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 -85:sc= 0.715 USER MOD Set 1.2: A 129 GLN :FLIP amide:sc= -4.96! C(o=-9.2!,f=-4.2!) USER MOD Set 1.3: A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 37 SER OG : rot -18:sc= 0.463! USER MOD Set 2.2: A 117 GLN : amide:sc= -1.26 K(o=-0.8,f=-3.5!) USER MOD Set 3.1: A 19 CYS SG : rot 22:sc= 0.674 USER MOD Set 3.2: A 23 LYS NZ :NH3+ 166:sc= -0.116 (180deg=0) USER MOD Set 3.3: A 26 ASN : amide:sc= -4.1! C(o=-3.5!,f=-10!) USER MOD Set 3.4: A 106 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 86 ASN :FLIP amide:sc= -6.15! C(o=-15!,f=-6.1!) USER MOD Set 4.2: A 95 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 47 LYS NZ :NH3+ 168:sc= 0.287 (180deg=0) USER MOD Set 5.2: A 87 TYR OH : rot -110:sc= -5.98! USER MOD Set 5.3: A 94 LYS NZ :NH3+ -139:sc=-0.00937 (180deg=-0.816) USER MOD Single : A 1 GLY N :NH3+ -124:sc= 0.15 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 MET CE :methyl -146:sc= -0.256 (180deg=-1.44!) USER MOD Single : A 11 CYS SG : rot -100:sc= -13.8! USER MOD Single : A 27 ASN : amide:sc= -0.193 X(o=-0.19,f=-0.019) USER MOD Single : A 35 GLN : amide:sc= -1.86 X(o=-1.9,f=-1.5) USER MOD Single : A 41 HIS :FLIP no HD1:sc= -4.11! C(o=-7.9!,f=-4.1!) USER MOD Single : A 42 HIS : no HD1:sc= -7.82! C(o=-7.8!,f=-10!) USER MOD Single : A 44 THR OG1 : rot 91:sc= -0.566 USER MOD Single : A 49 HIS : no HD1:sc= -12.9! C(o=-13!,f=-13!) USER MOD Single : A 59 THR OG1 : rot -80:sc= -0.821 USER MOD Single : A 64 THR OG1 : rot 57:sc= -4.7! USER MOD Single : A 65 GLN : amide:sc= -1.24 K(o=-1.2,f=-6.8!) USER MOD Single : A 74 GLN : amide:sc= -7.81! C(o=-7.8!,f=-12!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 169:sc= -3.64! (180deg=-3.85!) USER MOD Single : A 91 ASN : amide:sc= -2.01! C(o=-2!,f=-5.6!) USER MOD Single : A 92 LYS NZ :NH3+ -153:sc= -0.249 (180deg=-1.31!) USER MOD Single : A 98 TYR OH : rot -169:sc= 1.44 USER MOD Single : A 104 LYS NZ :NH3+ 165:sc= -6.74! (180deg=-8.74!) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 HIS :FLIP no HD1:sc= -2.19! C(o=-2.9!,f=-2.2!) USER MOD Single : A 116 HIS : no HD1:sc= -3.9 K(o=-3.9,f=-5.1!) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 GLN : amide:sc=-0.00488 K(o=-0.0049,f=-1.1) USER MOD Single : A 134 LYS NZ :NH3+ -165:sc= -0.0135 (180deg=-0.27) USER MOD Single : A 136 MET CE :methyl -115:sc= -6.6! (180deg=-15.5!) USER MOD Single : A 141 GLN :FLIP amide:sc= 0 F(o=-1.4!,f=0) USER MOD Single : A 144 HIS : no HE2:sc= -16.2! C(o=-16!,f=-23!) USER MOD Single : A 145 GLN : amide:sc= -0.026 X(o=-0.026,f=-0.069) USER MOD Single : A 148 CYS SG : rot 59:sc= 1.21 USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 8.079 -15.820 -16.557 1.00 0.00 N ATOM 2 CA GLY A 1 9.181 -16.661 -16.135 1.00 0.00 C ATOM 3 C GLY A 1 9.653 -16.254 -14.745 1.00 0.00 C ATOM 4 O GLY A 1 9.036 -15.410 -14.100 1.00 0.00 O ATOM 0 H1 GLY A 1 7.262 -16.415 -16.800 1.00 0.00 H new ATOM 0 H2 GLY A 1 7.819 -15.174 -15.784 1.00 0.00 H new ATOM 0 H3 GLY A 1 8.364 -15.266 -17.390 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.869 -17.705 -16.129 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.004 -16.578 -16.845 1.00 0.00 H new ATOM 8 N PRO A 2 10.752 -16.858 -14.287 1.00 0.00 N ATOM 9 CA PRO A 2 11.347 -16.598 -12.994 1.00 0.00 C ATOM 10 C PRO A 2 12.017 -15.231 -13.006 1.00 0.00 C ATOM 11 O PRO A 2 12.643 -14.854 -13.995 1.00 0.00 O ATOM 12 CB PRO A 2 12.375 -17.711 -12.804 1.00 0.00 C ATOM 13 CG PRO A 2 12.803 -18.024 -14.238 1.00 0.00 C ATOM 14 CD PRO A 2 11.502 -17.856 -15.019 1.00 0.00 C ATOM 0 HA PRO A 2 10.616 -16.587 -12.185 1.00 0.00 H new ATOM 0 HB2 PRO A 2 13.216 -17.385 -12.193 1.00 0.00 H new ATOM 0 HB3 PRO A 2 11.942 -18.582 -12.312 1.00 0.00 H new ATOM 0 HG2 PRO A 2 13.577 -17.341 -14.588 1.00 0.00 H new ATOM 0 HG3 PRO A 2 13.203 -19.034 -14.330 1.00 0.00 H new ATOM 0 HD2 PRO A 2 11.695 -17.533 -16.042 1.00 0.00 H new ATOM 0 HD3 PRO A 2 10.954 -18.796 -15.079 1.00 0.00 H new ATOM 22 N LEU A 3 11.916 -14.475 -11.960 1.00 0.00 N ATOM 23 CA LEU A 3 12.556 -13.133 -11.935 1.00 0.00 C ATOM 24 C LEU A 3 13.961 -13.269 -11.341 1.00 0.00 C ATOM 25 O LEU A 3 14.278 -14.250 -10.699 1.00 0.00 O ATOM 26 CB LEU A 3 11.715 -12.171 -11.094 1.00 0.00 C ATOM 27 CG LEU A 3 10.229 -12.457 -11.330 1.00 0.00 C ATOM 28 CD1 LEU A 3 9.820 -13.730 -10.589 1.00 0.00 C ATOM 29 CD2 LEU A 3 9.400 -11.289 -10.805 1.00 0.00 C ATOM 0 H LEU A 3 11.413 -14.728 -11.110 1.00 0.00 H new ATOM 0 HA LEU A 3 12.625 -12.735 -12.947 1.00 0.00 H new ATOM 0 HB2 LEU A 3 11.956 -12.288 -10.037 1.00 0.00 H new ATOM 0 HB3 LEU A 3 11.945 -11.140 -11.361 1.00 0.00 H new ATOM 0 HG LEU A 3 10.056 -12.587 -12.398 1.00 0.00 H new ATOM 0 HD11 LEU A 3 8.762 -13.927 -10.761 1.00 0.00 H new ATOM 0 HD12 LEU A 3 10.410 -14.570 -10.956 1.00 0.00 H new ATOM 0 HD13 LEU A 3 9.996 -13.602 -9.521 1.00 0.00 H new ATOM 0 HD21 LEU A 3 8.342 -11.490 -10.972 1.00 0.00 H new ATOM 0 HD22 LEU A 3 9.582 -11.164 -9.738 1.00 0.00 H new ATOM 0 HD23 LEU A 3 9.683 -10.377 -11.330 1.00 0.00 H new ATOM 41 N GLY A 4 14.814 -12.309 -11.566 1.00 0.00 N ATOM 42 CA GLY A 4 16.203 -12.412 -11.029 1.00 0.00 C ATOM 43 C GLY A 4 16.170 -12.886 -9.569 1.00 0.00 C ATOM 44 O GLY A 4 17.020 -13.640 -9.138 1.00 0.00 O ATOM 0 H GLY A 4 14.613 -11.461 -12.096 1.00 0.00 H new ATOM 0 HA2 GLY A 4 16.784 -13.109 -11.633 1.00 0.00 H new ATOM 0 HA3 GLY A 4 16.699 -11.444 -11.094 1.00 0.00 H new ATOM 48 N SER A 5 15.197 -12.457 -8.808 1.00 0.00 N ATOM 49 CA SER A 5 15.115 -12.893 -7.379 1.00 0.00 C ATOM 50 C SER A 5 13.875 -12.283 -6.715 1.00 0.00 C ATOM 51 O SER A 5 12.808 -12.226 -7.293 1.00 0.00 O ATOM 52 CB SER A 5 16.357 -12.423 -6.623 1.00 0.00 C ATOM 53 OG SER A 5 16.508 -11.021 -6.806 1.00 0.00 O ATOM 0 H SER A 5 14.456 -11.825 -9.112 1.00 0.00 H new ATOM 0 HA SER A 5 15.051 -13.981 -7.349 1.00 0.00 H new ATOM 0 HB2 SER A 5 16.263 -12.656 -5.562 1.00 0.00 H new ATOM 0 HB3 SER A 5 17.240 -12.947 -6.987 1.00 0.00 H new ATOM 0 HG SER A 5 17.302 -10.712 -6.322 1.00 0.00 H new ATOM 59 N MET A 6 14.017 -11.831 -5.496 1.00 0.00 N ATOM 60 CA MET A 6 12.869 -11.229 -4.770 1.00 0.00 C ATOM 61 C MET A 6 12.442 -9.953 -5.468 1.00 0.00 C ATOM 62 O MET A 6 13.052 -9.508 -6.415 1.00 0.00 O ATOM 63 CB MET A 6 13.293 -10.892 -3.345 1.00 0.00 C ATOM 64 CG MET A 6 13.959 -12.118 -2.722 1.00 0.00 C ATOM 65 SD MET A 6 12.842 -13.534 -2.848 1.00 0.00 S ATOM 66 CE MET A 6 11.509 -12.851 -1.833 1.00 0.00 C ATOM 0 H MET A 6 14.891 -11.856 -4.970 1.00 0.00 H new ATOM 0 HA MET A 6 12.041 -11.937 -4.755 1.00 0.00 H new ATOM 0 HB2 MET A 6 13.983 -10.049 -3.347 1.00 0.00 H new ATOM 0 HB3 MET A 6 12.427 -10.593 -2.755 1.00 0.00 H new ATOM 0 HG2 MET A 6 14.898 -12.334 -3.232 1.00 0.00 H new ATOM 0 HG3 MET A 6 14.201 -11.923 -1.677 1.00 0.00 H new ATOM 0 HE1 MET A 6 11.026 -13.655 -1.278 1.00 0.00 H new ATOM 0 HE2 MET A 6 11.921 -12.123 -1.134 1.00 0.00 H new ATOM 0 HE3 MET A 6 10.776 -12.363 -2.475 1.00 0.00 H new ATOM 76 N ALA A 7 11.385 -9.365 -5.007 1.00 0.00 N ATOM 77 CA ALA A 7 10.902 -8.127 -5.646 1.00 0.00 C ATOM 78 C ALA A 7 11.592 -6.917 -5.030 1.00 0.00 C ATOM 79 O ALA A 7 11.469 -6.631 -3.856 1.00 0.00 O ATOM 80 CB ALA A 7 9.399 -8.033 -5.453 1.00 0.00 C ATOM 0 H ALA A 7 10.834 -9.691 -4.213 1.00 0.00 H new ATOM 0 HA ALA A 7 11.133 -8.146 -6.711 1.00 0.00 H new ATOM 0 HB1 ALA A 7 9.028 -7.121 -5.921 1.00 0.00 H new ATOM 0 HB2 ALA A 7 8.919 -8.897 -5.911 1.00 0.00 H new ATOM 0 HB3 ALA A 7 9.170 -8.013 -4.388 1.00 0.00 H new ATOM 86 N LEU A 8 12.314 -6.209 -5.837 1.00 0.00 N ATOM 87 CA LEU A 8 13.029 -5.000 -5.364 1.00 0.00 C ATOM 88 C LEU A 8 12.182 -3.786 -5.725 1.00 0.00 C ATOM 89 O LEU A 8 11.532 -3.183 -4.894 1.00 0.00 O ATOM 90 CB LEU A 8 14.374 -4.909 -6.087 1.00 0.00 C ATOM 91 CG LEU A 8 14.673 -6.238 -6.790 1.00 0.00 C ATOM 92 CD1 LEU A 8 15.827 -6.044 -7.770 1.00 0.00 C ATOM 93 CD2 LEU A 8 15.051 -7.291 -5.746 1.00 0.00 C ATOM 0 H LEU A 8 12.443 -6.420 -6.827 1.00 0.00 H new ATOM 0 HA LEU A 8 13.195 -5.042 -4.288 1.00 0.00 H new ATOM 0 HB2 LEU A 8 14.352 -4.098 -6.815 1.00 0.00 H new ATOM 0 HB3 LEU A 8 15.166 -4.677 -5.375 1.00 0.00 H new ATOM 0 HG LEU A 8 13.790 -6.572 -7.335 1.00 0.00 H new ATOM 0 HD11 LEU A 8 16.041 -6.988 -8.271 1.00 0.00 H new ATOM 0 HD12 LEU A 8 15.552 -5.294 -8.511 1.00 0.00 H new ATOM 0 HD13 LEU A 8 16.712 -5.712 -7.228 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.264 -8.237 -6.244 1.00 0.00 H new ATOM 0 HD22 LEU A 8 15.935 -6.961 -5.200 1.00 0.00 H new ATOM 0 HD23 LEU A 8 14.224 -7.426 -5.049 1.00 0.00 H new ATOM 105 N ARG A 9 12.174 -3.456 -6.982 1.00 0.00 N ATOM 106 CA ARG A 9 11.358 -2.316 -7.458 1.00 0.00 C ATOM 107 C ARG A 9 10.355 -2.860 -8.466 1.00 0.00 C ATOM 108 O ARG A 9 10.712 -3.335 -9.526 1.00 0.00 O ATOM 109 CB ARG A 9 12.263 -1.253 -8.104 1.00 0.00 C ATOM 110 CG ARG A 9 12.137 -1.289 -9.634 1.00 0.00 C ATOM 111 CD ARG A 9 12.979 -0.164 -10.243 1.00 0.00 C ATOM 112 NE ARG A 9 14.425 -0.478 -10.067 1.00 0.00 N ATOM 113 CZ ARG A 9 15.292 0.484 -9.896 1.00 0.00 C ATOM 114 NH1 ARG A 9 14.896 1.728 -9.867 1.00 0.00 N ATOM 115 NH2 ARG A 9 16.559 0.197 -9.758 1.00 0.00 N ATOM 0 H ARG A 9 12.706 -3.936 -7.708 1.00 0.00 H new ATOM 0 HA ARG A 9 10.834 -1.840 -6.629 1.00 0.00 H new ATOM 0 HB2 ARG A 9 11.991 -0.264 -7.735 1.00 0.00 H new ATOM 0 HB3 ARG A 9 13.300 -1.427 -7.815 1.00 0.00 H new ATOM 0 HG2 ARG A 9 12.471 -2.254 -10.014 1.00 0.00 H new ATOM 0 HG3 ARG A 9 11.093 -1.175 -9.926 1.00 0.00 H new ATOM 0 HD2 ARG A 9 12.746 -0.053 -11.302 1.00 0.00 H new ATOM 0 HD3 ARG A 9 12.740 0.785 -9.763 1.00 0.00 H new ATOM 0 HE ARG A 9 14.739 -1.448 -10.080 1.00 0.00 H new ATOM 0 HH11 ARG A 9 13.907 1.951 -9.978 1.00 0.00 H new ATOM 0 HH12 ARG A 9 15.576 2.477 -9.733 1.00 0.00 H new ATOM 0 HH21 ARG A 9 16.868 -0.775 -9.784 1.00 0.00 H new ATOM 0 HH22 ARG A 9 17.240 0.945 -9.624 1.00 0.00 H new ATOM 129 N ALA A 10 9.099 -2.809 -8.140 1.00 0.00 N ATOM 130 CA ALA A 10 8.070 -3.328 -9.075 1.00 0.00 C ATOM 131 C ALA A 10 7.362 -2.143 -9.713 1.00 0.00 C ATOM 132 O ALA A 10 7.482 -1.022 -9.264 1.00 0.00 O ATOM 133 CB ALA A 10 7.052 -4.178 -8.308 1.00 0.00 C ATOM 0 H ALA A 10 8.739 -2.429 -7.264 1.00 0.00 H new ATOM 0 HA ALA A 10 8.540 -3.946 -9.840 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.299 -4.556 -9.000 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.562 -5.016 -7.833 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.569 -3.567 -7.545 1.00 0.00 H new ATOM 139 N CYS A 11 6.628 -2.373 -10.753 1.00 0.00 N ATOM 140 CA CYS A 11 5.910 -1.253 -11.403 1.00 0.00 C ATOM 141 C CYS A 11 4.474 -1.687 -11.649 1.00 0.00 C ATOM 142 O CYS A 11 4.219 -2.728 -12.217 1.00 0.00 O ATOM 143 CB CYS A 11 6.597 -0.893 -12.713 1.00 0.00 C ATOM 144 SG CYS A 11 8.172 -1.776 -12.823 1.00 0.00 S ATOM 0 H CYS A 11 6.493 -3.288 -11.183 1.00 0.00 H new ATOM 0 HA CYS A 11 5.919 -0.370 -10.764 1.00 0.00 H new ATOM 0 HB2 CYS A 11 5.959 -1.157 -13.556 1.00 0.00 H new ATOM 0 HB3 CYS A 11 6.765 0.183 -12.765 1.00 0.00 H new ATOM 0 HG CYS A 11 9.142 -0.975 -12.496 1.00 0.00 H new ATOM 150 N GLY A 12 3.532 -0.914 -11.201 1.00 0.00 N ATOM 151 CA GLY A 12 2.116 -1.304 -11.391 1.00 0.00 C ATOM 152 C GLY A 12 1.480 -0.436 -12.457 1.00 0.00 C ATOM 153 O GLY A 12 2.067 0.516 -12.931 1.00 0.00 O ATOM 0 H GLY A 12 3.681 -0.031 -10.713 1.00 0.00 H new ATOM 0 HA2 GLY A 12 2.054 -2.353 -11.680 1.00 0.00 H new ATOM 0 HA3 GLY A 12 1.572 -1.199 -10.452 1.00 0.00 H new ATOM 157 N LEU A 13 0.280 -0.755 -12.845 1.00 0.00 N ATOM 158 CA LEU A 13 -0.381 0.058 -13.887 1.00 0.00 C ATOM 159 C LEU A 13 -1.727 0.558 -13.368 1.00 0.00 C ATOM 160 O LEU A 13 -2.649 -0.208 -13.181 1.00 0.00 O ATOM 161 CB LEU A 13 -0.621 -0.812 -15.134 1.00 0.00 C ATOM 162 CG LEU A 13 -0.168 -0.099 -16.428 1.00 0.00 C ATOM 163 CD1 LEU A 13 -1.151 -0.374 -17.567 1.00 0.00 C ATOM 164 CD2 LEU A 13 -0.100 1.409 -16.229 1.00 0.00 C ATOM 0 H LEU A 13 -0.265 -1.539 -12.486 1.00 0.00 H new ATOM 0 HA LEU A 13 0.255 0.907 -14.140 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.081 -1.753 -15.030 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.680 -1.058 -15.207 1.00 0.00 H new ATOM 0 HG LEU A 13 0.820 -0.486 -16.676 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -0.815 0.137 -18.469 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -1.200 -1.447 -17.754 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -2.140 -0.008 -17.290 1.00 0.00 H new ATOM 0 HD21 LEU A 13 0.221 1.884 -17.156 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -1.085 1.784 -15.952 1.00 0.00 H new ATOM 0 HD23 LEU A 13 0.612 1.640 -15.437 1.00 0.00 H new ATOM 176 N ILE A 14 -1.866 1.838 -13.168 1.00 0.00 N ATOM 177 CA ILE A 14 -3.177 2.361 -12.701 1.00 0.00 C ATOM 178 C ILE A 14 -4.154 2.236 -13.863 1.00 0.00 C ATOM 179 O ILE A 14 -4.158 3.044 -14.769 1.00 0.00 O ATOM 180 CB ILE A 14 -3.038 3.836 -12.304 1.00 0.00 C ATOM 181 CG1 ILE A 14 -2.085 3.953 -11.112 1.00 0.00 C ATOM 182 CG2 ILE A 14 -4.408 4.421 -11.946 1.00 0.00 C ATOM 183 CD1 ILE A 14 -2.710 3.309 -9.871 1.00 0.00 C ATOM 0 H ILE A 14 -1.137 2.538 -13.306 1.00 0.00 H new ATOM 0 HA ILE A 14 -3.528 1.802 -11.834 1.00 0.00 H new ATOM 0 HB ILE A 14 -2.633 4.398 -13.146 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -1.138 3.467 -11.345 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -1.865 5.002 -10.915 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -4.295 5.468 -11.666 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -5.072 4.345 -12.807 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -4.833 3.866 -11.110 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.023 3.398 -9.030 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.645 3.814 -9.631 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -2.907 2.255 -10.068 1.00 0.00 H new ATOM 195 N ILE A 15 -4.981 1.227 -13.859 1.00 0.00 N ATOM 196 CA ILE A 15 -5.937 1.078 -14.987 1.00 0.00 C ATOM 197 C ILE A 15 -7.262 1.722 -14.628 1.00 0.00 C ATOM 198 O ILE A 15 -7.767 1.576 -13.532 1.00 0.00 O ATOM 199 CB ILE A 15 -6.200 -0.391 -15.309 1.00 0.00 C ATOM 200 CG1 ILE A 15 -4.900 -1.098 -15.697 1.00 0.00 C ATOM 201 CG2 ILE A 15 -7.189 -0.456 -16.478 1.00 0.00 C ATOM 202 CD1 ILE A 15 -5.234 -2.481 -16.252 1.00 0.00 C ATOM 0 H ILE A 15 -5.035 0.511 -13.135 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.491 1.562 -15.856 1.00 0.00 H new ATOM 0 HB ILE A 15 -6.611 -0.890 -14.431 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.361 -0.513 -16.442 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -4.247 -1.188 -14.829 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.392 -1.498 -16.726 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -8.119 0.037 -16.196 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -6.761 0.046 -17.345 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -4.313 -2.993 -16.532 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -5.756 -3.062 -15.491 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -5.872 -2.377 -17.130 1.00 0.00 H new ATOM 214 N PHE A 16 -7.840 2.416 -15.556 1.00 0.00 N ATOM 215 CA PHE A 16 -9.150 3.051 -15.288 1.00 0.00 C ATOM 216 C PHE A 16 -9.880 3.269 -16.613 1.00 0.00 C ATOM 217 O PHE A 16 -9.275 3.405 -17.658 1.00 0.00 O ATOM 218 CB PHE A 16 -8.943 4.396 -14.598 1.00 0.00 C ATOM 219 CG PHE A 16 -8.373 5.361 -15.593 1.00 0.00 C ATOM 220 CD1 PHE A 16 -9.222 5.996 -16.499 1.00 0.00 C ATOM 221 CD2 PHE A 16 -6.998 5.594 -15.631 1.00 0.00 C ATOM 222 CE1 PHE A 16 -8.698 6.876 -17.443 1.00 0.00 C ATOM 223 CE2 PHE A 16 -6.468 6.471 -16.579 1.00 0.00 C ATOM 224 CZ PHE A 16 -7.319 7.113 -17.488 1.00 0.00 C ATOM 0 H PHE A 16 -7.462 2.572 -16.491 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.741 2.404 -14.640 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -9.889 4.770 -14.207 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -8.269 4.286 -13.749 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -10.285 5.806 -16.469 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.345 5.097 -14.929 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.355 7.375 -18.140 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.404 6.654 -16.612 1.00 0.00 H new ATOM 0 HZ PHE A 16 -6.911 7.791 -18.223 1.00 0.00 H new ATOM 234 N ARG A 17 -11.174 3.318 -16.565 1.00 0.00 N ATOM 235 CA ARG A 17 -11.978 3.546 -17.800 1.00 0.00 C ATOM 236 C ARG A 17 -12.919 4.723 -17.552 1.00 0.00 C ATOM 237 O ARG A 17 -13.570 4.795 -16.528 1.00 0.00 O ATOM 238 CB ARG A 17 -12.800 2.292 -18.107 1.00 0.00 C ATOM 239 CG ARG A 17 -13.844 2.593 -19.192 1.00 0.00 C ATOM 240 CD ARG A 17 -13.166 2.898 -20.533 1.00 0.00 C ATOM 241 NE ARG A 17 -14.173 3.473 -21.470 1.00 0.00 N ATOM 242 CZ ARG A 17 -13.835 4.433 -22.290 1.00 0.00 C ATOM 243 NH1 ARG A 17 -12.610 4.881 -22.308 1.00 0.00 N ATOM 244 NH2 ARG A 17 -14.726 4.946 -23.096 1.00 0.00 N ATOM 0 H ARG A 17 -11.723 3.209 -15.712 1.00 0.00 H new ATOM 0 HA ARG A 17 -11.322 3.761 -18.644 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -12.142 1.489 -18.439 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -13.296 1.943 -17.201 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -14.514 1.741 -19.304 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -14.456 3.442 -18.888 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -12.344 3.599 -20.388 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -12.738 1.988 -20.953 1.00 0.00 H new ATOM 0 HE ARG A 17 -15.129 3.116 -21.471 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -11.912 4.482 -21.681 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -12.350 5.630 -22.950 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -15.684 4.597 -23.085 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -14.463 5.695 -23.736 1.00 0.00 H new ATOM 258 N ARG A 18 -13.000 5.651 -18.466 1.00 0.00 N ATOM 259 CA ARG A 18 -13.904 6.813 -18.244 1.00 0.00 C ATOM 260 C ARG A 18 -15.200 6.644 -19.050 1.00 0.00 C ATOM 261 O ARG A 18 -15.184 6.194 -20.178 1.00 0.00 O ATOM 262 CB ARG A 18 -13.191 8.100 -18.658 1.00 0.00 C ATOM 263 CG ARG A 18 -12.940 8.086 -20.163 1.00 0.00 C ATOM 264 CD ARG A 18 -12.002 9.239 -20.535 1.00 0.00 C ATOM 265 NE ARG A 18 -12.766 10.265 -21.295 1.00 0.00 N ATOM 266 CZ ARG A 18 -13.325 9.951 -22.427 1.00 0.00 C ATOM 267 NH1 ARG A 18 -13.187 8.745 -22.910 1.00 0.00 N ATOM 268 NH2 ARG A 18 -14.020 10.842 -23.077 1.00 0.00 N ATOM 0 H ARG A 18 -12.486 5.655 -19.347 1.00 0.00 H new ATOM 0 HA ARG A 18 -14.161 6.867 -17.186 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -13.796 8.966 -18.388 