 1.00 0.00 C ATOM 476 CD2 PHE A 31 -10.084 4.542 -9.071 1.00 0.00 C ATOM 477 CE1 PHE A 31 -8.291 5.596 -10.943 1.00 0.00 C ATOM 478 CE2 PHE A 31 -9.791 5.907 -9.066 1.00 0.00 C ATOM 479 CZ PHE A 31 -8.897 6.437 -10.001 1.00 0.00 C ATOM 0 H PHE A 31 -12.412 2.406 -10.547 1.00 0.00 H new ATOM 0 HA PHE A 31 -9.901 2.183 -12.158 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -10.429 1.981 -9.158 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -8.875 1.652 -9.898 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -8.116 3.575 -11.670 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -10.777 4.136 -8.349 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -7.600 6.003 -11.666 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -10.256 6.555 -8.338 1.00 0.00 H new ATOM 0 HZ PHE A 31 -8.674 7.494 -9.997 1.00 0.00 H new ATOM 489 N LEU A 32 -9.747 -0.331 -12.015 1.00 0.00 N ATOM 490 CA LEU A 32 -9.818 -1.807 -12.107 1.00 0.00 C ATOM 491 C LEU A 32 -8.782 -2.426 -11.150 1.00 0.00 C ATOM 492 O LEU A 32 -7.590 -2.379 -11.391 1.00 0.00 O ATOM 493 CB LEU A 32 -9.547 -2.199 -13.567 1.00 0.00 C ATOM 494 CG LEU A 32 -9.183 -3.680 -13.684 1.00 0.00 C ATOM 495 CD1 LEU A 32 -10.419 -4.545 -13.452 1.00 0.00 C ATOM 496 CD2 LEU A 32 -8.648 -3.954 -15.088 1.00 0.00 C ATOM 0 H LEU A 32 -8.956 0.094 -12.498 1.00 0.00 H new ATOM 0 HA LEU A 32 -10.800 -2.179 -11.815 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -10.429 -1.990 -14.172 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -8.736 -1.590 -13.965 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.428 -3.921 -12.936 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -10.148 -5.597 -13.538 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -10.816 -4.353 -12.455 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -11.177 -4.304 -14.197 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.386 -5.008 -15.178 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.413 -3.706 -15.824 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.762 -3.344 -15.265 1.00 0.00 H new ATOM 508 N LEU A 33 -9.239 -3.005 -10.066 1.00 0.00 N ATOM 509 CA LEU A 33 -8.309 -3.636 -9.072 1.00 0.00 C ATOM 510 C LEU A 33 -8.495 -5.152 -9.114 1.00 0.00 C ATOM 511 O LEU A 33 -9.477 -5.641 -9.628 1.00 0.00 O ATOM 512 CB LEU A 33 -8.647 -3.150 -7.660 1.00 0.00 C ATOM 513 CG LEU A 33 -8.187 -1.703 -7.457 1.00 0.00 C ATOM 514 CD1 LEU A 33 -8.917 -1.115 -6.250 1.00 0.00 C ATOM 515 CD2 LEU A 33 -6.679 -1.672 -7.187 1.00 0.00 C ATOM 0 H LEU A 33 -10.228 -3.069 -9.823 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.283 -3.365 -9.320 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -9.722 -3.221 -7.494 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.167 -3.795 -6.924 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.409 -1.123 -8.353 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.596 -0.085 -6.097 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -9.992 -1.138 -6.429 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -8.684 -1.703 -5.362 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.356 -0.641 -7.043 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.458 -2.250 -6.290 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.148 -2.103 -8.036 1.00 0.00 H new ATOM 527 N LEU A 34 -7.561 -5.903 -8.581 1.00 0.00 N ATOM 528 CA LEU A 34 -7.705 -7.388 -8.603 1.00 0.00 C ATOM 529 C LEU A 34 -7.645 -7.969 -7.186 1.00 0.00 C ATOM 530 O LEU A 34 -6.802 -7.606 -6.393 1.00 0.00 O ATOM 531 CB LEU A 34 -6.570 -8.003 -9.423 1.00 0.00 C ATOM 532 CG LEU A 34 -6.575 -7.434 -10.839 1.00 0.00 C ATOM 533 CD1 LEU A 34 -5.577 -8.211 -11.694 1.00 0.00 C ATOM 534 CD2 LEU A 34 -7.965 -7.589 -11.443 1.00 0.00 C ATOM 0 H LEU A 34 -6.713 -5.553 -8.136 1.00 0.00 H new ATOM 0 HA LEU A 34 -8.672 -7.624 -9.047 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.613 -7.797 -8.944 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.683 -9.087 -9.458 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.301 -6.379 -10.808 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -5.576 -7.809 -12.707 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.579 -8.117 -11.265 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.862 -9.263 -11.721 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -7.970 -7.183 -12.454 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -8.232 -8.645 -11.475 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -8.689 -7.050 -10.832 1.00 0.00 H new ATOM 546 N GLN A 35 -8.508 -8.905 -6.880 1.00 0.00 N ATOM 547 CA GLN A 35 -8.465 -9.546 -5.537 1.00 0.00 C ATOM 548 C GLN A 35 -7.796 -10.908 -5.707 1.00 0.00 C ATOM 549 O GLN A 35 -8.333 -11.791 -6.346 1.00 0.00 O ATOM 550 CB GLN A 35 -9.880 -9.748 -4.989 1.00 0.00 C ATOM 551 CG GLN A 35 -9.835 -9.846 -3.462 1.00 0.00 C ATOM 552 CD GLN A 35 -11.258 -10.010 -2.923 1.00 0.00 C ATOM 553 OE1 GLN A 35 -12.218 -9.803 -3.637 1.00 0.00 O ATOM 554 NE2 GLN A 35 -11.436 -10.385 -1.685 1.00 0.00 N ATOM 0 H GLN A 35 -9.238 -9.250 -7.503 1.00 0.00 H new ATOM 0 HA GLN A 35 -7.916 -8.914 -4.839 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -10.519 -8.918 -5.291 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -10.316 -10.655 -5.408 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -9.219 -10.693 -3.159 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -9.376 -8.951 -3.042 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -10.630 -10.559 -1.084 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -12.381 -10.504 -1.319 1.00 0.00 H new ATOM 563 N ALA A 36 -6.623 -11.087 -5.171 1.00 0.00 N ATOM 564 CA ALA A 36 -5.933 -12.396 -5.346 1.00 0.00 C ATOM 565 C ALA A 36 -6.643 -13.477 -4.532 1.00 0.00 C ATOM 566 O ALA A 36 -6.866 -13.331 -3.348 1.00 0.00 O ATOM 567 CB ALA A 36 -4.485 -12.273 -4.883 1.00 0.00 C ATOM 0 H ALA A 36 -6.115 -10.392 -4.624 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.957 -12.674 -6.400 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.980 -13.230 -5.011 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.977 -11.512 -5.476 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.462 -11.988 -3.831 1.00 0.00 H new ATOM 573 N SER A 37 -6.996 -14.566 -5.160 1.00 0.00 N ATOM 574 CA SER A 37 -7.692 -15.660 -4.424 1.00 0.00 C ATOM 575 C SER A 37 -6.675 -16.715 -3.977 1.00 0.00 C ATOM 576 O SER A 37 -6.981 -17.593 -3.196 1.00 0.00 O ATOM 577 CB SER A 37 -8.730 -16.307 -5.341 1.00 0.00 C ATOM 578 OG SER A 37 -9.159 -17.540 -4.775 1.00 0.00 O ATOM 0 H SER A 37 -6.832 -14.745 -6.151 1.00 0.00 H new ATOM 0 HA SER A 37 -8.187 -15.246 -3.546 1.00 0.00 H new ATOM 0 HB2 SER A 37 -9.581 -15.639 -5.473 1.00 0.00 H new ATOM 0 HB3 SER A 37 -8.302 -16.477 -6.329 1.00 0.00 H new ATOM 0 HG SER A 37 -8.675 -17.702 -3.938 1.00 0.00 H new ATOM 584 N ASP A 38 -5.470 -16.639 -4.466 1.00 0.00 N ATOM 585 CA ASP A 38 -4.443 -17.641 -4.067 1.00 0.00 C ATOM 586 C ASP A 38 -3.687 -17.134 -2.840 1.00 0.00 C ATOM 587 O ASP A 38 -2.710 -17.718 -2.415 1.00 0.00 O ATOM 588 CB ASP A 38 -3.462 -17.852 -5.223 1.00 0.00 C ATOM 589 CG ASP A 38 -2.533 -19.021 -4.893 1.00 0.00 C ATOM 590 OD1 ASP A 38 -1.571 -19.210 -5.618 1.00 0.00 O ATOM 591 OD2 ASP A 38 -2.800 -19.709 -3.922 1.00 0.00 O ATOM 0 H ASP A 38 -5.151 -15.928 -5.124 1.00 0.00 H new ATOM 0 HA ASP A 38 -4.930 -18.586 -3.827 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -4.007 -18.055 -6.145 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -2.879 -16.946 -5.390 1.00 0.00 H new ATOM 597 N GLY A 39 -4.134 -16.048 -2.268 1.00 0.00 N ATOM 598 CA GLY A 39 -3.442 -15.499 -1.070 1.00 0.00 C ATOM 599 C GLY A 39 -4.446 -15.319 0.071 1.00 0.00 C ATOM 600 O GLY A 39 -5.196 -16.215 0.402 1.00 0.00 O ATOM 0 H GLY A 39 -4.948 -15.519 -2.580 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -2.642 -16.172 -0.760 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.978 -14.543 -1.313 1.00 0.00 H new ATOM 604 N ILE A 40 -4.453 -14.165 0.674 1.00 0.00 N ATOM 605 CA ILE A 40 -5.397 -13.903 1.800 1.00 0.00 C ATOM 606 C ILE A 40 -6.605 -13.122 1.290 1.00 0.00 C ATOM 607 O ILE A 40 -7.457 -12.710 2.050 1.00 0.00 O ATOM 608 CB ILE A 40 -4.694 -13.085 2.878 1.00 0.00 C ATOM 609 CG1 ILE A 40 -3.408 -12.464 2.315 1.00 0.00 C ATOM 610 CG2 ILE A 40 -4.334 -14.005 4.040 1.00 0.00 C ATOM 611 CD1 ILE A 40 -3.701 -11.704 1.015 1.00 0.00 C ATOM 0 H ILE A 40 -3.841 -13.384 0.435 1.00 0.00 H new ATOM 0 HA ILE A 40 -5.726 -14.855 2.216 1.00 0.00 H new ATOM 0 HB ILE A 40 -5.358 -12.289 3.216 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -2.973 -11.786 3.049 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -2.672 -13.246 2.128 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -3.830 -13.430 4.817 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -5.242 -14.448 4.448 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -3.672 -14.795 3.687 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -2.778 -11.271 0.631 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -4.114 -12.391 0.277 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -4.420 -10.909 1.212 1.00 0.00 H new ATOM 623 N HIS A 41 -6.682 -12.928 0.001 1.00 0.00 N ATOM 624 CA HIS A 41 -7.831 -12.188 -0.582 1.00 0.00 C ATOM 625 C HIS A 41 -7.618 -10.687 -0.384 1.00 0.00 C ATOM 626 O HIS A 41 -8.281 -10.043 0.407 1.00 0.00 O ATOM 627 CB HIS A 41 -9.129 -12.650 0.087 1.00 0.00 C ATOM 628 CG HIS A 41 -9.107 -14.155 0.261 1.00 0.00 C ATOM 629 ND1 HIS A 41 -8.088 -15.089 0.214 1.00 0.00 N flip ATOM 630 CD2 HIS A 41 -10.262 -14.879 0.532 1.00 0.00 C flip ATOM 631 CE1 HIS A 41 -8.607 -16.354 0.458 1.00 0.00 C flip ATOM 632 NE2 HIS A 41 -9.915 -16.176 0.641 1.00 0.00 N flip ATOM 0 H HIS A 41 -5.992 -13.254 -0.675 1.00 0.00 H new ATOM 0 HA HIS A 41 -7.904 -12.391 -1.650 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -9.243 -12.164 1.056 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -9.986 -12.357 -0.519 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -11.258 -14.475 0.636 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -8.064 -17.287 0.492 1.00 0.00 H new ATOM 0 HE2 HIS A 41 -10.573 -16.930 0.839 1.00 0.00 H new ATOM 641 N HIS A 42 -6.678 -10.132 -1.104 1.00 0.00 N ATOM 642 CA HIS A 42 -6.375 -8.678 -0.985 1.00 0.00 C ATOM 643 C HIS A 42 -6.592 -8.001 -2.341 1.00 0.00 C ATOM 644 O HIS A 42 -6.362 -8.588 -3.379 1.00 0.00 O ATOM 645 CB HIS A 42 -4.914 -8.517 -0.571 1.00 0.00 C ATOM 646 CG HIS A 42 -4.056 -9.404 -1.438 1.00 0.00 C ATOM 647 ND1 HIS A 42 -4.120 -10.787 -1.363 1.00 0.00 N ATOM 648 CD2 HIS A 42 -3.114 -9.125 -2.397 1.00 0.00 C ATOM 649 CE1 HIS A 42 -3.236 -11.286 -2.246 1.00 0.00 C ATOM 650 NE2 HIS A 42 -2.601 -10.314 -2.903 1.00 0.00 N ATOM 0 H HIS A 42 -6.100 -10.634 -1.779 1.00 0.00 H new ATOM 0 HA HIS A 42 -7.029 -8.220 -0.243 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -4.606 -7.477 -0.676 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -4.789 -8.782 0.479 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -2.817 -8.135 -2.710 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -3.062 -12.340 -2.403 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -1.889 -10.421 -3.625 1.00 0.00 H new ATOM 659 N TRP A 43 -7.031 -6.770 -2.346 1.00 0.00 N ATOM 660 CA TRP A 43 -7.257 -6.067 -3.642 1.00 0.00 C ATOM 661 C TRP A 43 -6.004 -5.296 -4.053 1.00 0.00 C ATOM 662 O TRP A 43 -5.328 -4.706 -3.235 1.00 0.00 O ATOM 663 CB TRP A 43 -8.406 -5.077 -3.495 1.00 0.00 C ATOM 664 CG TRP A 43 -9.708 -5.787 -3.650 1.00 0.00 C ATOM 665 CD1 TRP A 43 -10.532 -6.122 -2.635 1.00 0.00 C ATOM 666 CD2 TRP A 43 -10.352 -6.242 -4.871 1.00 0.00 C ATOM 667 NE1 TRP A 43 -11.648 -6.753 -3.158 1.00 0.00 N ATOM 668 CE2 TRP A 43 -11.580 -6.854 -4.531 1.00 0.00 C ATOM 669 CE3 TRP A 43 -9.992 -6.186 -6.231 1.00 0.00 C ATOM 670 CZ2 TRP A 43 -12.423 -7.390 -5.501 1.00 0.00 C ATOM 671 CZ3 TRP A 43 -10.838 -6.728 -7.210 1.00 0.00 C ATOM 672 CH2 TRP A 43 -12.050 -7.329 -6.846 1.00 0.00 C ATOM 0 H TRP A 43 -7.242 -6.223 -1.511 1.00 0.00 H new ATOM 0 HA TRP A 43 -7.494 -6.812 -4.401 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -8.359 -4.594 -2.519 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -8.319 -4.291 -4.245 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -10.351 -5.930 -1.588 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -12.425 -7.100 -2.596 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -9.060 -5.724 -6.522 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -13.358 -7.849 -5.216 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -10.553 -6.682 -8.251 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -12.696 -7.745 -7.605 1.00 0.00 H new ATOM 683 N THR A 44 -5.703 -5.288 -5.322 1.00 0.00 N ATOM 684 CA THR A 44 -4.505 -4.545 -5.802 1.00 0.00 C ATOM 685 C THR A 44 -4.553 -4.433 -7.326 1.00 0.00 C ATOM 686 O THR A 44 -5.101 -5.283 -8.003 1.00 0.00 O ATOM 687 CB THR A 44 -3.234 -5.288 -5.390 1.00 0.00 C ATOM 688 OG1 THR A 44 -2.232 -5.088 -6.380 1.00 0.00 O ATOM 689 CG2 THR A 44 -3.533 -6.781 -5.257 1.00 0.00 C ATOM 0 H THR A 44 -6.237 -5.765 -6.049 1.00 0.00 H new ATOM 0 HA THR A 44 -4.500 -3.549 -5.359 1.00 0.00 H new ATOM 0 HB THR A 44 -2.882 -4.906 -4.432 1.00 0.00 H new ATOM 0 HG1 THR A 44 -1.415 -5.562 -6.119 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.626 -7.309 -4.963 1.00 0.00 H new ATOM 0 HG22 THR A 44 -4.302 -6.932 -4.500 1.00 0.00 H new ATOM 0 HG23 THR A 44 -3.885 -7.168 -6.213 1.00 0.00 H new ATOM 697 N PRO A 45 -3.977 -3.392 -7.859 1.00 0.00 N ATOM 698 CA PRO A 45 -3.939 -3.146 -9.329 1.00 0.00 C ATOM 699 C PRO A 45 -2.979 -4.107 -10.022 1.00 0.00 C ATOM 700 O PRO A 45 -2.124 -4.695 -9.393 1.00 0.00 O ATOM 701 CB PRO A 45 -3.408 -1.717 -9.436 1.00 0.00 C ATOM 702 CG PRO A 45 -2.556 -1.565 -8.227 1.00 0.00 C ATOM 703 CD PRO A 45 -3.292 -2.322 -7.124 1.00 0.00 C ATOM 0 HA PRO A 45 -4.911 -3.289 -9.801 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -2.834 -1.571 -10.351 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -4.219 -0.989 -9.448 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -1.561 -1.978 -8.392 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -2.426 -0.515 -7.966 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -2.603 -2.721 -6.379 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -3.997 -1.680 -6.595 1.00 0.00 H new ATOM 711 N PRO A 46 -3.101 -4.254 -11.305 1.00 0.00 N ATOM 712 CA PRO A 46 -2.204 -5.152 -12.080 1.00 0.00 C ATOM 713 C PRO A 46 -0.740 -4.724 -11.920 1.00 0.00 C ATOM 714 O PRO A 46 -0.248 -3.882 -12.643 1.00 0.00 O ATOM 715 CB PRO A 46 -2.666 -4.962 -13.525 1.00 0.00 C ATOM 716 CG PRO A 46 -4.056 -4.431 -13.428 1.00 0.00 C ATOM 717 CD PRO A 46 -4.094 -3.595 -12.162 1.00 0.00 C ATOM 0 HA PRO A 46 -2.255 -6.190 -11.751 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -2.016 -4.268 -14.057 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -2.642 -5.904 -14.072 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -4.306 -3.829 -14.301 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -4.782 -5.243 -13.382 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -3.833 -2.555 -12.357 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -5.084 -3.595 -11.707 1.00 0.00 H new ATOM 725 N LYS A 47 -0.047 -5.286 -10.966 1.00 0.00 N ATOM 726 CA LYS A 47 1.375 -4.894 -10.754 1.00 0.00 C ATOM 727 C LYS A 47 2.246 -6.141 -10.574 1.00 0.00 C ATOM 728 O LYS A 47 1.812 -7.143 -10.039 1.00 0.00 O ATOM 729 CB LYS A 47 1.475 -4.006 -9.506 1.00 0.00 C ATOM 730 CG LYS A 47 2.207 -4.753 -8.390 1.00 0.00 C ATOM 731 CD LYS A 47 2.043 -3.997 -7.075 1.00 0.00 C ATOM 732 CE LYS A 47 2.771 -4.759 -5.967 1.00 0.00 C ATOM 733 NZ LYS A 47 1.931 -5.910 -5.541 1.00 0.00 N ATOM 0 H LYS A 47 -0.403 -5.997 -10.327 1.00 0.00 H new ATOM 0 HA LYS A 47 1.729 -4.343 -11.625 1.00 0.00 H new ATOM 0 HB2 LYS A 47 2.005 -3.085 -9.747 1.00 0.00 H new ATOM 0 HB3 LYS A 47 0.478 -3.722 -9.171 1.00 0.00 H new ATOM 0 HG2 LYS A 47 1.809 -5.763 -8.293 1.00 0.00 H new ATOM 0 HG3 LYS A 47 3.264 -4.850 -8.636 1.00 0.00 H new ATOM 0 HD2 LYS A 47 2.448 -2.989 -7.167 1.00 0.00 H new ATOM 0 HD3 LYS A 47 0.986 -3.894 -6.829 1.00 0.00 H new ATOM 0 HE2 LYS A 47 3.739 -5.111 -6.325 1.00 0.00 H new ATOM 0 HE3 LYS A 47 2.964 -4.100 -5.