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -12.246 8.192 -18.123 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -12.499 7.134 -20.460 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -13.883 8.182 -20.701 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -11.574 9.680 -19.635 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -11.171 8.868 -21.135 1.00 0.00 H new ATOM 0 HE ARG A 18 -12.851 11.213 -20.929 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -12.641 8.051 -22.400 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -13.625 8.498 -23.797 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -14.125 11.783 -22.698 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -14.459 10.598 -23.965 1.00 0.00 H new ATOM 282 N CYS A 19 -16.321 7.004 -18.474 1.00 0.00 N ATOM 283 CA CYS A 19 -17.617 6.870 -19.200 1.00 0.00 C ATOM 284 C CYS A 19 -17.863 8.128 -20.028 1.00 0.00 C ATOM 285 O CYS A 19 -17.055 9.036 -20.055 1.00 0.00 O ATOM 286 CB CYS A 19 -18.771 6.686 -18.207 1.00 0.00 C ATOM 287 SG CYS A 19 -19.476 5.032 -18.415 1.00 0.00 S ATOM 0 H CYS A 19 -16.392 7.385 -17.531 1.00 0.00 H new ATOM 0 HA CYS A 19 -17.568 5.997 -19.851 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -18.412 6.816 -17.186 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -19.536 7.444 -18.375 1.00 0.00 H new ATOM 0 HG CYS A 19 -18.599 4.254 -18.978 1.00 0.00 H new ATOM 293 N LEU A 20 -18.969 8.187 -20.713 1.00 0.00 N ATOM 294 CA LEU A 20 -19.264 9.384 -21.548 1.00 0.00 C ATOM 295 C LEU A 20 -19.375 10.617 -20.661 1.00 0.00 C ATOM 296 O LEU A 20 -19.023 11.713 -21.054 1.00 0.00 O ATOM 297 CB LEU A 20 -20.581 9.181 -22.301 1.00 0.00 C ATOM 298 CG LEU A 20 -21.351 8.001 -21.702 1.00 0.00 C ATOM 299 CD1 LEU A 20 -22.844 8.157 -22.007 1.00 0.00 C ATOM 300 CD2 LEU A 20 -20.831 6.700 -22.316 1.00 0.00 C ATOM 0 H LEU A 20 -19.682 7.458 -20.731 1.00 0.00 H new ATOM 0 HA LEU A 20 -18.455 9.524 -22.265 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -21.185 10.086 -22.244 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -20.381 8.997 -23.357 1.00 0.00 H new ATOM 0 HG LEU A 20 -21.207 7.977 -20.622 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -23.392 7.317 -21.581 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -23.209 9.087 -21.571 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -22.995 8.178 -23.086 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -21.375 5.855 -21.894 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -20.978 6.723 -23.396 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -19.769 6.593 -22.097 1.00 0.00 H new ATOM 312 N ILE A 21 -19.870 10.450 -19.471 1.00 0.00 N ATOM 313 CA ILE A 21 -20.016 11.609 -18.558 1.00 0.00 C ATOM 314 C ILE A 21 -20.210 11.086 -17.130 1.00 0.00 C ATOM 315 O ILE A 21 -20.552 9.939 -16.921 1.00 0.00 O ATOM 316 CB ILE A 21 -21.238 12.430 -18.996 1.00 0.00 C ATOM 317 CG1 ILE A 21 -20.869 13.916 -19.180 1.00 0.00 C ATOM 318 CG2 ILE A 21 -22.353 12.301 -17.953 1.00 0.00 C ATOM 319 CD1 ILE A 21 -20.676 14.229 -20.671 1.00 0.00 C ATOM 0 H ILE A 21 -20.181 9.556 -19.090 1.00 0.00 H new ATOM 0 HA ILE A 21 -19.129 12.242 -18.591 1.00 0.00 H new ATOM 0 HB ILE A 21 -21.585 12.040 -19.953 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -21.655 14.548 -18.766 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -19.955 14.143 -18.631 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -23.217 12.886 -18.270 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -22.640 11.254 -17.855 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -21.997 12.671 -16.992 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -20.416 15.281 -20.791 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -19.875 13.609 -21.072 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -21.601 14.020 -21.209 1.00 0.00 H new ATOM 331 N PRO A 22 -19.991 11.928 -16.163 1.00 0.00 N ATOM 332 CA PRO A 22 -20.124 11.574 -14.721 1.00 0.00 C ATOM 333 C PRO A 22 -21.579 11.292 -14.330 1.00 0.00 C ATOM 334 O PRO A 22 -22.498 11.913 -14.826 1.00 0.00 O ATOM 335 CB PRO A 22 -19.600 12.816 -13.979 1.00 0.00 C ATOM 336 CG PRO A 22 -18.941 13.670 -15.014 1.00 0.00 C ATOM 337 CD PRO A 22 -19.585 13.314 -16.342 1.00 0.00 C ATOM 0 HA PRO A 22 -19.575 10.664 -14.478 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -20.415 13.352 -13.493 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -18.893 12.534 -13.198 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -19.077 14.728 -14.788 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -17.867 13.486 -15.042 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -20.438 13.957 -16.559 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -18.884 13.423 -17.170 1.00 0.00 H new ATOM 345 N LYS A 23 -21.801 10.353 -13.449 1.00 0.00 N ATOM 346 CA LYS A 23 -23.200 10.038 -13.042 1.00 0.00 C ATOM 347 C LYS A 23 -23.452 10.561 -11.638 1.00 0.00 C ATOM 348 O LYS A 23 -24.505 11.081 -11.334 1.00 0.00 O ATOM 349 CB LYS A 23 -23.410 8.527 -13.080 1.00 0.00 C ATOM 350 CG LYS A 23 -23.359 8.061 -14.532 1.00 0.00 C ATOM 351 CD LYS A 23 -23.640 6.560 -14.601 1.00 0.00 C ATOM 352 CE LYS A 23 -23.520 6.081 -16.048 1.00 0.00 C ATOM 353 NZ LYS A 23 -22.228 5.358 -16.230 1.00 0.00 N ATOM 0 H LYS A 23 -21.078 9.794 -12.996 1.00 0.00 H new ATOM 0 HA LYS A 23 -23.898 10.516 -13.730 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -22.640 8.024 -12.495 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -24.370 8.268 -12.634 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -24.093 8.606 -15.125 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -22.380 8.278 -14.959 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -22.936 6.019 -13.969 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -24.639 6.349 -14.219 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -24.354 5.424 -16.295 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -23.572 6.931 -16.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -22.247 4.834 -17.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -21.446 6.043 -16.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -22.089 4.692 -15.443 1.00 0.00 H new ATOM 367 N VAL A 24 -22.489 10.411 -10.788 1.00 0.00 N ATOM 368 CA VAL A 24 -22.630 10.875 -9.383 1.00 0.00 C ATOM 369 C VAL A 24 -21.659 10.081 -8.527 1.00 0.00 C ATOM 370 O VAL A 24 -20.793 10.618 -7.868 1.00 0.00 O ATOM 371 CB VAL A 24 -24.050 10.604 -8.883 1.00 0.00 C ATOM 372 CG1 VAL A 24 -24.532 9.250 -9.416 1.00 0.00 C ATOM 373 CG2 VAL A 24 -24.040 10.563 -7.355 1.00 0.00 C ATOM 0 H VAL A 24 -21.591 9.979 -11.007 1.00 0.00 H new ATOM 0 HA VAL A 24 -22.425 11.944 -9.325 1.00 0.00 H new ATOM 0 HB VAL A 24 -24.717 11.392 -9.232 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -25.544 9.058 -9.059 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -24.528 9.266 -10.506 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -23.867 8.462 -9.062 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -25.049 10.370 -6.990 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -23.374 9.770 -7.017 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -23.691 11.520 -6.968 1.00 0.00 H new ATOM 383 N ASP A 25 -21.805 8.792 -8.549 1.00 0.00 N ATOM 384 CA ASP A 25 -20.902 7.922 -7.761 1.00 0.00 C ATOM 385 C ASP A 25 -19.913 7.265 -8.709 1.00 0.00 C ATOM 386 O ASP A 25 -19.055 6.501 -8.310 1.00 0.00 O ATOM 387 CB ASP A 25 -21.726 6.847 -7.056 1.00 0.00 C ATOM 388 CG ASP A 25 -22.426 5.976 -8.103 1.00 0.00 C ATOM 389 OD1 ASP A 25 -22.116 6.122 -9.273 1.00 0.00 O ATOM 390 OD2 ASP A 25 -23.261 5.176 -7.714 1.00 0.00 O ATOM 0 H ASP A 25 -22.519 8.299 -9.085 1.00 0.00 H new ATOM 0 HA ASP A 25 -20.367 8.511 -7.016 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -21.081 6.233 -6.428 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -22.463 7.310 -6.400 1.00 0.00 H new ATOM 396 N ASN A 26 -20.036 7.556 -9.971 1.00 0.00 N ATOM 397 CA ASN A 26 -19.125 6.955 -10.974 1.00 0.00 C ATOM 398 C ASN A 26 -18.044 7.968 -11.334 1.00 0.00 C ATOM 399 O ASN A 26 -16.904 7.627 -11.583 1.00 0.00 O ATOM 400 CB ASN A 26 -19.937 6.649 -12.227 1.00 0.00 C ATOM 401 CG ASN A 26 -19.427 5.365 -12.873 1.00 0.00 C ATOM 402 OD1 ASN A 26 -18.659 4.636 -12.278 1.00 0.00 O ATOM 403 ND2 ASN A 26 -19.826 5.052 -14.074 1.00 0.00 N ATOM 0 H ASN A 26 -20.737 8.191 -10.352 1.00 0.00 H new ATOM 0 HA ASN A 26 -18.668 6.049 -10.576 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -20.991 6.544 -11.971 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -19.861 7.477 -12.932 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -19.493 4.194 -14.515 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -20.471 5.665 -14.573 1.00 0.00 H new ATOM 410 N ASN A 27 -18.414 9.210 -11.362 1.00 0.00 N ATOM 411 CA ASN A 27 -17.447 10.284 -11.709 1.00 0.00 C ATOM 412 C ASN A 27 -16.931 10.067 -13.133 1.00 0.00 C ATOM 413 O ASN A 27 -15.851 10.502 -13.487 1.00 0.00 O ATOM 414 CB ASN A 27 -16.273 10.259 -10.732 1.00 0.00 C ATOM 415 CG ASN A 27 -16.796 10.234 -9.292 1.00 0.00 C ATOM 416 OD1 ASN A 27 -16.271 9.518 -8.460 1.00 0.00 O ATOM 417 ND2 ASN A 27 -17.810 10.983 -8.959 1.00 0.00 N ATOM 0 H ASN A 27 -19.359 9.535 -11.157 1.00 0.00 H new ATOM 0 HA ASN A 27 -17.947 11.251 -11.646 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -15.652 9.383 -10.918 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -15.643 11.135 -10.884 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -18.162 10.968 -8.002 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -18.251 11.584 -9.656 1.00 0.00 H new ATOM 424 N ALA A 28 -17.699 9.406 -13.954 1.00 0.00 N ATOM 425 CA ALA A 28 -17.270 9.167 -15.358 1.00 0.00 C ATOM 426 C ALA A 28 -16.004 8.311 -15.380 1.00 0.00 C ATOM 427 O ALA A 28 -15.678 7.722 -16.383 1.00 0.00 O ATOM 428 CB ALA A 28 -16.984 10.505 -16.041 1.00 0.00 C ATOM 0 H ALA A 28 -18.611 9.019 -13.710 1.00 0.00 H new ATOM 0 HA ALA A 28 -18.067 8.645 -15.888 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -16.670 10.329 -17.070 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -17.887 11.116 -16.037 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -16.191 11.026 -15.504 1.00 0.00 H new ATOM 434 N ILE A 29 -15.280 8.246 -14.294 1.00 0.00 N ATOM 435 CA ILE A 29 -14.030 7.432 -14.287 1.00 0.00 C ATOM 436 C ILE A 29 -14.118 6.309 -13.251 1.00 0.00 C ATOM 437 O ILE A 29 -14.561 6.507 -12.139 1.00 0.00 O ATOM 438 CB ILE A 29 -12.842 8.340 -13.973 1.00 0.00 C ATOM 439 CG1 ILE A 29 -12.815 9.490 -14.996 1.00 0.00 C ATOM 440 CG2 ILE A 29 -11.548 7.527 -14.047 1.00 0.00 C ATOM 441 CD1 ILE A 29 -11.458 9.553 -15.709 1.00 0.00 C ATOM 0 H ILE A 29 -15.498 8.718 -13.417 1.00 0.00 H new ATOM 0 HA ILE A 29 -13.898 6.978 -15.269 1.00 0.00 H new ATOM 0 HB ILE A 29 -12.936 8.754 -12.969 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -13.610 9.350 -15.729 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.010 10.436 -14.491 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -10.699 8.173 -13.823 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -11.587 6.715 -13.321 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -11.435 7.113 -15.049 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -11.462 10.373 -16.427 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -10.669 9.717 -14.975 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -11.278 8.614 -16.232 1.00 0.00 H new ATOM 453 N GLU A 30 -13.686 5.125 -13.616 1.00 0.00 N ATOM 454 CA GLU A 30 -13.726 3.977 -12.666 1.00 0.00 C ATOM 455 C GLU A 30 -12.348 3.303 -12.636 1.00 0.00 C ATOM 456 O GLU A 30 -11.578 3.413 -13.571 1.00 0.00 O ATOM 457 CB GLU A 30 -14.767 2.957 -13.134 1.00 0.00 C ATOM 458 CG GLU A 30 -16.147 3.617 -13.219 1.00 0.00 C ATOM 459 CD GLU A 30 -17.181 2.572 -13.655 1.00 0.00 C ATOM 460 OE1 GLU A 30 -16.777 1.472 -13.990 1.00 0.00 O ATOM 461 OE2 GLU A 30 -18.359 2.893 -13.651 1.00 0.00 O ATOM 0 H GLU A 30 -13.306 4.907 -14.537 1.00 0.00 H new ATOM 0 HA GLU A 30 -13.990 4.338 -11.672 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -14.485 2.558 -14.109 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.800 2.115 -12.442 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -16.423 4.037 -12.252 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -16.125 4.443 -13.930 1.00 0.00 H new ATOM 469 N PHE A 31 -12.029 2.602 -11.577 1.00 0.00 N ATOM 470 CA PHE A 31 -10.699 1.923 -11.503 1.00 0.00 C ATOM 471 C PHE A 31 -10.871 0.408 -11.598 1.00 0.00 C ATOM 472 O PHE A 31 -11.809 -0.160 -11.072 1.00 0.00 O ATOM 473 CB PHE A 31 -10.019 2.234 -10.169 1.00 0.00 C ATOM 474 CG PHE A 31 -9.620 3.685 -10.105 1.00 0.00 C ATOM 475 CD1 PHE A 31 -8.699 4.200 -11.022 1.00 0.00 C ATOM 476 CD2 PHE A 31 -10.154 4.509 -9.115 1.00 0.00 C ATOM 477 CE1 PHE A 31 -8.314 5.543 -10.945 1.00 0.00 C ATOM 478 CE2 PHE A 31 -9.773 5.850 -9.040 1.00 0.00 C ATOM 479 CZ PHE A 31 -8.852 6.369 -9.953 1.00 0.00 C ATOM 0 H PHE A 31 -12.630 2.471 -10.763 1.00 0.00 H new ATOM 0 HA PHE A 31 -10.092 2.287 -12.332 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -10.695 2.000 -9.346 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -9.139 1.603 -10.047 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -8.285 3.562 -11.789 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -10.863 4.109 -8.405 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -7.601 5.942 -11.652 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -10.191 6.487 -8.275 1.00 0.00 H new ATOM 0 HZ PHE A 31 -8.556 7.406 -9.893 1.00 0.00 H new ATOM 489 N LEU A 32 -9.949 -0.252 -12.238 1.00 0.00 N ATOM 490 CA LEU A 32 -10.024 -1.730 -12.344 1.00 0.00 C ATOM 491 C LEU A 32 -9.018 -2.334 -11.352 1.00 0.00 C ATOM 492 O LEU A 32 -7.820 -2.293 -11.559 1.00 0.00 O ATOM 493 CB LEU A 32 -9.706 -2.131 -13.797 1.00 0.00 C ATOM 494 CG LEU A 32 -9.181 -3.570 -13.873 1.00 0.00 C ATOM 495 CD1 LEU A 32 -10.279 -4.560 -13.503 1.00 0.00 C ATOM 496 CD2 LEU A 32 -8.730 -3.872 -15.299 1.00 0.00 C ATOM 0 H LEU A 32 -9.142 0.174 -12.695 1.00 0.00 H new ATOM 0 HA LEU A 32 -11.018 -2.104 -12.097 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -10.604 -2.036 -14.408 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -8.964 -1.448 -14.211 1.00 0.00 H new ATOM 0 HG LEU A 32 -8.349 -3.668 -13.176 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.888 -5.576 -13.563 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -10.621 -4.362 -12.487 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -11.115 -4.452 -14.194 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -8.357 -4.895 -15.354 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.574 -3.757 -15.980 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.937 -3.181 -15.584 1.00 0.00 H new ATOM 508 N LEU A 33 -9.504 -2.891 -10.267 1.00 0.00 N ATOM 509 CA LEU A 33 -8.599 -3.502 -9.239 1.00 0.00 C ATOM 510 C LEU A 33 -8.700 -5.026 -9.324 1.00 0.00 C ATOM 511 O LEU A 33 -9.633 -5.553 -9.893 1.00 0.00 O ATOM 512 CB LEU A 33 -9.038 -3.079 -7.827 1.00 0.00 C ATOM 513 CG LEU A 33 -8.495 -1.696 -7.460 1.00 0.00 C ATOM 514 CD1 LEU A 33 -9.122 -1.264 -6.133 1.00 0.00 C ATOM 515 CD2 LEU A 33 -6.975 -1.768 -7.283 1.00 0.00 C ATOM 0 H LEU A 33 -10.498 -2.949 -10.048 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.579 -3.167 -9.428 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -10.127 -3.070 -7.771 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -8.688 -3.813 -7.101 1.00 0.00 H new ATOM 0 HG LEU A 33 -8.737 -0.985 -8.250 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.745 -0.279 -5.856 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.206 -1.221 -6.240 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -8.862 -1.983 -5.356 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -6.592 -0.782 -7.022 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.734 -2.473 -6.487 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.516 -2.101 -8.214 1.00 0.00 H new ATOM 527 N LEU A 34 -7.752 -5.738 -8.766 1.00 0.00 N ATOM 528 CA LEU A 34 -7.815 -7.231 -8.824 1.00 0.00 C ATOM 529 C LEU A 34 -7.701 -7.842 -7.428 1.00 0.00 C ATOM 530 O LEU A 34 -6.879 -7.441 -6.627 1.00 0.00 O ATOM 531 CB LEU A 34 -6.668 -7.769 -9.681 1.00 0.00 C ATOM 532 CG LEU A 34 -6.697 -7.120 -11.063 1.00 0.00 C ATOM 533 CD1 LEU A 34 -5.724 -7.854 -11.984 1.00 0.00 C ATOM 534 CD2 LEU A 34 -8.099 -7.220 -11.652 1.00 0.00 C ATOM 0 H LEU A 34 -6.944 -5.354 -8.277 1.00 0.00 H new ATOM 0 HA LEU A 34 -8.776 -7.505 -9.259 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.714 -7.565 -9.195 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -6.752 -8.851 -9.777 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.412 -6.072 -10.972 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -5.741 -7.394 -12.972 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.717 -7.792 -11.572 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -6.019 -8.900 -12.065 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -8.113 -6.755 -12.638 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -8.382 -8.269 -11.741 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -8.805 -6.708 -10.999 1.00 0.00 H new ATOM 546 N GLN A 35 -8.495 -8.840 -7.139 1.00 0.00 N ATOM 547 CA GLN A 35 -8.394 -9.499 -5.806 1.00 0.00 C ATOM 548 C GLN A 35 -7.632 -10.813 -5.987 1.00 0.00 C ATOM 549 O GLN A 35 -8.113 -11.734 -6.618 1.00 0.00 O ATOM 550 CB GLN A 35 -9.785 -9.793 -5.249 1.00 0.00 C ATOM 551 CG GLN A 35 -9.714 -9.866 -3.725 1.00 0.00 C ATOM 552 CD GLN A 35 -11.043 -10.390 -3.174 1.00 0.00 C ATOM 553 OE1 GLN A 35 -11.531 -11.414 -3.603 1.00 0.00 O ATOM 554 NE2 GLN A 35 -11.650 -9.718 -2.234 1.00 0.00 N ATOM 0 H GLN A 35 -9.204 -9.224 -7.764 1.00 0.00 H new ATOM 0 HA GLN A 35 -7.876 -8.842 -5.107 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -10.484 -9.014 -5.555 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -10.159 -10.734 -5.652 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -8.898 -10.521 -3.420 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -9.501 -8.880 -3.313 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -11.237 -8.857 -1.875 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -12.537 -10.054 -1.858 1.00 0.00 H new ATOM 563 N ALA A 36 -6.443 -10.907 -5.464 1.00 0.00 N ATOM 564 CA ALA A 36 -5.664 -12.163 -5.644 1.00 0.00 C ATOM 565 C ALA A 36 -6.253 -13.275 -4.776 1.00 0.00 C ATOM 566 O ALA A 36 -6.386 -13.141 -3.578 1.00 0.00 O ATOM 567 CB ALA A 36 -4.207 -11.917 -5.256 1.00 0.00 C ATOM 0 H ALA A 