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 2.503 -6.564 -4.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 1.130 -5.564 -4.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 1.572 -6.407 -6.381 1.00 0.00 H new ATOM 747 N GLY A 48 3.474 -6.081 -11.014 1.00 0.00 N ATOM 748 CA GLY A 48 4.378 -7.255 -10.866 1.00 0.00 C ATOM 749 C GLY A 48 5.815 -6.767 -10.647 1.00 0.00 C ATOM 750 O GLY A 48 6.134 -5.621 -10.894 1.00 0.00 O ATOM 0 H GLY A 48 3.889 -5.269 -11.470 1.00 0.00 H new ATOM 0 HA2 GLY A 48 4.059 -7.870 -10.024 1.00 0.00 H new ATOM 0 HA3 GLY A 48 4.327 -7.882 -11.756 1.00 0.00 H new ATOM 754 N HIS A 49 6.681 -7.630 -10.189 1.00 0.00 N ATOM 755 CA HIS A 49 8.098 -7.225 -9.954 1.00 0.00 C ATOM 756 C HIS A 49 8.815 -7.067 -11.294 1.00 0.00 C ATOM 757 O HIS A 49 8.366 -7.564 -12.307 1.00 0.00 O ATOM 758 CB HIS A 49 8.800 -8.301 -9.122 1.00 0.00 C ATOM 759 CG HIS A 49 10.295 -8.155 -9.243 1.00 0.00 C ATOM 760 ND1 HIS A 49 11.138 -7.090 -9.027 1.00 0.00 N flip ATOM 761 CD2 HIS A 49 11.114 -9.211 -9.621 1.00 0.00 C flip ATOM 762 CE1 HIS A 49 12.450 -7.480 -9.267 1.00 0.00 C flip ATOM 763 NE2 HIS A 49 12.384 -8.764 -9.619 1.00 0.00 N flip ATOM 0 H HIS A 49 6.468 -8.602 -9.966 1.00 0.00 H new ATOM 0 HA HIS A 49 8.122 -6.276 -9.419 1.00 0.00 H new ATOM 0 HB2 HIS A 49 8.502 -8.216 -8.077 1.00 0.00 H new ATOM 0 HB3 HIS A 49 8.495 -9.291 -9.461 1.00 0.00 H new ATOM 0 HD2 HIS A 49 10.790 -10.211 -9.871 1.00 0.00 H new ATOM 0 HE1 HIS A 49 13.338 -6.870 -9.185 1.00 0.00 H new ATOM 0 HE2 HIS A 49 13.194 -9.336 -9.857 1.00 0.00 H new ATOM 772 N VAL A 50 9.921 -6.376 -11.309 1.00 0.00 N ATOM 773 CA VAL A 50 10.661 -6.185 -12.583 1.00 0.00 C ATOM 774 C VAL A 50 11.641 -7.346 -12.775 1.00 0.00 C ATOM 775 O VAL A 50 12.414 -7.668 -11.897 1.00 0.00 O ATOM 776 CB VAL A 50 11.421 -4.848 -12.518 1.00 0.00 C ATOM 777 CG1 VAL A 50 12.923 -5.096 -12.346 1.00 0.00 C ATOM 778 CG2 VAL A 50 11.187 -4.055 -13.804 1.00 0.00 C ATOM 0 H VAL A 50 10.343 -5.936 -10.492 1.00 0.00 H new ATOM 0 HA VAL A 50 9.970 -6.165 -13.425 1.00 0.00 H new ATOM 0 HB VAL A 50 11.051 -4.281 -11.664 1.00 0.00 H new ATOM 0 HG11 VAL A 50 13.447 -4.141 -12.302 1.00 0.00 H new ATOM 0 HG12 VAL A 50 13.097 -5.649 -11.423 1.00 0.00 H new ATOM 0 HG13 VAL A 50 13.295 -5.675 -13.191 1.00 0.00 H new ATOM 0 HG21 VAL A 50 11.727 -3.110 -13.752 1.00 0.00 H new ATOM 0 HG22 VAL A 50 11.545 -4.631 -14.657 1.00 0.00 H new ATOM 0 HG23 VAL A 50 10.121 -3.858 -13.921 1.00 0.00 H new ATOM 788 N GLU A 51 11.622 -7.977 -13.918 1.00 0.00 N ATOM 789 CA GLU A 51 12.565 -9.104 -14.152 1.00 0.00 C ATOM 790 C GLU A 51 13.921 -8.506 -14.545 1.00 0.00 C ATOM 791 O GLU A 51 14.010 -7.346 -14.891 1.00 0.00 O ATOM 792 CB GLU A 51 12.030 -10.012 -15.269 1.00 0.00 C ATOM 793 CG GLU A 51 11.665 -11.393 -14.715 1.00 0.00 C ATOM 794 CD GLU A 51 11.743 -12.426 -15.841 1.00 0.00 C ATOM 795 OE1 GLU A 51 12.652 -13.238 -15.812 1.00 0.00 O ATOM 796 OE2 GLU A 51 10.892 -12.385 -16.714 1.00 0.00 O ATOM 0 H GLU A 51 10.997 -7.761 -14.695 1.00 0.00 H new ATOM 0 HA GLU A 51 12.671 -9.710 -13.252 1.00 0.00 H new ATOM 0 HB2 GLU A 51 11.153 -9.555 -15.727 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.781 -10.115 -16.052 1.00 0.00 H new ATOM 0 HG2 GLU A 51 12.345 -11.665 -13.908 1.00 0.00 H new ATOM 0 HG3 GLU A 51 10.661 -11.374 -14.292 1.00 0.00 H new ATOM 804 N PRO A 52 14.970 -9.276 -14.472 1.00 0.00 N ATOM 805 CA PRO A 52 16.341 -8.793 -14.805 1.00 0.00 C ATOM 806 C PRO A 52 16.493 -8.445 -16.287 1.00 0.00 C ATOM 807 O PRO A 52 17.569 -8.138 -16.761 1.00 0.00 O ATOM 808 CB PRO A 52 17.256 -9.953 -14.410 1.00 0.00 C ATOM 809 CG PRO A 52 16.384 -11.165 -14.379 1.00 0.00 C ATOM 810 CD PRO A 52 14.966 -10.687 -14.075 1.00 0.00 C ATOM 0 HA PRO A 52 16.581 -7.869 -14.279 1.00 0.00 H new ATOM 0 HB2 PRO A 52 18.067 -10.073 -15.128 1.00 0.00 H new ATOM 0 HB3 PRO A 52 17.715 -9.776 -13.437 1.00 0.00 H new ATOM 0 HG2 PRO A 52 16.418 -11.689 -15.334 1.00 0.00 H new ATOM 0 HG3 PRO A 52 16.726 -11.867 -13.618 1.00 0.00 H new ATOM 0 HD2 PRO A 52 14.225 -11.256 -14.636 1.00 0.00 H new ATOM 0 HD3 PRO A 52 14.724 -10.803 -13.018 1.00 0.00 H new ATOM 818 N GLY A 53 15.419 -8.483 -17.017 1.00 0.00 N ATOM 819 CA GLY A 53 15.486 -8.146 -18.467 1.00 0.00 C ATOM 820 C GLY A 53 14.220 -7.392 -18.873 1.00 0.00 C ATOM 821 O GLY A 53 13.740 -7.518 -19.983 1.00 0.00 O ATOM 0 H GLY A 53 14.492 -8.734 -16.673 1.00 0.00 H new ATOM 0 HA2 GLY A 53 16.366 -7.536 -18.669 1.00 0.00 H new ATOM 0 HA3 GLY A 53 15.586 -9.056 -19.059 1.00 0.00 H new ATOM 825 N GLU A 54 13.669 -6.612 -17.982 1.00 0.00 N ATOM 826 CA GLU A 54 12.428 -5.857 -18.318 1.00 0.00 C ATOM 827 C GLU A 54 12.644 -4.364 -18.067 1.00 0.00 C ATOM 828 O GLU A 54 13.748 -3.909 -17.837 1.00 0.00 O ATOM 829 CB GLU A 54 11.289 -6.328 -17.417 1.00 0.00 C ATOM 830 CG GLU A 54 11.241 -7.852 -17.381 1.00 0.00 C ATOM 831 CD GLU A 54 10.818 -8.396 -18.750 1.00 0.00 C ATOM 832 OE1 GLU A 54 10.395 -7.604 -19.574 1.00 0.00 O ATOM 833 OE2 GLU A 54 10.921 -9.598 -18.944 1.00 0.00 O ATOM 0 H GLU A 54 14.024 -6.465 -17.037 1.00 0.00 H new ATOM 0 HA GLU A 54 12.184 -6.030 -19.366 1.00 0.00 H new ATOM 0 HB2 GLU A 54 11.428 -5.937 -16.409 1.00 0.00 H new ATOM 0 HB3 GLU A 54 10.340 -5.936 -17.783 1.00 0.00 H new ATOM 0 HG2 GLU A 54 12.219 -8.248 -17.110 1.00 0.00 H new ATOM 0 HG3 GLU A 54 10.539 -8.184 -16.616 1.00 0.00 H new ATOM 841 N ASP A 55 11.579 -3.610 -18.077 1.00 0.00 N ATOM 842 CA ASP A 55 11.681 -2.151 -17.805 1.00 0.00 C ATOM 843 C ASP A 55 10.734 -1.821 -16.656 1.00 0.00 C ATOM 844 O ASP A 55 9.986 -2.664 -16.204 1.00 0.00 O ATOM 845 CB ASP A 55 11.273 -1.347 -19.040 1.00 0.00 C ATOM 846 CG ASP A 55 11.966 0.017 -19.018 1.00 0.00 C ATOM 847 OD1 ASP A 55 12.919 0.165 -18.270 1.00 0.00 O ATOM 848 OD2 ASP A 55 11.531 0.891 -19.748 1.00 0.00 O ATOM 0 H ASP A 55 10.635 -3.947 -18.264 1.00 0.00 H new ATOM 0 HA ASP A 55 12.709 -1.894 -17.550 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.545 -1.890 -19.945 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.191 -1.216 -19.060 1.00 0.00 H new ATOM 854 N ASP A 56 10.752 -0.613 -16.172 1.00 0.00 N ATOM 855 CA ASP A 56 9.836 -0.269 -15.049 1.00 0.00 C ATOM 856 C ASP A 56 8.393 -0.210 -15.564 1.00 0.00 C ATOM 857 O ASP A 56 7.524 -0.899 -15.070 1.00 0.00 O ATOM 858 CB ASP A 56 10.236 1.081 -14.453 1.00 0.00 C ATOM 859 CG ASP A 56 11.666 0.994 -13.917 1.00 0.00 C ATOM 860 OD1 ASP A 56 12.160 -0.111 -13.780 1.00 0.00 O ATOM 861 OD2 ASP A 56 12.242 2.037 -13.649 1.00 0.00 O ATOM 0 H ASP A 56 11.353 0.144 -16.499 1.00 0.00 H new ATOM 0 HA ASP A 56 9.907 -1.033 -14.275 1.00 0.00 H new ATOM 0 HB2 ASP A 56 10.167 1.861 -15.211 1.00 0.00 H new ATOM 0 HB3 ASP A 56 9.551 1.355 -13.651 1.00 0.00 H new ATOM 867 N LEU A 57 8.123 0.595 -16.562 1.00 0.00 N ATOM 868 CA LEU A 57 6.728 0.661 -17.095 1.00 0.00 C ATOM 869 C LEU A 57 6.415 -0.609 -17.874 1.00 0.00 C ATOM 870 O LEU A 57 5.356 -1.188 -17.729 1.00 0.00 O ATOM 871 CB LEU A 57 6.559 1.876 -18.013 1.00 0.00 C ATOM 872 CG LEU A 57 5.209 1.797 -18.738 1.00 0.00 C ATOM 873 CD1 LEU A 57 4.067 2.124 -17.775 1.00 0.00 C ATOM 874 CD2 LEU A 57 5.206 2.797 -19.895 1.00 0.00 C ATOM 0 H LEU A 57 8.799 1.202 -17.025 1.00 0.00 H new ATOM 0 HA LEU A 57 6.040 0.756 -16.255 1.00 0.00 H new ATOM 0 HB2 LEU A 57 6.615 2.795 -17.429 1.00 0.00 H new ATOM 0 HB3 LEU A 57 7.371 1.910 -18.740 1.00 0.00 H new ATOM 0 HG LEU A 57 5.065 0.786 -19.118 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.116 2.064 -18.304 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.070 1.410 -16.951 1.00 0.00 H new ATOM 0 HD13 LEU A 57 4.200 3.132 -17.382 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.250 2.748 -20.416 1.00 0.00 H new ATOM 0 HD22 LEU A 57 5.356 3.804 -19.506 1.00 0.00 H new ATOM 0 HD23 LEU A 57 6.010 2.553 -20.589 1.00 0.00 H new ATOM 886 N GLU A 58 7.321 -1.061 -18.696 1.00 0.00 N ATOM 887 CA GLU A 58 7.042 -2.300 -19.459 1.00 0.00 C ATOM 888 C GLU A 58 6.658 -3.372 -18.447 1.00 0.00 C ATOM 889 O GLU A 58 5.811 -4.206 -18.693 1.00 0.00 O ATOM 890 CB GLU A 58 8.292 -2.729 -20.233 1.00 0.00 C ATOM 891 CG GLU A 58 8.665 -1.638 -21.240 1.00 0.00 C ATOM 892 CD GLU A 58 7.554 -1.498 -22.284 1.00 0.00 C ATOM 893 OE1 GLU A 58 7.523 -0.479 -22.954 1.00 0.00 O ATOM 894 OE2 GLU A 58 6.758 -2.415 -22.399 1.00 0.00 O ATOM 0 H GLU A 58 8.229 -0.630 -18.868 1.00 0.00 H new ATOM 0 HA GLU A 58 6.239 -2.142 -20.179 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.119 -2.901 -19.544 1.00 0.00 H new ATOM 0 HB3 GLU A 58 8.107 -3.670 -20.751 1.00 0.00 H new ATOM 0 HG2 GLU A 58 8.814 -0.689 -20.724 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.607 -1.887 -21.728 1.00 0.00 H new ATOM 902 N THR A 59 7.257 -3.321 -17.289 1.00 0.00 N ATOM 903 CA THR A 59 6.914 -4.301 -16.228 1.00 0.00 C ATOM 904 C THR A 59 5.466 -4.057 -15.803 1.00 0.00 C ATOM 905 O THR A 59 4.690 -4.978 -15.644 1.00 0.00 O ATOM 906 CB THR A 59 7.841 -4.102 -15.030 1.00 0.00 C ATOM 907 OG1 THR A 59 8.967 -4.959 -15.155 1.00 0.00 O ATOM 908 CG2 THR A 59 7.088 -4.419 -13.741 1.00 0.00 C ATOM 0 H THR A 59 7.971 -2.639 -17.034 1.00 0.00 H new ATOM 0 HA THR A 59 7.031 -5.319 -16.600 1.00 0.00 H new ATOM 0 HB THR A 59 8.179 -3.066 -15.000 1.00 0.00 H new ATOM 0 HG1 THR A 59 8.667 -5.892 -15.182 1.00 0.00 H new ATOM 0 HG21 THR A 59 7.751 -4.276 -12.888 1.00 0.00 H new ATOM 0 HG22 THR A 59 6.229 -3.754 -13.648 1.00 0.00 H new ATOM 0 HG23 THR A 59 6.745 -5.453 -13.765 1.00 0.00 H new ATOM 916 N ALA A 60 5.087 -2.816 -15.641 1.00 0.00 N ATOM 917 CA ALA A 60 3.681 -2.521 -15.258 1.00 0.00 C ATOM 918 C ALA A 60 2.787 -2.978 -16.408 1.00 0.00 C ATOM 919 O ALA A 60 1.775 -3.621 -16.209 1.00 0.00 O ATOM 920 CB ALA A 60 3.509 -1.016 -15.030 1.00 0.00 C ATOM 0 H ALA A 60 5.689 -2.001 -15.757 1.00 0.00 H new ATOM 0 HA ALA A 60 3.416 -3.039 -14.336 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.477 -0.806 -14.750 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.175 -0.691 -14.231 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.752 -0.479 -15.947 1.00 0.00 H new ATOM 926 N LEU A 61 3.185 -2.680 -17.616 1.00 0.00 N ATOM 927 CA LEU A 61 2.395 -3.124 -18.792 1.00 0.00 C ATOM 928 C LEU A 61 2.388 -4.653 -18.804 1.00 0.00 C ATOM 929 O LEU A 61 1.403 -5.280 -19.138 1.00 0.00 O ATOM 930 CB LEU A 61 3.045 -2.581 -20.072 1.00 0.00 C ATOM 931 CG LEU A 61 2.876 -1.058 -20.115 1.00 0.00 C ATOM 932 CD1 LEU A 61 3.768 -0.464 -21.203 1.00 0.00 C ATOM 933 CD2 LEU A 61 1.422 -0.715 -20.429 1.00 0.00 C ATOM 0 H LEU A 61 4.026 -2.147 -17.836 1.00 0.00 H new ATOM 0 HA LEU A 61 1.372 -2.751 -18.739 1.00 0.00 H new ATOM 0 HB2 LEU A 61 4.103 -2.842 -20.096 1.00 0.00 H new ATOM 0 HB3 LEU A 61 2.584 -3.035 -20.949 1.00 0.00 H new ATOM 0 HG LEU A 61 3.157 -0.645 -19.146 1.00 0.00 H new ATOM 0 HD11 LEU A 61 3.642 0.618 -21.226 1.00 0.00 H new ATOM 0 HD12 LEU A 61 4.810 -0.703 -20.990 1.00 0.00 H new ATOM 0 HD13 LEU A 61 3.490 -0.883 -22.170 1.00 0.00 H new ATOM 0 HD21 LEU A 61 1.302 0.368 -20.459 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.149 -1.138 -21.396 1.00 0.00 H new ATOM 0 HD23 LEU A 61 0.775 -1.130 -19.656 1.00 0.00 H new ATOM 945 N ARG A 62 3.482 -5.256 -18.413 1.00 0.00 N ATOM 946 CA ARG A 62 3.543 -6.744 -18.365 1.00 0.00 C ATOM 947 C ARG A 62 2.513 -7.251 -17.355 1.00 0.00 C ATOM 948 O ARG A 62 1.730 -8.135 -17.643 1.00 0.00 O ATOM 949 CB ARG A 62 4.944 -7.168 -17.913 1.00 0.00 C ATOM 950 CG ARG A 62 5.004 -8.687 -17.736 1.00 0.00 C ATOM 951 CD ARG A 62 6.336 -9.060 -17.083 1.00 0.00 C ATOM 952 NE ARG A 62 6.415 -10.537 -16.920 1.00 0.00 N ATOM 953 CZ ARG A 62 5.768 -11.125 -15.949 1.00 0.00 C ATOM 954 NH1 ARG A 62 5.031 -10.422 -15.133 1.00 0.00 N ATOM 955 NH2 ARG A 62 5.855 -12.418 -15.798 1.00 0.00 N ATOM 0 H ARG A 62 4.336 -4.779 -18.125 1.00 0.00 H new ATOM 0 HA ARG A 62 3.330 -7.160 -19.350 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.683 -6.851 -18.649 1.00 0.00 H new ATOM 0 HB3 ARG A 62 5.196 -6.675 -16.974 1.00 0.00 H new ATOM 0 HG2 ARG A 62 4.173 -9.027 -17.118 1.00 0.00 H new ATOM 0 HG3 ARG A 62 4.906 -9.183 -18.702 1.00 0.00 H new ATOM 0 HD2 ARG A 62 7.165 -8.707 -17.696 1.00 0.00 H new ATOM 0 HD3 ARG A 62 6.427 -8.571 -16.113 1.00 0.00 H new ATOM 0 HE ARG A 62 6.975 -11.091 -17.567 1.00 0.00 H new ATOM 0 HH11 ARG A 62 4.959 -9.412 -15.253 1.00 0.00 H new ATOM 0 HH12 ARG A 62 4.527 -10.883 -14.376 1.00 0.00 H new ATOM 0 HH21 ARG A 62 6.428 -12.969 -16.438 1.00 0.00 H new ATOM 0 HH22 ARG A 62 5.350 -12.878 -15.040 1.00 0.00 H new ATOM 969 N ALA A 63 2.500 -6.688 -16.174 1.00 0.00 N ATOM 970 CA ALA A 63 1.510 -7.129 -15.150 1.00 0.00 C ATOM 971 C ALA A 63 0.121 -6.715 -15.619 1.00 0.00 C ATOM 972 O ALA A 63 -0.853 -7.414 -15.428 1.00 0.00 O ATOM 973 CB ALA A 63 1.818 -6.464 -13.805 1.00 0.00 C ATOM 0 H ALA A 63 3.131 -5.944 -15.876 1.00 0.00 H new ATOM 0 HA ALA A 63 1.560 -8.211 -15.024 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.090 -6.791 -13.062 1.00 0.00 H new ATOM 0 HB2 ALA A 63 2.820 -6.746 -13.481 1.00 0.00 H new ATOM 0 HB3 ALA A 63 1.763 -5.381 -13.914 1.00 0.00 H new ATOM 979 N THR A 64 0.037 -5.580 -16.247 1.00 0.00 N ATOM 980 CA THR A 64 -1.270 -5.100 -16.756 1.00 0.00 C ATOM 981 C THR A 64 -1.892 -6.181 -17.633 1.00 0.00 C ATOM 982 O THR A 64 -3.050 -6.523 -17.500 1.00 0.00 O