36 -5.980 -10.176 -4.924 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.714 -12.470 -6.689 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.635 -12.836 -5.387 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.789 -11.136 -5.890 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.156 -11.604 -4.213 1.00 0.00 H new ATOM 573 N SER A 37 -6.602 -14.384 -5.378 1.00 0.00 N ATOM 574 CA SER A 37 -7.175 -15.509 -4.589 1.00 0.00 C ATOM 575 C SER A 37 -6.040 -16.382 -4.050 1.00 0.00 C ATOM 576 O SER A 37 -6.255 -17.291 -3.275 1.00 0.00 O ATOM 577 CB SER A 37 -8.093 -16.347 -5.479 1.00 0.00 C ATOM 578 OG SER A 37 -8.500 -17.511 -4.772 1.00 0.00 O ATOM 0 H SER A 37 -6.514 -14.556 -6.380 1.00 0.00 H new ATOM 0 HA SER A 37 -7.753 -15.110 -3.755 1.00 0.00 H new ATOM 0 HB2 SER A 37 -8.965 -15.763 -5.773 1.00 0.00 H new ATOM 0 HB3 SER A 37 -7.573 -16.627 -6.395 1.00 0.00 H new ATOM 0 HG SER A 37 -7.895 -17.663 -4.016 1.00 0.00 H new ATOM 584 N ASP A 38 -4.830 -16.104 -4.452 1.00 0.00 N ATOM 585 CA ASP A 38 -3.677 -16.907 -3.962 1.00 0.00 C ATOM 586 C ASP A 38 -3.407 -16.563 -2.499 1.00 0.00 C ATOM 587 O ASP A 38 -3.827 -17.265 -1.601 1.00 0.00 O ATOM 588 CB ASP A 38 -2.441 -16.579 -4.799 1.00 0.00 C ATOM 589 CG ASP A 38 -2.674 -17.036 -6.240 1.00 0.00 C ATOM 590 OD1 ASP A 38 -1.958 -16.570 -7.112 1.00 0.00 O ATOM 591 OD2 ASP A 38 -3.565 -17.842 -6.448 1.00 0.00 O ATOM 0 H ASP A 38 -4.591 -15.353 -5.100 1.00 0.00 H new ATOM 0 HA ASP A 38 -3.905 -17.969 -4.050 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -2.243 -15.508 -4.772 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -1.564 -17.076 -4.384 1.00 0.00 H new ATOM 597 N GLY A 39 -2.720 -15.479 -2.249 1.00 0.00 N ATOM 598 CA GLY A 39 -2.436 -15.091 -0.839 1.00 0.00 C ATOM 599 C GLY A 39 -3.727 -15.202 -0.037 1.00 0.00 C ATOM 600 O GLY A 39 -3.846 -15.999 0.870 1.00 0.00 O ATOM 0 H GLY A 39 -2.345 -14.849 -2.958 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -1.670 -15.740 -0.415 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.050 -14.072 -0.797 1.00 0.00 H new ATOM 604 N ILE A 40 -4.694 -14.403 -0.379 1.00 0.00 N ATOM 605 CA ILE A 40 -5.993 -14.441 0.338 1.00 0.00 C ATOM 606 C ILE A 40 -7.051 -13.759 -0.548 1.00 0.00 C ATOM 607 O ILE A 40 -7.409 -14.268 -1.590 1.00 0.00 O ATOM 608 CB ILE A 40 -5.851 -13.726 1.696 1.00 0.00 C ATOM 609 CG1 ILE A 40 -4.563 -12.899 1.708 1.00 0.00 C ATOM 610 CG2 ILE A 40 -5.791 -14.768 2.819 1.00 0.00 C ATOM 611 CD1 ILE A 40 -4.594 -11.915 0.544 1.00 0.00 C ATOM 0 H ILE A 40 -4.639 -13.718 -1.133 1.00 0.00 H new ATOM 0 HA ILE A 40 -6.301 -15.468 0.534 1.00 0.00 H new ATOM 0 HB ILE A 40 -6.708 -13.070 1.849 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -4.469 -12.362 2.652 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -3.695 -13.553 1.625 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -5.691 -14.262 3.779 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -6.706 -15.361 2.815 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -4.934 -15.423 2.662 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -3.680 -11.321 0.545 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -4.669 -12.464 -0.395 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -5.455 -11.255 0.648 1.00 0.00 H new ATOM 623 N HIS A 41 -7.552 -12.616 -0.158 1.00 0.00 N ATOM 624 CA HIS A 41 -8.574 -11.925 -1.000 1.00 0.00 C ATOM 625 C HIS A 41 -8.292 -10.418 -1.006 1.00 0.00 C ATOM 626 O HIS A 41 -9.183 -9.608 -1.161 1.00 0.00 O ATOM 627 CB HIS A 41 -9.972 -12.196 -0.434 1.00 0.00 C ATOM 628 CG HIS A 41 -10.007 -13.593 0.109 1.00 0.00 C ATOM 629 ND1 HIS A 41 -9.208 -14.243 1.016 1.00 0.00 N flip ATOM 630 CD2 HIS A 41 -10.938 -14.525 -0.312 1.00 0.00 C flip ATOM 631 CE1 HIS A 41 -9.632 -15.555 1.152 1.00 0.00 C flip ATOM 632 NE2 HIS A 41 -10.677 -15.678 0.332 1.00 0.00 N flip ATOM 0 H HIS A 41 -7.299 -12.132 0.704 1.00 0.00 H new ATOM 0 HA HIS A 41 -8.525 -12.303 -2.021 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -10.207 -11.479 0.352 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -10.725 -12.074 -1.212 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -11.730 -14.358 -1.027 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -9.206 -16.317 1.788 1.00 0.00 H new ATOM 0 HE2 HIS A 41 -11.211 -16.538 0.208 1.00 0.00 H new ATOM 641 N HIS A 42 -7.051 -10.042 -0.839 1.00 0.00 N ATOM 642 CA HIS A 42 -6.692 -8.592 -0.832 1.00 0.00 C ATOM 643 C HIS A 42 -6.921 -7.995 -2.221 1.00 0.00 C ATOM 644 O HIS A 42 -6.798 -8.666 -3.224 1.00 0.00 O ATOM 645 CB HIS A 42 -5.220 -8.437 -0.454 1.00 0.00 C ATOM 646 CG HIS A 42 -4.363 -8.942 -1.582 1.00 0.00 C ATOM 647 ND1 HIS A 42 -3.596 -10.092 -1.466 1.00 0.00 N ATOM 648 CD2 HIS A 42 -4.138 -8.468 -2.855 1.00 0.00 C ATOM 649 CE1 HIS A 42 -2.951 -10.271 -2.635 1.00 0.00 C ATOM 650 NE2 HIS A 42 -3.246 -9.309 -3.511 1.00 0.00 N ATOM 0 H HIS A 42 -6.266 -10.680 -0.706 1.00 0.00 H new ATOM 0 HA HIS A 42 -7.317 -8.070 -0.107 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -4.993 -7.391 -0.250 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -5.006 -8.994 0.458 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -4.585 -7.581 -3.278 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -2.279 -11.091 -2.838 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -2.892 -9.211 -4.462 1.00 0.00 H new ATOM 659 N TRP A 43 -7.252 -6.734 -2.286 1.00 0.00 N ATOM 660 CA TRP A 43 -7.496 -6.095 -3.611 1.00 0.00 C ATOM 661 C TRP A 43 -6.280 -5.290 -4.057 1.00 0.00 C ATOM 662 O TRP A 43 -5.640 -4.624 -3.269 1.00 0.00 O ATOM 663 CB TRP A 43 -8.692 -5.155 -3.512 1.00 0.00 C ATOM 664 CG TRP A 43 -9.947 -5.929 -3.722 1.00 0.00 C ATOM 665 CD1 TRP A 43 -10.778 -6.345 -2.741 1.00 0.00 C ATOM 666 CD2 TRP A 43 -10.523 -6.389 -4.972 1.00 0.00 C ATOM 667 NE1 TRP A 43 -11.830 -7.035 -3.313 1.00 0.00 N ATOM 668 CE2 TRP A 43 -11.718 -7.091 -4.687 1.00 0.00 C ATOM 669 CE3 TRP A 43 -10.130 -6.266 -6.314 1.00 0.00 C ATOM 670 CZ2 TRP A 43 -12.489 -7.658 -5.700 1.00 0.00 C ATOM 671 CZ3 TRP A 43 -10.902 -6.835 -7.336 1.00 0.00 C ATOM 672 CH2 TRP A 43 -12.081 -7.530 -7.030 1.00 0.00 C ATOM 0 H TRP A 43 -7.364 -6.119 -1.480 1.00 0.00 H new ATOM 0 HA TRP A 43 -7.690 -6.883 -4.339 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -8.709 -4.671 -2.535 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -8.610 -4.364 -4.258 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -10.642 -6.168 -1.684 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -12.596 -7.452 -2.784 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -9.226 -5.729 -6.561 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -13.396 -8.193 -5.459 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -10.587 -6.738 -8.365 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -12.673 -7.966 -7.821 1.00 0.00 H new ATOM 683 N THR A 44 -5.975 -5.334 -5.325 1.00 0.00 N ATOM 684 CA THR A 44 -4.820 -4.557 -5.843 1.00 0.00 C ATOM 685 C THR A 44 -4.861 -4.550 -7.377 1.00 0.00 C ATOM 686 O THR A 44 -5.281 -5.509 -7.996 1.00 0.00 O ATOM 687 CB THR A 44 -3.516 -5.187 -5.355 1.00 0.00 C ATOM 688 OG1 THR A 44 -2.419 -4.548 -5.991 1.00 0.00 O ATOM 689 CG2 THR A 44 -3.499 -6.683 -5.682 1.00 0.00 C ATOM 0 H THR A 44 -6.480 -5.878 -6.025 1.00 0.00 H new ATOM 0 HA THR A 44 -4.874 -3.531 -5.478 1.00 0.00 H new ATOM 0 HB THR A 44 -3.439 -5.061 -4.275 1.00 0.00 H new ATOM 0 HG1 THR A 44 -2.117 -3.794 -5.443 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.565 -7.122 -5.330 1.00 0.00 H new ATOM 0 HG22 THR A 44 -4.339 -7.173 -5.189 1.00 0.00 H new ATOM 0 HG23 THR A 44 -3.581 -6.821 -6.760 1.00 0.00 H new ATOM 697 N PRO A 45 -4.426 -3.479 -7.994 1.00 0.00 N ATOM 698 CA PRO A 45 -4.415 -3.358 -9.470 1.00 0.00 C ATOM 699 C PRO A 45 -3.268 -4.146 -10.090 1.00 0.00 C ATOM 700 O PRO A 45 -2.340 -4.542 -9.414 1.00 0.00 O ATOM 701 CB PRO A 45 -4.244 -1.868 -9.747 1.00 0.00 C ATOM 702 CG PRO A 45 -3.771 -1.242 -8.476 1.00 0.00 C ATOM 703 CD PRO A 45 -3.894 -2.274 -7.348 1.00 0.00 C ATOM 0 HA PRO A 45 -5.329 -3.761 -9.905 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -3.524 -1.704 -10.549 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -5.186 -1.424 -10.069 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -2.737 -0.914 -8.578 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -4.365 -0.357 -8.246 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -2.927 -2.469 -6.884 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -4.560 -1.921 -6.561 1.00 0.00 H new ATOM 711 N PRO A 46 -3.339 -4.380 -11.366 1.00 0.00 N ATOM 712 CA PRO A 46 -2.294 -5.150 -12.090 1.00 0.00 C ATOM 713 C PRO A 46 -0.881 -4.647 -11.767 1.00 0.00 C ATOM 714 O PRO A 46 -0.584 -3.478 -11.913 1.00 0.00 O ATOM 715 CB PRO A 46 -2.616 -4.904 -13.562 1.00 0.00 C ATOM 716 CG PRO A 46 -4.056 -4.512 -13.614 1.00 0.00 C ATOM 717 CD PRO A 46 -4.419 -3.929 -12.255 1.00 0.00 C ATOM 0 HA PRO A 46 -2.301 -6.204 -11.811 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -1.983 -4.117 -13.973 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -2.435 -5.800 -14.155 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -4.226 -3.780 -14.403 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -4.681 -5.376 -13.840 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -4.476 -2.841 -12.291 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -5.390 -4.288 -11.915 1.00 0.00 H new ATOM 725 N LYS A 47 -0.007 -5.515 -11.329 1.00 0.00 N ATOM 726 CA LYS A 47 1.379 -5.066 -11.000 1.00 0.00 C ATOM 727 C LYS A 47 2.317 -6.271 -10.923 1.00 0.00 C ATOM 728 O LYS A 47 1.929 -7.348 -10.509 1.00 0.00 O ATOM 729 CB LYS A 47 1.360 -4.309 -9.660 1.00 0.00 C ATOM 730 CG LYS A 47 2.400 -4.888 -8.683 1.00 0.00 C ATOM 731 CD LYS A 47 2.030 -4.520 -7.241 1.00 0.00 C ATOM 732 CE LYS A 47 2.725 -5.486 -6.270 1.00 0.00 C ATOM 733 NZ LYS A 47 1.702 -6.292 -5.543 1.00 0.00 N ATOM 0 H LYS A 47 -0.190 -6.508 -11.186 1.00 0.00 H new ATOM 0 HA LYS A 47 1.744 -4.400 -11.782 1.00 0.00 H new ATOM 0 HB2 LYS A 47 1.567 -3.253 -9.832 1.00 0.00 H new ATOM 0 HB3 LYS A 47 0.366 -4.371 -9.217 1.00 0.00 H new ATOM 0 HG2 LYS A 47 2.447 -5.972 -8.789 1.00 0.00 H new ATOM 0 HG3 LYS A 47 3.390 -4.501 -8.923 1.00 0.00 H new ATOM 0 HD2 LYS A 47 2.331 -3.494 -7.028 1.00 0.00 H new ATOM 0 HD3 LYS A 47 0.949 -4.569 -7.108 1.00 0.00 H new ATOM 0 HE2 LYS A 47 3.399 -6.145 -6.818 1.00 0.00 H new ATOM 0 HE3 LYS A 47 3.334 -4.927 -5.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 2.168 -7.076 -5.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 1.209 -5.688 -4.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 1.014 -6.675 -6.223 1.00 0.00 H new ATOM 747 N GLY A 48 3.551 -6.102 -11.317 1.00 0.00 N ATOM 748 CA GLY A 48 4.509 -7.244 -11.260 1.00 0.00 C ATOM 749 C GLY A 48 5.904 -6.735 -10.901 1.00 0.00 C ATOM 750 O GLY A 48 6.183 -5.554 -10.962 1.00 0.00 O ATOM 0 H GLY A 48 3.936 -5.227 -11.674 1.00 0.00 H new ATOM 0 HA2 GLY A 48 4.177 -7.972 -10.520 1.00 0.00 H new ATOM 0 HA3 GLY A 48 4.536 -7.756 -12.222 1.00 0.00 H new ATOM 754 N HIS A 49 6.786 -7.623 -10.535 1.00 0.00 N ATOM 755 CA HIS A 49 8.169 -7.202 -10.175 1.00 0.00 C ATOM 756 C HIS A 49 8.990 -7.047 -11.455 1.00 0.00 C ATOM 757 O HIS A 49 8.575 -7.461 -12.519 1.00 0.00 O ATOM 758 CB HIS A 49 8.804 -8.265 -9.272 1.00 0.00 C ATOM 759 CG HIS A 49 10.309 -8.133 -9.281 1.00 0.00 C ATOM 760 ND1 HIS A 49 11.145 -9.188 -9.634 1.00 0.00 N ATOM 761 CD2 HIS A 49 11.144 -7.085 -8.967 1.00 0.00 C ATOM 762 CE1 HIS A 49 12.415 -8.756 -9.522 1.00 0.00 C ATOM 763 NE2 HIS A 49 12.467 -7.484 -9.121 1.00 0.00 N ATOM 0 H HIS A 49 6.608 -8.625 -10.469 1.00 0.00 H new ATOM 0 HA HIS A 49 8.144 -6.251 -9.643 1.00 0.00 H new ATOM 0 HB2 HIS A 49 8.429 -8.158 -8.254 1.00 0.00 H new ATOM 0 HB3 HIS A 49 8.518 -9.260 -9.614 1.00 0.00 H new ATOM 0 HD2 HIS A 49 10.821 -6.104 -8.650 1.00 0.00 H new ATOM 0 HE1 HIS A 49 13.284 -9.363 -9.731 1.00 0.00 H new ATOM 0 HE2 HIS A 49 13.303 -6.922 -8.961 1.00 0.00 H new ATOM 772 N VAL A 50 10.146 -6.451 -11.367 1.00 0.00 N ATOM 773 CA VAL A 50 10.978 -6.272 -12.589 1.00 0.00 C ATOM 774 C VAL A 50 11.955 -7.437 -12.735 1.00 0.00 C ATOM 775 O VAL A 50 12.692 -7.766 -11.828 1.00 0.00 O ATOM 776 CB VAL A 50 11.757 -4.948 -12.496 1.00 0.00 C ATOM 777 CG1 VAL A 50 13.266 -5.213 -12.437 1.00 0.00 C ATOM 778 CG2 VAL A 50 11.459 -4.098 -13.731 1.00 0.00 C ATOM 0 H VAL A 50 10.549 -6.082 -10.506 1.00 0.00 H new ATOM 0 HA VAL A 50 10.326 -6.247 -13.462 1.00 0.00 H new ATOM 0 HB VAL A 50 11.448 -4.427 -11.590 1.00 0.00 H new ATOM 0 HG11 VAL A 50 13.800 -4.265 -12.372 1.00 0.00 H new ATOM 0 HG12 VAL A 50 13.495 -5.819 -11.561 1.00 0.00 H new ATOM 0 HG13 VAL A 50 13.578 -5.743 -13.337 1.00 0.00 H new ATOM 0 HG21 VAL A 50 12.009 -3.159 -13.668 1.00 0.00 H new ATOM 0 HG22 VAL A 50 11.764 -4.638 -14.627 1.00 0.00 H new ATOM 0 HG23 VAL A 50 10.390 -3.889 -13.780 1.00 0.00 H new ATOM 788 N GLU A 51 11.981 -8.051 -13.885 1.00 0.00 N ATOM 789 CA GLU A 51 12.929 -9.175 -14.103 1.00 0.00 C ATOM 790 C GLU A 51 14.207 -8.593 -14.721 1.00 0.00 C ATOM 791 O GLU A 51 14.165 -7.582 -15.394 1.00 0.00 O ATOM 792 CB GLU A 51 12.301 -10.216 -15.041 1.00 0.00 C ATOM 793 CG GLU A 51 10.807 -10.358 -14.732 1.00 0.00 C ATOM 794 CD GLU A 51 10.124 -11.140 -15.856 1.00 0.00 C ATOM 795 OE1 GLU A 51 9.463 -10.514 -16.670 1.00 0.00 O ATOM 796 OE2 GLU A 51 10.270 -12.350 -15.881 1.00 0.00 O ATOM 0 H GLU A 51 11.387 -7.822 -14.682 1.00 0.00 H new ATOM 0 HA GLU A 51 13.161 -9.672 -13.161 1.00 0.00 H new ATOM 0 HB2 GLU A 51 12.440 -9.914 -16.079 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.800 -11.177 -14.919 1.00 0.00 H new ATOM 0 HG2 GLU A 51 10.669 -10.873 -13.781 1.00 0.00 H new ATOM 0 HG3 GLU A 51 10.351 -9.373 -14.631 1.00 0.00 H new ATOM 804 N PRO A 52 15.335 -9.207 -14.479 1.00 0.00 N ATOM 805 CA PRO A 52 16.652 -8.720 -14.997 1.00 0.00 C ATOM 806 C PRO A 52 16.643 -8.501 -16.508 1.00 0.00 C ATOM 807 O PRO A 52 17.648 -8.178 -17.112 1.00 0.00 O ATOM 808 CB PRO A 52 17.646 -9.822 -14.615 1.00 0.00 C ATOM 809 CG PRO A 52 16.817 -10.993 -14.190 1.00 0.00 C ATOM 810 CD PRO A 52 15.491 -10.431 -13.691 1.00 0.00 C ATOM 0 HA PRO A 52 16.908 -7.749 -14.572 1.00 0.00 H new ATOM 0 HB2 PRO A 52 18.285 -10.082 -15.459 1.00 0.00 H new ATOM 0 HB3 PRO A 52 18.302 -9.494 -13.808 1.00 0.00 H new ATOM 0 HG2 PRO A 52 16.658 -11.678 -15.023 1.00 0.00 H new ATOM 0 HG3 PRO A 52 17.319 -11.558 -13.404 1.00 0.00 H new ATOM 0 HD2 PRO A 52 14.669 -11.127 -13.859 1.00 0.00 H new ATOM 0 HD3 PRO A 52 15.518 -10.222 -12.622 1.00 0.00 H new ATOM 818 N GLY A 53 15.512 -8.668 -17.114 1.00 0.00 N ATOM 819 CA GLY A 53 15.413 -8.466 -18.584 1.00 0.00 C ATOM 820 C GLY A 53 14.110 -7.730 -18.889 1.00 0.00 C ATOM 821 O GLY A 53 13.338 -8.141 -19.733 1.00 0.00 O ATOM 0 H GLY A 53 14.642 -8.938 -16.655 1.00 0.00 H new ATOM 0 HA2 GLY A 53 16.266 -7.891 -18.945 1.00 0.00 H new ATOM 0 HA3 GLY A 53 15.435 -9.426 -19.100 1.00 0.00 H new ATOM 825 N GLU A 54 13.843 -6.654 -18.190 1.00 0.00 N ATOM 826 CA GLU A 54 12.571 -5.908 -18.420 1.00 0.00 C ATOM 827 C GLU A 54 12.805 -4.413 -18.205 1.00 0.00 C ATOM 828 O GLU A 54 13.925 -3.942 -18.182 1.00 0.00 O ATOM 829 CB GLU A 54 11.526 -6.384 -17.407 1.00 0.00 C ATOM 830 CG GLU A 54 11.640 -7.893 -17.212 1.00 0.00 C ATOM 831 CD GLU A 54 11.184 -8.608 -18.483 1.00 0.00 C ATOM 832 OE1 GLU A 54 11.351 -9.813 -18.555 1.00 0.00 O ATOM 833 OE2 GLU A 54 10.681 -7.933 -19.366 1.00 0.00 O ATOM 0 H GLU A 54 14.451 -6.262 -17.471 1.00 0.00 H new ATOM 0 HA GLU A 54 12.227 -6.086 -19.439 1.00 0.00 H new ATOM 0 HB2 GLU A 54 11.671 -5.874 -16.455 1.00 0.00 H new ATOM 0 HB3 GLU A 54 10.526 -6.128 -17.756 1.00 0.00 H new ATOM 0 HG2 GLU A 54 12.670 -8.163 -16.980 1.00 0.00 H new ATOM 0 HG3 GLU A 54 11.029 -8.208 -16.366 1.00 0.00 H new ATOM 841 N ASP A 55 11.745 -3.672 -18.026 1.00 0.00 N ATOM 842 CA ASP A 55 11.873 -2.208 -17.783 1.00 0.00 C ATOM 843 C ASP A 55 10.905 -1.827 -16.668 1.00 0.00 C ATOM 844 O ASP A 55 10.177 -2.655 -16.166 1.00 0.00 O ATOM 845 CB ASP A 55 11.513 -1.429 -19.045 1.00 0.00 C ATOM 846 CG ASP A 55 12.295 -0.114 -19.080 1.00 0.00 C ATOM 847 OD1 ASP A 55 11.783 0.840 -19.644 1.00 0.00 O ATOM 848 OD2 ASP A 55 13.391 -0.082 -18.547 1.00 0.00 O ATOM 0 H ASP A 55 10.787 -4.023 -18.038 1.00 0.00 H new ATOM 0 HA ASP A 55 12.900 -1.969 -17.505 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.743 -2.024 -19.929 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.442 -1.227 -19.066 1.00 0.00 H new ATOM 854 N ASP A 56 10.894 -0.593 -16.263 1.00 0.00 N ATOM 855 CA ASP A 56 9.970 -0.201 -15.168 1.00 0.00 C ATOM 856 C ASP A 56 8.522 -0.171 -15.681 1.00 0.00 C ATOM 857 O ASP A 56 7.694 -0.956 -15.261 1.00 0.00 O ATOM 858 CB ASP A 56 10.370 1.171 -14.630 1.00 0.00 C ATOM 859 CG ASP A 56 11.773 1.084 -14.029 1.00 0.00 C ATOM 860 OD1 ASP A 56 12.235 -0.024 -13.809 1.00 0.00 O ATOM 861 OD2 ASP A 56 12.362 2.127 -13.797 1.00 0.00 O ATOM 0 H ASP A 56 11.478 0.155 -16.637 1.00 0.00 H new ATOM 0 HA ASP A 56 10.035 -0.933 -14.363 1.00 0.00 H new ATOM 0 HB2 ASP A 56 10.350 1.910 -15.431 1.00 0.00 H new ATOM 0 HB3 ASP A 56 9.657 1.501 -13.874 1.00 0.00 H new ATOM 867 N LEU A 57 8.198 0.717 -16.587 1.00 0.00 N ATOM 868 CA LEU A 57 6.799 0.757 -17.102 1.00 0.00 C ATOM 869 C LEU A 57 6.501 -0.512 -17.888 1.00 0.00 C ATOM 870 O LEU A 57 5.451 -1.104 -17.749 1.00 0.00 O ATOM 871 CB LEU A 57 6.602 1.970 -18.013 1.00 0.00 C ATOM 872 CG LEU A 57 5.235 1.875 -18.700 1.00 0.00 C ATOM 873 CD1 LEU A 57 4.117 2.192 -17.706 1.00 0.00 C ATOM 874 CD2 LEU A 57 5.189 2.871 -19.855 1.00 0.00 C ATOM 0 H LEU A 57 8.834 1.407 -16.987 1.00 0.00 H new ATOM 0 HA LEU A 57 6.119 0.832 -16.253 1.00 0.00 H new ATOM 0 HB2 LEU A 57 6.666 2.890 -17.431 1.00 0.00 H new ATOM 0 HB3 LEU A 57 7.395 2.010 -18.760 1.00 0.00 H new ATOM 0 HG LEU A 57 5.092 0.862 -19.075 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.152 2.121 -18.208 1.00 0.00 H new ATOM 0 HD12 LEU A 57 4.150 1.480 -16.882 1.00 0.00 H new ATOM 0 HD13 LEU A 57 4.250 3.202 -17.318 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.220 2.810 -20.350 1.00 0.00 H new ATOM 0 HD22 LEU A 57 5.338 3.880 -19.471 1.00 0.00 H new ATOM 0 HD23 LEU A 57 5.977 2.635 -20.570 1.00 0.00 H new ATOM 886 N GLU A 58 7.411 -0.947 -18.712 1.00 0.00 N ATOM 887 CA GLU A 58 7.139 -2.184 -19.478 1.00 0.00 C ATOM 888 C GLU A 58 6.736 -3.256 -18.464 1.00 0.00 C ATOM 889 O GLU A 58 5.878 -4.077 -18.713 1.00 0.00 O ATOM 890 CB GLU A 58 8.395 -2.618 -20.239 1.00 0.00 C ATOM 891 CG GLU A 58 8.818 -1.514 -21.223 1.00 0.00 