ATOM 983 CB THR A 64 -1.016 -3.855 -17.597 1.00 0.00 C ATOM 984 OG1 THR A 64 -0.287 -2.913 -16.833 1.00 0.00 O ATOM 985 CG2 THR A 64 -2.339 -3.248 -18.038 1.00 0.00 C ATOM 0 H THR A 64 0.826 -4.960 -16.430 1.00 0.00 H new ATOM 0 HA THR A 64 -1.944 -4.873 -15.930 1.00 0.00 H new ATOM 0 HB THR A 64 -0.441 -4.128 -18.482 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.626 -3.240 -16.695 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.149 -2.358 -18.639 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.893 -3.975 -18.632 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.925 -2.975 -17.160 1.00 0.00 H new ATOM 993 N GLN A 65 -1.121 -6.716 -18.531 1.00 0.00 N ATOM 994 CA GLN A 65 -1.635 -7.773 -19.436 1.00 0.00 C ATOM 995 C GLN A 65 -1.722 -9.116 -18.711 1.00 0.00 C ATOM 996 O GLN A 65 -2.766 -9.726 -18.635 1.00 0.00 O ATOM 997 CB GLN A 65 -0.688 -7.900 -20.627 1.00 0.00 C ATOM 998 CG GLN A 65 -1.077 -9.114 -21.465 1.00 0.00 C ATOM 999 CD GLN A 65 -0.326 -9.069 -22.796 1.00 0.00 C ATOM 1000 OE1 GLN A 65 0.282 -8.072 -23.129 1.00 0.00 O ATOM 1001 NE2 GLN A 65 -0.345 -10.115 -23.576 1.00 0.00 N ATOM 0 H GLN A 65 -0.144 -6.463 -18.678 1.00 0.00 H new ATOM 0 HA GLN A 65 -2.636 -7.499 -19.771 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -0.731 -6.997 -21.236 1.00 0.00 H new ATOM 0 HB3 GLN A 65 0.340 -8.001 -20.278 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -0.837 -10.032 -20.929 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -2.153 -9.120 -21.641 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -0.856 -10.952 -23.295 1.00 0.00 H new ATOM 0 HE22 GLN A 65 0.151 -10.096 -24.467 1.00 0.00 H new ATOM 1010 N GLU A 66 -0.626 -9.594 -18.208 1.00 0.00 N ATOM 1011 CA GLU A 66 -0.631 -10.918 -17.526 1.00 0.00 C ATOM 1012 C GLU A 66 -1.478 -10.902 -16.249 1.00 0.00 C ATOM 1013 O GLU A 66 -2.185 -11.846 -15.960 1.00 0.00 O ATOM 1014 CB GLU A 66 0.807 -11.286 -17.159 1.00 0.00 C ATOM 1015 CG GLU A 66 0.839 -12.686 -16.547 1.00 0.00 C ATOM 1016 CD GLU A 66 2.261 -13.009 -16.085 1.00 0.00 C ATOM 1017 OE1 GLU A 66 2.468 -14.107 -15.597 1.00 0.00 O ATOM 1018 OE2 GLU A 66 3.117 -12.152 -16.225 1.00 0.00 O ATOM 0 H GLU A 66 0.280 -9.126 -18.238 1.00 0.00 H new ATOM 0 HA GLU A 66 -1.065 -11.649 -18.209 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.439 -11.252 -18.046 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.210 -10.560 -16.452 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.150 -12.742 -15.704 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.507 -13.422 -17.279 1.00 0.00 H new ATOM 1026 N GLU A 67 -1.383 -9.874 -15.454 1.00 0.00 N ATOM 1027 CA GLU A 67 -2.150 -9.865 -14.171 1.00 0.00 C ATOM 1028 C GLU A 67 -3.648 -9.610 -14.401 1.00 0.00 C ATOM 1029 O GLU A 67 -4.482 -10.238 -13.778 1.00 0.00 O ATOM 1030 CB GLU A 67 -1.562 -8.803 -13.242 1.00 0.00 C ATOM 1031 CG GLU A 67 -1.963 -9.113 -11.801 1.00 0.00 C ATOM 1032 CD GLU A 67 -1.242 -8.156 -10.854 1.00 0.00 C ATOM 1033 OE1 GLU A 67 -0.314 -7.504 -11.303 1.00 0.00 O ATOM 1034 OE2 GLU A 67 -1.627 -8.092 -9.699 1.00 0.00 O ATOM 0 H GLU A 67 -0.814 -9.046 -15.631 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.061 -10.849 -13.710 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -0.476 -8.785 -13.333 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.922 -7.815 -13.527 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -3.042 -9.014 -11.683 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -1.709 -10.144 -11.556 1.00 0.00 H new ATOM 1042 N ALA A 68 -4.010 -8.707 -15.271 1.00 0.00 N ATOM 1043 CA ALA A 68 -5.465 -8.447 -15.498 1.00 0.00 C ATOM 1044 C ALA A 68 -5.880 -8.977 -16.866 1.00 0.00 C ATOM 1045 O ALA A 68 -7.038 -9.253 -17.105 1.00 0.00 O ATOM 1046 CB ALA A 68 -5.740 -6.949 -15.442 1.00 0.00 C ATOM 0 H ALA A 68 -3.371 -8.142 -15.830 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.036 -8.954 -14.720 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -6.802 -6.768 -15.608 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.455 -6.563 -14.463 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.160 -6.444 -16.214 1.00 0.00 H new ATOM 1052 N GLY A 69 -4.953 -9.130 -17.766 1.00 0.00 N ATOM 1053 CA GLY A 69 -5.321 -9.650 -19.108 1.00 0.00 C ATOM 1054 C GLY A 69 -5.488 -8.489 -20.087 1.00 0.00 C ATOM 1055 O GLY A 69 -5.975 -8.667 -21.185 1.00 0.00 O ATOM 0 H GLY A 69 -3.964 -8.919 -17.632 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -4.550 -10.332 -19.467 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -6.248 -10.220 -19.045 1.00 0.00 H new ATOM 1059 N ILE A 70 -5.098 -7.300 -19.708 1.00 0.00 N ATOM 1060 CA ILE A 70 -5.258 -6.155 -20.644 1.00 0.00 C ATOM 1061 C ILE A 70 -3.907 -5.807 -21.270 1.00 0.00 C ATOM 1062 O ILE A 70 -2.937 -5.559 -20.581 1.00 0.00 O ATOM 1063 CB ILE A 70 -5.764 -4.929 -19.895 1.00 0.00 C ATOM 1064 CG1 ILE A 70 -6.905 -5.307 -18.956 1.00 0.00 C ATOM 1065 CG2 ILE A 70 -6.288 -3.916 -20.909 1.00 0.00 C ATOM 1066 CD1 ILE A 70 -7.172 -4.126 -18.027 1.00 0.00 C ATOM 0 H ILE A 70 -4.682 -7.077 -18.804 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.973 -6.440 -21.416 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.945 -4.509 -19.312 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -7.801 -5.552 -19.526 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -6.643 -6.193 -18.378 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -6.654 -3.033 -20.385 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.483 -3.629 -21.586 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -7.102 -4.361 -21.481 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -7.986 -4.375 -17.346 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -6.273 -3.905 -17.452 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.448 -3.253 -18.618 1.00 0.00 H new ATOM 1078 N GLU A 71 -3.844 -5.764 -22.569 1.00 0.00 N ATOM 1079 CA GLU A 71 -2.568 -5.414 -23.241 1.00 0.00 C ATOM 1080 C GLU A 71 -2.465 -3.900 -23.380 1.00 0.00 C ATOM 1081 O GLU A 71 -3.446 -3.189 -23.312 1.00 0.00 O ATOM 1082 CB GLU A 71 -2.532 -6.051 -24.629 1.00 0.00 C ATOM 1083 CG GLU A 71 -3.657 -5.468 -25.487 1.00 0.00 C ATOM 1084 CD GLU A 71 -3.710 -6.203 -26.827 1.00 0.00 C ATOM 1085 OE1 GLU A 71 -2.860 -7.051 -27.050 1.00 0.00 O ATOM 1086 OE2 GLU A 71 -4.598 -5.907 -27.607 1.00 0.00 O ATOM 0 H GLU A 71 -4.625 -5.957 -23.196 1.00 0.00 H new ATOM 0 HA GLU A 71 -1.733 -5.784 -22.647 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -1.567 -5.866 -25.101 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -2.645 -7.132 -24.548 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -4.611 -5.565 -24.969 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -3.490 -4.403 -25.650 1.00 0.00 H new ATOM 1094 N ALA A 72 -1.283 -3.400 -23.582 1.00 0.00 N ATOM 1095 CA ALA A 72 -1.122 -1.933 -23.737 1.00 0.00 C ATOM 1096 C ALA A 72 -1.822 -1.500 -25.024 1.00 0.00 C ATOM 1097 O ALA A 72 -2.244 -0.369 -25.171 1.00 0.00 O ATOM 1098 CB ALA A 72 0.363 -1.583 -23.816 1.00 0.00 C ATOM 0 H ALA A 72 -0.422 -3.943 -23.646 1.00 0.00 H new ATOM 0 HA ALA A 72 -1.561 -1.418 -22.882 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.477 -0.505 -23.930 1.00 0.00 H new ATOM 0 HB2 ALA A 72 0.862 -1.906 -22.903 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.811 -2.088 -24.672 1.00 0.00 H new ATOM 1104 N GLY A 73 -1.940 -2.401 -25.962 1.00 0.00 N ATOM 1105 CA GLY A 73 -2.599 -2.068 -27.254 1.00 0.00 C ATOM 1106 C GLY A 73 -3.992 -1.489 -26.999 1.00 0.00 C ATOM 1107 O GLY A 73 -4.442 -0.613 -27.709 1.00 0.00 O ATOM 0 H GLY A 73 -1.605 -3.361 -25.886 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -1.993 -1.349 -27.806 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -2.676 -2.962 -27.873 1.00 0.00 H new ATOM 1111 N GLN A 74 -4.680 -1.962 -25.994 1.00 0.00 N ATOM 1112 CA GLN A 74 -6.039 -1.411 -25.718 1.00 0.00 C ATOM 1113 C GLN A 74 -5.951 -0.363 -24.604 1.00 0.00 C ATOM 1114 O GLN A 74 -6.942 0.212 -24.203 1.00 0.00 O ATOM 1115 CB GLN A 74 -7.007 -2.534 -25.330 1.00 0.00 C ATOM 1116 CG GLN A 74 -6.473 -3.320 -24.135 1.00 0.00 C ATOM 1117 CD GLN A 74 -7.284 -4.613 -23.991 1.00 0.00 C ATOM 1118 OE1 GLN A 74 -6.672 -5.730 -23.706 1.00 0.00 O flip ATOM 1119 NE2 GLN A 74 -8.489 -4.606 -24.146 1.00 0.00 N flip ATOM 0 H GLN A 74 -4.365 -2.696 -25.360 1.00 0.00 H new ATOM 0 HA GLN A 74 -6.421 -0.936 -26.622 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.982 -2.112 -25.087 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -7.152 -3.205 -26.177 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -5.417 -3.551 -24.277 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -6.550 -2.723 -23.226 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -8.969 -3.734 -24.369 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -9.020 -5.472 -24.053 1.00 0.00 H new ATOM 1128 N LEU A 75 -4.766 -0.097 -24.120 1.00 0.00 N ATOM 1129 CA LEU A 75 -4.608 0.931 -23.051 1.00 0.00 C ATOM 1130 C LEU A 75 -3.775 2.097 -23.568 1.00 0.00 C ATOM 1131 O LEU A 75 -2.808 1.918 -24.282 1.00 0.00 O ATOM 1132 CB LEU A 75 -3.861 0.357 -21.848 1.00 0.00 C ATOM 1133 CG LEU A 75 -4.607 -0.838 -21.281 1.00 0.00 C ATOM 1134 CD1 LEU A 75 -3.655 -1.654 -20.418 1.00 0.00 C ATOM 1135 CD2 LEU A 75 -5.758 -0.344 -20.409 1.00 0.00 C ATOM 0 H LEU A 75 -3.901 -0.548 -24.419 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.608 1.253 -22.762 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -2.856 0.058 -22.145 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.752 1.123 -21.080 1.00 0.00 H new ATOM 0 HG LEU A 75 -4.993 -1.450 -22.096 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.183 -2.514 -20.007 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.818 -1.998 -21.025 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.281 -1.034 -19.603 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -6.297 -1.198 -19.999 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -5.363 0.261 -19.593 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -6.438 0.259 -21.011 1.00 0.00 H new ATOM 1147 N THR A 76 -4.107 3.281 -23.159 1.00 0.00 N ATOM 1148 CA THR A 76 -3.303 4.456 -23.559 1.00 0.00 C ATOM 1149 C THR A 76 -2.712 5.021 -22.271 1.00 0.00 C ATOM 1150 O THR A 76 -3.427 5.304 -21.330 1.00 0.00 O ATOM 1151 CB THR A 76 -4.198 5.484 -24.258 1.00 0.00 C ATOM 1152 OG1 THR A 76 -3.513 6.014 -25.383 1.00 0.00 O ATOM 1153 CG2 THR A 76 -4.552 6.618 -23.297 1.00 0.00 C ATOM 0 H THR A 76 -4.907 3.486 -22.560 1.00 0.00 H new ATOM 0 HA THR A 76 -2.513 4.192 -24.262 1.00 0.00 H new ATOM 0 HB THR A 76 -5.117 4.995 -24.580 1.00 0.00 H new ATOM 0 HG1 THR A 76 -4.084 6.671 -25.834 1.00 0.00 H new ATOM 0 HG21 THR A 76 -5.188 7.342 -23.807 1.00 0.00 H new ATOM 0 HG22 THR A 76 -5.082 6.212 -22.435 1.00 0.00 H new ATOM 0 HG23 THR A 76 -3.639 7.110 -22.963 1.00 0.00 H new ATOM 1161 N ILE A 77 -1.421 5.153 -22.180 1.00 0.00 N ATOM 1162 CA ILE A 77 -0.852 5.659 -20.905 1.00 0.00 C ATOM 1163 C ILE A 77 -0.989 7.170 -20.822 1.00 0.00 C ATOM 1164 O ILE A 77 -0.257 7.908 -21.452 1.00 0.00 O ATOM 1165 CB ILE A 77 0.629 5.302 -20.780 1.00 0.00 C ATOM 1166 CG1 ILE A 77 0.829 3.803 -21.024 1.00 0.00 C ATOM 1167 CG2 ILE A 77 1.102 5.667 -19.366 1.00 0.00 C ATOM 1168 CD1 ILE A 77 1.179 3.108 -19.709 1.00 0.00 C ATOM 0 H ILE A 77 -0.748 4.938 -22.916 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.408 5.188 -20.095 1.00 0.00 H new ATOM 0 HB ILE A 77 1.207 5.855 -21.521 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -0.078 3.369 -21.445 1.00 0.00 H new ATOM 0 HG13 ILE A 77 1.625 3.646 -21.752 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.158 5.418 -19.260 1.00 0.00 H new ATOM 0 HG22 ILE A 77 0.962 6.735 -19.200 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.522 5.107 -18.632 1.00 0.00 H new ATOM 0 HD11 ILE A 77 1.320 2.042 -19.887 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.098 3.534 -19.306 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.369 3.252 -18.994 1.00 0.00 H new ATOM 1180 N ILE A 78 -1.884 7.640 -20.007 1.00 0.00 N ATOM 1181 CA ILE A 78 -2.019 9.105 -19.839 1.00 0.00 C ATOM 1182 C ILE A 78 -0.704 9.599 -19.277 1.00 0.00 C ATOM 1183 O ILE A 78 -0.300 10.726 -19.477 1.00 0.00 O ATOM 1184 CB ILE A 78 -3.112 9.424 -18.822 1.00 0.00 C ATOM 1185 CG1 ILE A 78 -4.489 9.252 -19.460 1.00 0.00 C ATOM 1186 CG2 ILE A 78 -2.936 10.862 -18.331 1.00 0.00 C ATOM 1187 CD1 ILE A 78 -4.665 7.799 -19.882 1.00 0.00 C ATOM 0 H ILE A 78 -2.526 7.074 -19.452 1.00 0.00 H new ATOM 0 HA ILE A 78 -2.271 9.573 -20.791 1.00 0.00 H new ATOM 0 HB ILE A 78 -3.034 8.739 -17.977 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -5.269 9.535 -18.753 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -4.588 9.909 -20.324 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -3.714 11.096 -17.604 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -1.958 10.969 -17.863 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -3.011 11.547 -19.176 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -5.646 7.669 -20.338 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -3.892 7.533 -20.603 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.583 7.154 -19.007 1.00 0.00 H new ATOM 1199 N GLU A 79 -0.056 8.748 -18.536 1.00 0.00 N ATOM 1200 CA GLU A 79 1.226 9.129 -17.899 1.00 0.00 C ATOM 1201 C GLU A 79 0.943 10.255 -16.919 1.00 0.00 C ATOM 1202 O GLU A 79 0.201 10.095 -15.970 1.00 0.00 O ATOM 1203 CB GLU A 79 2.232 9.594 -18.959 1.00 0.00 C ATOM 1204 CG GLU A 79 2.630 8.407 -19.832 1.00 0.00 C ATOM 1205 CD GLU A 79 3.737 8.827 -20.800 1.00 0.00 C ATOM 1206 OE1 GLU A 79 4.312 7.953 -21.428 1.00 0.00 O ATOM 1207 OE2 GLU A 79 3.994 10.015 -20.894 1.00 0.00 O ATOM 0 H GLU A 79 -0.365 7.795 -18.344 1.00 0.00 H new ATOM 0 HA GLU A 79 1.657 8.272 -17.381 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.793 10.381 -19.573 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.114 10.019 -18.479 1.00 0.00 H new ATOM 0 HG2 GLU A 79 2.974 7.583 -19.207 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.765 8.046 -20.388 1.00 0.00 H new ATOM 1215 N GLY A 80 1.514 11.395 -17.144 1.00 0.00 N ATOM 1216 CA GLY A 80 1.262 12.536 -16.224 1.00 0.00 C ATOM 1217 C GLY A 80 1.773 12.182 -14.829 1.00 0.00 C ATOM 1218 O GLY A 80 2.653 12.831 -14.300 1.00 0.00 O ATOM 0 H GLY A 80 2.144 11.591 -17.922 1.00 0.00 H new ATOM 0 HA2 GLY A 80 1.763 13.432 -16.591 1.00 0.00 H new ATOM 0 HA3 GLY A 80 0.196 12.760 -16.187 1.00 0.00 H new ATOM 1222 N PHE A 81 1.230 11.159 -14.223 1.00 0.00 N ATOM 1223 CA PHE A 81 1.701 10.784 -12.861 1.00 0.00 C ATOM 1224 C PHE A 81 2.564 9.523 -12.934 1.00 0.00 C ATOM 1225 O PHE A 81 2.114 8.467 -13.330 1.00 0.00 O ATOM 1226 CB PHE A 81 0.502 10.507 -11.955 1.00 0.00 C ATOM 1227 CG PHE A 81 0.942 10.593 -10.512 1.00 0.00 C ATOM 1228 CD1 PHE A 81 1.748 9.589 -9.956 1.00 0.00 C ATOM 1229 CD2 PHE A 81 0.548 11.686 -9.732 1.00 0.00 C ATOM 1230 CE1 PHE A 81 2.157 9.681 -8.619 1.00 0.00 C ATOM 1231 CE2 PHE A 81 0.955 11.776 -8.397 1.00 0.00 C ATOM 1232 CZ PHE A 81 1.761 10.776 -7.840 1.00 0.00 C ATOM 0 H PHE A 81 0.489 10.574 -14.608 1.00 0.00 H new ATOM 0 HA PHE A 81 2.288 11.609 -12.457 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -0.291 11.229 -12.150 1.00 0.00 H new ATOM 0 HB3 PHE A 81 0.092 9.519 -12.165 1.00 0.00 H new ATOM 0 HD1 PHE A 81 2.053 8.746 -10.558 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -0.071 12.460 -10.161 1.00 0.00 H new ATOM 0 HE1 PHE A 81 2.777 8.908 -8.189 1.00 0.00 H new ATOM 0 HE2 PHE A 81 0.647 12.618 -7.795 1.00 0.00 H new ATOM 0 HZ PHE A 81 2.077 10.849 -6.810 1.00 0.00 H new ATOM 1242 N LYS A 82 3.797 9.627 -12.525 1.00 0.00 N ATOM 1243 CA LYS A 82 4.697 8.441 -12.531 1.00 0.00 C ATOM 1244 C LYS A 82 5.627 8.549 -11.336 1.00 0.00 C ATOM 1245 O LYS A 82 6.381 9.491 -11.213 1.00 0.00 O ATOM 1246 CB LYS A 82 5.540 8.403 -13.808 1.00 0.00 C ATOM 1247 CG LYS A 82 6.532 7.231 -13.732 1.00 0.00 C ATOM 1248 CD LYS A 82 7.855 7.687 -13.099 1.00 0.00 C ATOM 1249 CE LYS A 82 8.901 6.577 -13.236 1.00 0.00 C ATOM 1250 NZ LYS A 82 10.188 7.028 -12.629 1.00 0.00 N ATOM 0 H LYS A 82 4.223 10.489 -12.184 1.00 0.00 H new ATOM 0 HA LYS A 82 4.095 7.533 -12.485 1.00 0.00 H new ATOM 0 HB2 LYS A 82 4.895 8.291 -14.679 1.00 0.00 H new ATOM 0 HB3 LYS A 82 6.079 9.343 -13.929 1.00 0.00 H new ATOM 0 HG2 LYS A 82 6.102 6.420 -13.145 1.00 0.00 H new ATOM 0 HG3 LYS A 82 6.717 6.838 -14.732 1.00 0.00 H new ATOM 0 HD2 LYS A 82 8.209 8.596 -13.586 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.702 7.928 -12.047 1.00 0.00 H new ATOM 0 HE2 LYS A 82 8.552 5.670 -12.742 1.00 0.00 H new ATOM 0 HE3 LYS A 82 9.049 6.330 -14.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 10.899 6.274 -12.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 10.523 7.882 -13.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 10.041 7.243 -11.622 1.00 0.00 H new ATOM 1264 N ARG A 83 5.596 7.593 -10.464 1.00 0.00 N ATOM 1265 CA ARG A 83 6.495 7.642 -9.287 1.00 0.00 C ATOM 1266 C ARG A 83 6.558 6.254 -8.672 1.00 0.00 C ATOM 1267 O ARG A 83 5.779 5.385 -9.006 1.00 0.00 O ATOM 1268 CB ARG A 83 5.954 8.650 -8.270 1.00 0.00 C ATOM 1269 CG ARG A 83 7.115 9.335 -7.538 1.00 0.00 C ATOM 1270 CD ARG A 83 8.014 10.048 -8.551 1.00 0.00 C ATOM 1271 NE ARG A 83 8.357 11.407 -8.050 1.00 0.00 N ATOM 1272 CZ ARG A 83 9.513 11.937 -8.342 1.00 0.00 C ATOM 1273 NH1 ARG A 83 10.379 11.268 -9.053 1.00 0.00 N ATOM 1274 NH2 ARG A 83 9.797 13.140 -7.928 1.00 0.00 N ATOM 0 H ARG A 83 4.986 6.777 -10.514 1.00 0.00 H new ATOM 0 HA ARG A 83 7.495 7.956 -9.586 1.00 0.00 H new ATOM 0 HB2 ARG A 83 5.342 9.397 -8.776 1.00 0.00 H new ATOM 0 HB3 ARG A 83 5.309 8.143 -7.552 1.00 0.00 H new ATOM 0 HG2 ARG A 83 6.729 10.051 -6.813 1.00 0.00 H new ATOM 0 HG3 ARG A 83 7.692 8.597 -6.981 1.00 0.00 H new ATOM 0 HD2 ARG A 83 8.924 9.470 -8.714 1.00 0.00 H new ATOM 0 HD3 ARG A 83 7.507 10.122 -9.513 1.00 0.00 H new ATOM 0 HE ARG A 83 7.689 11.924 -7.479 1.00 0.00 H new ATOM 0 HH11 ARG A 83 10.153 10.329 -9.381 1.00 0.00 H new ATOM 0 HH12 ARG A 83 11.282 11.684 -9.280 1.00 0.00 H new ATOM 0 HH21 ARG A 83 9.117 13.664 -7.378 1.00 0.00 H new ATOM 0 HH22 ARG A 83 10.700 13.557 -8.154 1.00 0.00 H new ATOM 1288 N GLU A 84 7.475 6.030 -7.780 1.00 0.00 N ATOM 1289 CA GLU A 84 7.574 4.689 -7.162 1.00 0.00 C ATOM 1290 C GLU A 84 6.526 4.553 -6.062 1.00 0.00 C ATOM 1291 O GLU A 84 6.684 5.059 -4.970 1.00 0.00 O ATOM 1292 CB GLU A 84 8.971 4.505 -6.570 1.00 0.00 C ATOM 1293 CG GLU A 84 9.992 4.348 -7.697 1.00 0.00 C ATOM 1294 CD GLU A 84 11.391 4.195 -7.100 1.00 0.00 C ATOM 1295 OE1 GLU A 84 12.307 3.915 -7.854 1.00 0.00 O ATOM 1296 OE2 GLU A 84 11.521 4.358 -5.898 1.00 0.00 O ATOM 0 H GLU A 84 8.157 6.715 -7.454 1.00 0.00 H new ATOM 0 HA GLU A 84 7.398 3.925 -7.920 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.229 5.363 -5.949 1.00 0.00 H new ATOM 0 HB3 GLU A 84 8.990 3.627 -5.924 1.00 0.00 H new ATOM 0 HG2 GLU A 84 9.747 3.477 -8.305 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.959 5.216 -8.356 1.00 0.00 H new ATOM 1304 N LEU A 85 5.471 3.840 -6.335 1.00 0.00 N ATOM 1305 CA LEU A 85 4.431 3.631 -5.301 1.00 0.00 C ATOM 1306 C LEU A 85 5.021 2.647 -4.299 1.00 0.00 C ATOM 1307 O LEU A 85 5.529 1.615 -4.678 1.00 0.00 O ATOM 1308 CB LEU A 85 3.180 3.017 -5.944 1.00 0.00 C ATOM 1309 CG LEU A 85 1.972 3.221 -5.020 1.00 0.00 C ATOM 1310 CD1 LEU A 85 1.010 4.252 -5.620 1.00 0.00 C ATOM 1311 CD2 LEU A 85 1.222 1.899 -4.829 1.00 0.00 C ATOM 0 H LEU A 85 5.287 3.393 -7.233 1.00 0.00 H new ATOM 0 HA LEU A 85 4.147 4.569 -4.825 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.992 3.481 -6.912 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.337 1.954 -6.125 1.00 0.00 H new ATOM 0 HG LEU A 85 2.338 3.579 -4.058 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.158 4.386 -4.953 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.527 5.203 -5.744 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.659 3.901 -6.591 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.367 2.057 -4.171 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.874 1.535 -5.796 1.00 0.00 H new ATOM 0 HD23 LEU A 85 1.891 1.162 -4.384 1.00 0.00 H new ATOM 1323 N ASN A 86 5.005 2.955 -3.039 1.00 0.00 N ATOM 1324 CA ASN A 86 5.615 2.011 -2.063 1.00 0.00 C ATOM 1325 C ASN A 86 4.606 1.663 -0.976 1.00 0.00 C ATOM 1326 O ASN A 86 4.221 2.490 -0.176 1.00 0.00 O ATOM 1327 CB ASN A 86 6.858 2.666 -1.465 1.00 0.00 C ATOM 1328 CG ASN A 86 7.868 2.878 -2.593 1.00 0.00 C ATOM 1329 OD1 ASN A 86 7.585 2.411 -3.782 1.00 0.00 O flip ATOM 1330 ND2 ASN A 86 8.918 3.460 -2.396 1.00 0.00 N flip ATOM 0 H ASN A 86 4.604 3.805 -2.643 1.00 0.00 H new ATOM 0 HA ASN A 86 5.901 1.085 -2.562 1.00 0.00 H new ATOM 0 HB2 ASN A 86 6.601 3.618 -1.000 1.00 0.00 H new ATOM 0 HB3 ASN A 86 7.284 2.035 -0.685 1.00 0.00 H new ATOM 0 HD21 ASN A 86 9.134 3.822 -1.467 1.00 0.00 H new ATOM 0 HD22 ASN A 86 9.582 3.586 -3.160 1.00 0.00 H new ATOM 1337 N TYR A 87 4.169 0.435 -0.952 1.00 0.00 N ATOM 1338 CA TYR A 87 3.175 0.013 0.068 1.00 0.00 C ATOM 1339 C TYR A 87 3.422 -1.440 0.451 1.00 0.00 C ATOM 1340 O TYR A 87 4.095 -2.172 -0.249 1.00 0.00 O ATOM 1341 CB TYR A 87 1.771 0.162 -0.519 1.00 0.00 C ATOM 1342 CG TYR A 87 1.550 -0.885 -1.583 1.00 0.00 C ATOM 1343 CD1 TYR A 87 2.214 -0.786 -2.817 1.00 0.00 C ATOM 1344 CD2 TYR A 87 0.664 -1.942 -1.349 1.00 0.00 C ATOM 1345 CE1 TYR A 87 1.986 -1.746 -3.811 1.00 0.00 C ATOM 1346 CE2 TYR A 87 0.441 -2.903 -2.340 1.00 0.00 C ATOM 1347 CZ TYR A 87 1.098 -2.804 -3.571 1.00 0.00 C ATOM 1348 OH TYR A 87 0.864 -3.747 -4.551 1.00 0.00 O ATOM 0 H TYR A 87 4.461 -0.297 -1.600 1.00 0.00 H new ATOM 0 HA TYR A 87 3.269 0.635 0.958 1.00 0.00 H new ATOM 0 HB2 TYR A 87 1.024 0.057 0.268 1.00 0.00 H new ATOM 0 HB3 TYR A 87 1.648 1.158 -0.944 1.00 0.00 H new ATOM 0 HD1 TYR A 87 2.899 0.029 -2.999 1.00 0.00 H new ATOM 0 HD2 TYR A 87 0.151 -2.016 -0.401 1.00 0.00 H new ATOM 0 HE1 TYR A 87 2.494 -1.671 -4.761 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -0.239 -3.722 -2.155 1.00 0.00 H new ATOM 0 HH TYR A 87 -0.102 -3.862 -4.670 1.00 0.00 H new ATOM 1358 N VAL A 88 2.883 -1.864 1.557 1.00 0.00 N ATOM 1359 CA VAL A 88 3.082 -3.269 1.988 1.00 0.00 C ATOM 1360 C VAL A 88 1.722 -3.943 2.122 1.00 0.00 C ATOM 1361 O VAL A 88 0.781 -3.367 2.626 1.00 0.00 O ATOM 1362 CB VAL A 88 3.784 -3.303 3.348 1.00 0.00 C ATOM 1363 CG1 VAL A 88 4.955 -2.319 3.360 1.00 0.00 C ATOM 1364 CG2 VAL A 88 2.785 -2.918 4.439 1.00 0.00 C ATOM 0 H VAL A 88 2.312 -1.295 2.182 1.00 0.00 H new ATOM 0 HA VAL A 88 3.693 -3.789 1.250 1.00 0.00 H new ATOM 0 HB VAL A 88 4.164 -4.308 3.531 1.00 0.00 H new ATOM 0 HG11 VAL A 88 5.447 -2.351 4.332 1.00 0.00 H new ATOM 0 HG12 VAL A 88 5.668 -2.593 2.583 1.00 0.00 H new ATOM 0 HG13 VAL A 88 4.585 -1.311 3.174 1.00 0.00 H new ATOM 0 HG21 VAL A 88 3.280 -2.941 5.410 1.00 0.00 H new ATOM 0 HG22 VAL A 88 2.407 -1.914 4.248 1.00 0.00 H new ATOM 0 HG23 VAL A 88 1.955 -3.625 4.438 1.00 0.00 H new ATOM 1374 N ALA A 89 1.616 -5.165 1.697 1.00 0.00 N ATOM 1375 CA ALA A 89 0.326 -5.892 1.826 1.00 0.00 C ATOM 1376 C ALA A 89 0.603 -7.164 2.615 1.00 0.00 C ATOM 1377 O ALA A 89 -0.289 -7.888 3.011 1.00 0.00 O ATOM 1378 CB ALA A 89 -0.217 -6.233 0.440 1.00 0.00 C ATOM 0 H ALA A 89 2.371 -5.696 1.263 1.00 0.00 H new ATOM 0 HA ALA A 89 -0.418 -5.281 2.336 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -1.163 -6.766 0.541 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -0.376 -5.314 -0.124 1.00 0.00 H new ATOM 0 HB3 ALA A 89 0.500 -6.863 -0.087 1.00 0.00 H new ATOM 1384 N ARG A 90 1.858 -7.413 2.856 1.00 0.00 N ATOM 1385 CA ARG A 90 2.280 -8.606 3.634 1.00 0.00 C ATOM 1386 C ARG A 90 3.605 -8.264 4.307 1.00 0.00 C ATOM 1387 O ARG A 90 4.522 -9.062 4.342 1.00 0.00 O ATOM 1388 CB ARG A 90 2.481 -9.799 2.696 1.00 0.00 C ATOM 1389 CG ARG A 90 1.145 -10.206 2.073 1.00 0.00 C ATOM 1390 CD ARG A 90 1.350 -11.446 1.200 1.00 0.00 C ATOM 1391 NE ARG A 90 1.693 -12.611 2.065 1.00 0.00 N ATOM 1392 CZ ARG A 90 1.571 -13.825 1.600 1.00 0.00 C ATOM 1393 NH1 ARG A 90 1.138 -14.018 0.386 1.00 0.00 N ATOM 1394 NH2 ARG A 90 1.877 -14.846 2.355 1.00 0.00 N ATOM 0 H ARG A 90 2.627 -6.824 2.538 1.00 0.00 H new ATOM 0 HA ARG A 90 1.521 -8.869 4.371 1.00 0.00 H new ATOM 0 HB2 ARG A 90 3.193 -9.540 1.912 1.00 0.00 H new ATOM 0 HB3 ARG A 90 2.905 -10.638 3.247 1.00 0.00 H new ATOM 0 HG2 ARG A 90 0.415 -10.414 2.855 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.746 -9.388 1.474 1.00 0.00 H new ATOM 0 HD2 ARG A 90 0.445 -11.656 0.630 1.00 0.00 H new ATOM 0 HD3 ARG A 90 2.147 -11.268 0.478 1.00 0.00 H new ATOM 0 HE ARG A 90 2.022 -12.460 3.018 1.00 0.00 H new ATOM 0 HH11 ARG A 90 0.894 -13.220 -0.201 1.00 0.00 H new ATOM 0 HH12 ARG A 90 1.043 -14.967 0.023 1.00 0.00 H new ATOM 0 HH21 ARG A 90 2.211 -14.695 3.307 1.00 0.00 H new ATOM 0 HH22 ARG A 90 1.782 -15.795 1.993 1.00 0.00 H new ATOM 1408 N ASN A 91 3.719 -7.061 4.805 1.00 0.00 N ATOM 1409 CA ASN A 91 4.990 -6.619 5.445 1.00 0.00 C ATOM 1410 C ASN A 91 6.097 -6.635 4.389 1.00 0.00 C ATOM 1411 O ASN A 91 7.247 -6.908 4.674 1.00 0.00 O ATOM 1412 CB ASN A 91 5.351 -7.548 6.608 1.00 0.00 C ATOM 1413 CG ASN A 91 4.273 -7.453 7.690 1.00 0.00 C ATOM 1414 OD1 ASN A 91 3.253 -6.659 7.508 1.00 0.00 O flip ATOM 1415 ND2 ASN A 91 4.360 -8.105 8.710 1.00 0.00 N flip ATOM 0 H ASN A 91 2.978 -6.360 4.795 1.00 0.00 H new ATOM 0 HA ASN A 91 4.873 -5.611 5.843 1.00 0.00 H new ATOM 0 HB2 ASN A 91 5.436 -8.575 6.254 1.00 0.00 H new ATOM 0 HB3 ASN A 91 6.321 -7.271 7.021 1.00 0.00 H new ATOM 0 HD21 ASN A 91 5.157 -8.725 8.852 1.00 0.00 H new ATOM 0 HD22 ASN A 91 3.636 -8.033 9.425 1.00 0.00 H new ATOM 1422 N LYS A 92 5.744 -6.332 3.167 1.00 0.00 N ATOM 1423 CA LYS A 92 6.744 -6.308 2.060 1.00 0.00 C ATOM 1424 C LYS A 92 6.563 -5.007 1.267 1.00 0.00 C ATOM 1425 O LYS A 92 5.798 -4.956 0.323 1.00 0.00 O ATOM 1426 CB LYS A 92 6.506 -7.503 1.135 1.00 0.00 C ATOM 1427 CG LYS A 92 7.106 -8.767 1.754 1.00 0.00 C ATOM 1428 CD LYS A 92 6.667 -9.988 0.941 1.00 0.00 C ATOM 1429 CE LYS A 92 7.025 -11.266 1.704 1.00 0.00 C ATOM 1430 NZ LYS A 92 6.567 -12.453 0.929 1.00 0.00 N ATOM 0 H LYS A 92 4.792 -6.097 2.886 1.00 0.00 H new ATOM 0 HA LYS A 92 7.754 -6.362 2.466 1.00 0.00 H new ATOM 0 HB2 LYS A 92 5.437 -7.640 0.971 1.00 0.00 H new ATOM 0 HB3 LYS A 92 6.957 -7.315 0.160 1.00 0.00 H new ATOM 0 HG2 LYS A 92 8.194 -8.697 1.768 1.00 0.00 H new ATOM 0 HG3 LYS A 92 6.780 -8.869 2.789 1.00 0.00 H new ATOM 0 HD2 LYS A 92 5.593 -9.950 0.759 1.00 0.00 H new ATOM 0 HD3 LYS A 92 7.156 -9.984 -0.033 1.00 0.00 H new ATOM 0 HE2 LYS A 92 8.102 -11.317 1.864 1.00 0.00 H new ATOM 0 HE3 LYS A 92 6.556 -11.258 2.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 6.810 -13.321 1.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 5.536 -12.405 0.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 7.034 -12.462 -0.000 1.00 0.00 H new ATOM 1444 N PRO A 93 7.238 -3.956 1.659 1.00 0.00 N ATOM 1445 CA PRO A 93 7.118 -2.633 0.985 1.00 0.00 C ATOM 1446 C PRO A 93 7.812 -2.588 -0.378 1.00 0.00 C ATOM 1447 O PRO A 93 7.178 -2.387 -1.397 1.00 0.00 O ATOM 1448 CB PRO A 93 7.790 -1.653 1.947 1.00 0.00 C ATOM 1449 CG PRO A 93 8.667 -2.471 2.841 1.00 0.00 C ATOM 1450 CD PRO A 93 8.185 -3.922 2.781 1.00 0.00 C ATOM 0 HA PRO A 93 6.073 -2.399 0.780 1.00 0.00 H new ATOM 0 HB2 PRO A 93 8.375 -0.913 1.401 1.00 0.00 H new ATOM 0 HB3 PRO A 93 7.046 -1.107 2.527 1.00 0.00 H new ATOM 0 HG2 PRO A 93 9.707 -2.402 2.521 1.00 0.00 H new ATOM 0 HG3 PRO A 93 8.622 -2.097 3.864 1.00 0.00 H new ATOM 0 HD2 PRO A 93 9.016 -4.609 2.618 1.00 0.00 H new ATOM 0 HD3 PRO A 93 7.705 -4.218 3.713 1.00 0.00 H new ATOM 1458 N LYS A 94 9.105 -2.747 -0.412 1.00 0.00 N ATOM 1459 CA LYS A 94 9.814 -2.684 -1.718 1.00 0.00 C ATOM 1460 C LYS A 94 9.309 -1.456 -2.472 1.00 0.00 C ATOM 1461 O LYS A 94 8.742 -0.558 -1.886 1.00 0.00 O ATOM 1462 CB LYS A 94 9.512 -3.944 -2.527 1.00 0.00 C ATOM 1463 CG LYS A 94 9.832 -5.183 -1.687 1.00 0.00 C ATOM 1464 CD LYS A 94 11.324 -5.205 -1.346 1.00 0.00 C ATOM 1465 CE LYS A 94 11.715 -6.595 -0.843 1.00 0.00 C ATOM 1466 NZ LYS A 94 13.197 -6.665 -0.687 1.00 0.00 N ATOM 0 H LYS A 94 9.697 -2.916 0.401 1.00 0.00 H new ATOM 0 HA LYS A 94 10.891 -2.617 -1.562 1.00 0.00 H new ATOM 0 HB2 LYS A 94 8.463 -3.955 -2.824 1.00 0.00 H new ATOM 0 HB3 LYS A 94 10.103 -3.951 -3.443 1.00 0.00 H new ATOM 0 HG2 LYS A 94 9.240 -5.176 -0.772 1.00 0.00 H new ATOM 0 HG3 LYS A 94 9.561 -6.085 -2.235 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.912 -4.947 -2.227 1.00 0.00 H new ATOM 0 HD3 LYS A 94 11.544 -4.457 -0.585 1.00 0.00 H new ATOM 0 HE2 LYS A 94 11.228 -6.800 0.110 1.00 0.00 H new ATOM 0 HE3 LYS A 94 11.375 -7.357 -1.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 13.466 -7.610 -0.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 13.652 -6.487 -1.