C ATOM 892 CD GLU A 58 7.722 -1.285 -22.268 1.00 0.00 C ATOM 893 OE1 GLU A 58 7.739 -0.235 -22.891 1.00 0.00 O ATOM 894 OE2 GLU A 58 6.888 -2.160 -22.431 1.00 0.00 O ATOM 0 H GLU A 58 8.315 -0.506 -18.884 1.00 0.00 H new ATOM 0 HA GLU A 58 6.347 -2.025 -20.209 1.00 0.00 H new ATOM 0 HB2 GLU A 58 9.204 -2.821 -19.537 1.00 0.00 H new ATOM 0 HB3 GLU A 58 8.201 -3.545 -20.780 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.012 -0.589 -20.681 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.748 -1.795 -21.717 1.00 0.00 H new ATOM 902 N THR A 59 7.332 -3.220 -17.299 1.00 0.00 N ATOM 903 CA THR A 59 6.964 -4.201 -16.245 1.00 0.00 C ATOM 904 C THR A 59 5.520 -3.931 -15.808 1.00 0.00 C ATOM 905 O THR A 59 4.734 -4.842 -15.639 1.00 0.00 O ATOM 906 CB THR A 59 7.897 -4.040 -15.046 1.00 0.00 C ATOM 907 OG1 THR A 59 8.926 -5.018 -15.112 1.00 0.00 O ATOM 908 CG2 THR A 59 7.101 -4.216 -13.755 1.00 0.00 C ATOM 0 H THR A 59 8.057 -2.552 -17.036 1.00 0.00 H new ATOM 0 HA THR A 59 7.054 -5.215 -16.634 1.00 0.00 H new ATOM 0 HB THR A 59 8.343 -3.046 -15.062 1.00 0.00 H new ATOM 0 HG1 THR A 59 8.584 -5.875 -14.783 1.00 0.00 H new ATOM 0 HG21 THR A 59 7.766 -4.101 -12.899 1.00 0.00 H new ATOM 0 HG22 THR A 59 6.314 -3.463 -13.707 1.00 0.00 H new ATOM 0 HG23 THR A 59 6.653 -5.210 -13.736 1.00 0.00 H new ATOM 916 N ALA A 60 5.153 -2.682 -15.636 1.00 0.00 N ATOM 917 CA ALA A 60 3.750 -2.380 -15.235 1.00 0.00 C ATOM 918 C ALA A 60 2.851 -2.827 -16.378 1.00 0.00 C ATOM 919 O ALA A 60 1.849 -3.484 -16.184 1.00 0.00 O ATOM 920 CB ALA A 60 3.569 -0.876 -14.984 1.00 0.00 C ATOM 0 H ALA A 60 5.760 -1.871 -15.755 1.00 0.00 H new ATOM 0 HA ALA A 60 3.499 -2.901 -14.311 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.538 -0.677 -14.692 1.00 0.00 H new ATOM 0 HB2 ALA A 60 4.240 -0.557 -14.186 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.801 -0.325 -15.895 1.00 0.00 H new ATOM 926 N LEU A 61 3.241 -2.504 -17.579 1.00 0.00 N ATOM 927 CA LEU A 61 2.458 -2.934 -18.761 1.00 0.00 C ATOM 928 C LEU A 61 2.513 -4.458 -18.831 1.00 0.00 C ATOM 929 O LEU A 61 1.563 -5.115 -19.208 1.00 0.00 O ATOM 930 CB LEU A 61 3.088 -2.333 -20.017 1.00 0.00 C ATOM 931 CG LEU A 61 2.834 -0.826 -20.045 1.00 0.00 C ATOM 932 CD1 LEU A 61 3.700 -0.192 -21.130 1.00 0.00 C ATOM 933 CD2 LEU A 61 1.360 -0.547 -20.360 1.00 0.00 C ATOM 0 H LEU A 61 4.075 -1.956 -17.790 1.00 0.00 H new ATOM 0 HA LEU A 61 1.423 -2.600 -18.687 1.00 0.00 H new ATOM 0 HB2 LEU A 61 4.160 -2.532 -20.030 1.00 0.00 H new ATOM 0 HB3 LEU A 61 2.666 -2.800 -20.907 1.00 0.00 H new ATOM 0 HG LEU A 61 3.081 -0.405 -19.071 1.00 0.00 H new ATOM 0 HD11 LEU A 61 3.523 0.883 -21.155 1.00 0.00 H new ATOM 0 HD12 LEU A 61 4.751 -0.382 -20.914 1.00 0.00 H new ATOM 0 HD13 LEU A 61 3.445 -0.624 -22.098 1.00 0.00 H new ATOM 0 HD21 LEU A 61 1.189 0.529 -20.378 1.00 0.00 H new ATOM 0 HD22 LEU A 61 1.109 -0.970 -21.333 1.00 0.00 H new ATOM 0 HD23 LEU A 61 0.732 -1.002 -19.594 1.00 0.00 H new ATOM 945 N ARG A 62 3.629 -5.019 -18.455 1.00 0.00 N ATOM 946 CA ARG A 62 3.780 -6.497 -18.473 1.00 0.00 C ATOM 947 C ARG A 62 2.765 -7.122 -17.519 1.00 0.00 C ATOM 948 O ARG A 62 2.031 -8.024 -17.875 1.00 0.00 O ATOM 949 CB ARG A 62 5.190 -6.841 -17.999 1.00 0.00 C ATOM 950 CG ARG A 62 5.386 -8.353 -17.953 1.00 0.00 C ATOM 951 CD ARG A 62 6.723 -8.663 -17.275 1.00 0.00 C ATOM 952 NE ARG A 62 6.905 -10.137 -17.190 1.00 0.00 N ATOM 953 CZ ARG A 62 7.082 -10.834 -18.279 1.00 0.00 C ATOM 954 NH1 ARG A 62 7.116 -10.233 -19.436 1.00 0.00 N ATOM 955 NH2 ARG A 62 7.221 -12.129 -18.213 1.00 0.00 N ATOM 0 H ARG A 62 4.451 -4.508 -18.133 1.00 0.00 H new ATOM 0 HA ARG A 62 3.613 -6.880 -19.480 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.924 -6.394 -18.669 1.00 0.00 H new ATOM 0 HB3 ARG A 62 5.361 -6.416 -17.010 1.00 0.00 H new ATOM 0 HG2 ARG A 62 4.569 -8.822 -17.405 1.00 0.00 H new ATOM 0 HG3 ARG A 62 5.371 -8.765 -18.962 1.00 0.00 H new ATOM 0 HD2 ARG A 62 7.542 -8.217 -17.840 1.00 0.00 H new ATOM 0 HD3 ARG A 62 6.748 -8.225 -16.277 1.00 0.00 H new ATOM 0 HE ARG A 62 6.891 -10.602 -16.282 1.00 0.00 H new ATOM 0 HH11 ARG A 62 7.004 -9.220 -19.488 1.00 0.00 H new ATOM 0 HH12 ARG A 62 7.254 -10.776 -20.289 1.00 0.00 H new ATOM 0 HH21 ARG A 62 7.191 -12.600 -17.309 1.00 0.00 H new ATOM 0 HH22 ARG A 62 7.359 -12.671 -19.066 1.00 0.00 H new ATOM 969 N ALA A 63 2.717 -6.642 -16.306 1.00 0.00 N ATOM 970 CA ALA A 63 1.749 -7.199 -15.328 1.00 0.00 C ATOM 971 C ALA A 63 0.342 -6.755 -15.714 1.00 0.00 C ATOM 972 O ALA A 63 -0.635 -7.416 -15.424 1.00 0.00 O ATOM 973 CB ALA A 63 2.073 -6.690 -13.924 1.00 0.00 C ATOM 0 H ALA A 63 3.307 -5.889 -15.953 1.00 0.00 H new ATOM 0 HA ALA A 63 1.813 -8.287 -15.335 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.358 -7.104 -13.213 1.00 0.00 H new ATOM 0 HB2 ALA A 63 3.081 -7.001 -13.648 1.00 0.00 H new ATOM 0 HB3 ALA A 63 2.012 -5.602 -13.908 1.00 0.00 H new ATOM 979 N THR A 64 0.231 -5.634 -16.367 1.00 0.00 N ATOM 980 CA THR A 64 -1.112 -5.146 -16.769 1.00 0.00 C ATOM 981 C THR A 64 -1.821 -6.253 -17.544 1.00 0.00 C ATOM 982 O THR A 64 -2.952 -6.598 -17.264 1.00 0.00 O ATOM 983 CB THR A 64 -0.940 -3.904 -17.646 1.00 0.00 C ATOM 984 OG1 THR A 64 -0.167 -2.944 -16.944 1.00 0.00 O ATOM 985 CG2 THR A 64 -2.300 -3.300 -17.989 1.00 0.00 C ATOM 0 H THR A 64 1.012 -5.036 -16.639 1.00 0.00 H new ATOM 0 HA THR A 64 -1.708 -4.884 -15.895 1.00 0.00 H new ATOM 0 HB THR A 64 -0.438 -4.190 -18.570 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.695 -3.338 -16.693 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.159 -2.418 -18.613 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.899 -4.034 -18.528 1.00 0.00 H new ATOM 0 HG23 THR A 64 -2.814 -3.017 -17.071 1.00 0.00 H new ATOM 993 N GLN A 65 -1.157 -6.826 -18.505 1.00 0.00 N ATOM 994 CA GLN A 65 -1.782 -7.927 -19.284 1.00 0.00 C ATOM 995 C GLN A 65 -1.766 -9.223 -18.463 1.00 0.00 C ATOM 996 O GLN A 65 -2.699 -9.991 -18.480 1.00 0.00 O ATOM 997 CB GLN A 65 -0.999 -8.142 -20.579 1.00 0.00 C ATOM 998 CG GLN A 65 0.111 -7.093 -20.682 1.00 0.00 C ATOM 999 CD GLN A 65 0.836 -7.240 -22.023 1.00 0.00 C ATOM 1000 OE1 GLN A 65 0.224 -7.170 -23.068 1.00 0.00 O ATOM 1001 NE2 GLN A 65 2.126 -7.445 -22.034 1.00 0.00 N ATOM 0 H GLN A 65 -0.208 -6.579 -18.785 1.00 0.00 H new ATOM 0 HA GLN A 65 -2.813 -7.660 -19.516 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -0.570 -9.144 -20.596 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -1.667 -8.067 -21.437 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -0.312 -6.092 -20.594 1.00 0.00 H new ATOM 0 HG3 GLN A 65 0.817 -7.214 -19.860 1.00 0.00 H new ATOM 0 HE21 GLN A 65 2.641 -7.504 -21.155 1.00 0.00 H new ATOM 0 HE22 GLN A 65 2.619 -7.546 -22.921 1.00 0.00 H new ATOM 1010 N GLU A 66 -0.692 -9.484 -17.771 1.00 0.00 N ATOM 1011 CA GLU A 66 -0.596 -10.751 -16.984 1.00 0.00 C ATOM 1012 C GLU A 66 -1.542 -10.745 -15.773 1.00 0.00 C ATOM 1013 O GLU A 66 -2.224 -11.719 -15.516 1.00 0.00 O ATOM 1014 CB GLU A 66 0.845 -10.927 -16.504 1.00 0.00 C ATOM 1015 CG GLU A 66 1.758 -11.164 -17.707 1.00 0.00 C ATOM 1016 CD GLU A 66 3.185 -11.415 -17.222 1.00 0.00 C ATOM 1017 OE1 GLU A 66 3.426 -11.242 -16.039 1.00 0.00 O ATOM 1018 OE2 GLU A 66 4.012 -11.778 -18.041 1.00 0.00 O ATOM 0 H GLU A 66 0.125 -8.876 -17.715 1.00 0.00 H new ATOM 0 HA GLU A 66 -0.891 -11.578 -17.630 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.168 -10.041 -15.958 1.00 0.00 H new ATOM 0 HB3 GLU A 66 0.909 -11.768 -15.814 1.00 0.00 H new ATOM 0 HG2 GLU A 66 1.403 -12.018 -18.284 1.00 0.00 H new ATOM 0 HG3 GLU A 66 1.735 -10.300 -18.371 1.00 0.00 H new ATOM 1026 N GLU A 67 -1.581 -9.685 -15.010 1.00 0.00 N ATOM 1027 CA GLU A 67 -2.475 -9.669 -13.809 1.00 0.00 C ATOM 1028 C GLU A 67 -3.944 -9.477 -14.201 1.00 0.00 C ATOM 1029 O GLU A 67 -4.824 -10.061 -13.604 1.00 0.00 O ATOM 1030 CB GLU A 67 -2.052 -8.551 -12.857 1.00 0.00 C ATOM 1031 CG GLU A 67 -0.895 -9.036 -11.979 1.00 0.00 C ATOM 1032 CD GLU A 67 0.384 -9.118 -12.807 1.00 0.00 C ATOM 1033 OE1 GLU A 67 0.316 -8.832 -13.985 1.00 0.00 O ATOM 1034 OE2 GLU A 67 1.410 -9.467 -12.245 1.00 0.00 O ATOM 0 H GLU A 67 -1.038 -8.835 -15.162 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.378 -10.635 -13.313 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -1.748 -7.672 -13.425 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -2.895 -8.252 -12.234 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.753 -8.355 -11.140 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -1.130 -10.014 -11.559 1.00 0.00 H new ATOM 1042 N ALA A 68 -4.228 -8.662 -15.180 1.00 0.00 N ATOM 1043 CA ALA A 68 -5.655 -8.451 -15.565 1.00 0.00 C ATOM 1044 C ALA A 68 -5.927 -9.011 -16.953 1.00 0.00 C ATOM 1045 O ALA A 68 -7.058 -9.268 -17.313 1.00 0.00 O ATOM 1046 CB ALA A 68 -5.967 -6.960 -15.584 1.00 0.00 C ATOM 0 H ALA A 68 -3.544 -8.138 -15.725 1.00 0.00 H new ATOM 0 HA ALA A 68 -6.281 -8.964 -14.835 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.009 -6.810 -15.865 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.794 -6.540 -14.593 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.321 -6.462 -16.307 1.00 0.00 H new ATOM 1052 N GLY A 69 -4.918 -9.195 -17.743 1.00 0.00 N ATOM 1053 CA GLY A 69 -5.162 -9.722 -19.106 1.00 0.00 C ATOM 1054 C GLY A 69 -5.279 -8.555 -20.078 1.00 0.00 C ATOM 1055 O GLY A 69 -5.583 -8.739 -21.239 1.00 0.00 O ATOM 0 H GLY A 69 -3.943 -9.006 -17.509 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -4.347 -10.381 -19.406 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -6.075 -10.317 -19.121 1.00 0.00 H new ATOM 1059 N ILE A 70 -5.051 -7.350 -19.631 1.00 0.00 N ATOM 1060 CA ILE A 70 -5.173 -6.213 -20.579 1.00 0.00 C ATOM 1061 C ILE A 70 -3.807 -5.897 -21.178 1.00 0.00 C ATOM 1062 O ILE A 70 -2.866 -5.589 -20.474 1.00 0.00 O ATOM 1063 CB ILE A 70 -5.688 -4.969 -19.864 1.00 0.00 C ATOM 1064 CG1 ILE A 70 -6.856 -5.352 -18.970 1.00 0.00 C ATOM 1065 CG2 ILE A 70 -6.178 -3.965 -20.911 1.00 0.00 C ATOM 1066 CD1 ILE A 70 -7.296 -4.132 -18.165 1.00 0.00 C ATOM 0 H ILE A 70 -4.792 -7.109 -18.674 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.876 -6.496 -21.363 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.890 -4.531 -19.264 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -7.685 -5.722 -19.574 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -6.565 -6.160 -18.298 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -6.549 -3.070 -20.411 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.353 -3.696 -21.571 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -6.981 -4.413 -21.497 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -8.134 -4.403 -17.522 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -6.466 -3.783 -17.551 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.603 -3.338 -18.846 1.00 0.00 H new ATOM 1078 N GLU A 71 -3.690 -5.942 -22.473 1.00 0.00 N ATOM 1079 CA GLU A 71 -2.384 -5.614 -23.097 1.00 0.00 C ATOM 1080 C GLU A 71 -2.312 -4.106 -23.293 1.00 0.00 C ATOM 1081 O GLU A 71 -3.312 -3.420 -23.249 1.00 0.00 O ATOM 1082 CB GLU A 71 -2.251 -6.311 -24.450 1.00 0.00 C ATOM 1083 CG GLU A 71 -3.359 -5.819 -25.384 1.00 0.00 C ATOM 1084 CD GLU A 71 -3.332 -6.617 -26.689 1.00 0.00 C ATOM 1085 OE1 GLU A 71 -2.401 -7.386 -26.872 1.00 0.00 O ATOM 1086 OE2 GLU A 71 -4.239 -6.443 -27.486 1.00 0.00 O ATOM 0 H GLU A 71 -4.437 -6.190 -23.122 1.00 0.00 H new ATOM 0 HA GLU A 71 -1.574 -5.954 -22.452 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -1.274 -6.102 -24.885 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -2.319 -7.391 -24.324 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -4.330 -5.929 -24.900 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -3.225 -4.758 -25.594 1.00 0.00 H new ATOM 1094 N ALA A 72 -1.148 -3.584 -23.506 1.00 0.00 N ATOM 1095 CA ALA A 72 -1.029 -2.117 -23.702 1.00 0.00 C ATOM 1096 C ALA A 72 -1.709 -1.729 -25.016 1.00 0.00 C ATOM 1097 O ALA A 72 -2.109 -0.597 -25.212 1.00 0.00 O ATOM 1098 CB ALA A 72 0.443 -1.726 -23.756 1.00 0.00 C ATOM 0 H ALA A 72 -0.272 -4.105 -23.554 1.00 0.00 H new ATOM 0 HA ALA A 72 -1.509 -1.597 -22.873 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.528 -0.649 -23.900 1.00 0.00 H new ATOM 0 HB2 ALA A 72 0.929 -2.007 -22.821 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.926 -2.242 -24.585 1.00 0.00 H new ATOM 1104 N GLY A 73 -1.829 -2.662 -25.920 1.00 0.00 N ATOM 1105 CA GLY A 73 -2.468 -2.368 -27.234 1.00 0.00 C ATOM 1106 C GLY A 73 -3.855 -1.760 -27.023 1.00 0.00 C ATOM 1107 O GLY A 73 -4.300 -0.940 -27.799 1.00 0.00 O ATOM 0 H GLY A 73 -1.509 -3.623 -25.804 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -1.844 -1.680 -27.804 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -2.550 -3.284 -27.820 1.00 0.00 H new ATOM 1111 N GLN A 74 -4.543 -2.149 -25.984 1.00 0.00 N ATOM 1112 CA GLN A 74 -5.899 -1.575 -25.746 1.00 0.00 C ATOM 1113 C GLN A 74 -5.816 -0.499 -24.669 1.00 0.00 C ATOM 1114 O GLN A 74 -6.806 0.101 -24.299 1.00 0.00 O ATOM 1115 CB GLN A 74 -6.874 -2.675 -25.322 1.00 0.00 C ATOM 1116 CG GLN A 74 -6.417 -3.314 -24.011 1.00 0.00 C ATOM 1117 CD GLN A 74 -7.095 -4.676 -23.855 1.00 0.00 C ATOM 1118 OE1 GLN A 74 -6.606 -5.534 -23.152 1.00 0.00 O ATOM 1119 NE2 GLN A 74 -8.210 -4.913 -24.492 1.00 0.00 N ATOM 0 H GLN A 74 -4.229 -2.833 -25.295 1.00 0.00 H new ATOM 0 HA GLN A 74 -6.265 -1.128 -26.670 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.874 -2.257 -25.202 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -6.937 -3.434 -26.102 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -5.333 -3.431 -24.007 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -6.671 -2.669 -23.170 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -8.622 -4.192 -25.084 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -8.669 -5.819 -24.398 1.00 0.00 H new ATOM 1128 N LEU A 75 -4.638 -0.242 -24.170 1.00 0.00 N ATOM 1129 CA LEU A 75 -4.484 0.808 -23.125 1.00 0.00 C ATOM 1130 C LEU A 75 -3.656 1.968 -23.652 1.00 0.00 C ATOM 1131 O LEU A 75 -2.695 1.792 -24.381 1.00 0.00 O ATOM 1132 CB LEU A 75 -3.750 0.245 -21.919 1.00 0.00 C ATOM 1133 CG LEU A 75 -4.548 -0.889 -21.305 1.00 0.00 C ATOM 1134 CD1 LEU A 75 -3.627 -1.699 -20.405 1.00 0.00 C ATOM 1135 CD2 LEU A 75 -5.693 -0.303 -20.478 1.00 0.00 C ATOM 0 H LEU A 75 -3.776 -0.714 -24.441 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.483 1.145 -22.849 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -2.765 -0.114 -22.218 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -3.592 1.031 -21.180 1.00 0.00 H new ATOM 0 HG LEU A 75 -4.958 -1.531 -22.085 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.187 -2.519 -19.955 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.804 -2.102 -20.995 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.230 -1.057 -19.619 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -6.272 -1.112 -20.033 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -5.286 0.328 -19.688 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -6.339 0.293 -21.122 1.00 0.00 H new ATOM 1147 N THR A 76 -3.988 3.146 -23.229 1.00 0.00 N ATOM 1148 CA THR A 76 -3.203 4.339 -23.619 1.00 0.00 C ATOM 1149 C THR A 76 -2.660 4.925 -22.317 1.00 0.00 C ATOM 1150 O THR A 76 -3.406 5.189 -21.394 1.00 0.00 O ATOM 1151 CB THR A 76 -4.104 5.349 -24.343 1.00 0.00 C ATOM 1152 OG1 THR A 76 -3.389 5.913 -25.430 1.00 0.00 O ATOM 1153 CG2 THR A 76 -4.526 6.460 -23.385 1.00 0.00 C ATOM 0 H THR A 76 -4.783 3.337 -22.619 1.00 0.00 H new ATOM 0 HA THR A 76 -2.393 4.088 -24.304 1.00 0.00 H new ATOM 0 HB THR A 76 -4.995 4.838 -24.707 1.00 0.00 H new ATOM 0 HG1 THR A 76 -3.960 6.558 -25.898 1.00 0.00 H new ATOM 0 HG21 THR A 76 -5.165 7.170 -23.910 1.00 0.00 H new ATOM 0 HG22 THR A 76 -5.074 6.029 -22.547 1.00 0.00 H new ATOM 0 HG23 THR A 76 -3.641 6.975 -23.012 1.00 0.00 H new ATOM 1161 N ILE A 77 -1.378 5.089 -22.198 1.00 0.00 N ATOM 1162 CA ILE A 77 -0.847 5.607 -20.911 1.00 0.00 C ATOM 1163 C ILE A 77 -0.988 7.117 -20.845 1.00 0.00 C ATOM 1164 O ILE A 77 -0.248 7.853 -21.463 1.00 0.00 O ATOM 1165 CB ILE A 77 0.625 5.243 -20.748 1.00 0.00 C ATOM 1166 CG1 ILE A 77 0.803 3.735 -20.949 1.00 0.00 C ATOM 1167 CG2 ILE A 77 1.077 5.636 -19.335 1.00 0.00 C ATOM 1168 CD1 ILE A 77 1.123 3.077 -19.607 1.00 0.00 C ATOM 0 H ILE A 77 -0.685 4.892 -22.920 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.425 5.150 -20.108 1.00 0.00 H new ATOM 0 HB ILE A 77 1.225 5.773 -21.487 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -0.105 3.304 -21.370 1.00 0.00 H new ATOM 0 HG13 ILE A 77 1.606 3.544 -21.661 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.129 5.381 -19.205 1.00 0.00 H new ATOM 0 HG22 ILE A 77 0.944 6.709 -19.196 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.480 5.098 -18.599 1.00 0.00 H new ATOM 0 HD11 ILE A 77 1.250 2.004 -19.749 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.043 3.501 -19.204 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.305 3.256 -18.910 1.00 0.00 H new ATOM 1180 N ILE A 78 -1.907 7.583 -20.055 1.00 0.00 N ATOM 1181 CA ILE A 78 -2.063 9.045 -19.898 1.00 0.00 C ATOM 1182 C ILE A 78 -0.761 9.569 -19.364 1.00 0.00 C ATOM 1183 O ILE A 78 -0.380 10.702 -19.579 1.00 0.00 O ATOM 1184 CB ILE A 78 -3.129 9.344 -18.860 1.00 0.00 C ATOM 1185 CG1 ILE A 78 -4.501 9.153 -19.485 1.00 0.00 C ATOM 1186 CG2 ILE A 78 -2.945 10.776 -18.367 1.00 0.00 C ATOM 1187 CD1 ILE A 78 -4.591 7.723 -20.006 1.00 0.00 C ATOM 0 H ILE A 78 -2.556 7.013 -19.512 1.00 0.00 H new ATOM 0 HA ILE A 78 -2.339 9.497 -20.851 1.00 0.00 H new ATOM 0 HB ILE A 78 -3.041 8.666 -18.011 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -5.283 9.340 -18.749 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -4.651 9.864 -20.297 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -3.705 11.004 -17.620 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -1.956 10.883 -17.922 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -3.042 11.465 -19.206 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -5.569 7.562 -20.460 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -3.813 7.558 -20.752 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.455 7.025 -19.180 1.00 0.00 H new ATOM 1199 N GLU A 79 -0.103 8.741 -18.620 1.00 0.00 N ATOM 1200 CA GLU A 79 1.162 9.157 -18.000 1.00 0.00 C ATOM 1201 C GLU A 79 0.863 10.351 -17.125 1.00 0.00 C ATOM 1202 O GLU A 79 0.067 10.282 -16.208 1.00 0.00 O ATOM 1203 CB GLU A 79 2.180 9.548 -19.072 1.00 0.00 C ATOM 1204 CG GLU A 79 2.598 8.300 -19.839 1.00 0.00 C