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 13.508 -5.947 -0.002 1.00 0.00 H new ATOM 1480 N THR A 95 9.493 -1.400 -3.762 1.00 0.00 N ATOM 1481 CA THR A 95 8.999 -0.212 -4.509 1.00 0.00 C ATOM 1482 C THR A 95 8.033 -0.632 -5.610 1.00 0.00 C ATOM 1483 O THR A 95 8.190 -1.652 -6.249 1.00 0.00 O ATOM 1484 CB THR A 95 10.170 0.552 -5.129 1.00 0.00 C ATOM 1485 OG1 THR A 95 10.580 1.582 -4.238 1.00 0.00 O ATOM 1486 CG2 THR A 95 9.725 1.164 -6.463 1.00 0.00 C ATOM 0 H THR A 95 9.957 -2.114 -4.323 1.00 0.00 H new ATOM 0 HA THR A 95 8.477 0.435 -3.804 1.00 0.00 H new ATOM 0 HB THR A 95 11.005 -0.126 -5.305 1.00 0.00 H new ATOM 0 HG1 THR A 95 10.832 2.378 -4.752 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.557 1.710 -6.908 1.00 0.00 H new ATOM 0 HG22 THR A 95 9.408 0.370 -7.140 1.00 0.00 H new ATOM 0 HG23 THR A 95 8.894 1.848 -6.290 1.00 0.00 H new ATOM 1494 N VAL A 96 7.038 0.173 -5.836 1.00 0.00 N ATOM 1495 CA VAL A 96 6.046 -0.126 -6.895 1.00 0.00 C ATOM 1496 C VAL A 96 5.790 1.148 -7.698 1.00 0.00 C ATOM 1497 O VAL A 96 5.493 2.176 -7.139 1.00 0.00 O ATOM 1498 CB VAL A 96 4.751 -0.589 -6.233 1.00 0.00 C ATOM 1499 CG1 VAL A 96 3.628 -0.667 -7.271 1.00 0.00 C ATOM 1500 CG2 VAL A 96 4.974 -1.973 -5.620 1.00 0.00 C ATOM 0 H VAL A 96 6.869 1.038 -5.323 1.00 0.00 H new ATOM 0 HA VAL A 96 6.416 -0.907 -7.559 1.00 0.00 H new ATOM 0 HB VAL A 96 4.467 0.122 -5.458 1.00 0.00 H new ATOM 0 HG11 VAL A 96 2.709 -0.998 -6.788 1.00 0.00 H new ATOM 0 HG12 VAL A 96 3.472 0.317 -7.713 1.00 0.00 H new ATOM 0 HG13 VAL A 96 3.903 -1.376 -8.052 1.00 0.00 H new ATOM 0 HG21 VAL A 96 4.054 -2.313 -5.144 1.00 0.00 H new ATOM 0 HG22 VAL A 96 5.259 -2.676 -6.403 1.00 0.00 H new ATOM 0 HG23 VAL A 96 5.768 -1.918 -4.876 1.00 0.00 H new ATOM 1510 N ILE A 97 5.889 1.100 -8.997 1.00 0.00 N ATOM 1511 CA ILE A 97 5.636 2.338 -9.789 1.00 0.00 C ATOM 1512 C ILE A 97 4.251 2.246 -10.413 1.00 0.00 C ATOM 1513 O ILE A 97 3.883 1.239 -10.984 1.00 0.00 O ATOM 1514 CB ILE A 97 6.690 2.492 -10.882 1.00 0.00 C ATOM 1515 CG1 ILE A 97 8.063 2.118 -10.317 1.00 0.00 C ATOM 1516 CG2 ILE A 97 6.713 3.953 -11.345 1.00 0.00 C ATOM 1517 CD1 ILE A 97 9.154 2.801 -11.141 1.00 0.00 C ATOM 0 H ILE A 97 6.130 0.271 -9.539 1.00 0.00 H new ATOM 0 HA ILE A 97 5.691 3.207 -9.134 1.00 0.00 H new ATOM 0 HB ILE A 97 6.453 1.840 -11.722 1.00 0.00 H new ATOM 0 HG12 ILE A 97 8.135 2.424 -9.273 1.00 0.00 H new ATOM 0 HG13 ILE A 97 8.196 1.036 -10.342 1.00 0.00 H new ATOM 0 HG21 ILE A 97 7.463 4.075 -12.126 1.00 0.00 H new ATOM 0 HG22 ILE A 97 5.733 4.226 -11.737 1.00 0.00 H new ATOM 0 HG23 ILE A 97 6.959 4.598 -10.502 1.00 0.00 H new ATOM 0 HD11 ILE A 97 10.132 2.536 -10.740 1.00 0.00 H new ATOM 0 HD12 ILE A 97 9.086 2.473 -12.178 1.00 0.00 H new ATOM 0 HD13 ILE A 97 9.023 3.882 -11.093 1.00 0.00 H new ATOM 1529 N TYR A 98 3.472 3.281 -10.283 1.00 0.00 N ATOM 1530 CA TYR A 98 2.087 3.254 -10.827 1.00 0.00 C ATOM 1531 C TYR A 98 1.920 4.296 -11.940 1.00 0.00 C ATOM 1532 O TYR A 98 2.219 5.461 -11.776 1.00 0.00 O ATOM 1533 CB TYR A 98 1.125 3.568 -9.671 1.00 0.00 C ATOM 1534 CG TYR A 98 0.738 2.307 -8.909 1.00 0.00 C ATOM 1535 CD1 TYR A 98 1.382 1.073 -9.138 1.00 0.00 C ATOM 1536 CD2 TYR A 98 -0.284 2.383 -7.956 1.00 0.00 C ATOM 1537 CE1 TYR A 98 1.000 -0.063 -8.413 1.00 0.00 C ATOM 1538 CE2 TYR A 98 -0.661 1.245 -7.235 1.00 0.00 C ATOM 1539 CZ TYR A 98 -0.020 0.024 -7.463 1.00 0.00 C ATOM 1540 OH TYR A 98 -0.395 -1.098 -6.747 1.00 0.00 O ATOM 0 H TYR A 98 3.737 4.151 -9.820 1.00 0.00 H new ATOM 0 HA TYR A 98 1.874 2.274 -11.253 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.594 4.277 -8.989 1.00 0.00 H new ATOM 0 HB3 TYR A 98 0.228 4.047 -10.063 1.00 0.00 H new ATOM 0 HD1 TYR A 98 2.170 1.004 -9.873 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.783 3.324 -7.777 1.00 0.00 H new ATOM 0 HE1 TYR A 98 1.495 -1.007 -8.589 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -1.450 1.310 -6.500 1.00 0.00 H new ATOM 0 HH TYR A 98 -1.149 -0.876 -6.162 1.00 0.00 H new ATOM 1550 N TRP A 99 1.426 3.868 -13.075 1.00 0.00 N ATOM 1551 CA TRP A 99 1.209 4.801 -14.221 1.00 0.00 C ATOM 1552 C TRP A 99 -0.285 4.901 -14.519 1.00 0.00 C ATOM 1553 O TRP A 99 -1.037 3.983 -14.264 1.00 0.00 O ATOM 1554 CB TRP A 99 1.893 4.259 -15.473 1.00 0.00 C ATOM 1555 CG TRP A 99 3.310 4.702 -15.540 1.00 0.00 C ATOM 1556 CD1 TRP A 99 3.732 5.901 -15.992 1.00 0.00 C ATOM 1557 CD2 TRP A 99 4.500 3.956 -15.175 1.00 0.00 C ATOM 1558 NE1 TRP A 99 5.111 5.941 -15.924 1.00 0.00 N ATOM 1559 CE2 TRP A 99 5.630 4.763 -15.424 1.00 0.00 C ATOM 1560 CE3 TRP A 99 4.702 2.670 -14.653 1.00 0.00 C ATOM 1561 CZ2 TRP A 99 6.922 4.308 -15.168 1.00 0.00 C ATOM 1562 CZ3 TRP A 99 5.999 2.208 -14.392 1.00 0.00 C ATOM 1563 CH2 TRP A 99 7.109 3.026 -14.651 1.00 0.00 C ATOM 0 H TRP A 99 1.161 2.900 -13.257 1.00 0.00 H new ATOM 0 HA TRP A 99 1.619 5.775 -13.956 1.00 0.00 H new ATOM 0 HB2 TRP A 99 1.848 3.170 -15.473 1.00 0.00 H new ATOM 0 HB3 TRP A 99 1.359 4.600 -16.360 1.00 0.00 H new ATOM 0 HD1 TRP A 99 3.096 6.698 -16.348 1.00 0.00 H new ATOM 0 HE1 TRP A 99 5.676 6.741 -16.208 1.00 0.00 H new ATOM 0 HE3 TRP A 99 3.854 2.033 -14.451 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.772 4.943 -15.368 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 6.145 1.217 -13.989 1.00 0.00 H new ATOM 0 HH2 TRP A 99 8.106 2.664 -14.450 1.00 0.00 H new ATOM 1574 N LEU A 100 -0.719 5.993 -15.088 1.00 0.00 N ATOM 1575 CA LEU A 100 -2.165 6.128 -15.427 1.00 0.00 C ATOM 1576 C LEU A 100 -2.439 5.438 -16.763 1.00 0.00 C ATOM 1577 O LEU A 100 -1.683 5.565 -17.707 1.00 0.00 O ATOM 1578 CB LEU A 100 -2.537 7.611 -15.514 1.00 0.00 C ATOM 1579 CG LEU A 100 -2.621 8.196 -14.102 1.00 0.00 C ATOM 1580 CD1 LEU A 100 -2.825 9.713 -14.175 1.00 0.00 C ATOM 1581 CD2 LEU A 100 -3.808 7.564 -13.368 1.00 0.00 C ATOM 0 H LEU A 100 -0.138 6.795 -15.332 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.769 5.658 -14.651 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.793 8.151 -16.100 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -3.492 7.729 -16.026 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.694 7.984 -13.569 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.884 10.121 -13.166 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -1.986 10.168 -14.702 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -3.750 9.930 -14.709 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.874 7.976 -12.361 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.728 7.781 -13.910 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -3.667 6.485 -13.310 1.00 0.00 H new ATOM 1593 N ALA A 101 -3.514 4.699 -16.847 1.00 0.00 N ATOM 1594 CA ALA A 101 -3.833 3.988 -18.119 1.00 0.00 C ATOM 1595 C ALA A 101 -5.352 3.951 -18.330 1.00 0.00 C ATOM 1596 O ALA A 101 -6.116 3.805 -17.396 1.00 0.00 O ATOM 1597 CB ALA A 101 -3.296 2.553 -18.040 1.00 0.00 C ATOM 0 H ALA A 101 -4.184 4.557 -16.091 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.369 4.514 -18.954 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -3.526 2.027 -18.967 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.216 2.576 -17.894 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -3.764 2.035 -17.203 1.00 0.00 H new ATOM 1603 N GLU A 102 -5.791 4.080 -19.557 1.00 0.00 N ATOM 1604 CA GLU A 102 -7.257 4.047 -19.843 1.00 0.00 C ATOM 1605 C GLU A 102 -7.553 2.971 -20.893 1.00 0.00 C ATOM 1606 O GLU A 102 -6.832 2.824 -21.859 1.00 0.00 O ATOM 1607 CB GLU A 102 -7.699 5.409 -20.385 1.00 0.00 C ATOM 1608 CG GLU A 102 -9.211 5.402 -20.629 1.00 0.00 C ATOM 1609 CD GLU A 102 -9.624 6.707 -21.309 1.00 0.00 C ATOM 1610 OE1 GLU A 102 -10.792 6.841 -21.630 1.00 0.00 O ATOM 1611 OE2 GLU A 102 -8.763 7.550 -21.501 1.00 0.00 O ATOM 0 H GLU A 102 -5.195 4.207 -20.375 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.798 3.820 -18.924 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -7.439 6.195 -19.676 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.172 5.630 -21.313 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.485 4.552 -21.253 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -9.742 5.288 -19.684 1.00 0.00 H new ATOM 1619 N VAL A 103 -8.612 2.223 -20.725 1.00 0.00 N ATOM 1620 CA VAL A 103 -8.939 1.172 -21.732 1.00 0.00 C ATOM 1621 C VAL A 103 -9.844 1.758 -22.808 1.00 0.00 C ATOM 1622 O VAL A 103 -10.949 2.185 -22.539 1.00 0.00 O ATOM 1623 CB VAL A 103 -9.664 -0.007 -21.068 1.00 0.00 C ATOM 1624 CG1 VAL A 103 -8.724 -0.733 -20.109 1.00 0.00 C ATOM 1625 CG2 VAL A 103 -10.882 0.497 -20.293 1.00 0.00 C ATOM 0 H VAL A 103 -9.260 2.294 -19.940 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.007 0.819 -22.173 1.00 0.00 H new ATOM 0 HB VAL A 103 -9.987 -0.697 -21.847 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -9.251 -1.567 -19.645 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.862 -1.110 -20.660 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.387 -0.042 -19.337 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -11.390 -0.346 -19.825 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.559 1.198 -19.523 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -11.566 0.999 -20.977 1.00 0.00 H new ATOM 1635 N LYS A 104 -9.401 1.754 -24.032 1.00 0.00 N ATOM 1636 CA LYS A 104 -10.260 2.280 -25.119 1.00 0.00 C ATOM 1637 C LYS A 104 -11.358 1.252 -25.369 1.00 0.00 C ATOM 1638 O LYS A 104 -12.308 1.493 -26.085 1.00 0.00 O ATOM 1639 CB LYS A 104 -9.426 2.494 -26.382 1.00 0.00 C ATOM 1640 CG LYS A 104 -8.786 1.172 -26.806 1.00 0.00 C ATOM 1641 CD LYS A 104 -7.778 1.428 -27.929 1.00 0.00 C ATOM 1642 CE LYS A 104 -6.620 2.272 -27.390 1.00 0.00 C ATOM 1643 NZ LYS A 104 -5.338 1.795 -27.981 1.00 0.00 N ATOM 0 H LYS A 104 -8.486 1.411 -24.323 1.00 0.00 H new ATOM 0 HA LYS A 104 -10.697 3.239 -24.842 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.056 2.878 -27.184 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -8.654 3.241 -26.197 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -8.288 0.708 -25.955 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -9.554 0.476 -27.144 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -7.402 0.482 -28.318 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -8.263 1.943 -28.758 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -6.777 3.322 -27.635 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -6.580 2.201 -26.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -4.545 2.323 -27.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -5.221 0.781 -27.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -5.352 1.947 -29.010 1.00 0.00 H new ATOM 1657 N ASP A 105 -11.232 0.107 -24.752 1.00 0.00 N ATOM 1658 CA ASP A 105 -12.259 -0.954 -24.909 1.00 0.00 C ATOM 1659 C ASP A 105 -13.164 -0.943 -23.677 1.00 0.00 C ATOM 1660 O ASP A 105 -12.832 -1.487 -22.641 1.00 0.00 O ATOM 1661 CB ASP A 105 -11.575 -2.321 -25.019 1.00 0.00 C ATOM 1662 CG ASP A 105 -11.035 -2.527 -26.437 1.00 0.00 C ATOM 1663 OD1 ASP A 105 -11.311 -1.695 -27.285 1.00 0.00 O ATOM 1664 OD2 ASP A 105 -10.356 -3.518 -26.651 1.00 0.00 O ATOM 0 H ASP A 105 -10.453 -0.137 -24.141 1.00 0.00 H new ATOM 0 HA ASP A 105 -12.845 -0.771 -25.810 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -10.760 -2.388 -24.298 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -12.284 -3.112 -24.773 1.00 0.00 H new ATOM 1670 N TYR A 106 -14.306 -0.329 -23.782 1.00 0.00 N ATOM 1671 CA TYR A 106 -15.236 -0.280 -22.623 1.00 0.00 C ATOM 1672 C TYR A 106 -15.565 -1.711 -22.197 1.00 0.00 C ATOM 1673 O TYR A 106 -15.829 -1.988 -21.042 1.00 0.00 O ATOM 1674 CB TYR A 106 -16.518 0.446 -23.043 1.00 0.00 C ATOM 1675 CG TYR A 106 -17.420 0.642 -21.852 1.00 0.00 C ATOM 1676 CD1 TYR A 106 -18.305 -0.372 -21.468 1.00 0.00 C ATOM 1677 CD2 TYR A 106 -17.380 1.845 -21.138 1.00 0.00 C ATOM 1678 CE1 TYR A 106 -19.149 -0.184 -20.369 1.00 0.00 C ATOM 1679 CE2 TYR A 106 -18.223 2.033 -20.038 1.00 0.00 C ATOM 1680 CZ TYR A 106 -19.110 1.019 -19.653 1.00 0.00 C ATOM 1681 OH TYR A 106 -19.944 1.205 -18.571 1.00 0.00 O ATOM 0 H TYR A 106 -14.637 0.143 -24.624 1.00 0.00 H new ATOM 0 HA TYR A 106 -14.777 0.252 -21.790 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -16.270 1.412 -23.483 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -17.036 -0.130 -23.810 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -18.336 -1.300 -22.020 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -16.698 2.628 -21.436 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -19.831 -0.967 -20.072 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -18.190 2.960 -19.485 1.00 0.00 H new ATOM 0 HH TYR A 106 -19.789 2.093 -18.187 1.00 0.00 H new ATOM 1691 N ASP A 107 -15.550 -2.618 -23.129 1.00 0.00 N ATOM 1692 CA ASP A 107 -15.859 -4.038 -22.806 1.00 0.00 C ATOM 1693 C ASP A 107 -14.563 -4.851 -22.757 1.00 0.00 C ATOM 1694 O ASP A 107 -14.575 -6.054 -22.927 1.00 0.00 O ATOM 1695 CB ASP A 107 -16.777 -4.613 -23.887 1.00 0.00 C ATOM 1696 CG ASP A 107 -16.021 -4.687 -25.216 1.00 0.00 C ATOM 1697 OD1 ASP A 107 -16.663 -4.904 -26.231 1.00 0.00 O ATOM 1698 OD2 ASP A 107 -14.813 -4.528 -25.196 1.00 0.00 O ATOM 0 H ASP A 107 -15.335 -2.436 -24.109 1.00 0.00 H new ATOM 0 HA ASP A 107 -16.353 -4.089 -21.836 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -17.120 -5.606 -23.596 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -17.664 -3.988 -23.996 1.00 0.00 H new ATOM 1704 N VAL A 108 -13.440 -4.214 -22.547 1.00 0.00 N ATOM 1705 CA VAL A 108 -12.160 -4.977 -22.510 1.00 0.00 C ATOM 1706 C VAL A 108 -12.360 -6.272 -21.731 1.00 0.00 C ATOM 1707 O VAL A 108 -13.155 -6.343 -20.813 1.00 0.00 O ATOM 1708 CB VAL A 108 -11.065 -4.152 -21.837 1.00 0.00 C ATOM 1709 CG1 VAL A 108 -11.502 -3.745 -20.430 1.00 0.00 C ATOM 1710 CG2 VAL A 108 -9.789 -4.993 -21.750 1.00 0.00 C ATOM 0 H VAL A 108 -13.355 -3.208 -22.401 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.859 -5.201 -23.533 1.00 0.00 H new ATOM 0 HB VAL A 108 -10.880 -3.252 -22.424 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -10.714 -3.157 -19.960 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -12.412 -3.149 -20.490 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -11.692 -4.638 -19.835 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -9.002 -4.411 -21.271 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -9.984 -5.891 -21.164 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -9.471 -5.276 -22.753 1.00 0.00 H new ATOM 1720 N GLU A 109 -11.640 -7.294 -22.089 1.00 0.00 N ATOM 1721 CA GLU A 109 -11.773 -8.589 -21.380 1.00 0.00 C ATOM 1722 C GLU A 109 -10.654 -8.703 -20.351 1.00 0.00 C ATOM 1723 O GLU A 109 -9.515 -8.969 -20.677 1.00 0.00 O ATOM 1724 CB GLU A 109 -11.672 -9.729 -22.397 1.00 0.00 C ATOM 1725 CG GLU A 109 -11.089 -10.976 -21.730 1.00 0.00 C ATOM 1726 CD GLU A 109 -11.495 -12.217 -22.528 1.00 0.00 C ATOM 1727 OE1 GLU A 109 -11.783 -12.073 -23.704 1.00 0.00 O ATOM 1728 OE2 GLU A 109 -11.516 -13.290 -21.947 1.00 0.00 O ATOM 0 H GLU A 109 -10.960 -7.286 -22.849 1.00 0.00 H new ATOM 0 HA GLU A 109 -12.736 -8.648 -20.874 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -12.658 -9.952 -22.805 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -11.042 -9.426 -23.234 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -10.003 -10.901 -21.681 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -11.450 -11.056 -20.705 1.00 0.00 H new ATOM 1736 N ILE A 110 -10.969 -8.494 -19.108 1.00 0.00 N ATOM 1737 CA ILE A 110 -9.927 -8.582 -18.054 1.00 0.00 C ATOM 1738 C ILE A 110 -9.574 -10.045 -17.813 1.00 0.00 C ATOM 1739 O ILE A 110 -10.244 -10.738 -17.073 1.00 0.00 O ATOM 1740 CB ILE A 110 -10.463 -8.001 -16.749 1.00 0.00 C ATOM 1741 CG1 ILE A 110 -11.094 -6.632 -17.007 1.00 0.00 C ATOM 1742 CG2 ILE A 110 -9.316 -7.863 -15.744 1.00 0.00 C ATOM 1743 CD1 ILE A 110 -10.075 -5.691 -17.613 1.00 0.00 C ATOM 0 H ILE A 110 -11.906 -8.265 -18.775 1.00 0.00 H new ATOM 0 HA ILE A 110 -9.048 -8.026 -18.379 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.223 -8.669 -16.343 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -11.946 -6.737 -17.678 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.473 -6.217 -16.073 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -9.698 -7.448 -14.811 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -8.879 -8.843 -15.553 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -8.553 -7.199 -16.151 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -10.537 -4.720 -17.792 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -9.236 -5.573 -16.927 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.717 -6.102 -18.557 1.00 0.00 H new ATOM 1755 N ARG A 111 -8.528 -10.519 -18.412 1.00 0.00 N ATOM 1756 CA ARG A 111 -8.149 -11.938 -18.184 1.00 0.00 C ATOM 1757 C ARG A 111 -7.134 -12.006 -17.057 1.00 0.00 C ATOM 1758 O ARG A 111 -6.074 -11.418 -17.116 1.00 0.00 O ATOM 1759 CB ARG A 111 -7.575 -12.542 -19.459 1.00 0.00 C ATOM 1760 CG ARG A 111 -8.728 -13.097 -20.288 1.00 0.00 C ATOM 1761 CD ARG A 111 -8.261 -13.315 -21.724 1.00 0.00 C ATOM 1762 NE ARG A 111 -7.824 -12.014 -22.300 1.00 0.00 N ATOM 1763 CZ ARG A 111 -7.329 -11.970 -23.504 1.00 0.00 C ATOM 1764 NH1 ARG A 111 -7.205 -13.070 -24.193 1.00 0.00 N ATOM 1765 NH2 ARG A 111 -6.951 -10.831 -24.019 1.00 0.00 N ATOM 0 H ARG A 111 -7.922 -9.995 -19.044 1.00 0.00 H new ATOM 0 HA ARG A 111 -9.033 -12.512 -17.906 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -7.030 -11.787 -20.025 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -6.865 -13.333 -19.218 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -9.078 -14.037 -19.861 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -9.570 -12.405 -20.269 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -7.439 -14.031 -21.747 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -9.069 -13.738 -22.321 1.00 0.00 H new ATOM 0 HE ARG A 111 -7.912 -11.158 -21.753 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -7.495 -13.960 -23.789 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -6.818 -13.040 -25.136 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -7.043 -9.971 -23.478 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -6.564 -10.801 -24.962 1.00 0.00 H new ATOM 1779 N LEU A 112 -7.470 -12.707 -16.020 1.00 0.00 N ATOM 1780 CA LEU A 112 -6.551 -12.803 -14.862 1.00 0.00 C ATOM 1781 C LEU A 112 -5.676 -14.044 -15.011 1.00 0.00 C ATOM 1782 O LEU A 112 -6.129 -15.157 -14.844 1.00 0.00 O ATOM 1783 CB LEU A 112 -7.380 -12.922 -13.580 1.00 0.00 C ATOM 1784 CG LEU A 112 -8.610 -12.016 -13.677 1.00 0.00 C ATOM 1785 CD1 LEU A 112 -9.437 -12.138 -12.394 1.00 0.00 C ATOM 1786 CD2 LEU A 112 -8.169 -10.563 -13.869 1.00 0.00 C ATOM 0 H LEU A 112 -8.346 -13.221 -15.923 1.00 0.00 H new ATOM 0 HA LEU A 112 -5.919 -11.916 -14.817 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.689 -13.956 -13.430 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.776 -12.641 -12.717 1.00 0.00 H new ATOM 0 HG LEU A 112 -9.216 -12.321 -14.530 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.313 -11.493 -12.463 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.757 -13.172 -12.264 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.830 -11.836 -11.540 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -9.048 -9.922 -13.938 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -7.559 -10.253 -13.021 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.586 -10.478 -14.786 1.00 0.00 H new ATOM 1798 N SER A 113 -4.424 -13.862 -15.312 1.00 0.00 N ATOM 1799 CA SER A 113 -3.524 -15.037 -15.456 1.00 0.00 C ATOM 1800 C SER A 113 -3.366 -15.694 -14.087 1.00 0.00 C ATOM 1801 O SER A 113 -3.853 -15.190 -13.096 1.00 0.00 O ATOM 1802 CB SER A 113 -2.160 -14.583 -15.975 1.00 0.00 C ATOM 1803 OG SER A 113 -2.342 -13.812 -17.153 1.00 0.00 O ATOM 0 H SER A 113 -3.985 -12.954 -15.464 1.00 0.00 H new ATOM 0 HA SER A 113 -3.947 -15.749 -16.165 1.00 0.00 H new ATOM 0 HB2 SER A 113 -1.647 -13.993 -15.216 1.00 0.00 H new ATOM 0 HB3 SER A 113 -1.531 -15.448 -16.186 1.00 0.00 H new ATOM 0 HG SER A 113 -2.652 -12.914 -16.912 1.00 0.00 H new ATOM 1809 N HIS A 114 -2.707 -16.817 -14.014 1.00 0.00 N ATOM 1810 CA HIS A 114 -2.539 -17.491 -12.693 1.00 0.00 C ATOM 1811 C HIS A 114 -1.993 -16.489 -11.669 1.00 0.00 C ATOM 1812 O HIS A 114 -0.837 -16.528 -11.304 1.00 0.00 O ATOM 1813 CB HIS A 114 -1.547 -18.645 -12.845 1.00 0.00 C ATOM 1814 CG HIS A 114 -0.177 -18.075 -13.082 1.00 0.00 C ATOM 1815 ND1 HIS A 114 0.938 -18.512 -12.385 1.00 0.00 N ATOM 1816 CD2 HIS A 114 0.267 -17.083 -13.920 1.00 0.00 C ATOM 1817 CE1 HIS A 114 1.991 -17.789 -12.813 1.00 0.00 C ATOM 1818 NE2 HIS A 114 1.634 -16.908 -13.746 1.00 0.00 N ATOM 0 H HIS A 114 -2.279 -17.296 -14.806 1.00 0.00 H new ATOM 0 HA HIS A 114 -3.502 -17.869 -12.351 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -1.548 -19.265 -11.948 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -1.838 -19.287 -13.677 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -0.351 -16.525 -14.608 1.00 0.00 H new ATOM 0 HE1 HIS A 114 2.999 -17.909 -12.445 1.00 0.00 H new ATOM 0 HE2 HIS A 114 2.238 -16.244 -14.231 1.00 0.00 H new ATOM 1827 N GLU A 115 -2.823 -15.603 -11.190 1.00 0.00 N ATOM 1828 CA GLU A 115 -2.365 -14.604 -10.183 1.00 0.00 C ATOM 1829 C GLU A 115 -3.577 -14.011 -9.471 1.00 0.00 C ATOM 1830 O GLU A 115 -3.563 -13.788 -8.276 1.00 0.00 O ATOM 1831 CB GLU A 115 -1.600 -13.467 -10.869 1.00 0.00 C ATOM 1832 CG GLU A 115 -0.161 -13.896 -11.163 1.00 0.00 C ATOM 1833 CD GLU A 115 0.623 -12.694 -11.692 1.00 0.00 C ATOM 1834 OE1 GLU A 115 1.835 -12.794 -11.781 1.00 0.00 O ATOM 1835 OE2 GLU A 115 -0.003 -11.691 -11.998 1.00 0.00 O ATOM 0 H GLU A 115 -3.805 -15.528 -11.455 1.00 0.00 H new ATOM 0 HA GLU A 115 -1.710 -15.104 -9.470 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -2.101 -13.191 -11.797 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -1.600 -12.583 -10.231 1.00 0.00 H new ATOM 0 HG2 GLU A 115 0.308 -14.282 -10.258 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -0.152 -14.703 -11.896 1.00 0.00 H new ATOM 1843 N HIS A 116 -4.626 -13.735 -10.199 1.00 0.00 N ATOM 1844 CA HIS A 116 -5.829 -13.136 -9.565 1.00 0.00 C ATOM 1845 C HIS A 116 -7.097 -13.823 -10.077 1.00 0.00 C ATOM 1846 O HIS A 116 -7.183 -14.224 -11.219 1.00 0.00 O ATOM 1847 CB HIS A 116 -5.885 -11.650 -9.913 1.00 0.00 C ATOM 1848 CG HIS A 116 -4.655 -10.972 -9.379 1.00 0.00 C ATOM 1849 ND1 HIS A 116 -3.397 -11.191 -9.924 1.00 0.00 N ATOM 1850 CD2 HIS A 116 -4.468 -10.086 -8.347 1.00 0.00 C ATOM 1851 CE1 HIS A 116 -2.516 -10.454 -9.220 1.00 0.00 C ATOM 1852 NE2 HIS A 116 -3.117 -9.764 -8.252 1.00 0.00 N ATOM 0 H HIS A 116 -4.699 -13.899 -11.203 1.00 0.00 H new ATOM 0 HA HIS A 116 -5.768 -13.268 -8.485 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -5.947 -11.519 -10.993 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -6.779 -11.197 -9.485 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -5.248 -9.699 -7.708 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -1.454 -10.426 -9.416 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -2.679 -9.132 -7.582 1.00 0.00 H new ATOM 1861 N GLN A 117 -8.089 -13.943 -9.238 1.00 0.00 N ATOM 1862 CA GLN A 117 -9.363 -14.579 -9.671 1.00 0.00 C ATOM 1863 C GLN A 117 -10.495 -13.566 -9.505 1.00 0.00 C ATOM 1864 O GLN A 117 -11.658 -13.887 -9.643 1.00 0.00 O ATOM 1865 CB GLN A 117 -9.647 -15.814 -8.810 1.00 0.00 C ATOM 1866 CG GLN A 117 -10.716 -16.671 -9.492 1.00 0.00 C ATOM 1867 CD GLN A 117 -11.068 -17.859 -8.597 1.00 0.00 C ATOM 1868 OE1 GLN A 117 -10.373 -18.071 -7.514 1.00 0.00 O flip ATOM 1869 NE2 GLN A 117 -11.984 -18.600 -8.886 1.00 0.00 N flip ATOM 0 H GLN A 117 -8.071 -13.627 -8.268 1.00 0.00 H new ATOM 0 HA GLN A 117 -9.287 -14.887 -10.714 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -8.734 -16.393 -8.672 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -9.985 -15.511 -7.819 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -11.606 -16.073 -9.687 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -10.352 -17.025 -10.457 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -12.527 -18.433 -9.733 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -12.211 -19.390 -8.282 1.00 0.00 H new ATOM 1878 N ALA A 118 -10.163 -12.343 -9.199 1.00 0.00 N ATOM 1879 CA ALA A 118 -11.222 -11.316 -9.016 1.00 0.00 C ATOM 1880 C ALA A 118 -10.772 -9.990 -9.621 1.00 0.00 C ATOM 1881 O ALA A 118 -9.662 -9.546 -9.421 1.00 0.00 O ATOM 1882 CB ALA A 118 -11.472 -11.115 -7.525 1.00 0.00 C ATOM 0 H ALA A 118 -9.207 -12.012 -9.068 1.00 0.00 H new ATOM 0 HA ALA A 118 -12.134 -11.651 -9.511 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -12.248 -10.363 -7.384 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.794 -12.056 -7.080 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -10.552 -10.782 -7.044 1.00 0.00 H new ATOM 1888 N TYR A 119 -11.644 -9.351 -10.340 1.00 0.00 N ATOM 1889 CA TYR A 119 -11.306 -8.041 -10.948 1.00 0.00 C ATOM 1890 C TYR A 119 -12.600 -7.248 -11.103 1.00 0.00 C ATOM 1891 O TYR A 119 -13.599 -7.770 -11.557 1.00 0.00 O ATOM 1892 CB TYR A 119 -10.653 -8.270 -12.309 1.00 0.00 C ATOM 1893 CG TYR A 119 -11.688 -8.626 -13.337 1.00 0.00 C ATOM 1894 CD1 TYR A 119 -12.178 -9.931 -13.417 1.00 0.00 C ATOM 1895 CD2 TYR A 119 -12.144 -7.649 -14.221 1.00 0.00 C ATOM 1896 CE1 TYR A 119 -13.129 -10.261 -14.386 1.00 0.00 C ATOM 1897 CE2 TYR A 119 -13.093 -7.971 -15.194 1.00 0.00 C ATOM 1898 CZ TYR A 119 -13.586 -9.280 -15.278 1.00 0.00 C ATOM 1899 OH TYR A 119 -14.515 -9.607 -16.243 1.00 0.00 O ATOM 0 H TYR A 119 -12.588 -9.684 -10.535 1.00 0.00 H new ATOM 0 HA TYR A 119 -10.608 -7.488 -10.320 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -10.119 -7.371 -12.618 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -9.916 -9.069 -12.235 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -11.822 -10.685 -12.730 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -11.763 -6.641 -14.153 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -13.511 -11.269 -14.448 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -13.445 -7.214 -15.879 1.00 0.00 H new ATOM 0 HH TYR A 119 -14.725 -8.813 -16.777 1.00 0.00 H new ATOM 1909 N ARG A 120 -12.612 -6.006 -10.706 1.00 0.00 N ATOM 1910 CA ARG A 120 -13.873 -5.222 -10.812 1.00 0.00 C ATOM 1911 C ARG A 120 -13.588 -3.794 -11.268 1.00 0.00 C ATOM 1912 O ARG A 120 -12.557 -3.226 -10.971 1.00 0.00 O ATOM 1913 CB ARG A 120 -14.529 -5.145 -9.436 1.00 0.00 C ATOM 1914 CG ARG A 120 -14.910 -6.538 -8.939 1.00 0.00 C ATOM 1915 CD ARG A 120 -15.301 -6.438 -7.461 1.00 0.00 C ATOM 1916 NE ARG A 120 -16.591 -7.140 -7.230 1.00 0.00 N ATOM 1917 CZ ARG A 120 -17.372 -6.759 -6.256 1.00 0.00 C ATOM 1918 NH1 ARG A 120 -17.026 -5.752 -5.498 1.00 0.00 N ATOM 1919 NH2 ARG A 120 -18.499 -7.378 -6.041 1.00 0.00 N ATOM 0 H ARG A 120 -11.813 -5.505 -10.317 1.00 0.00 H new ATOM 0 HA ARG A 120 -14.522 -5.716 -11.536 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -13.846 -4.675 -8.728 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -15.418 -4.516 -9.486 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -15.740 -6.935 -9.524 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -14.074 -7.226 -9.064 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -14.521 -6.878 -6.839 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -15.389 -5.391 -7.169 1.00 0.00 H new ATOM 0 HE ARG A 120 -16.865 -7.917 -7.831 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -16.146 -5.265 -5.668 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -17.636 -5.454 -4.737 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -18.772 -8.162 -6.634 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -19.108 -7.079 -5.279 1.00 0.00 H new ATOM 1933 N TRP A 121 -14.530 -3.195 -11.938 1.00 0.00 N ATOM 1934 CA TRP A 121 -14.366 -1.780 -12.369 1.00 0.00 C ATOM 1935 C TRP A 121 -15.169 -0.915 -11.391 1.00 0.00 C ATOM 1936 O TRP A 121 -16.382 -0.952 -11.383 1.00 0.00 O ATOM 1937 CB TRP A 121 -14.926 -1.607 -13.782 1.00 0.00 C ATOM 1938 CG TRP A 121 -13.982 -2.184 -14.791 1.00 0.00 C ATOM 1939 CD1 TRP A 121 -14.108 -3.401 -15.372 1.00 0.00 C ATOM 1940 CD2 TRP A 121 -12.781 -1.587 -15.356 1.00 0.00 C ATOM 1941 NE1 TRP A 121 -13.064 -3.583 -16.262 1.00 0.00 N ATOM 1942 CE2 TRP A 121 -12.218 -2.493 -16.284 1.00 0.00 C ATOM 1943 CE3 TRP A 121 -12.131 -0.359 -15.154 1.00 0.00 C ATOM 1944 CZ2 TRP A 121 -11.054 -2.187 -16.990 1.00 0.00 C ATOM 1945 CZ3 TRP A 121 -10.959 -0.053 -15.861 1.00 0.00 C ATOM 1946 CH2 TRP A 121 -10.422 -0.964 -16.776 1.00 0.00 C ATOM 0 H TRP A 121 -15.413 -3.628 -12.208 1.00 0.00 H new ATOM 0 HA TRP A 121 -13.315 -1.493 -12.373 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -15.896 -2.099 -13.859 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -15.088 -0.549 -13.989 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -14.895 -4.113 -15.173 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -12.936 -4.420 -16.831 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -12.536 0.354 -14.451 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -10.646 -2.893 -17.698 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -10.467 0.894 -15.697 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -9.519 -0.720 -17.316 1.00 0.00 H new ATOM 1957 N LEU A 122 -14.515 -0.163 -10.540 1.00 0.00 N ATOM 1958 CA LEU A 122 -15.278 0.656 -9.548 1.00 0.00 C ATOM 1959 C LEU A 122 -14.819 2.115 -9.570 1.00 0.00 C ATOM 1960 O LEU A 122 -13.857 2.468 -10.219 1.00 0.00 O ATOM 1961 CB LEU A 122 -15.061 0.110 -8.135 1.00 0.00 C ATOM 1962 CG LEU A 122 -14.509 -1.318 -8.178 1.00 0.00 C ATOM 1963 CD1 LEU A 122 -13.141 -1.339 -7.505 1.00 0.00 C ATOM 1964 CD2 LEU A 122 -15.459 -2.267 -7.441 1.00 0.00 C ATOM 0 H LEU A 122 -13.500 -0.081 -10.489 1.00 0.00 H new ATOM 0 HA LEU A 122 -16.332 0.601 -9.820 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -14.369 0.755 -7.594 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -16.003 0.123 -7.587 1.00 0.00 H new ATOM 0 HG LEU A 122 -14.418 -1.644 -9.214 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.739 -2.352 -7.530 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.465 -0.667 -8.034 