ATOM 1205 CD GLU A 79 3.725 8.649 -20.810 1.00 0.00 C ATOM 1206 OE1 GLU A 79 4.049 9.820 -20.915 1.00 0.00 O ATOM 1207 OE2 GLU A 79 4.248 7.738 -21.431 1.00 0.00 O ATOM 0 H GLU A 79 -0.393 7.785 -18.415 1.00 0.00 H new ATOM 0 HA GLU A 79 1.584 8.339 -17.417 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.747 10.281 -19.753 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.050 10.016 -18.612 1.00 0.00 H new ATOM 0 HG2 GLU A 79 2.929 7.528 -19.145 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.746 7.894 -20.385 1.00 0.00 H new ATOM 1215 N GLY A 80 1.478 11.448 -17.408 1.00 0.00 N ATOM 1216 CA GLY A 80 1.225 12.657 -16.599 1.00 0.00 C ATOM 1217 C GLY A 80 1.611 12.378 -15.151 1.00 0.00 C ATOM 1218 O GLY A 80 2.424 13.067 -14.576 1.00 0.00 O ATOM 0 H GLY A 80 2.149 11.563 -18.168 1.00 0.00 H new ATOM 0 HA2 GLY A 80 1.802 13.497 -16.987 1.00 0.00 H new ATOM 0 HA3 GLY A 80 0.173 12.937 -16.661 1.00 0.00 H new ATOM 1222 N PHE A 81 1.033 11.371 -14.550 1.00 0.00 N ATOM 1223 CA PHE A 81 1.375 11.065 -13.139 1.00 0.00 C ATOM 1224 C PHE A 81 2.212 9.786 -13.063 1.00 0.00 C ATOM 1225 O PHE A 81 1.783 8.724 -13.470 1.00 0.00 O ATOM 1226 CB PHE A 81 0.085 10.876 -12.338 1.00 0.00 C ATOM 1227 CG PHE A 81 0.420 10.796 -10.868 1.00 0.00 C ATOM 1228 CD1 PHE A 81 0.843 9.585 -10.307 1.00 0.00 C ATOM 1229 CD2 PHE A 81 0.327 11.943 -10.070 1.00 0.00 C ATOM 1230 CE1 PHE A 81 1.169 9.519 -8.947 1.00 0.00 C ATOM 1231 CE2 PHE A 81 0.656 11.879 -8.712 1.00 0.00 C ATOM 1232 CZ PHE A 81 1.077 10.668 -8.150 1.00 0.00 C ATOM 0 H PHE A 81 0.343 10.753 -14.977 1.00 0.00 H new ATOM 0 HA PHE A 81 1.953 11.891 -12.724 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -0.597 11.706 -12.523 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -0.425 9.967 -12.657 1.00 0.00 H new ATOM 0 HD1 PHE A 81 0.918 8.701 -10.924 1.00 0.00 H new ATOM 0 HD2 PHE A 81 0.001 12.877 -10.503 1.00 0.00 H new ATOM 0 HE1 PHE A 81 1.491 8.584 -8.513 1.00 0.00 H new ATOM 0 HE2 PHE A 81 0.585 12.764 -8.097 1.00 0.00 H new ATOM 0 HZ PHE A 81 1.331 10.619 -7.101 1.00 0.00 H new ATOM 1242 N LYS A 82 3.394 9.879 -12.521 1.00 0.00 N ATOM 1243 CA LYS A 82 4.261 8.676 -12.387 1.00 0.00 C ATOM 1244 C LYS A 82 5.193 8.853 -11.200 1.00 0.00 C ATOM 1245 O LYS A 82 5.956 9.795 -11.143 1.00 0.00 O ATOM 1246 CB LYS A 82 5.127 8.481 -13.630 1.00 0.00 C ATOM 1247 CG LYS A 82 6.097 7.318 -13.378 1.00 0.00 C ATOM 1248 CD LYS A 82 7.437 7.837 -12.837 1.00 0.00 C ATOM 1249 CE LYS A 82 8.456 6.695 -12.830 1.00 0.00 C ATOM 1250 NZ LYS A 82 8.830 6.360 -11.424 1.00 0.00 N ATOM 0 H LYS A 82 3.799 10.744 -12.162 1.00 0.00 H new ATOM 0 HA LYS A 82 3.612 7.811 -12.254 1.00 0.00 H new ATOM 0 HB2 LYS A 82 4.501 8.270 -14.497 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.681 9.393 -13.851 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.658 6.619 -12.666 1.00 0.00 H new ATOM 0 HG3 LYS A 82 6.262 6.768 -14.304 1.00 0.00 H new ATOM 0 HD2 LYS A 82 7.798 8.658 -13.456 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.307 8.230 -11.829 1.00 0.00 H new ATOM 0 HE2 LYS A 82 8.037 5.818 -13.323 1.00 0.00 H new ATOM 0 HE3 LYS A 82 9.343 6.984 -13.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 9.372 5.472 -11.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 9.411 7.126 -11.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 7.968 6.248 -10.853 1.00 0.00 H new ATOM 1264 N ARG A 83 5.172 7.941 -10.276 1.00 0.00 N ATOM 1265 CA ARG A 83 6.099 8.032 -9.114 1.00 0.00 C ATOM 1266 C ARG A 83 6.347 6.624 -8.588 1.00 0.00 C ATOM 1267 O ARG A 83 5.683 5.685 -8.983 1.00 0.00 O ATOM 1268 CB ARG A 83 5.503 8.903 -8.002 1.00 0.00 C ATOM 1269 CG ARG A 83 5.517 10.378 -8.422 1.00 0.00 C ATOM 1270 CD ARG A 83 6.958 10.822 -8.721 1.00 0.00 C ATOM 1271 NE ARG A 83 7.258 12.102 -8.012 1.00 0.00 N ATOM 1272 CZ ARG A 83 7.028 13.248 -8.599 1.00 0.00 C ATOM 1273 NH1 ARG A 83 6.520 13.276 -9.798 1.00 0.00 N ATOM 1274 NH2 ARG A 83 7.308 14.368 -7.987 1.00 0.00 N ATOM 0 H ARG A 83 4.551 7.132 -10.272 1.00 0.00 H new ATOM 0 HA ARG A 83 7.034 8.492 -9.434 1.00 0.00 H new ATOM 0 HB2 ARG A 83 4.482 8.587 -7.790 1.00 0.00 H new ATOM 0 HB3 ARG A 83 6.074 8.773 -7.083 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.893 10.520 -9.304 1.00 0.00 H new ATOM 0 HG3 ARG A 83 5.094 10.995 -7.629 1.00 0.00 H new ATOM 0 HD2 ARG A 83 7.658 10.049 -8.404 1.00 0.00 H new ATOM 0 HD3 ARG A 83 7.091 10.952 -9.795 1.00 0.00 H new ATOM 0 HE ARG A 83 7.643 12.082 -7.068 1.00 0.00 H new ATOM 0 HH11 ARG A 83 6.301 12.404 -10.280 1.00 0.00 H new ATOM 0 HH12 ARG A 83 6.341 14.170 -10.255 1.00 0.00 H new ATOM 0 HH21 ARG A 83 7.707 14.350 -7.049 1.00 0.00 H new ATOM 0 HH22 ARG A 83 7.127 15.260 -8.448 1.00 0.00 H new ATOM 1288 N GLU A 84 7.286 6.453 -7.707 1.00 0.00 N ATOM 1289 CA GLU A 84 7.538 5.091 -7.191 1.00 0.00 C ATOM 1290 C GLU A 84 6.615 4.826 -6.011 1.00 0.00 C ATOM 1291 O GLU A 84 6.883 5.202 -4.888 1.00 0.00 O ATOM 1292 CB GLU A 84 9.001 4.948 -6.765 1.00 0.00 C ATOM 1293 CG GLU A 84 9.900 5.140 -7.989 1.00 0.00 C ATOM 1294 CD GLU A 84 10.253 6.620 -8.164 1.00 0.00 C ATOM 1295 OE1 GLU A 84 10.914 6.935 -9.140 1.00 0.00 O ATOM 1296 OE2 GLU A 84 9.859 7.411 -7.323 1.00 0.00 O ATOM 0 H GLU A 84 7.882 7.189 -7.327 1.00 0.00 H new ATOM 0 HA GLU A 84 7.339 4.362 -7.977 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.244 5.686 -6.001 1.00 0.00 H new ATOM 0 HB3 GLU A 84 9.170 3.965 -6.325 1.00 0.00 H new ATOM 0 HG2 GLU A 84 10.811 4.553 -7.875 1.00 0.00 H new ATOM 0 HG3 GLU A 84 9.394 4.772 -8.881 1.00 0.00 H new ATOM 1304 N LEU A 85 5.534 4.155 -6.267 1.00 0.00 N ATOM 1305 CA LEU A 85 4.581 3.827 -5.186 1.00 0.00 C ATOM 1306 C LEU A 85 5.237 2.737 -4.341 1.00 0.00 C ATOM 1307 O LEU A 85 5.731 1.764 -4.865 1.00 0.00 O ATOM 1308 CB LEU A 85 3.287 3.306 -5.825 1.00 0.00 C ATOM 1309 CG LEU A 85 2.109 3.480 -4.859 1.00 0.00 C ATOM 1310 CD1 LEU A 85 1.067 4.430 -5.448 1.00 0.00 C ATOM 1311 CD2 LEU A 85 1.423 2.138 -4.610 1.00 0.00 C ATOM 0 H LEU A 85 5.269 3.817 -7.192 1.00 0.00 H new ATOM 0 HA LEU A 85 4.341 4.692 -4.567 1.00 0.00 H new ATOM 0 HB2 LEU A 85 3.089 3.844 -6.752 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.400 2.254 -6.086 1.00 0.00 H new ATOM 0 HG LEU A 85 2.505 3.885 -3.928 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.239 4.541 -4.748 1.00 0.00 H new ATOM 0 HD12 LEU A 85 1.523 5.404 -5.628 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.695 4.024 -6.389 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.589 2.278 -3.922 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.052 1.738 -5.554 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.138 1.439 -4.176 1.00 0.00 H new ATOM 1323 N ASN A 86 5.300 2.899 -3.046 1.00 0.00 N ATOM 1324 CA ASN A 86 5.981 1.865 -2.212 1.00 0.00 C ATOM 1325 C ASN A 86 5.078 1.432 -1.062 1.00 0.00 C ATOM 1326 O ASN A 86 4.613 2.236 -0.280 1.00 0.00 O ATOM 1327 CB ASN A 86 7.288 2.448 -1.674 1.00 0.00 C ATOM 1328 CG ASN A 86 8.150 2.855 -2.865 1.00 0.00 C ATOM 1329 OD1 ASN A 86 7.737 2.556 -4.065 1.00 0.00 O flip ATOM 1330 ND2 ASN A 86 9.205 3.437 -2.707 1.00 0.00 N flip ATOM 0 H ASN A 86 4.915 3.693 -2.534 1.00 0.00 H new ATOM 0 HA ASN A 86 6.196 0.987 -2.821 1.00 0.00 H new ATOM 0 HB2 ASN A 86 7.087 3.310 -1.037 1.00 0.00 H new ATOM 0 HB3 ASN A 86 7.809 1.713 -1.060 1.00 0.00 H new ATOM 0 HD21 ASN A 86 9.524 3.669 -1.766 1.00 0.00 H new ATOM 0 HD22 ASN A 86 9.772 3.694 -3.515 1.00 0.00 H new ATOM 1337 N TYR A 87 4.819 0.158 -0.965 1.00 0.00 N ATOM 1338 CA TYR A 87 3.935 -0.347 0.117 1.00 0.00 C ATOM 1339 C TYR A 87 4.315 -1.786 0.465 1.00 0.00 C ATOM 1340 O TYR A 87 5.085 -2.419 -0.228 1.00 0.00 O ATOM 1341 CB TYR A 87 2.491 -0.271 -0.369 1.00 0.00 C ATOM 1342 CG TYR A 87 2.300 -1.188 -1.552 1.00 0.00 C ATOM 1343 CD1 TYR A 87 2.782 -0.818 -2.819 1.00 0.00 C ATOM 1344 CD2 TYR A 87 1.620 -2.397 -1.390 1.00 0.00 C ATOM 1345 CE1 TYR A 87 2.577 -1.663 -3.917 1.00 0.00 C ATOM 1346 CE2 TYR A 87 1.422 -3.241 -2.486 1.00 0.00 C ATOM 1347 CZ TYR A 87 1.897 -2.874 -3.748 1.00 0.00 C ATOM 1348 OH TYR A 87 1.684 -3.703 -4.824 1.00 0.00 O ATOM 0 H TYR A 87 5.185 -0.558 -1.593 1.00 0.00 H new ATOM 0 HA TYR A 87 4.048 0.259 1.016 1.00 0.00 H new ATOM 0 HB2 TYR A 87 1.812 -0.554 0.435 1.00 0.00 H new ATOM 0 HB3 TYR A 87 2.245 0.754 -0.648 1.00 0.00 H new ATOM 0 HD1 TYR A 87 3.309 0.116 -2.946 1.00 0.00 H new ATOM 0 HD2 TYR A 87 1.247 -2.680 -0.417 1.00 0.00 H new ATOM 0 HE1 TYR A 87 2.943 -1.380 -4.893 1.00 0.00 H new ATOM 0 HE2 TYR A 87 0.901 -4.178 -2.358 1.00 0.00 H new ATOM 0 HH TYR A 87 0.731 -3.706 -5.051 1.00 0.00 H new ATOM 1358 N VAL A 88 3.800 -2.299 1.549 1.00 0.00 N ATOM 1359 CA VAL A 88 4.153 -3.689 1.960 1.00 0.00 C ATOM 1360 C VAL A 88 2.941 -4.616 1.810 1.00 0.00 C ATOM 1361 O VAL A 88 3.038 -5.804 2.055 1.00 0.00 O ATOM 1362 CB VAL A 88 4.579 -3.675 3.431 1.00 0.00 C ATOM 1363 CG1 VAL A 88 5.646 -2.603 3.653 1.00 0.00 C ATOM 1364 CG2 VAL A 88 3.358 -3.369 4.305 1.00 0.00 C ATOM 0 H VAL A 88 3.150 -1.816 2.169 1.00 0.00 H new ATOM 0 HA VAL A 88 4.962 -4.052 1.326 1.00 0.00 H new ATOM 0 HB VAL A 88 4.990 -4.648 3.698 1.00 0.00 H new ATOM 0 HG11 VAL A 88 5.945 -2.598 4.701 1.00 0.00 H new ATOM 0 HG12 VAL A 88 6.514 -2.819 3.030 1.00 0.00 H new ATOM 0 HG13 VAL A 88 5.242 -1.626 3.387 1.00 0.00 H new ATOM 0 HG21 VAL A 88 3.655 -3.358 5.354 1.00 0.00 H new ATOM 0 HG22 VAL A 88 2.950 -2.395 4.033 1.00 0.00 H new ATOM 0 HG23 VAL A 88 2.599 -4.136 4.151 1.00 0.00 H new ATOM 1374 N ALA A 89 1.802 -4.093 1.430 1.00 0.00 N ATOM 1375 CA ALA A 89 0.590 -4.958 1.297 1.00 0.00 C ATOM 1376 C ALA A 89 0.639 -6.042 2.375 1.00 0.00 C ATOM 1377 O ALA A 89 0.232 -5.832 3.501 1.00 0.00 O ATOM 1378 CB ALA A 89 0.547 -5.611 -0.092 1.00 0.00 C ATOM 0 H ALA A 89 1.659 -3.108 1.207 1.00 0.00 H new ATOM 0 HA ALA A 89 -0.305 -4.348 1.419 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -0.341 -6.237 -0.172 1.00 0.00 H new ATOM 0 HB2 ALA A 89 0.515 -4.836 -0.858 1.00 0.00 H new ATOM 0 HB3 ALA A 89 1.437 -6.224 -0.234 1.00 0.00 H new ATOM 1384 N ARG A 90 1.136 -7.196 2.036 1.00 0.00 N ATOM 1385 CA ARG A 90 1.220 -8.301 3.029 1.00 0.00 C ATOM 1386 C ARG A 90 2.385 -8.051 3.995 1.00 0.00 C ATOM 1387 O ARG A 90 2.255 -8.216 5.192 1.00 0.00 O ATOM 1388 CB ARG A 90 1.457 -9.605 2.268 1.00 0.00 C ATOM 1389 CG ARG A 90 0.344 -9.782 1.232 1.00 0.00 C ATOM 1390 CD ARG A 90 0.617 -11.022 0.382 1.00 0.00 C ATOM 1391 NE ARG A 90 1.976 -10.921 -0.222 1.00 0.00 N ATOM 1392 CZ ARG A 90 2.499 -11.953 -0.826 1.00 0.00 C ATOM 1393 NH1 ARG A 90 1.823 -13.065 -0.915 1.00 0.00 N ATOM 1394 NH2 ARG A 90 3.694 -11.870 -1.349 1.00 0.00 N ATOM 0 H ARG A 90 1.490 -7.423 1.107 1.00 0.00 H new ATOM 0 HA ARG A 90 0.297 -8.357 3.605 1.00 0.00 H new ATOM 0 HB2 ARG A 90 2.430 -9.584 1.777 1.00 0.00 H new ATOM 0 HB3 ARG A 90 1.467 -10.448 2.959 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -0.619 -9.879 1.733 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.285 -8.900 0.595 1.00 0.00 H new ATOM 0 HD2 ARG A 90 0.546 -11.920 0.996 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -0.135 -11.112 -0.402 1.00 0.00 H new ATOM 0 HE ARG A 90 2.497 -10.046 -0.163 1.00 0.00 H new ATOM 0 HH11 ARG A 90 0.888 -13.127 -0.513 1.00 0.00 H new ATOM 0 HH12 ARG A 90 2.230 -13.873 -1.387 1.00 0.00 H new ATOM 0 HH21 ARG A 90 4.219 -10.998 -1.285 1.00 0.00 H new ATOM 0 HH22 ARG A 90 4.101 -12.677 -1.821 1.00 0.00 H new ATOM 1408 N ASN A 91 3.522 -7.657 3.478 1.00 0.00 N ATOM 1409 CA ASN A 91 4.711 -7.397 4.349 1.00 0.00 C ATOM 1410 C ASN A 91 5.918 -7.055 3.473 1.00 0.00 C ATOM 1411 O ASN A 91 5.833 -7.028 2.263 1.00 0.00 O ATOM 1412 CB ASN A 91 5.045 -8.650 5.163 1.00 0.00 C ATOM 1413 CG ASN A 91 5.533 -9.760 4.221 1.00 0.00 C ATOM 1414 OD1 ASN A 91 5.677 -9.543 3.032 1.00 0.00 O ATOM 1415 ND2 ASN A 91 5.791 -10.946 4.701 1.00 0.00 N ATOM 0 H ASN A 91 3.679 -7.503 2.482 1.00 0.00 H new ATOM 0 HA ASN A 91 4.482 -6.569 5.020 1.00 0.00 H new ATOM 0 HB2 ASN A 91 5.813 -8.422 5.902 1.00 0.00 H new ATOM 0 HB3 ASN A 91 4.165 -8.985 5.711 1.00 0.00 H new ATOM 0 HD21 ASN A 91 6.113 -11.689 4.080 1.00 0.00 H new ATOM 0 HD22 ASN A 91 5.671 -11.130 5.697 1.00 0.00 H new ATOM 1422 N LYS A 92 7.049 -6.816 4.082 1.00 0.00 N ATOM 1423 CA LYS A 92 8.276 -6.498 3.296 1.00 0.00 C ATOM 1424 C LYS A 92 8.008 -5.306 2.372 1.00 0.00 C ATOM 1425 O LYS A 92 7.290 -5.425 1.399 1.00 0.00 O ATOM 1426 CB LYS A 92 8.667 -7.708 2.452 1.00 0.00 C ATOM 1427 CG LYS A 92 10.156 -7.631 2.122 1.00 0.00 C ATOM 1428 CD LYS A 92 10.481 -8.630 1.013 1.00 0.00 C ATOM 1429 CE LYS A 92 11.919 -8.416 0.543 1.00 0.00 C ATOM 1430 NZ LYS A 92 12.111 -6.987 0.179 1.00 0.00 N ATOM 0 H LYS A 92 7.176 -6.827 5.094 1.00 0.00 H new ATOM 0 HA LYS A 92 9.085 -6.249 3.983 1.00 0.00 H new ATOM 0 HB2 LYS A 92 8.449 -8.629 2.993 1.00 0.00 H new ATOM 0 HB3 LYS A 92 8.080 -7.731 1.534 1.00 0.00 H new ATOM 0 HG2 LYS A 92 10.418 -6.621 1.806 1.00 0.00 H new ATOM 0 HG3 LYS A 92 10.749 -7.851 3.010 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.354 -9.649 1.378 1.00 0.00 H new ATOM 0 HD3 LYS A 92 9.791 -8.502 0.179 1.00 0.00 H new ATOM 0 HE2 LYS A 92 12.617 -8.699 1.331 1.00 0.00 H new ATOM 0 HE3 LYS A 92 12.132 -9.053 -0.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 12.864 -6.909 -0.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 11.225 -6.606 -0.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 12.378 -6.446 1.026 1.00 0.00 H new ATOM 1444 N PRO A 93 8.587 -4.165 2.667 1.00 0.00 N ATOM 1445 CA PRO A 93 8.409 -2.937 1.845 1.00 0.00 C ATOM 1446 C PRO A 93 9.260 -2.976 0.574 1.00 0.00 C ATOM 1447 O PRO A 93 10.430 -3.299 0.606 1.00 0.00 O ATOM 1448 CB PRO A 93 8.869 -1.808 2.769 1.00 0.00 C ATOM 1449 CG PRO A 93 9.823 -2.433 3.732 1.00 0.00 C ATOM 1450 CD PRO A 93 9.480 -3.923 3.816 1.00 0.00 C ATOM 0 HA PRO A 93 7.381 -2.819 1.502 1.00 0.00 H new ATOM 0 HB2 PRO A 93 9.351 -1.011 2.203 1.00 0.00 H new ATOM 0 HB3 PRO A 93 8.023 -1.361 3.291 1.00 0.00 H new ATOM 0 HG2 PRO A 93 10.851 -2.294 3.398 1.00 0.00 H new ATOM 0 HG3 PRO A 93 9.740 -1.964 4.713 1.00 0.00 H new ATOM 0 HD2 PRO A 93 10.377 -4.540 3.758 1.00 0.00 H new ATOM 0 HD3 PRO A 93 8.988 -4.164 4.758 1.00 0.00 H new ATOM 1458 N LYS A 94 8.677 -2.649 -0.544 1.00 0.00 N ATOM 1459 CA LYS A 94 9.440 -2.662 -1.824 1.00 0.00 C ATOM 1460 C LYS A 94 9.034 -1.444 -2.658 1.00 0.00 C ATOM 1461 O LYS A 94 8.104 -0.738 -2.314 1.00 0.00 O ATOM 1462 CB LYS A 94 9.118 -3.950 -2.590 1.00 0.00 C ATOM 1463 CG LYS A 94 7.647 -3.936 -3.024 1.00 0.00 C ATOM 1464 CD LYS A 94 7.282 -5.276 -3.675 1.00 0.00 C ATOM 1465 CE LYS A 94 5.926 -5.151 -4.374 1.00 0.00 C ATOM 1466 NZ LYS A 94 4.854 -5.068 -3.344 1.00 0.00 N ATOM 0 H LYS A 94 7.699 -2.372 -0.628 1.00 0.00 H new ATOM 0 HA LYS A 94 10.511 -2.623 -1.623 1.00 0.00 H new ATOM 0 HB2 LYS A 94 9.765 -4.037 -3.463 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.314 -4.818 -1.961 1.00 0.00 H new ATOM 0 HG2 LYS A 94 7.006 -3.754 -2.161 1.00 0.00 H new ATOM 0 HG3 LYS A 94 7.474 -3.121 -3.727 1.00 0.00 H new ATOM 0 HD2 LYS A 94 8.049 -5.564 -4.394 1.00 0.00 H new ATOM 0 HD3 LYS A 94 7.243 -6.061 -2.920 1.00 0.00 H new ATOM 0 HE2 LYS A 94 5.909 -4.264 -5.007 1.00 0.00 H new ATOM 0 HE3 LYS A 94 5.757 -6.009 -5.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 4.039 -5.640 -3.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 5.215 -5.429 -2.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 4.559 -4.077 -3.229 1.00 0.00 H new ATOM 1480 N THR A 95 9.703 -1.181 -3.753 1.00 0.00 N ATOM 1481 CA THR A 95 9.307 0.001 -4.574 1.00 0.00 C ATOM 1482 C THR A 95 8.345 -0.431 -5.671 1.00 0.00 C ATOM 1483 O THR A 95 8.522 -1.439 -6.326 1.00 0.00 O ATOM 1484 CB THR A 95 10.524 0.681 -5.209 1.00 0.00 C ATOM 1485 OG1 THR A 95 11.079 1.605 -4.281 1.00 0.00 O ATOM 1486 CG2 THR A 95 10.085 1.426 -6.478 1.00 0.00 C ATOM 0 H THR A 95 10.491 -1.723 -4.108 1.00 0.00 H new ATOM 0 HA THR A 95 8.822 0.717 -3.910 1.00 0.00 H new ATOM 0 HB THR A 95 11.272 -0.068 -5.470 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.859 2.042 -4.682 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.949 1.911 -6.932 1.00 0.00 H new ATOM 0 HG22 THR A 95 9.653 0.717 -7.185 1.00 0.00 H new ATOM 0 HG23 THR A 95 9.341 2.179 -6.219 1.00 0.00 H new ATOM 1494 N VAL A 96 7.320 0.344 -5.867 1.00 0.00 N ATOM 1495 CA VAL A 96 6.314 0.027 -6.909 1.00 0.00 C ATOM 1496 C VAL A 96 5.986 1.301 -7.681 1.00 0.00 C ATOM 1497 O VAL A 96 5.727 2.327 -7.100 1.00 0.00 O ATOM 1498 CB VAL A 96 5.052 -0.502 -6.233 1.00 0.00 C ATOM 1499 CG1 VAL A 96 3.900 -0.530 -7.235 1.00 0.00 C ATOM 1500 CG2 VAL A 96 5.311 -1.916 -5.717 1.00 0.00 C ATOM 0 H VAL A 96 7.135 1.197 -5.340 1.00 0.00 H new ATOM 0 HA VAL A 96 6.703 -0.726 -7.594 1.00 0.00 H new ATOM 0 HB VAL A 96 4.788 0.151 -5.401 1.00 0.00 H new ATOM 0 HG11 VAL A 96 3.002 -0.909 -6.747 1.00 0.00 H new ATOM 0 HG12 VAL A 96 3.714 0.479 -7.604 1.00 0.00 H new ATOM 0 HG13 VAL A 96 4.160 -1.180 -8.070 1.00 0.00 H new ATOM 0 HG21 VAL A 96 4.412 -2.297 -5.233 1.00 0.00 H new ATOM 0 HG22 VAL A 96 5.577 -2.565 -6.551 1.00 0.00 H new ATOM 0 HG23 VAL A 96 6.129 -1.896 -4.997 1.00 0.00 H new ATOM 1510 N ILE A 97 5.982 1.254 -8.980 1.00 0.00 N ATOM 1511 CA ILE A 97 5.658 2.483 -9.752 1.00 0.00 C ATOM 1512 C ILE A 97 4.258 2.345 -10.337 1.00 0.00 C ATOM 1513 O ILE A 97 3.869 1.296 -10.801 1.00 0.00 O ATOM 1514 CB ILE A 97 6.671 2.672 -10.869 1.00 0.00 C ATOM 1515 CG1 ILE A 97 8.030 2.174 -10.384 1.00 0.00 C ATOM 1516 CG2 ILE A 97 6.769 4.160 -11.222 1.00 0.00 C ATOM 1517 CD1 ILE A 97 9.130 2.764 -11.260 1.00 0.00 C ATOM 0 H ILE A 97 6.187 0.425 -9.538 1.00 0.00 H new ATOM 0 HA ILE A 97 5.696 3.352 -9.095 1.00 0.00 H new ATOM 0 HB ILE A 97 6.362 2.113 -11.752 1.00 0.00 H new ATOM 0 HG12 ILE A 97 8.185 2.462 -9.344 1.00 0.00 H new ATOM 0 HG13 ILE A 97 8.065 1.085 -10.422 1.00 0.00 H new ATOM 0 HG21 ILE A 97 7.495 4.297 -12.023 1.00 0.00 H new ATOM 0 HG22 ILE A 97 5.794 4.521 -11.550 1.00 0.00 H new ATOM 0 HG23 ILE A 97 7.087 4.722 -10.344 1.00 0.00 H new ATOM 0 HD11 ILE A 97 10.101 2.409 -10.914 1.00 0.00 H new ATOM 0 HD12 ILE A 97 8.977 2.454 -12.294 1.00 0.00 H new ATOM 0 HD13 ILE A 97 9.099 3.852 -11.199 1.00 0.00 H new ATOM 1529 N TYR A 98 3.492 3.396 -10.286 1.00 0.00 N ATOM 1530 CA TYR A 98 2.093 3.333 -10.800 1.00 0.00 C ATOM 1531 C TYR A 98 1.908 4.325 -11.962 1.00 0.00 C ATOM 1532 O TYR A 98 2.130 5.510 -11.821 1.00 0.00 O ATOM 1533 CB TYR A 98 1.164 3.710 -9.637 1.00 0.00 C ATOM 1534 CG TYR A 98 0.803 2.502 -8.789 1.00 0.00 C ATOM 1535 CD1 TYR A 98 1.420 1.252 -8.975 1.00 