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -13.240 -1.013 -6.469 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -15.060 -3.281 -7.476 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -15.556 -1.951 -6.402 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -16.438 -2.246 -7.920 1.00 0.00 H new ATOM 1976 N GLY A 123 -15.512 2.959 -8.846 1.00 0.00 N ATOM 1977 CA GLY A 123 -15.143 4.404 -8.795 1.00 0.00 C ATOM 1978 C GLY A 123 -14.010 4.621 -7.788 1.00 0.00 C ATOM 1979 O GLY A 123 -13.489 3.687 -7.211 1.00 0.00 O ATOM 0 H GLY A 123 -16.324 2.704 -8.284 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -14.832 4.743 -9.783 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -16.011 5.000 -8.512 1.00 0.00 H new ATOM 1983 N LEU A 124 -13.625 5.851 -7.587 1.00 0.00 N ATOM 1984 CA LEU A 124 -12.519 6.161 -6.627 1.00 0.00 C ATOM 1985 C LEU A 124 -12.868 5.690 -5.216 1.00 0.00 C ATOM 1986 O LEU A 124 -12.077 5.049 -4.552 1.00 0.00 O ATOM 1987 CB LEU A 124 -12.307 7.678 -6.615 1.00 0.00 C ATOM 1988 CG LEU A 124 -11.391 8.082 -5.455 1.00 0.00 C ATOM 1989 CD1 LEU A 124 -10.118 7.233 -5.456 1.00 0.00 C ATOM 1990 CD2 LEU A 124 -11.012 9.557 -5.615 1.00 0.00 C ATOM 0 H LEU A 124 -14.031 6.664 -8.049 1.00 0.00 H new ATOM 0 HA LEU A 124 -11.614 5.642 -6.944 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -11.869 7.998 -7.561 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -13.267 8.185 -6.521 1.00 0.00 H new ATOM 0 HG LEU A 124 -11.917 7.924 -4.513 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -9.479 7.534 -4.625 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -10.382 6.181 -5.348 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -9.584 7.379 -6.395 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -10.360 9.856 -4.795 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -10.492 9.698 -6.562 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -11.915 10.168 -5.602 1.00 0.00 H new ATOM 2002 N GLU A 125 -14.030 6.016 -4.740 1.00 0.00 N ATOM 2003 CA GLU A 125 -14.402 5.602 -3.358 1.00 0.00 C ATOM 2004 C GLU A 125 -14.363 4.077 -3.233 1.00 0.00 C ATOM 2005 O GLU A 125 -13.727 3.542 -2.348 1.00 0.00 O ATOM 2006 CB GLU A 125 -15.803 6.118 -3.038 1.00 0.00 C ATOM 2007 CG GLU A 125 -16.852 5.237 -3.717 1.00 0.00 C ATOM 2008 CD GLU A 125 -18.219 5.912 -3.606 1.00 0.00 C ATOM 2009 OE1 GLU A 125 -19.168 5.379 -4.157 1.00 0.00 O ATOM 2010 OE2 GLU A 125 -18.294 6.953 -2.975 1.00 0.00 O ATOM 0 H GLU A 125 -14.739 6.549 -5.243 1.00 0.00 H new ATOM 0 HA GLU A 125 -13.688 6.025 -2.651 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -15.961 6.121 -1.960 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -15.906 7.149 -3.378 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -16.593 5.083 -4.764 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -16.879 4.254 -3.247 1.00 0.00 H new ATOM 2018 N GLU A 126 -15.021 3.370 -4.108 1.00 0.00 N ATOM 2019 CA GLU A 126 -14.990 1.887 -4.012 1.00 0.00 C ATOM 2020 C GLU A 126 -13.552 1.408 -4.193 1.00 0.00 C ATOM 2021 O GLU A 126 -13.127 0.440 -3.598 1.00 0.00 O ATOM 2022 CB GLU A 126 -15.878 1.273 -5.089 1.00 0.00 C ATOM 2023 CG GLU A 126 -15.887 -0.238 -4.909 1.00 0.00 C ATOM 2024 CD GLU A 126 -17.138 -0.827 -5.565 1.00 0.00 C ATOM 2025 OE1 GLU A 126 -17.361 -2.016 -5.402 1.00 0.00 O ATOM 2026 OE2 GLU A 126 -17.855 -0.080 -6.209 1.00 0.00 O ATOM 0 H GLU A 126 -15.573 3.750 -4.877 1.00 0.00 H new ATOM 0 HA GLU A 126 -15.362 1.578 -3.035 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -16.891 1.669 -5.015 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -15.506 1.534 -6.080 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -14.992 -0.672 -5.354 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -15.869 -0.488 -3.848 1.00 0.00 H new ATOM 2034 N ALA A 127 -12.795 2.082 -5.003 1.00 0.00 N ATOM 2035 CA ALA A 127 -11.382 1.677 -5.203 1.00 0.00 C ATOM 2036 C ALA A 127 -10.600 1.994 -3.925 1.00 0.00 C ATOM 2037 O ALA A 127 -9.613 1.364 -3.609 1.00 0.00 O ATOM 2038 CB ALA A 127 -10.798 2.461 -6.377 1.00 0.00 C ATOM 0 H ALA A 127 -13.094 2.898 -5.537 1.00 0.00 H new ATOM 0 HA ALA A 127 -11.318 0.610 -5.419 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -9.759 2.168 -6.529 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -11.372 2.247 -7.279 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.846 3.528 -6.162 1.00 0.00 H new ATOM 2044 N CYS A 128 -11.041 2.983 -3.192 1.00 0.00 N ATOM 2045 CA CYS A 128 -10.337 3.369 -1.938 1.00 0.00 C ATOM 2046 C CYS A 128 -10.498 2.274 -0.876 1.00 0.00 C ATOM 2047 O CYS A 128 -9.568 1.959 -0.160 1.00 0.00 O ATOM 2048 CB CYS A 128 -10.927 4.679 -1.412 1.00 0.00 C ATOM 2049 SG CYS A 128 -11.124 4.569 0.384 1.00 0.00 S ATOM 0 H CYS A 128 -11.865 3.543 -3.412 1.00 0.00 H new ATOM 0 HA CYS A 128 -9.276 3.498 -2.152 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -10.274 5.514 -1.667 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -11.890 4.872 -1.884 1.00 0.00 H new ATOM 0 HG CYS A 128 -12.240 3.963 0.662 1.00 0.00 H new ATOM 2055 N GLN A 129 -11.664 1.696 -0.754 1.00 0.00 N ATOM 2056 CA GLN A 129 -11.849 0.627 0.277 1.00 0.00 C ATOM 2057 C GLN A 129 -11.023 -0.598 -0.102 1.00 0.00 C ATOM 2058 O GLN A 129 -10.334 -1.176 0.715 1.00 0.00 O ATOM 2059 CB GLN A 129 -13.326 0.210 0.374 1.00 0.00 C ATOM 2060 CG GLN A 129 -14.090 0.659 -0.870 1.00 0.00 C ATOM 2061 CD GLN A 129 -14.755 2.012 -0.607 1.00 0.00 C ATOM 2062 OE1 GLN A 129 -14.107 2.945 -0.175 1.00 0.00 O ATOM 2063 NE2 GLN A 129 -16.029 2.158 -0.848 1.00 0.00 N ATOM 0 H GLN A 129 -12.488 1.913 -1.315 1.00 0.00 H new ATOM 0 HA GLN A 129 -11.524 1.023 1.239 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -13.398 -0.872 0.482 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -13.777 0.650 1.264 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -13.410 0.736 -1.718 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -14.844 -0.083 -1.133 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -16.572 1.375 -1.211 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -16.481 3.055 -0.674 1.00 0.00 H new ATOM 2072 N LEU A 130 -11.105 -1.010 -1.333 1.00 0.00 N ATOM 2073 CA LEU A 130 -10.348 -2.212 -1.771 1.00 0.00 C ATOM 2074 C LEU A 130 -8.844 -1.968 -1.653 1.00 0.00 C ATOM 2075 O LEU A 130 -8.109 -2.809 -1.174 1.00 0.00 O ATOM 2076 CB LEU A 130 -10.692 -2.500 -3.224 1.00 0.00 C ATOM 2077 CG LEU A 130 -12.209 -2.547 -3.399 1.00 0.00 C ATOM 2078 CD1 LEU A 130 -12.526 -2.675 -4.880 1.00 0.00 C ATOM 2079 CD2 LEU A 130 -12.799 -3.753 -2.664 1.00 0.00 C ATOM 0 H LEU A 130 -11.666 -0.564 -2.058 1.00 0.00 H new ATOM 0 HA LEU A 130 -10.618 -3.057 -1.138 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -10.267 -1.730 -3.867 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -10.252 -3.449 -3.530 1.00 0.00 H new ATOM 0 HG LEU A 130 -12.641 -1.635 -2.987 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -13.607 -2.710 -5.019 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -12.119 -1.817 -5.415 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -12.080 -3.590 -5.270 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -13.880 -3.769 -2.801 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -12.369 -4.670 -3.066 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -12.569 -3.680 -1.601 1.00 0.00 H new ATOM 2091 N ALA A 131 -8.371 -0.834 -2.089 1.00 0.00 N ATOM 2092 CA ALA A 131 -6.912 -0.568 -1.996 1.00 0.00 C ATOM 2093 C ALA A 131 -6.493 -0.602 -0.529 1.00 0.00 C ATOM 2094 O ALA A 131 -5.561 -1.286 -0.154 1.00 0.00 O ATOM 2095 CB ALA A 131 -6.602 0.803 -2.590 1.00 0.00 C ATOM 0 H ALA A 131 -8.928 -0.086 -2.502 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.362 -1.328 -2.551 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.531 0.996 -2.521 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -6.907 0.824 -3.636 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -7.145 1.570 -2.038 1.00 0.00 H new ATOM 2101 N GLN A 132 -7.182 0.110 0.316 1.00 0.00 N ATOM 2102 CA GLN A 132 -6.823 0.092 1.761 1.00 0.00 C ATOM 2103 C GLN A 132 -5.391 0.608 1.945 1.00 0.00 C ATOM 2104 O GLN A 132 -4.918 0.757 3.054 1.00 0.00 O ATOM 2105 CB GLN A 132 -6.952 -1.351 2.279 1.00 0.00 C ATOM 2106 CG GLN A 132 -5.678 -1.789 3.017 1.00 0.00 C ATOM 2107 CD GLN A 132 -5.654 -1.172 4.417 1.00 0.00 C ATOM 2108 OE1 GLN A 132 -6.654 -1.165 5.109 1.00 0.00 O ATOM 2109 NE2 GLN A 132 -4.546 -0.649 4.867 1.00 0.00 N ATOM 0 H GLN A 132 -7.976 0.702 0.071 1.00 0.00 H new ATOM 0 HA GLN A 132 -7.493 0.740 2.326 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -7.808 -1.425 2.950 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -7.142 -2.025 1.444 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -5.643 -2.876 3.088 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -4.796 -1.477 2.457 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -3.707 -0.655 4.287 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -4.519 -0.235 5.799 1.00 0.00 H new ATOM 2118 N PHE A 133 -4.691 0.884 0.878 1.00 0.00 N ATOM 2119 CA PHE A 133 -3.294 1.385 1.025 1.00 0.00 C ATOM 2120 C PHE A 133 -3.279 2.909 0.851 1.00 0.00 C ATOM 2121 O PHE A 133 -3.899 3.447 -0.047 1.00 0.00 O ATOM 2122 CB PHE A 133 -2.398 0.744 -0.040 1.00 0.00 C ATOM 2123 CG PHE A 133 -2.779 -0.709 -0.229 1.00 0.00 C ATOM 2124 CD1 PHE A 133 -2.442 -1.657 0.748 1.00 0.00 C ATOM 2125 CD2 PHE A 133 -3.460 -1.111 -1.387 1.00 0.00 C ATOM 2126 CE1 PHE A 133 -2.787 -3.001 0.566 1.00 0.00 C ATOM 2127 CE2 PHE A 133 -3.805 -2.456 -1.565 1.00 0.00 C ATOM 2128 CZ PHE A 133 -3.467 -3.399 -0.590 1.00 0.00 C ATOM 0 H PHE A 133 -5.022 0.785 -0.082 1.00 0.00 H new ATOM 0 HA PHE A 133 -2.920 1.124 2.015 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -2.499 1.281 -0.983 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -1.353 0.819 0.259 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -1.917 -1.350 1.640 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -3.718 -0.383 -2.142 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -2.528 -3.731 1.318 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -4.332 -2.765 -2.455 1.00 0.00 H new ATOM 0 HZ PHE A 133 -3.731 -4.437 -0.729 1.00 0.00 H new ATOM 2138 N LYS A 134 -2.583 3.614 1.708 1.00 0.00 N ATOM 2139 CA LYS A 134 -2.539 5.103 1.588 1.00 0.00 C ATOM 2140 C LYS A 134 -1.979 5.502 0.225 1.00 0.00 C ATOM 2141 O LYS A 134 -2.478 6.402 -0.420 1.00 0.00 O ATOM 2142 CB LYS A 134 -1.638 5.686 2.682 1.00 0.00 C ATOM 2143 CG LYS A 134 -1.676 7.215 2.613 1.00 0.00 C ATOM 2144 CD LYS A 134 -0.690 7.795 3.629 1.00 0.00 C ATOM 2145 CE LYS A 134 -0.842 9.316 3.682 1.00 0.00 C ATOM 2146 NZ LYS A 134 -1.069 9.846 2.307 1.00 0.00 N ATOM 0 H LYS A 134 -2.046 3.224 2.482 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.552 5.491 1.696 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -1.972 5.347 3.662 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -0.616 5.331 2.554 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -1.419 7.551 1.608 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -2.684 7.574 2.822 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -0.874 7.367 4.614 1.00 0.00 H new ATOM 0 HD3 LYS A 134 0.331 7.531 3.352 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -1.677 9.585 4.329 1.00 0.00 H new ATOM 0 HE3 LYS A 134 0.053 9.766 4.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -0.920 10.875 2.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -0.402 9.397 1.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -2.044 9.636 2.011 1.00 0.00 H new ATOM 2160 N GLU A 135 -0.943 4.850 -0.220 1.00 0.00 N ATOM 2161 CA GLU A 135 -0.364 5.216 -1.539 1.00 0.00 C ATOM 2162 C GLU A 135 -1.389 4.943 -2.634 1.00 0.00 C ATOM 2163 O GLU A 135 -1.666 5.788 -3.458 1.00 0.00 O ATOM 2164 CB GLU A 135 0.883 4.379 -1.793 1.00 0.00 C ATOM 2165 CG GLU A 135 1.917 4.665 -0.705 1.00 0.00 C ATOM 2166 CD GLU A 135 2.329 6.137 -0.768 1.00 0.00 C ATOM 2167 OE1 GLU A 135 2.159 6.734 -1.816 1.00 0.00 O ATOM 2168 OE2 GLU A 135 2.803 6.640 0.235 1.00 0.00 O ATOM 0 H GLU A 135 -0.476 4.086 0.268 1.00 0.00 H new ATOM 0 HA GLU A 135 -0.100 6.274 -1.542 1.00 0.00 H new ATOM 0 HB2 GLU A 135 0.628 3.319 -1.798 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.297 4.612 -2.774 1.00 0.00 H new ATOM 0 HG2 GLU A 135 1.502 4.434 0.276 1.00 0.00 H new ATOM 0 HG3 GLU A 135 2.790 4.026 -0.840 1.00 0.00 H new ATOM 2176 N MET A 136 -1.962 3.773 -2.647 1.00 0.00 N ATOM 2177 CA MET A 136 -2.972 3.456 -3.691 1.00 0.00 C ATOM 2178 C MET A 136 -4.128 4.435 -3.600 1.00 0.00 C ATOM 2179 O MET A 136 -4.586 4.967 -4.593 1.00 0.00 O ATOM 2180 CB MET A 136 -3.521 2.059 -3.460 1.00 0.00 C ATOM 2181 CG MET A 136 -2.486 1.023 -3.875 1.00 0.00 C ATOM 2182 SD MET A 136 -3.249 -0.176 -4.990 1.00 0.00 S ATOM 2183 CE MET A 136 -3.985 1.005 -6.153 1.00 0.00 C ATOM 0 H MET A 136 -1.774 3.024 -1.981 1.00 0.00 H new ATOM 0 HA MET A 136 -2.497 3.522 -4.670 1.00 0.00 H new ATOM 0 HB2 MET A 136 -3.778 1.929 -2.409 1.00 0.00 H new ATOM 0 HB3 MET A 136 -4.438 1.920 -4.032 1.00 0.00 H new ATOM 0 HG2 MET A 136 -1.645 1.511 -4.368 1.00 0.00 H new ATOM 0 HG3 MET A 136 -2.089 0.517 -2.995 1.00 0.00 H new ATOM 0 HE1 MET A 136 -4.034 0.556 -7.145 1.00 0.00 H new ATOM 0 HE2 MET A 136 -4.991 1.263 -5.822 1.00 0.00 H new ATOM 0 HE3 MET A 136 -3.373 1.906 -6.192 1.00 0.00 H new ATOM 2193 N LYS A 137 -4.604 4.682 -2.418 1.00 0.00 N ATOM 2194 CA LYS A 137 -5.729 5.629 -2.277 1.00 0.00 C ATOM 2195 C LYS A 137 -5.294 6.958 -2.886 1.00 0.00 C ATOM 2196 O LYS A 137 -6.002 7.556 -3.672 1.00 0.00 O ATOM 2197 CB LYS A 137 -6.060 5.811 -0.794 1.00 0.00 C ATOM 2198 CG LYS A 137 -7.322 6.663 -0.646 1.00 0.00 C ATOM 2199 CD LYS A 137 -7.755 6.682 0.820 1.00 0.00 C ATOM 2200 CE LYS A 137 -6.653 7.309 1.675 1.00 0.00 C ATOM 2201 NZ LYS A 137 -6.097 8.503 0.976 1.00 0.00 N ATOM 0 H LYS A 137 -4.263 4.270 -1.549 1.00 0.00 H new ATOM 0 HA LYS A 137 -6.618 5.255 -2.785 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -6.209 4.839 -0.323 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -5.225 6.289 -0.282 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -7.131 7.678 -0.993 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -8.121 6.259 -1.267 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -8.680 7.249 0.929 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -7.961 5.668 1.162 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -7.053 7.597 2.647 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -5.862 6.581 1.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -5.627 9.122 1.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -5.407 8.197 0.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -6.868 9.024 0.512 1.00 0.00 H new ATOM 2215 N ALA A 138 -4.117 7.413 -2.547 1.00 0.00 N ATOM 2216 CA ALA A 138 -3.622 8.688 -3.127 1.00 0.00 C ATOM 2217 C ALA A 138 -3.232 8.462 -4.591 1.00 0.00 C ATOM 2218 O ALA A 138 -3.550 9.258 -5.451 1.00 0.00 O ATOM 2219 CB ALA A 138 -2.415 9.185 -2.338 1.00 0.00 C ATOM 0 H ALA A 138 -3.480 6.955 -1.894 1.00 0.00 H new ATOM 0 HA ALA A 138 -4.410 9.439 -3.074 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -2.058 10.120 -2.770 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -2.702 9.351 -1.300 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -1.621 8.440 -2.380 1.00 0.00 H new ATOM 2225 N ALA A 139 -2.555 7.379 -4.892 1.00 0.00 N ATOM 2226 CA ALA A 139 -2.174 7.129 -6.310 1.00 0.00 C ATOM 2227 C ALA A 139 -3.452 7.139 -7.145 1.00 0.00 C ATOM 2228 O ALA A 139 -3.494 7.663 -8.240 1.00 0.00 O ATOM 2229 CB ALA A 139 -1.487 5.764 -6.438 1.00 0.00 C ATOM 0 H ALA A 139 -2.255 6.669 -4.224 1.00 0.00 H new ATOM 0 HA ALA A 139 -1.482 7.897 -6.655 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.213 5.591 -7.479 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -0.590 5.749 -5.819 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -2.169 4.981 -6.108 1.00 0.00 H new ATOM 2235 N LEU A 140 -4.500 6.580 -6.610 1.00 0.00 N ATOM 2236 CA LEU A 140 -5.801 6.566 -7.331 1.00 0.00 C ATOM 2237 C LEU A 140 -6.396 7.975 -7.306 1.00 0.00 C ATOM 2238 O LEU A 140 -6.891 8.473 -8.297 1.00 0.00 O ATOM 2239 CB LEU A 140 -6.750 5.603 -6.618 1.00 0.00 C ATOM 2240 CG LEU A 140 -6.409 4.164 -7.004 1.00 0.00 C ATOM 2241 CD1 LEU A 140 -6.839 3.229 -5.875 1.00 0.00 C ATOM 2242 CD2 LEU A 140 -7.162 3.790 -8.282 1.00 0.00 C ATOM 0 H LEU A 140 -4.510 6.128 -5.696 1.00 0.00 H new ATOM 0 HA LEU A 140 -5.657 6.246 -8.363 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -6.668 5.729 -5.538 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -7.782 5.827 -6.888 1.00 0.00 H new ATOM 0 HG LEU A 140 -5.336 4.073 -7.172 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -6.599 2.200 -6.143 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -6.312 3.498 -4.959 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -7.913 3.321 -5.716 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -6.920 2.764 -8.560 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -8.235 3.877 -8.111 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -6.868 4.463 -9.088 1.00 0.00 H new ATOM 2254 N GLN A 141 -6.342 8.621 -6.172 1.00 0.00 N ATOM 2255 CA GLN A 141 -6.895 9.999 -6.067 1.00 0.00 C ATOM 2256 C GLN A 141 -6.015 10.958 -6.872 1.00 0.00 C ATOM 2257 O GLN A 141 -6.504 11.747 -7.658 1.00 0.00 O ATOM 2258 CB GLN A 141 -6.937 10.419 -4.592 1.00 0.00 C ATOM 2259 CG GLN A 141 -6.323 11.809 -4.417 1.00 0.00 C ATOM 2260 CD GLN A 141 -6.493 12.252 -2.963 1.00 0.00 C ATOM 2261 OE1 GLN A 141 -7.148 11.484 -2.136 1.00 0.00 O flip ATOM 2262 NE2 GLN A 141 -6.026 13.304 -2.578 1.00 0.00 N flip ATOM 0 H GLN A 141 -5.937 8.251 -5.312 1.00 0.00 H new ATOM 0 HA GLN A 141 -7.908 10.027 -6.469 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -7.968 10.422 -4.237 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -6.393 9.695 -3.985 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -5.266 11.789 -4.683 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -6.807 12.521 -5.086 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -5.514 13.903 -3.226 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -6.145 13.590 -1.606 1.00 0.00 H new ATOM 2271 N GLU A 142 -4.723 10.890 -6.703 1.00 0.00 N ATOM 2272 CA GLU A 142 -3.835 11.791 -7.485 1.00 0.00 C ATOM 2273 C GLU A 142 -3.966 11.430 -8.959 1.00 0.00 C ATOM 2274 O GLU A 142 -3.961 12.281 -9.824 1.00 0.00 O ATOM 2275 CB GLU A 142 -2.383 11.614 -7.034 1.00 0.00 C ATOM 2276 CG GLU A 142 -2.252 12.059 -5.578 1.00 0.00 C ATOM 2277 CD GLU A 142 -0.790 11.968 -5.139 1.00 0.00 C ATOM 2278 OE1 GLU A 142 -0.478 12.487 -4.081 1.00 0.00 O ATOM 2279 OE2 GLU A 142 -0.007 11.377 -5.866 1.00 0.00 O ATOM 0 H GLU A 142 -4.248 10.254 -6.062 1.00 0.00 H new ATOM 0 HA GLU A 142 -4.123 12.830 -7.325 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -2.082 10.571 -7.137 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -1.719 12.201 -7.668 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -2.612 13.082 -5.467 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -2.873 11.431 -4.939 1.00 0.00 H new ATOM 2287 N GLY A 143 -4.106 10.165 -9.250 1.00 0.00 N ATOM 2288 CA GLY A 143 -4.264 9.745 -10.667 1.00 0.00 C ATOM 2289 C GLY A 143 -5.552 10.358 -11.211 1.00 0.00 C ATOM 2290 O GLY A 143 -5.596 10.868 -12.310 1.00 0.00 O ATOM 0 H GLY A 143 -4.117 9.407 -8.567 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.409 10.074 -11.257 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.302 8.658 -10.738 1.00 0.00 H new ATOM 2294 N HIS A 144 -6.597 10.327 -10.429 1.00 0.00 N ATOM 2295 CA HIS A 144 -7.889 10.917 -10.871 1.00 0.00 C ATOM 2296 C HIS A 144 -7.694 12.415 -11.117 1.00 0.00 C ATOM 2297 O HIS A 144 -8.296 12.995 -11.999 1.00 0.00 O ATOM 2298 CB HIS A 144 -8.940 10.723 -9.774 1.00 0.00 C ATOM 2299 CG HIS A 144 -9.981 9.729 -10.218 1.00 0.00 C ATOM 2300 ND1 HIS A 144 -10.498 8.769 -9.357 1.00 0.00 N ATOM 2301 CD2 HIS A 144 -10.618 9.537 -11.420 1.00 0.00 C ATOM 2302 CE1 HIS A 144 -11.399 8.048 -10.049 1.00 0.00 C ATOM 2303 NE2 HIS A 144 -11.508 8.475 -11.306 1.00 0.00 N ATOM 0 H HIS A 144 -6.609 9.915 -9.496 1.00 0.00 H new ATOM 0 HA HIS A 144 -8.222 10.428 -11.787 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -8.461 10.374 -8.859 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -9.414 11.677 -9.542 1.00 0.00 H new ATOM 0 HD1 HIS A 144 -10.241 8.635 -8.379 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -10.453 10.120 -12.314 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -11.964 7.225 -9.636 1.00 0.00 H new ATOM 2312 N GLN A 145 -6.863 13.048 -10.332 1.00 0.00 N ATOM 2313 CA GLN A 145 -6.640 14.510 -10.512 1.00 0.00 C ATOM 2314 C GLN A 145 -6.215 14.808 -11.950 1.00 0.00 C ATOM 2315 O GLN A 145 -6.771 15.670 -12.603 1.00 0.00 O ATOM 2316 CB GLN A 145 -5.541 14.976 -9.560 1.00 0.00 C ATOM 2317 CG GLN A 145 -5.265 16.457 -9.807 1.00 0.00 C ATOM 2318 CD GLN A 145 -4.337 16.993 -8.718 1.00 0.00 C ATOM 2319 OE1 GLN A 145 -3.928 16.262 -7.838 1.00 0.00 O ATOM 2320 NE2 GLN A 145 -3.996 18.252 -8.731 1.00 0.00 N ATOM 0 H GLN A 145 -6.331 12.616 -9.576 1.00 0.00 H new ATOM 0 HA GLN A 145 -7.569 15.037 -10.297 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -5.846 14.817 -8.526 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -4.634 14.393 -9.718 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -4.809 16.594 -10.788 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -6.201 17.016 -9.810 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -4.339 18.866 -9.470 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -3.386 18.623 -8.002 1.00 0.00 H new ATOM 2329 N PHE A 146 -5.237 14.109 -12.449 1.00 0.00 N ATOM 2330 CA PHE A 146 -4.785 14.364 -13.846 1.00 0.00 C ATOM 2331 C PHE A 146 -5.949 14.106 -14.802 1.00 0.00 C ATOM 2332 O PHE A 146 -6.215 14.886 -15.692 1.00 0.00 O ATOM 2333 CB PHE A 146 -3.625 13.422 -14.187 1.00 0.00 C ATOM 2334 CG PHE A 146 -2.956 13.865 -15.472 1.00 0.00 C ATOM 2335 CD1 PHE A 146 -3.620 13.736 -16.699 1.00 0.00 C ATOM 2336 CD2 PHE A 146 -1.658 14.392 -15.436 1.00 0.00 C ATOM 2337 CE1 PHE A 146 -2.985 14.134 -17.881 1.00 0.00 C ATOM 2338 CE2 PHE A 146 -1.032 14.789 -16.623 1.00 0.00 C ATOM 2339 CZ PHE A 146 -1.700 14.658 -17.843 1.00 0.00 C ATOM 0 H PHE A 146 -4.731 13.374 -11.954 1.00 0.00 H new ATOM 0 HA PHE A 146 -4.451 15.397 -13.943 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -2.900 13.416 -13.373 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -3.994 12.402 -14.293 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.620 13.330 -16.733 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -1.141 14.492 -14.493 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -3.497 14.033 -18.827 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -0.032 15.197 -16.596 1.00 0.00 H new ATOM 0 HZ PHE A 146 -1.216 14.965 -18.758 1.00 0.00 H new ATOM 2349 N LEU A 147 -6.640 13.012 -14.624 1.00 0.00 N ATOM 2350 CA LEU A 147 -7.784 12.690 -15.527 1.00 0.00 C ATOM 2351 C LEU A 147 -8.765 13.861 -15.559 1.00 0.00 C ATOM 2352 O LEU A 147 -9.248 14.244 -16.606 1.00 0.00 O ATOM 2353 CB LEU A 147 -8.494 11.438 -15.013 1.00 0.00 C ATOM 2354 CG LEU A 147 -7.485 10.294 -14.893 1.00 0.00 C ATOM 2355 CD1 LEU A 147 -8.210 9.011 -14.493 1.00 0.00 C ATOM 2356 CD2 LEU A 147 -6.784 10.081 -16.236 1.00 0.00 C ATOM 0 H LEU A 147 -6.462 12.326 -13.891 1.00 0.00 H new ATOM 0 HA LEU A 147 -7.411 12.511 -16.536 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -8.951 11.638 -14.044 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -9.299 11.158 -15.693 1.00 0.00 H new ATOM 0 HG LEU A 147 -6.745 10.548 -14.133 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -7.490 8.197 -14.408 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.707 9.158 -13.534 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -8.952 8.761 -15.251 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -6.066 9.266 -16.146 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -7.524 9.832 -16.997 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -6.262 10.994 -16.523 1.00 0.00 H new ATOM 2368 N CYS A 148 -9.054 14.444 -14.432 1.00 0.00 N ATOM 2369 CA CYS A 148 -9.995 15.599 -14.421 1.00 0.00 C ATOM 2370 C CYS A 148 -9.381 16.744 -15.231 1.00 0.00 C ATOM 2371 O CYS A 148 -10.068 17.631 -15.701 1.00 0.00 O ATOM 2372 CB CYS A 148 -10.227 16.058 -12.982 1.00 0.00 C ATOM 2373 SG CYS A 148 -10.512 17.845 -12.959 1.00 0.00 S ATOM 0 H CYS A 148 -8.682 14.174 -13.521 1.00 0.00 H new ATOM 0 HA CYS A 148 -10.948 15.304 -14.860 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -11.084 15.537 -12.556 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -9.363 15.808 -12.365 1.00 0.00 H new ATOM 0 HG CYS A 148 -10.678 18.274 -14.175 1.00 0.00 H new ATOM 2379 N SER A 149 -8.083 16.731 -15.382 1.00 0.00 N ATOM 2380 CA SER A 149 -7.396 17.811 -16.146 1.00 0.00 C ATOM 2381 C SER A 149 -7.369 17.474 -17.639 1.00 0.00 C ATOM 2382 O SER A 149 -7.005 18.294 -18.459 1.00 0.00 O ATOM 2383 CB SER A 149 -5.957 17.935 -15.647 1.00 0.00 C ATOM 2384 OG SER A 149 -5.478 19.250 -15.900 1.00 0.00 O ATOM 0 H SER A 149 -7.465 16.012 -15.005 1.00 0.00 H new ATOM 0 HA SER A 149 -7.936 18.746 -15.998 1.00 0.00 H new ATOM 0 HB2 SER A 149 -5.911 17.719 -14.580 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.323 17.203 -16.148 1.00 0.00 H new ATOM 0 HG SER A 149 -4.556 19.330 -15.578 1.00 0.00 H new ATOM 2390 N ILE A 150 -7.733 16.276 -18.002 1.00 0.00 N ATOM 2391 CA ILE A 150 -7.707 15.899 -19.438 1.00 0.00 C ATOM 2392 C ILE A 150 -9.068 16.174 -20.063 1.00 0.00 C ATOM 2393 O ILE A 150 -9.736 17.136 -19.741 1.00 0.00 O ATOM 2394 CB ILE A 150 -7.390 14.411 -19.555 1.00 0.00 C ATOM 2395 CG1 ILE A 150 -6.209 14.082 -18.647 1.00 0.00 C ATOM 2396 CG2 ILE A 150 -7.026 14.081 -20.999 1.00 0.00 C ATOM 2397 CD1 ILE A 150 -5.739 12.649 -18.906 1.00 0.00 C ATOM 0 H ILE A 150 -8.047 15.544 -17.365 1.00 0.00 H new ATOM 0 HA ILE A 150 -6.947 16.483 -19.957 1.00 0.00 H new ATOM 0 HB ILE A 150 -8.259 13.824 -19.258 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -5.393 14.781 -18.830 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -6.499 14.196 -17.602 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -6.799 13.018 -21.083 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -7.865 14.326 -21.651 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.153 14.663 -21.296 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -4.895 12.419 -18.255 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -6.555 11.956 -18.701 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -5.431 12.550 -19.947 1.00 0.00 H new ATOM 2409 N GLU A 151 -9.479 15.324 -20.953 1.00 0.00 N ATOM 2410 CA GLU A 151 -10.797 15.512 -21.611 1.00 0.00 C ATOM 2411 C GLU A 151 -11.854 14.804 -20.774 1.00 0.00 C ATOM 2412 O GLU A 151 -12.967 14.573 -21.201 1.00 0.00 O ATOM 2413 CB GLU A 151 -10.751 14.932 -23.022 1.00 0.00 C ATOM 2414 CG GLU A 151 -9.500 15.464 -23.719 1.00 0.00 C ATOM 2415 CD GLU A 151 -9.716 15.494 -25.232 1.00 0.00 C ATOM 2416 OE1 GLU A 151 -8.885 16.069 -25.916 1.00 0.00 O ATOM 2417 OE2 GLU A 151 -10.709 14.947 -25.683 1.00 0.00 O ATOM 0 H GLU A 151 -8.957 14.502 -21.256 1.00 0.00 H new ATOM 0 HA GLU A 151 -11.041 16.572 -21.685 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -10.730 13.843 -22.984 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -11.645 15.215 -23.578 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -9.270 16.466 -23.356 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -8.644 14.834 -23.478 1.00 0.00 H new ATOM 2425 N ALA A 152 -11.489 14.464 -19.573 1.00 0.00 N ATOM 2426 CA ALA A 152 -12.439 13.767 -18.659 1.00 0.00 C ATOM 2427 C ALA A 152 -13.602 14.704 -18.321 1.00 0.00 C ATOM 2428 O ALA A 152 -14.743 14.293 -18.248 1.00 0.00 O ATOM 2429 CB ALA A 152 -11.709 13.376 -17.371 1.00 0.00 C ATOM 0 H ALA A 152 -10.565 14.640 -19.179 1.00 0.00 H new ATOM 0 HA ALA A 152 -12.824 12.872 -19.147 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -12.401 12.866 -16.701 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -10.880 12.711 -17.611 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -11.326 14.272 -16.883 1.00 0.00 H new ATOM 2435 N LEU A 153 -13.318 15.965 -18.117 1.00 0.00 N ATOM 2436 CA LEU A 153 -14.399 16.940 -17.786 1.00 0.00 C ATOM 2437 C LEU A 153 -14.599 17.894 -18.966 1.00 0.00 C ATOM 2438 O LEU A 153 -13.930 17.774 -19.990 1.00 0.00 O ATOM 2439 CB LEU A 153 -14.001 17.749 -16.548 1.00 0.00 C ATOM 2440 CG LEU A 153 -13.752 16.803 -15.370 1.00 0.00 C ATOM 2441 CD1 LEU A 153 -13.406 17.617 -14.120 1.00 0.00 C ATOM 2442 CD2 LEU A 153 -15.018 15.988 -15.102 1.00 0.00 C ATOM 0 H LEU A 153 -12.380 16.362 -18.166 1.00 0.00 H new ATOM 0 HA LEU A 153 -15.324 16.400 -17.586 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -13.103 18.331 -16.755 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -14.789 18.458 -16.297 1.00 0.00 H new ATOM 0 HG LEU A 153 -12.924 16.136 -15.611 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -13.229 16.941 -13.283 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -12.508 18.206 -14.306 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -14.234 18.284 -13.879 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -14.845 15.313 -14.264 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -15.840 16.662 -14.862 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -15.272 15.408 -15.989 1.00 0.00 H new TER 2454 LEU A 153