0.00 C ATOM 1536 CD2 TYR A 98 -0.161 2.651 -7.788 1.00 0.00 C ATOM 1537 CE1 TYR A 98 1.068 0.170 -8.161 1.00 0.00 C ATOM 1538 CE2 TYR A 98 -0.509 1.572 -6.980 1.00 0.00 C ATOM 1539 CZ TYR A 98 0.104 0.331 -7.163 1.00 0.00 C ATOM 1540 OH TYR A 98 -0.245 -0.733 -6.359 1.00 0.00 O ATOM 0 H TYR A 98 3.774 4.301 -9.909 1.00 0.00 H new ATOM 0 HA TYR A 98 1.865 2.334 -11.172 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.649 4.460 -9.013 1.00 0.00 H new ATOM 0 HB3 TYR A 98 0.254 4.163 -10.031 1.00 0.00 H new ATOM 0 HD1 TYR A 98 2.166 1.127 -9.746 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.639 3.608 -7.641 1.00 0.00 H new ATOM 0 HE1 TYR A 98 1.542 -0.790 -8.304 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -1.255 1.695 -6.209 1.00 0.00 H new ATOM 0 HH TYR A 98 -1.045 -0.503 -5.841 1.00 0.00 H new ATOM 1550 N TRP A 99 1.489 3.842 -13.109 1.00 0.00 N ATOM 1551 CA TRP A 99 1.273 4.751 -14.280 1.00 0.00 C ATOM 1552 C TRP A 99 -0.216 4.838 -14.591 1.00 0.00 C ATOM 1553 O TRP A 99 -0.969 3.925 -14.320 1.00 0.00 O ATOM 1554 CB TRP A 99 1.975 4.213 -15.530 1.00 0.00 C ATOM 1555 CG TRP A 99 3.371 4.718 -15.610 1.00 0.00 C ATOM 1556 CD1 TRP A 99 3.739 5.925 -16.100 1.00 0.00 C ATOM 1557 CD2 TRP A 99 4.597 4.040 -15.224 1.00 0.00 C ATOM 1558 NE1 TRP A 99 5.112 6.034 -16.025 1.00 0.00 N ATOM 1559 CE2 TRP A 99 5.686 4.897 -15.492 1.00 0.00 C ATOM 1560 CE3 TRP A 99 4.866 2.778 -14.666 1.00 0.00 C ATOM 1561 CZ2 TRP A 99 6.999 4.515 -15.219 1.00 0.00 C ATOM 1562 CZ3 TRP A 99 6.187 2.391 -14.391 1.00 0.00 C ATOM 1563 CH2 TRP A 99 7.252 3.258 -14.668 1.00 0.00 C ATOM 0 H TRP A 99 1.287 2.858 -13.284 1.00 0.00 H new ATOM 0 HA TRP A 99 1.679 5.729 -14.021 1.00 0.00 H new ATOM 0 HB2 TRP A 99 1.978 3.123 -15.510 1.00 0.00 H new ATOM 0 HB3 TRP A 99 1.423 4.514 -16.420 1.00 0.00 H new ATOM 0 HD1 TRP A 99 3.068 6.678 -16.486 1.00 0.00 H new ATOM 0 HE1 TRP A 99 5.639 6.854 -16.326 1.00 0.00 H new ATOM 0 HE3 TRP A 99 4.052 2.103 -14.448 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.816 5.188 -15.433 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 6.384 1.419 -13.963 1.00 0.00 H new ATOM 0 HH2 TRP A 99 8.266 2.954 -14.456 1.00 0.00 H new ATOM 1574 N LEU A 100 -0.637 5.917 -15.189 1.00 0.00 N ATOM 1575 CA LEU A 100 -2.072 6.055 -15.550 1.00 0.00 C ATOM 1576 C LEU A 100 -2.329 5.336 -16.877 1.00 0.00 C ATOM 1577 O LEU A 100 -1.555 5.435 -17.811 1.00 0.00 O ATOM 1578 CB LEU A 100 -2.429 7.542 -15.675 1.00 0.00 C ATOM 1579 CG LEU A 100 -2.441 8.186 -14.289 1.00 0.00 C ATOM 1580 CD1 LEU A 100 -2.707 9.690 -14.414 1.00 0.00 C ATOM 1581 CD2 LEU A 100 -3.551 7.545 -13.457 1.00 0.00 C ATOM 0 H LEU A 100 -0.047 6.709 -15.443 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.693 5.608 -14.774 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.706 8.047 -16.315 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -3.405 7.653 -16.147 1.00 0.00 H new ATOM 0 HG LEU A 100 -1.475 8.034 -13.808 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.714 10.142 -13.422 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -1.923 10.149 -15.016 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -3.673 9.850 -14.893 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.569 7.997 -12.465 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.512 7.705 -13.947 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -3.365 6.475 -13.365 1.00 0.00 H new ATOM 1593 N ALA A 101 -3.406 4.600 -16.960 1.00 0.00 N ATOM 1594 CA ALA A 101 -3.720 3.853 -18.215 1.00 0.00 C ATOM 1595 C ALA A 101 -5.236 3.827 -18.435 1.00 0.00 C ATOM 1596 O ALA A 101 -6.003 3.683 -17.503 1.00 0.00 O ATOM 1597 CB ALA A 101 -3.216 2.413 -18.082 1.00 0.00 C ATOM 0 H ALA A 101 -4.086 4.483 -16.208 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.235 4.345 -19.058 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -3.442 1.862 -18.995 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -2.138 2.418 -17.919 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -3.708 1.932 -17.237 1.00 0.00 H new ATOM 1603 N GLU A 102 -5.677 3.958 -19.661 1.00 0.00 N ATOM 1604 CA GLU A 102 -7.146 3.939 -19.933 1.00 0.00 C ATOM 1605 C GLU A 102 -7.483 2.863 -20.966 1.00 0.00 C ATOM 1606 O GLU A 102 -6.792 2.696 -21.947 1.00 0.00 O ATOM 1607 CB GLU A 102 -7.583 5.300 -20.477 1.00 0.00 C ATOM 1608 CG GLU A 102 -9.093 5.286 -20.726 1.00 0.00 C ATOM 1609 CD GLU A 102 -9.522 6.606 -21.372 1.00 0.00 C ATOM 1610 OE1 GLU A 102 -8.680 7.478 -21.515 1.00 0.00 O ATOM 1611 OE2 GLU A 102 -10.687 6.719 -21.717 1.00 0.00 O ATOM 0 H GLU A 102 -5.085 4.077 -20.483 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.669 3.721 -19.002 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -7.327 6.087 -19.767 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -7.052 5.521 -21.403 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -9.357 4.450 -21.374 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -9.625 5.140 -19.786 1.00 0.00 H new ATOM 1619 N VAL A 103 -8.558 2.147 -20.768 1.00 0.00 N ATOM 1620 CA VAL A 103 -8.939 1.107 -21.760 1.00 0.00 C ATOM 1621 C VAL A 103 -9.939 1.698 -22.749 1.00 0.00 C ATOM 1622 O VAL A 103 -11.018 2.119 -22.385 1.00 0.00 O ATOM 1623 CB VAL A 103 -9.598 -0.086 -21.055 1.00 0.00 C ATOM 1624 CG1 VAL A 103 -8.611 -0.782 -20.126 1.00 0.00 C ATOM 1625 CG2 VAL A 103 -10.767 0.409 -20.222 1.00 0.00 C ATOM 0 H VAL A 103 -9.183 2.238 -19.967 1.00 0.00 H new ATOM 0 HA VAL A 103 -8.041 0.772 -22.278 1.00 0.00 H new ATOM 0 HB VAL A 103 -9.933 -0.791 -21.816 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -9.102 -1.624 -19.638 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -7.760 -1.143 -20.704 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -8.264 -0.077 -19.370 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -11.239 -0.435 -19.719 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -10.408 1.120 -19.478 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -11.494 0.898 -20.870 1.00 0.00 H new ATOM 1635 N LYS A 104 -9.596 1.714 -24.002 1.00 0.00 N ATOM 1636 CA LYS A 104 -10.534 2.252 -25.018 1.00 0.00 C ATOM 1637 C LYS A 104 -11.716 1.290 -25.135 1.00 0.00 C ATOM 1638 O LYS A 104 -12.700 1.564 -25.793 1.00 0.00 O ATOM 1639 CB LYS A 104 -9.800 2.377 -26.353 1.00 0.00 C ATOM 1640 CG LYS A 104 -9.128 1.046 -26.702 1.00 0.00 C ATOM 1641 CD LYS A 104 -7.937 1.312 -27.628 1.00 0.00 C ATOM 1642 CE LYS A 104 -6.864 2.126 -26.891 1.00 0.00 C ATOM 1643 NZ LYS A 104 -7.121 2.096 -25.422 1.00 0.00 N ATOM 0 H LYS A 104 -8.705 1.377 -24.367 1.00 0.00 H new ATOM 0 HA LYS A 104 -10.901 3.237 -24.731 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -10.501 2.658 -27.139 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -9.052 3.168 -26.295 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -8.793 0.545 -25.794 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -9.841 0.381 -27.189 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -7.515 0.367 -27.971 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -8.270 1.853 -28.514 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -5.876 1.718 -27.104 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -6.868 3.156 -27.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -6.274 2.422 -24.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -7.921 2.721 -25.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -7.347 1.124 -25.129 1.00 0.00 H new ATOM 1657 N ASP A 105 -11.626 0.168 -24.472 1.00 0.00 N ATOM 1658 CA ASP A 105 -12.739 -0.821 -24.503 1.00 0.00 C ATOM 1659 C ASP A 105 -13.440 -0.823 -23.141 1.00 0.00 C ATOM 1660 O ASP A 105 -12.965 -1.406 -22.189 1.00 0.00 O ATOM 1661 CB ASP A 105 -12.188 -2.218 -24.784 1.00 0.00 C ATOM 1662 CG ASP A 105 -11.925 -2.384 -26.281 1.00 0.00 C ATOM 1663 OD1 ASP A 105 -12.234 -1.467 -27.022 1.00 0.00 O ATOM 1664 OD2 ASP A 105 -11.418 -3.428 -26.660 1.00 0.00 O ATOM 0 H ASP A 105 -10.823 -0.106 -23.907 1.00 0.00 H new ATOM 0 HA ASP A 105 -13.443 -0.549 -25.289 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -11.265 -2.373 -24.225 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -12.897 -2.973 -24.445 1.00 0.00 H new ATOM 1670 N TYR A 106 -14.564 -0.178 -23.044 1.00 0.00 N ATOM 1671 CA TYR A 106 -15.296 -0.142 -21.747 1.00 0.00 C ATOM 1672 C TYR A 106 -15.611 -1.575 -21.305 1.00 0.00 C ATOM 1673 O TYR A 106 -15.737 -1.861 -20.133 1.00 0.00 O ATOM 1674 CB TYR A 106 -16.598 0.637 -21.926 1.00 0.00 C ATOM 1675 CG TYR A 106 -17.217 0.914 -20.574 1.00 0.00 C ATOM 1676 CD1 TYR A 106 -17.997 -0.066 -19.955 1.00 0.00 C ATOM 1677 CD2 TYR A 106 -17.025 2.154 -19.946 1.00 0.00 C ATOM 1678 CE1 TYR A 106 -18.586 0.185 -18.710 1.00 0.00 C ATOM 1679 CE2 TYR A 106 -17.614 2.406 -18.698 1.00 0.00 C ATOM 1680 CZ TYR A 106 -18.393 1.421 -18.080 1.00 0.00 C ATOM 1681 OH TYR A 106 -18.976 1.668 -16.854 1.00 0.00 O ATOM 0 H TYR A 106 -15.011 0.328 -23.808 1.00 0.00 H new ATOM 0 HA TYR A 106 -14.682 0.345 -20.989 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -16.403 1.575 -22.446 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -17.292 0.067 -22.544 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -18.146 -1.020 -20.438 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -16.424 2.914 -20.423 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -19.189 -0.575 -18.235 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -17.466 3.360 -18.214 1.00 0.00 H new ATOM 0 HH TYR A 106 -18.741 2.572 -16.556 1.00 0.00 H new ATOM 1691 N ASP A 107 -15.745 -2.471 -22.243 1.00 0.00 N ATOM 1692 CA ASP A 107 -16.057 -3.887 -21.896 1.00 0.00 C ATOM 1693 C ASP A 107 -14.803 -4.745 -22.062 1.00 0.00 C ATOM 1694 O ASP A 107 -14.880 -5.948 -22.218 1.00 0.00 O ATOM 1695 CB ASP A 107 -17.146 -4.413 -22.831 1.00 0.00 C ATOM 1696 CG ASP A 107 -18.458 -3.683 -22.547 1.00 0.00 C ATOM 1697 OD1 ASP A 107 -18.509 -2.957 -21.567 1.00 0.00 O ATOM 1698 OD2 ASP A 107 -19.392 -3.862 -23.311 1.00 0.00 O ATOM 0 H ASP A 107 -15.651 -2.283 -23.241 1.00 0.00 H new ATOM 0 HA ASP A 107 -16.401 -3.935 -20.863 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -16.852 -4.263 -23.870 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -17.276 -5.486 -22.688 1.00 0.00 H new ATOM 1704 N VAL A 108 -13.649 -4.140 -22.050 1.00 0.00 N ATOM 1705 CA VAL A 108 -12.403 -4.932 -22.233 1.00 0.00 C ATOM 1706 C VAL A 108 -12.502 -6.234 -21.450 1.00 0.00 C ATOM 1707 O VAL A 108 -13.186 -6.328 -20.448 1.00 0.00 O ATOM 1708 CB VAL A 108 -11.191 -4.131 -21.752 1.00 0.00 C ATOM 1709 CG1 VAL A 108 -11.372 -3.724 -20.288 1.00 0.00 C ATOM 1710 CG2 VAL A 108 -9.935 -4.996 -21.894 1.00 0.00 C ATOM 0 H VAL A 108 -13.515 -3.137 -21.922 1.00 0.00 H new ATOM 0 HA VAL A 108 -12.280 -5.155 -23.293 1.00 0.00 H new ATOM 0 HB VAL A 108 -11.092 -3.229 -22.355 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -10.503 -3.155 -19.958 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -12.267 -3.110 -20.189 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -11.475 -4.617 -19.672 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -9.066 -4.434 -21.554 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -10.044 -5.897 -21.290 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -9.801 -5.274 -22.939 1.00 0.00 H new ATOM 1720 N GLU A 109 -11.824 -7.244 -21.908 1.00 0.00 N ATOM 1721 CA GLU A 109 -11.874 -8.542 -21.208 1.00 0.00 C ATOM 1722 C GLU A 109 -10.708 -8.624 -20.237 1.00 0.00 C ATOM 1723 O GLU A 109 -9.569 -8.820 -20.620 1.00 0.00 O ATOM 1724 CB GLU A 109 -11.780 -9.682 -22.215 1.00 0.00 C ATOM 1725 CG GLU A 109 -12.001 -11.006 -21.485 1.00 0.00 C ATOM 1726 CD GLU A 109 -13.468 -11.111 -21.053 1.00 0.00 C ATOM 1727 OE1 GLU A 109 -14.295 -10.455 -21.666 1.00 0.00 O ATOM 1728 OE2 GLU A 109 -13.740 -11.845 -20.116 1.00 0.00 O ATOM 0 H GLU A 109 -11.236 -7.222 -22.741 1.00 0.00 H new ATOM 0 HA GLU A 109 -12.816 -8.627 -20.666 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -12.526 -9.555 -22.999 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -10.804 -9.677 -22.700 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -11.742 -11.841 -22.136 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -11.349 -11.067 -20.614 1.00 0.00 H new ATOM 1736 N ILE A 110 -10.996 -8.478 -18.984 1.00 0.00 N ATOM 1737 CA ILE A 110 -9.927 -8.544 -17.957 1.00 0.00 C ATOM 1738 C ILE A 110 -9.526 -9.997 -17.761 1.00 0.00 C ATOM 1739 O ILE A 110 -10.055 -10.683 -16.911 1.00 0.00 O ATOM 1740 CB ILE A 110 -10.460 -8.004 -16.635 1.00 0.00 C ATOM 1741 CG1 ILE A 110 -11.195 -6.692 -16.884 1.00 0.00 C ATOM 1742 CG2 ILE A 110 -9.288 -7.754 -15.688 1.00 0.00 C ATOM 1743 CD1 ILE A 110 -10.347 -5.829 -17.782 1.00 0.00 C ATOM 0 H ILE A 110 -11.935 -8.314 -18.620 1.00 0.00 H new ATOM 0 HA ILE A 110 -9.071 -7.952 -18.280 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.145 -8.727 -16.192 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -12.163 -6.883 -17.347 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.388 -6.181 -15.941 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -9.662 -7.367 -14.740 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -8.755 -8.689 -15.514 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -8.609 -7.027 -16.133 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -10.860 -4.886 -17.970 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -9.390 -5.632 -17.299 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -10.177 -6.344 -18.727 1.00 0.00 H new ATOM 1755 N ARG A 111 -8.596 -10.480 -18.530 1.00 0.00 N ATOM 1756 CA ARG A 111 -8.190 -11.898 -18.352 1.00 0.00 C ATOM 1757 C ARG A 111 -7.193 -11.998 -17.211 1.00 0.00 C ATOM 1758 O ARG A 111 -6.137 -11.405 -17.231 1.00 0.00 O ATOM 1759 CB ARG A 111 -7.580 -12.444 -19.639 1.00 0.00 C ATOM 1760 CG ARG A 111 -8.698 -13.080 -20.452 1.00 0.00 C ATOM 1761 CD ARG A 111 -8.257 -13.249 -21.904 1.00 0.00 C ATOM 1762 NE ARG A 111 -9.368 -13.851 -22.685 1.00 0.00 N ATOM 1763 CZ ARG A 111 -9.182 -14.180 -23.931 1.00 0.00 C ATOM 1764 NH1 ARG A 111 -8.011 -14.009 -24.482 1.00 0.00 N ATOM 1765 NH2 ARG A 111 -10.165 -14.677 -24.629 1.00 0.00 N ATOM 0 H ARG A 111 -8.106 -9.966 -19.262 1.00 0.00 H new ATOM 0 HA ARG A 111 -9.071 -12.495 -18.113 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -7.104 -11.644 -20.205 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -6.807 -13.178 -19.413 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -8.961 -14.049 -20.028 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -9.592 -12.458 -20.405 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -7.980 -12.283 -22.327 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -7.373 -13.885 -21.957 1.00 0.00 H new ATOM 0 HE ARG A 111 -10.275 -14.006 -22.246 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -7.243 -13.618 -23.937 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -7.864 -14.266 -25.458 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -11.081 -14.808 -24.199 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -10.018 -14.934 -25.605 1.00 0.00 H new ATOM 1779 N LEU A 112 -7.536 -12.738 -16.200 1.00 0.00 N ATOM 1780 CA LEU A 112 -6.618 -12.859 -15.042 1.00 0.00 C ATOM 1781 C LEU A 112 -5.819 -14.164 -15.135 1.00 0.00 C ATOM 1782 O LEU A 112 -6.316 -15.229 -14.825 1.00 0.00 O ATOM 1783 CB LEU A 112 -7.432 -12.869 -13.748 1.00 0.00 C ATOM 1784 CG LEU A 112 -8.656 -11.954 -13.882 1.00 0.00 C ATOM 1785 CD1 LEU A 112 -9.441 -11.963 -12.565 1.00 0.00 C ATOM 1786 CD2 LEU A 112 -8.211 -10.523 -14.193 1.00 0.00 C ATOM 0 H LEU A 112 -8.408 -13.262 -16.125 1.00 0.00 H new ATOM 0 HA LEU A 112 -5.931 -12.013 -15.047 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.753 -13.886 -13.520 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.810 -12.537 -12.917 1.00 0.00 H new ATOM 0 HG LEU A 112 -9.286 -12.317 -14.694 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.312 -11.314 -12.656 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.767 -12.979 -12.343 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.803 -11.603 -11.758 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -9.087 -9.882 -14.286 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -7.577 -10.156 -13.386 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.652 -10.511 -15.128 1.00 0.00 H new ATOM 1798 N SER A 113 -4.581 -14.086 -15.539 1.00 0.00 N ATOM 1799 CA SER A 113 -3.744 -15.319 -15.630 1.00 0.00 C ATOM 1800 C SER A 113 -3.370 -15.784 -14.222 1.00 0.00 C ATOM 1801 O SER A 113 -3.714 -15.162 -13.237 1.00 0.00 O ATOM 1802 CB SER A 113 -2.465 -15.014 -16.409 1.00 0.00 C ATOM 1803 OG SER A 113 -2.802 -14.614 -17.730 1.00 0.00 O ATOM 0 H SER A 113 -4.111 -13.222 -15.810 1.00 0.00 H new ATOM 0 HA SER A 113 -4.308 -16.100 -16.141 1.00 0.00 H new ATOM 0 HB2 SER A 113 -1.902 -14.225 -15.911 1.00 0.00 H new ATOM 0 HB3 SER A 113 -1.824 -15.895 -16.436 1.00 0.00 H new ATOM 0 HG SER A 113 -1.983 -14.416 -18.231 1.00 0.00 H new ATOM 1809 N HIS A 114 -2.665 -16.876 -14.115 1.00 0.00 N ATOM 1810 CA HIS A 114 -2.270 -17.377 -12.769 1.00 0.00 C ATOM 1811 C HIS A 114 -1.809 -16.206 -11.893 1.00 0.00 C ATOM 1812 O HIS A 114 -0.671 -15.779 -11.953 1.00 0.00 O ATOM 1813 CB HIS A 114 -1.129 -18.383 -12.915 1.00 0.00 C ATOM 1814 CG HIS A 114 -0.116 -18.144 -11.829 1.00 0.00 C ATOM 1815 ND1 HIS A 114 1.106 -17.514 -11.835 1.00 0.00 N flip ATOM 1816 CD2 HIS A 114 -0.317 -18.569 -10.524 1.00 0.00 C flip ATOM 1817 CE1 HIS A 114 1.653 -17.552 -10.559 1.00 0.00 C flip ATOM 1818 NE2 HIS A 114 0.759 -18.195 -9.804 1.00 0.00 N flip ATOM 0 H HIS A 114 -2.346 -17.443 -14.901 1.00 0.00 H new ATOM 0 HA HIS A 114 -3.127 -17.861 -12.300 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -1.515 -19.400 -12.851 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -0.661 -18.281 -13.894 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -1.179 -19.103 -10.152 1.00 0.00 H new ATOM 0 HE1 HIS A 114 2.603 -17.146 -10.243 1.00 0.00 H new ATOM 0 HE2 HIS A 114 0.876 -18.380 -8.808 1.00 0.00 H new ATOM 1827 N GLU A 115 -2.682 -15.687 -11.075 1.00 0.00 N ATOM 1828 CA GLU A 115 -2.300 -14.552 -10.187 1.00 0.00 C ATOM 1829 C GLU A 115 -3.552 -13.971 -9.545 1.00 0.00 C ATOM 1830 O GLU A 115 -3.702 -13.967 -8.340 1.00 0.00 O ATOM 1831 CB GLU A 115 -1.596 -13.459 -10.996 1.00 0.00 C ATOM 1832 CG GLU A 115 -0.163 -13.315 -10.493 1.00 0.00 C ATOM 1833 CD GLU A 115 0.590 -12.327 -11.381 1.00 0.00 C ATOM 1834 OE1 GLU A 115 1.688 -11.951 -11.013 1.00 0.00 O ATOM 1835 OE2 GLU A 115 0.058 -11.972 -12.420 1.00 0.00 O ATOM 0 H GLU A 115 -3.648 -16.001 -10.983 1.00 0.00 H new ATOM 0 HA GLU A 115 -1.621 -14.918 -9.417 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -1.599 -13.714 -12.056 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -2.128 -12.513 -10.894 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -0.162 -12.966 -9.460 1.00 0.00 H new ATOM 0 HG3 GLU A 115 0.337 -14.284 -10.503 1.00 0.00 H new ATOM 1843 N HIS A 116 -4.445 -13.472 -10.346 1.00 0.00 N ATOM 1844 CA HIS A 116 -5.686 -12.875 -9.796 1.00 0.00 C ATOM 1845 C HIS A 116 -6.913 -13.620 -10.318 1.00 0.00 C ATOM 1846 O HIS A 116 -6.949 -14.072 -11.442 1.00 0.00 O ATOM 1847 CB HIS A 116 -5.773 -11.417 -10.236 1.00 0.00 C ATOM 1848 CG HIS A 116 -4.655 -10.634 -9.610 1.00 0.00 C ATOM 1849 ND1 HIS A 116 -3.356 -10.679 -10.093 1.00 0.00 N ATOM 1850 CD2 HIS A 116 -4.625 -9.782 -8.534 1.00 0.00 C ATOM 1851 CE1 HIS A 116 -2.605 -9.879 -9.316 1.00 0.00 C ATOM 1852 NE2 HIS A 116 -3.331 -9.311 -8.353 1.00 0.00 N ATOM 0 H HIS A 116 -4.368 -13.452 -11.363 1.00 0.00 H new ATOM 0 HA HIS A 116 -5.661 -12.946 -8.709 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -5.713 -11.350 -11.322 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -6.734 -10.995 -9.943 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -5.476 -9.519 -7.923 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -1.546 -9.717 -9.455 1.00 0.00 H new ATOM 0 HE2 HIS A 116 -3.005 -8.666 -7.634 1.00 0.00 H new ATOM 1861 N GLN A 117 -7.926 -13.732 -9.507 1.00 0.00 N ATOM 1862 CA GLN A 117 -9.167 -14.421 -9.947 1.00 0.00 C ATOM 1863 C GLN A 117 -10.343 -13.467 -9.749 1.00 0.00 C ATOM 1864 O GLN A 117 -11.493 -13.856 -9.819 1.00 0.00 O ATOM 1865 CB GLN A 117 -9.386 -15.684 -9.111 1.00 0.00 C ATOM 1866 CG GLN A 117 -8.230 -16.662 -9.335 1.00 0.00 C ATOM 1867 CD GLN A 117 -8.441 -17.907 -8.471 1.00 0.00 C ATOM 1868 OE1 GLN A 117 -9.277 -17.913 -7.589 1.00 0.00 O ATOM 1869 NE2 GLN A 117 -7.715 -18.968 -8.691 1.00 0.00 N ATOM 0 H GLN A 117 -7.947 -13.373 -8.552 1.00 0.00 H new ATOM 0 HA GLN A 117 -9.083 -14.705 -10.996 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -9.455 -15.424 -8.055 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -10.330 -16.154 -9.386 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -8.175 -16.941 -10.387 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -7.283 -16.186 -9.081 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -7.014 -18.962 -9.432 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -7.849 -19.804 -8.122 1.00 0.00 H new ATOM 1878 N ALA A 118 -10.066 -12.216 -9.486 1.00 0.00 N ATOM 1879 CA ALA A 118 -11.173 -11.241 -9.267 1.00 0.00 C ATOM 1880 C ALA A 118 -10.805 -9.881 -9.863 1.00 0.00 C ATOM 1881 O ALA A 118 -9.701 -9.407 -9.702 1.00 0.00 O ATOM 1882 CB ALA A 118 -11.389 -11.066 -7.764 1.00 0.00 C ATOM 0 H ALA A 118 -9.125 -11.830 -9.414 1.00 0.00 H new ATOM 0 HA ALA A 118 -12.077 -11.617 -9.747 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -12.197 -10.355 -7.593 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.651 -12.026 -7.320 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -10.473 -10.692 -7.306 1.00 0.00 H new ATOM 1888 N TYR A 119 -11.731 -9.234 -10.520 1.00 0.00 N ATOM 1889 CA TYR A 119 -11.439 -7.884 -11.085 1.00 0.00 C ATOM 1890 C TYR A 119 -12.752 -7.105 -11.194 1.00 0.00 C ATOM 1891 O TYR A 119 -13.761 -7.634 -11.617 1.00 0.00 O ATOM 1892 CB TYR A 119 -10.772 -8.017 -12.458 1.00 0.00 C ATOM 1893 CG TYR A 119 -11.784 -8.441 -13.480 1.00 0.00 C ATOM 1894 CD1 TYR A 119 -12.201 -9.768 -13.519 1.00 0.00 C ATOM 1895 CD2 TYR A 119 -12.296 -7.513 -14.389 1.00 0.00 C ATOM 1896 CE1 TYR A 119 -13.138 -10.178 -14.467 1.00 0.00 C ATOM 1897 CE2 TYR A 119 -13.235 -7.918 -15.341 1.00 0.00 C ATOM 1898 CZ TYR A 119 -13.658 -9.252 -15.382 1.00 0.00 C ATOM 1899 OH TYR A 119 -14.589 -9.654 -16.318 1.00 0.00 O ATOM 0 H TYR A 119 -12.675 -9.581 -10.690 1.00 0.00 H new ATOM 0 HA TYR A 119 -10.752 -7.348 -10.431 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -10.326 -7.066 -12.749 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -9.964 -8.747 -12.410 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -11.799 -10.481 -12.815 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -11.967 -6.485 -14.356 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -13.463 -11.208 -14.496 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -13.634 -7.203 -16.045 1.00 0.00 H new ATOM 0 HH TYR A 119 -14.846 -8.889 -16.873 1.00 0.00 H new ATOM 1909 N ARG A 120 -12.765 -5.856 -10.802 1.00 0.00 N ATOM 1910 CA ARG A 120 -14.039 -5.077 -10.876 1.00 0.00 C ATOM 1911 C ARG A 120 -13.769 -3.664 -11.375 1.00 0.00 C ATOM 1912 O ARG A 120 -12.718 -3.100 -11.148 1.00 0.00 O ATOM 1913 CB ARG A 120 -14.650 -4.936 -9.483 1.00 0.00 C ATOM 1914 CG ARG A 120 -14.706 -6.282 -8.777 1.00 0.00 C ATOM 1915 CD ARG A 120 -15.046 -6.053 -7.300 1.00 0.00 C ATOM 1916 NE ARG A 120 -16.525 -5.931 -7.145 1.00 0.00 N ATOM 1917 CZ ARG A 120 -17.033 -5.615 -5.986 1.00 0.00 C ATOM 1918 NH1 ARG A 120 -16.248 -5.411 -4.965 1.00 0.00 N ATOM 1919 NH2 ARG A 120 -18.330 -5.503 -5.847 1.00 0.00 N ATOM 0 H ARG A 120 -11.960 -5.347 -10.438 1.00 0.00 H new ATOM 0 HA ARG A 120 -14.710 -5.609 -11.551 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -14.061 -4.235 -8.892 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -15.654 -4.520 -9.562 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -15.457 -6.921 -9.242 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -13.749 -6.796 -8.868 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -14.673 -6.881 -6.697 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -14.556 -5.149 -6.938 1.00 0.00 H new ATOM 0 HE ARG A 120 -17.138 -6.094 -7.944 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -15.238 -5.499 -5.073 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -16.644 -5.164 -4.058 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -18.944 -5.663 -6.645 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -18.726 -5.256 -4.940 1.00 0.00 H new ATOM 1933 N TRP A 121 -14.741 -3.070 -11.994 1.00 0.00 N ATOM 1934 CA TRP A 121 -14.589 -1.667 -12.446 1.00 0.00 C ATOM 1935 C TRP A 121 -15.384 -0.798 -11.467 1.00 0.00 C ATOM 1936 O TRP A 121 -16.600 -0.814 -11.459 1.00 0.00 O ATOM 1937 CB TRP A 121 -15.133 -1.525 -13.871 1.00 0.00 C ATOM 1938 CG TRP A 121 -14.142 -2.093 -14.837 1.00 0.00 C ATOM 1939 CD1 TRP A 121 -14.192 -3.336 -15.367 1.00 0.00 C ATOM 1940 CD2 TRP A 121 -12.955 -1.460 -15.397 1.00 0.00 C ATOM 1941 NE1 TRP A 121 -13.108 -3.507 -16.210 1.00 0.00 N ATOM 1942 CE2 TRP A 121 -12.320 -2.378 -16.263 1.00 0.00 C ATOM 1943 CE3 TRP A 121 -12.374 -0.189 -15.238 1.00 0.00 C ATOM 1944 CZ2 TRP A 121 -11.149 -2.050 -16.945 1.00 0.00 C ATOM 1945 CZ3 TRP A 121 -11.197 0.141 -15.925 1.00 0.00 C ATOM 1946 CH2 TRP A 121 -10.587 -0.788 -16.776 1.00 0.00 C ATOM 0 H TRP A 121 -15.641 -3.499 -12.208 1.00 0.00 H new ATOM 0 HA TRP A 121 -13.543 -1.360 -12.461 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -16.086 -2.045 -13.962 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -15.320 -0.475 -14.099 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -14.954 -4.075 -15.165 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -12.916 -4.364 -16.729 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -12.836 0.536 -14.584 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -10.681 -2.770 -17.600 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -10.758 1.119 -15.797 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -9.681 -0.526 -17.301 1.00 0.00 H new ATOM 1957 N LEU A 122 -14.708 -0.078 -10.602 1.00 0.00 N ATOM 1958 CA LEU A 122 -15.430 0.748 -9.584 1.00 0.00 C ATOM 1959 C LEU A 122 -14.952 2.197 -9.612 1.00 0.00 C ATOM 1960 O LEU A 122 -14.015 2.547 -10.300 1.00 0.00 O ATOM 1961 CB LEU A 122 -15.167 0.202 -8.182 1.00 0.00 C ATOM 1962 CG LEU A 122 -14.671 -1.241 -8.239 1.00 0.00 C ATOM 1963 CD1 LEU A 122 -13.315 -1.337 -7.541 1.00 0.00 C ATOM 1964 CD2 LEU A 122 -15.675 -2.151 -7.525 1.00 0.00 C ATOM 0 H LEU A 122 -13.690 -0.027 -10.558 1.00 0.00 H new ATOM 0 HA LEU A 122 -16.492 0.704 -9.825 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -14.427 0.825 -7.679 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -16.081 0.253 -7.591 1.00 0.00 H new ATOM 0 HG LEU A 122 -14.570 -1.553 -9.279 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.958 -2.366 -7.580 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.600 -0.686 -8.044 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -13.418 -1.028 -6.501 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -15.323 -3.182 -7.564 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -15.772 -1.840 -6.485 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -16.645 -2.079 -8.017 1.00 0.00 H new ATOM 1976 N GLY A 123 -15.592 3.039 -8.841 1.00 0.00 N ATOM 1977 CA GLY A 123 -15.192 4.474 -8.788 1.00 0.00 C ATOM 1978 C GLY A 123 -14.039 4.656 -7.791 1.00 0.00 C ATOM 1979 O GLY A 123 -13.556 3.709 -7.205 1.00 0.00 O ATOM 0 H GLY A 123 -16.380 2.790 -8.243 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -14.886 4.812 -9.778 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -16.042 5.087 -8.490 1.00 0.00 H new ATOM 1983 N LEU A 124 -13.596 5.869 -7.604 1.00 0.00 N ATOM 1984 CA LEU A 124 -12.470 6.129 -6.655 1.00 0.00 C ATOM 1985 C LEU A 124 -12.814 5.627 -5.256 1.00 0.00 C ATOM 1986 O LEU A 124 -12.045 4.925 -4.631 1.00 0.00 O ATOM 1987 CB LEU A 124 -12.221 7.639 -6.600 1.00 0.00 C ATOM 1988 CG LEU A 124 -11.275 8.006 -5.446 1.00 0.00 C ATOM 1989 CD1 LEU A 124 -10.034 7.111 -5.455 1.00 0.00 C ATOM 1990 CD2 LEU A 124 -10.842 9.465 -5.608 1.00 0.00 C ATOM 0 H LEU A 124 -13.966 6.698 -8.069 1.00 0.00 H new ATOM 0 HA LEU A 124 -11.581 5.602 -7.002 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -11.793 7.974 -7.545 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -13.169 8.162 -6.476 1.00 0.00 H new ATOM 0 HG LEU A 124 -11.799 7.864 -4.501 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -9.379 7.389 -4.629 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -10.336 6.069 -5.344 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -9.502 7.236 -6.398 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -10.170 9.738 -4.794 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -10.327 9.588 -6.561 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -11.720 10.110 -5.584 1.00 0.00 H new ATOM 2002 N GLU A 125 -13.950 5.999 -4.748 1.00 0.00 N ATOM 2003 CA GLU A 125 -14.314 5.561 -3.374 1.00 0.00 C ATOM 2004 C GLU A 125 -14.296 4.033 -3.277 1.00 0.00 C ATOM 2005 O GLU A 125 -13.636 3.478 -2.422 1.00 0.00 O ATOM 2006 CB GLU A 125 -15.700 6.097 -3.019 1.00 0.00 C ATOM 2007 CG GLU A 125 -16.781 5.245 -3.683 1.00 0.00 C ATOM 2008 CD GLU A 125 -18.137 5.929 -3.506 1.00 0.00 C ATOM 2009 OE1 GLU A 125 -18.190 6.914 -2.788 1.00 0.00 O ATOM 2010 OE2 GLU A 125 -19.100 5.459 -4.088 1.00 0.00 O ATOM 0 H GLU A 125 -14.640 6.584 -5.219 1.00 0.00 H new ATOM 0 HA GLU A 125 -13.583 5.957 -2.669 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -15.835 6.090 -1.937 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -15.792 7.133 -3.345 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -16.560 5.117 -4.743 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -16.801 4.250 -3.239 1.00 0.00 H new ATOM 2018 N GLU A 126 -14.996 3.341 -4.138 1.00 0.00 N ATOM 2019 CA GLU A 126 -14.982 1.850 -4.059 1.00 0.00 C ATOM 2020 C GLU A 126 -13.562 1.353 -4.291 1.00 0.00 C ATOM 2021 O GLU A 126 -13.116 0.401 -3.691 1.00 0.00 O ATOM 2022 CB GLU A 126 -15.885 1.254 -5.132 1.00 0.00 C ATOM 2023 CG GLU A 126 -15.906 -0.266 -4.966 1.00 0.00 C ATOM 2024 CD GLU A 126 -17.222 -0.830 -5.500 1.00 0.00 C ATOM 2025 OE1 GLU A 126 -17.513 -1.977 -5.203 1.00 0.00 O ATOM 2026 OE2 GLU A 126 -17.914 -0.109 -6.201 1.00 0.00 O ATOM 0 H GLU A 126 -15.569 3.737 -4.883 1.00 0.00 H new ATOM 0 HA GLU A 126 -15.340 1.546 -3.075 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -16.894 1.658 -5.044 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -15.520 1.521 -6.124 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -15.066 -0.710 -5.501 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -15.789 -0.527 -3.914 1.00 0.00 H new ATOM 2034 N ALA A 127 -12.847 1.993 -5.158 1.00 0.00 N ATOM 2035 CA ALA A 127 -11.454 1.561 -5.417 1.00 0.00 C ATOM 2036 C ALA A 127 -10.621 1.839 -4.170 1.00 0.00 C ATOM 2037 O ALA A 127 -9.649 1.170 -3.885 1.00 0.00 O ATOM 2038 CB ALA A 127 -10.896 2.369 -6.581 1.00 0.00 C ATOM 0 H ALA A 127 -13.164 2.797 -5.700 1.00 0.00 H new ATOM 0 HA ALA A 127 -11.425 0.498 -5.658 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -9.870 2.059 -6.780 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -11.506 2.198 -7.468 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.912 3.429 -6.329 1.00 0.00 H new ATOM 2044 N CYS A 128 -11.004 2.849 -3.436 1.00 0.00 N ATOM 2045 CA CYS A 128 -10.259 3.229 -2.205 1.00 0.00 C ATOM 2046 C CYS A 128 -10.460 2.176 -1.113 1.00 0.00 C ATOM 2047 O CYS A 128 -9.539 1.836 -0.398 1.00 0.00 O ATOM 2048 CB CYS A 128 -10.767 4.589 -1.715 1.00 0.00 C ATOM 2049 SG CYS A 128 -11.285 4.461 0.014 1.00 0.00 S ATOM 0 H CYS A 128 -11.814 3.434 -3.642 1.00 0.00 H new ATOM 0 HA CYS A 128 -9.195 3.291 -2.433 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -9.982 5.339 -1.815 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -11.603 4.919 -2.331 1.00 0.00 H new ATOM 0 HG CYS A 128 -12.511 4.033 0.069 1.00 0.00 H new ATOM 2055 N GLN A 129 -11.651 1.648 -0.966 1.00 0.00 N ATOM 2056 CA GLN A 129 -11.866 0.615 0.095 1.00 0.00 C ATOM 2057 C GLN A 129 -11.106 -0.650 -0.279 1.00 0.00 C ATOM 2058 O GLN A 129 -10.424 -1.247 0.531 1.00 0.00 O ATOM 2059 CB GLN A 129 -13.349 0.240 0.229 1.00 0.00 C ATOM 2060 CG GLN A 129 -14.143 0.746 -0.970 1.00 0.00 C ATOM 2061 CD GLN A 129 -14.750 2.110 -0.644 1.00 0.00 C ATOM 2062 OE1 GLN A 129 -13.982 3.068 -0.202 1.00 0.00 O flip ATOM 2063 NE2 GLN A 129 -15.940 2.306 -0.795 1.00 0.00 N flip ATOM 0 H GLN A 129 -12.471 1.883 -1.525 1.00 0.00 H new ATOM 0 HA GLN A 129 -11.515 1.033 1.038 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -13.450 -0.842 0.308 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -13.755 0.666 1.146 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -13.494 0.825 -1.842 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -14.931 0.037 -1.222 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -16.540 1.557 -1.140 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -16.338 3.219 -0.576 1.00 0.00 H new ATOM 2072 N LEU A 130 -11.244 -1.073 -1.499 1.00 0.00 N ATOM 2073 CA LEU A 130 -10.560 -2.311 -1.937 1.00 0.00 C ATOM 2074 C LEU A 130 -9.039 -2.135 -1.816 1.00 0.00 C ATOM 2075 O LEU A 130 -8.351 -2.993 -1.298 1.00 0.00 O ATOM 2076 CB LEU A 130 -10.949 -2.593 -3.388 1.00 0.00 C ATOM 2077 CG LEU A 130 -12.475 -2.636 -3.518 1.00 0.00 C ATOM 2078 CD1 LEU A 130 -12.842 -2.908 -4.969 1.00 0.00 C ATOM 2079 CD2 LEU A 130 -13.045 -3.756 -2.650 1.00 0.00 C ATOM 0 H LEU A 130 -11.805 -0.611 -2.215 1.00 0.00 H new ATOM 0 HA LEU A 130 -10.860 -3.149 -1.308 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -10.541 -1.821 -4.040 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -10.521 -3.542 -3.711 1.00 0.00 H new ATOM 0 HG LEU A 130 -12.887 -1.681 -3.193 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -13.927 -2.940 -5.070 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -12.442 -2.115 -5.600 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -12.420 -3.865 -5.278 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -14.130 -3.777 -2.750 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -12.632 -4.712 -2.972 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -12.780 -3.579 -1.608 1.00 0.00 H new ATOM 2091 N ALA A 131 -8.505 -1.029 -2.270 1.00 0.00 N ATOM 2092 CA ALA A 131 -7.029 -0.832 -2.153 1.00 0.00 C ATOM 2093 C ALA A 131 -6.643 -0.841 -0.672 1.00 0.00 C ATOM 2094 O ALA A 131 -5.741 -1.539 -0.262 1.00 0.00 O ATOM 2095 CB ALA A 131 -6.620 0.506 -2.776 1.00 0.00 C ATOM 0 H ALA A 131 -9.018 -0.265 -2.710 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.516 -1.636 -2.681 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.542 0.636 -2.683 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -6.898 0.517 -3.830 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -7.129 1.319 -2.259 1.00 0.00 H new ATOM 2101 N GLN A 132 -7.333 -0.084 0.135 1.00 0.00 N ATOM 2102 CA GLN A 132 -7.023 -0.054 1.595 1.00 0.00 C ATOM 2103 C GLN A 132 -5.595 0.452 1.827 1.00 0.00 C ATOM 2104 O GLN A 132 -5.168 0.627 2.951 1.00 0.00 O ATOM 2105 CB GLN A 132 -7.176 -1.468 2.175 1.00 0.00 C ATOM 2106 CG GLN A 132 -5.806 -2.033 2.588 1.00 0.00 C ATOM 2107 CD GLN A 132 -5.952 -3.511 2.971 1.00 0.00 C ATOM 2108 OE1 GLN A 132 -6.729 -4.230 2.377 1.00 0.00 O ATOM 2109 NE2 GLN A 132 -5.221 -4.000 3.939 1.00 0.00 N ATOM 0 H GLN A 132 -8.103 0.519 -0.154 1.00 0.00 H new ATOM 0 HA GLN A 132 -7.716 0.624 2.093 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -7.841 -1.443 3.038 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -7.638 -2.122 1.436 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -5.096 -1.928 1.768 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -5.407 -1.467 3.429 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -4.568 -3.397 4.439 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -5.304 -4.984 4.194 1.00 0.00 H new ATOM 2118 N PHE A 133 -4.849 0.687 0.783 1.00 0.00 N ATOM 2119 CA PHE A 133 -3.451 1.172 0.973 1.00 0.00 C ATOM 2120 C PHE A 133 -3.402 2.694 0.787 1.00 0.00 C ATOM 2121 O PHE A 133 -3.892 3.224 -0.189 1.00 0.00 O ATOM 2122 CB PHE A 133 -2.537 0.515 -0.066 1.00 0.00 C ATOM 2123 CG PHE A 133 -2.954 -0.923 -0.286 1.00 0.00 C ATOM 2124 CD1 PHE A 133 -2.699 -1.876 0.703 1.00 0.00 C ATOM 2125 CD2 PHE A 133 -3.587 -1.309 -1.480 1.00 0.00 C ATOM 2126 CE1 PHE A 133 -3.071 -3.210 0.506 1.00 0.00 C ATOM 2127 CE2 PHE A 133 -3.960 -2.642 -1.677 1.00 0.00 C ATOM 2128 CZ PHE A 133 -3.701 -3.595 -0.685 1.00 0.00 C ATOM 0 H PHE A 133 -5.143 0.566 -0.186 1.00 0.00 H new ATOM 0 HA PHE A 133 -3.117 0.914 1.978 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -2.587 1.065 -1.006 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -1.501 0.554 0.272 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -2.214 -1.582 1.622 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -3.786 -0.575 -2.247 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -2.872 -3.944 1.273 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -4.448 -2.936 -2.594 1.00 0.00 H new ATOM 0 HZ PHE A 133 -3.986 -4.625 -0.837 1.00 0.00 H new ATOM 2138 N LYS A 134 -2.806 3.405 1.709 1.00 0.00 N ATOM 2139 CA LYS A 134 -2.727 4.890 1.569 1.00 0.00 C ATOM 2140 C LYS A 134 -2.062 5.236 0.236 1.00 0.00 C ATOM 2141 O LYS A 134 -2.485 6.128 -0.470 1.00 0.00 O ATOM 2142 CB LYS A 134 -1.895 5.466 2.714 1.00 0.00 C ATOM 2143 CG LYS A 134 -1.893 6.991 2.628 1.00 0.00 C ATOM 2144 CD LYS A 134 -1.013 7.554 3.743 1.00 0.00 C ATOM 2145 CE LYS A 134 -1.096 9.082 3.747 1.00 0.00 C ATOM 2146 NZ LYS A 134 -0.508 9.615 2.486 1.00 0.00 N ATOM 0 H LYS A 134 -2.372 3.024 2.550 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.731 5.314 1.600 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -2.305 5.146 3.672 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -0.874 5.087 2.662 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -1.519 7.312 1.656 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -2.909 7.374 2.721 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -1.335 7.161 4.707 1.00 0.00 H new ATOM 0 HD3 LYS A 134 0.020 7.237 3.599 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -2.134 9.400 3.839 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -0.562 9.484 4.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -0.330 10.634 2.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 0.388 9.126 2.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -1.171 9.458 1.700 1.00 0.00 H new ATOM 2160 N GLU A 135 -1.026 4.523 -0.116 1.00 0.00 N ATOM 2161 CA GLU A 135 -0.335 4.794 -1.407 1.00 0.00 C ATOM 2162 C GLU A 135 -1.325 4.587 -2.547 1.00 0.00 C ATOM 2163 O GLU A 135 -1.518 5.446 -3.382 1.00 0.00 O ATOM 2164 CB GLU A 135 0.823 3.809 -1.554 1.00 0.00 C ATOM 2165 CG GLU A 135 1.874 4.093 -0.480 1.00 0.00 C ATOM 2166 CD GLU A 135 2.464 5.486 -0.701 1.00 0.00 C ATOM 2167 OE1 GLU A 135 2.301 6.012 -1.790 1.00 0.00 O ATOM 2168 OE2 GLU A 135 3.069 6.004 0.222 1.00 0.00 O ATOM 0 H GLU A 135 -0.629 3.763 0.437 1.00 0.00 H new ATOM 0 HA GLU A 135 0.042 5.816 -1.431 1.00 0.00 H new ATOM 0 HB2 GLU A 135 0.458 2.786 -1.460 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.267 3.899 -2.545 1.00 0.00 H new ATOM 0 HG2 GLU A 135 1.424 4.030 0.511 1.00 0.00 H new ATOM 0 HG3 GLU A 135 2.663 3.342 -0.520 1.00 0.00 H new ATOM 2176 N MET A 136 -1.970 3.456 -2.571 1.00 0.00 N ATOM 2177 CA MET A 136 -2.964 3.189 -3.642 1.00 0.00 C ATOM 2178 C MET A 136 -4.120 4.166 -3.518 1.00 0.00 C ATOM 2179 O MET A 136 -4.559 4.748 -4.491 1.00 0.00 O ATOM 2180 CB MET A 136 -3.514 1.781 -3.475 1.00 0.00 C ATOM 2181 CG MET A 136 -2.424 0.766 -3.810 1.00 0.00 C ATOM 2182 SD MET A 136 -3.001 -0.348 -5.115 1.00 0.00 S ATOM 2183 CE MET A 136 -3.593 0.917 -6.270 1.00 0.00 C ATOM 0 H MET A 136 -1.850 2.704 -1.893 1.00 0.00 H new ATOM 0 HA MET A 136 -2.481 3.298 -4.613 1.00 0.00 H new ATOM 0 HB2 MET A 136 -3.861 1.634 -2.452 1.00 0.00 H new ATOM 0 HB3 MET A 136 -4.375 1.635 -4.128 1.00 0.00 H new ATOM 0 HG2 MET A 136 -1.521 1.283 -4.134 1.00 0.00 H new ATOM 0 HG3 MET A 136 -2.162 0.193 -2.920 1.00 0.00 H new ATOM 0 HE1 MET A 136 -4.674 0.830 -6.382 1.00 0.00 H new ATOM 0 HE2 MET A 136 -3.347 1.906 -5.884 1.00 0.00 H new ATOM 0 HE3 MET A 136 -3.115 0.777 -7.240 1.00 0.00 H new ATOM 2193 N LYS A 137 -4.623 4.356 -2.333 1.00 0.00 N ATOM 2194 CA LYS A 137 -5.754 5.297 -2.177 1.00 0.00 C ATOM 2195 C LYS A 137 -5.325 6.654 -2.726 1.00 0.00 C ATOM 2196 O LYS A 137 -6.040 7.284 -3.475 1.00 0.00 O ATOM 2197 CB LYS A 137 -6.124 5.431 -0.700 1.00 0.00 C ATOM 2198 CG LYS A 137 -6.774 4.134 -0.210 1.00 0.00 C ATOM 2199 CD LYS A 137 -7.059 4.243 1.286 1.00 0.00 C ATOM 2200 CE LYS A 137 -8.057 5.374 1.530 1.00 0.00 C ATOM 2201 NZ LYS A 137 -8.772 5.125 2.812 1.00 0.00 N ATOM 0 H LYS A 137 -4.302 3.904 -1.477 1.00 0.00 H new ATOM 0 HA LYS A 137 -6.624 4.927 -2.719 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -5.233 5.648 -0.110 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -6.809 6.267 -0.561 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -7.700 3.950 -0.755 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -6.115 3.288 -0.405 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -7.460 3.301 1.661 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -6.135 4.435 1.831 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -7.538 6.332 1.569 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -8.769 5.431 0.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -9.453 5.892 2.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -9.278 4.218 2.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -8.085 5.091 3.592 1.00 0.00 H new ATOM 2215 N ALA A 138 -4.150 7.100 -2.369 1.00 0.00 N ATOM 2216 CA ALA A 138 -3.668 8.408 -2.884 1.00 0.00 C ATOM 2217 C ALA A 138 -3.308 8.271 -4.363 1.00 0.00 C ATOM 2218 O ALA A 138 -3.635 9.119 -5.168 1.00 0.00 O ATOM 2219 CB ALA A 138 -2.437 8.852 -2.097 1.00 0.00 C ATOM 0 H ALA A 138 -3.507 6.614 -1.744 1.00 0.00 H new ATOM 0 HA ALA A 138 -4.455 9.153 -2.768 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -2.088 9.811 -2.479 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -2.696 8.953 -1.043 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -1.647 8.109 -2.207 1.00 0.00 H new ATOM 2225 N ALA A 139 -2.640 7.207 -4.738 1.00 0.00 N ATOM 2226 CA ALA A 139 -2.280 7.040 -6.174 1.00 0.00 C ATOM 2227 C ALA A 139 -3.560 7.093 -7.001 1.00 0.00 C ATOM 2228 O ALA A 139 -3.639 7.780 -7.997 1.00 0.00 O ATOM 2229 CB ALA A 139 -1.592 5.691 -6.390 1.00 0.00 C ATOM 0 H ALA A 139 -2.333 6.457 -4.118 1.00 0.00 H new ATOM 0 HA ALA A 139 -1.598 7.834 -6.477 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.333 5.579 -7.443 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -0.686 5.644 -5.786 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -2.266 4.887 -6.095 1.00 0.00 H new ATOM 2235 N LEU A 140 -4.573 6.389 -6.580 1.00 0.00 N ATOM 2236 CA LEU A 140 -5.857 6.421 -7.327 1.00 0.00 C ATOM 2237 C LEU A 140 -6.431 7.833 -7.245 1.00 0.00 C ATOM 2238 O LEU A 140 -6.972 8.359 -8.200 1.00 0.00 O ATOM 2239 CB LEU A 140 -6.844 5.445 -6.687 1.00 0.00 C ATOM 2240 CG LEU A 140 -6.467 4.008 -7.048 1.00 0.00 C ATOM 2241 CD1 LEU A 140 -6.842 3.078 -5.893 1.00 0.00 C ATOM 2242 CD2 LEU A 140 -7.244 3.593 -8.298 1.00 0.00 C ATOM 0 H LEU A 140 -4.566 5.794 -5.752 1.00 0.00 H new ATOM 0 HA LEU A 140 -5.689 6.139 -8.366 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -6.841 5.569 -5.604 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -7.856 5.661 -7.030 1.00 0.00 H new ATOM 0 HG LEU A 140 -5.395 3.943 -7.234 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -6.574 2.053 -6.149 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -6.305 3.380 -4.994 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -7.915 3.138 -5.712 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -6.983 2.569 -8.565 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -8.314 3.655 -8.099 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -6.990 4.259 -9.122 1.00 0.00 H new ATOM 2254 N GLN A 141 -6.308 8.451 -6.103 1.00 0.00 N ATOM 2255 CA GLN A 141 -6.835 9.832 -5.938 1.00 0.00 C ATOM 2256 C GLN A 141 -5.956 10.800 -6.736 1.00 0.00 C ATOM 2257 O GLN A 141 -6.447 11.622 -7.483 1.00 0.00 O ATOM 2258 CB GLN A 141 -6.838 10.194 -4.446 1.00 0.00 C ATOM 2259 CG GLN A 141 -6.199 11.567 -4.229 1.00 0.00 C ATOM 2260 CD GLN A 141 -6.305 11.947 -2.752 1.00 0.00 C ATOM 2261 OE1 GLN A 141 -6.941 11.158 -1.929 1.00 0.00 O flip ATOM 2262 NE2 GLN A 141 -5.799 12.973 -2.341 1.00 0.00 N flip ATOM 0 H GLN A 141 -5.863 8.056 -5.274 1.00 0.00 H new ATOM 0 HA GLN A 141 -7.856 9.899 -6.313 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -7.860 10.198 -4.068 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -6.292 9.438 -3.881 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -5.154 11.547 -4.537 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -6.698 12.315 -4.845 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -5.302 13.590 -2.984 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -5.871 13.217 -1.353 1.00 0.00 H new ATOM 2271 N GLU A 142 -4.657 10.696 -6.602 1.00 0.00 N ATOM 2272 CA GLU A 142 -3.756 11.600 -7.376 1.00 0.00 C ATOM 2273 C GLU A 142 -3.909 11.288 -8.865 1.00 0.00 C ATOM 2274 O GLU A 142 -3.883 12.168 -9.700 1.00 0.00 O ATOM 2275 CB GLU A 142 -2.300 11.377 -6.950 1.00 0.00 C ATOM 2276 CG GLU A 142 -2.125 11.787 -5.485 1.00 0.00 C ATOM 2277 CD GLU A 142 -2.418 13.281 -5.335 1.00 0.00 C ATOM 2278 OE1 GLU A 142 -2.312 13.986 -6.324 1.00 0.00 O ATOM 2279 OE2 GLU A 142 -2.747 13.690 -4.235 1.00 0.00 O ATOM 0 H GLU A 142 -4.185 10.028 -5.993 1.00 0.00 H new ATOM 0 HA GLU A 142 -4.023 12.639 -7.183 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -2.029 10.329 -7.080 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -1.632 11.960 -7.584 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -2.797 11.208 -4.852 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -1.109 11.570 -5.154 1.00 0.00 H new ATOM 2287 N GLY A 143 -4.082 10.036 -9.203 1.00 0.00 N ATOM 2288 CA GLY A 143 -4.255 9.670 -10.637 1.00 0.00 C ATOM 2289 C GLY A 143 -5.543 10.312 -11.160 1.00 0.00 C ATOM 2290 O GLY A 143 -5.589 10.844 -12.253 1.00 0.00 O ATOM 0 H GLY A 143 -4.111 9.254 -8.548 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.400 10.012 -11.219 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.302 8.587 -10.747 1.00 0.00 H new ATOM 2294 N HIS A 144 -6.587 10.274 -10.375 1.00 0.00 N ATOM 2295 CA HIS A 144 -7.875 10.890 -10.805 1.00 0.00 C ATOM 2296 C HIS A 144 -7.671 12.396 -10.983 1.00 0.00 C ATOM 2297 O HIS A 144 -8.211 13.007 -11.883 1.00 0.00 O ATOM 2298 CB HIS A 144 -8.942 10.642 -9.732 1.00 0.00 C ATOM 2299 CG HIS A 144 -9.909 9.593 -10.211 1.00 0.00 C ATOM 2300 ND1 HIS A 144 -10.471 8.653 -9.355 1.00 0.00 N ATOM 2301 CD2 HIS A 144 -10.436 9.330 -11.452 1.00 0.00 C ATOM 2302 CE1 HIS A 144 -11.296 7.880 -10.088 1.00 0.00 C ATOM 2303 NE2 HIS A 144 -11.308 8.251 -11.368 1.00 0.00 N ATOM 0 H HIS A 144 -6.602 9.841 -9.452 1.00 0.00 H new ATOM 0 HA HIS A 144 -8.200 10.448 -11.747 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -8.470 10.319 -8.804 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -9.474 11.568 -9.513 1.00 0.00 H new ATOM 0 HD1 HIS A 144 -10.292 8.565 -8.355 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -10.208 9.878 -12.354 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -11.876 7.061 -9.688 1.00 0.00 H new ATOM 2312 N GLN A 145 -6.892 12.994 -10.124 1.00 0.00 N ATOM 2313 CA GLN A 145 -6.642 14.460 -10.224 1.00 0.00 C ATOM 2314 C GLN A 145 -6.122 14.803 -11.622 1.00 0.00 C ATOM 2315 O GLN A 145 -6.589 15.729 -12.256 1.00 0.00 O ATOM 2316 CB GLN A 145 -5.595 14.851 -9.177 1.00 0.00 C ATOM 2317 CG GLN A 145 -5.380 16.365 -9.192 1.00 0.00 C ATOM 2318 CD GLN A 145 -6.527 17.056 -8.451 1.00 0.00 C ATOM 2319 OE1 GLN A 145 -6.705 16.860 -7.266 1.00 0.00 O ATOM 2320 NE2 GLN A 145 -7.313 17.868 -9.105 1.00 0.00 N ATOM 0 H GLN A 145 -6.415 12.527 -9.353 1.00 0.00 H new ATOM 0 HA GLN A 145 -7.569 15.006 -10.048 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -5.922 14.532 -8.187 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -4.655 14.340 -9.383 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -4.429 16.612 -8.720 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -5.329 16.725 -10.220 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -7.163 18.032 -10.100 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -8.077 18.338 -8.620 1.00 0.00 H new ATOM 2329 N PHE A 146 -5.162 14.068 -12.111 1.00 0.00 N ATOM 2330 CA PHE A 146 -4.623 14.365 -13.468 1.00 0.00 C ATOM 2331 C PHE A 146 -5.704 14.149 -14.529 1.00 0.00 C ATOM 2332 O PHE A 146 -5.887 14.959 -15.416 1.00 0.00 O ATOM 2333 CB PHE A 146 -3.450 13.444 -13.769 1.00 0.00 C ATOM 2334 CG PHE A 146 -2.921 13.781 -15.137 1.00 0.00 C ATOM 2335 CD1 PHE A 146 -3.606 13.331 -16.269 1.00 0.00 C ATOM 2336 CD2 PHE A 146 -1.764 14.555 -15.281 1.00 0.00 C ATOM 2337 CE1 PHE A 146 -3.134 13.648 -17.544 1.00 0.00 C ATOM 2338 CE2 PHE A 146 -1.291 14.874 -16.561 1.00 0.00 C ATOM 2339 CZ PHE A 146 -1.978 14.420 -17.693 1.00 0.00 C ATOM 0 H PHE A 146 -4.729 13.278 -11.632 1.00 0.00 H new ATOM 0 HA PHE A 146 -4.296 15.405 -13.489 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -2.669 13.567 -13.019 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -3.767 12.402 -13.731 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.501 12.737 -16.157 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -1.236 14.906 -14.407 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -3.663 13.296 -18.417 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -0.397 15.470 -16.674 1.00 0.00 H new ATOM 0 HZ PHE A 146 -1.615 14.666 -18.680 1.00 0.00 H new ATOM 2349 N LEU A 147 -6.414 13.057 -14.453 1.00 0.00 N ATOM 2350 CA LEU A 147 -7.468 12.787 -15.464 1.00 0.00 C ATOM 2351 C LEU A 147 -8.430 13.978 -15.520 1.00 0.00 C ATOM 2352 O LEU A 147 -8.912 14.351 -16.567 1.00 0.00 O ATOM 2353 CB LEU A 147 -8.218 11.510 -15.075 1.00 0.00 C ATOM 2354 CG LEU A 147 -7.246 10.324 -15.062 1.00 0.00 C ATOM 2355 CD1 LEU A 147 -8.013 9.045 -14.723 1.00 0.00 C ATOM 2356 CD2 LEU A 147 -6.585 10.167 -16.438 1.00 0.00 C ATOM 0 H LEU A 147 -6.308 12.342 -13.734 1.00 0.00 H new ATOM 0 HA LEU A 147 -7.021 12.650 -16.448 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -8.674 11.630 -14.092 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -9.027 11.322 -15.781 1.00 0.00 H new ATOM 0 HG LEU A 147 -6.474 10.505 -14.314 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -7.325 8.200 -14.713 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.476 9.148 -13.742 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -8.786 8.875 -15.473 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -5.897 9.322 -16.417 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -7.352 9.992 -17.192 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -6.036 11.076 -16.684 1.00 0.00 H new ATOM 2368 N CYS A 148 -8.695 14.600 -14.411 1.00 0.00 N ATOM 2369 CA CYS A 148 -9.610 15.775 -14.440 1.00 0.00 C ATOM 2370 C CYS A 148 -9.189 16.704 -15.583 1.00 0.00 C ATOM 2371 O CYS A 148 -10.010 17.299 -16.250 1.00 0.00 O ATOM 2372 CB CYS A 148 -9.504 16.531 -13.119 1.00 0.00 C ATOM 2373 SG CYS A 148 -10.067 15.471 -11.767 1.00 0.00 S ATOM 0 H CYS A 148 -8.324 14.352 -13.494 1.00 0.00 H new ATOM 0 HA CYS A 148 -10.636 15.440 -14.589 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -8.473 16.840 -12.947 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -10.107 17.438 -13.158 1.00 0.00 H new ATOM 0 HG CYS A 148 -9.342 14.392 -11.731 1.00 0.00 H new ATOM 2379 N SER A 149 -7.909 16.818 -15.807 1.00 0.00 N ATOM 2380 CA SER A 149 -7.404 17.692 -16.903 1.00 0.00 C ATOM 2381 C SER A 149 -7.316 16.879 -18.195 1.00 0.00 C ATOM 2382 O SER A 149 -6.830 17.348 -19.208 1.00 0.00 O ATOM 2383 CB SER A 149 -6.012 18.197 -16.535 1.00 0.00 C ATOM 2384 OG SER A 149 -6.098 18.995 -15.362 1.00 0.00 O ATOM 0 H SER A 149 -7.185 16.338 -15.272 1.00 0.00 H new ATOM 0 HA SER A 149 -8.080 18.535 -17.044 1.00 0.00 H new ATOM 0 HB2 SER A 149 -5.339 17.356 -16.368 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.595 18.780 -17.356 1.00 0.00 H new ATOM 0 HG SER A 149 -5.205 19.320 -15.121 1.00 0.00 H new ATOM 2390 N ILE A 150 -7.774 15.661 -18.167 1.00 0.00 N ATOM 2391 CA ILE A 150 -7.712 14.810 -19.377 1.00 0.00 C ATOM 2392 C ILE A 150 -9.038 14.905 -20.122 1.00 0.00 C ATOM 2393 O ILE A 150 -9.664 15.944 -20.180 1.00 0.00 O ATOM 2394 CB ILE A 150 -7.457 13.362 -18.944 1.00 0.00 C ATOM 2395 CG1 ILE A 150 -6.919 12.562 -20.115 1.00 0.00 C ATOM 2396 CG2 ILE A 150 -8.756 12.710 -18.468 1.00 0.00 C ATOM 2397 CD1 ILE A 150 -5.406 12.706 -20.165 1.00 0.00 C ATOM 0 H ILE A 150 -8.192 15.218 -17.349 1.00 0.00 H new ATOM 0 HA ILE A 150 -6.909 15.141 -20.035 1.00 0.00 H new ATOM 0 HB ILE A 150 -6.733 13.372 -18.130 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -7.193 11.512 -20.010 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -7.361 12.916 -21.046 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -8.557 11.682 -18.164 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -9.154 13.268 -17.621 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -9.484 12.714 -19.279 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -5.014 12.133 -21.005 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -5.144 13.757 -20.289 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -4.974 12.332 -19.237 1.00 0.00 H new ATOM 2409 N GLU A 151 -9.470 13.817 -20.672 1.00 0.00 N ATOM 2410 CA GLU A 151 -10.762 13.806 -21.404 1.00 0.00 C ATOM 2411 C GLU A 151 -11.870 13.603 -20.392 1.00 0.00 C ATOM 2412 O GLU A 151 -12.979 13.224 -20.715 1.00 0.00 O ATOM 2413 CB GLU A 151 -10.764 12.668 -22.413 1.00 0.00 C ATOM 2414 CG GLU A 151 -9.440 12.704 -23.165 1.00 0.00 C ATOM 2415 CD GLU A 151 -9.608 12.052 -24.535 1.00 0.00 C ATOM 2416 OE1 GLU A 151 -10.630 11.420 -24.749 1.00 0.00 O ATOM 2417 OE2 GLU A 151 -8.714 12.199 -25.350 1.00 0.00 O ATOM 0 H GLU A 151 -8.981 12.922 -20.648 1.00 0.00 H new ATOM 0 HA GLU A 151 -10.909 14.745 -21.938 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -10.889 11.711 -21.907 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -11.599 12.774 -23.106 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -9.105 13.735 -23.281 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -8.672 12.181 -22.594 1.00 0.00 H new ATOM 2425 N ALA A 152 -11.556 13.847 -19.161 1.00 0.00 N ATOM 2426 CA ALA A 152 -12.556 13.673 -18.078 1.00 0.00 C ATOM 2427 C ALA A 152 -13.684 14.688 -18.246 1.00 0.00 C ATOM 2428 O ALA A 152 -14.823 14.422 -17.918 1.00 0.00 O ATOM 2429 CB ALA A 152 -11.877 13.888 -16.727 1.00 0.00 C ATOM 0 H ALA A 152 -10.637 14.164 -18.851 1.00 0.00 H new ATOM 0 HA ALA A 152 -12.970 12.666 -18.127 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -12.608 13.761 -15.928 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -11.074 13.161 -16.603 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -11.464 14.896 -16.684 1.00 0.00 H new ATOM 2435 N LEU A 153 -13.382 15.852 -18.751 1.00 0.00 N ATOM 2436 CA LEU A 153 -14.445 16.878 -18.931 1.00 0.00 C ATOM 2437 C LEU A 153 -15.596 16.270 -19.736 1.00 0.00 C ATOM 2438 O LEU A 153 -15.552 15.101 -20.111 1.00 0.00 O ATOM 2439 CB LEU A 153 -13.870 18.080 -19.681 1.00 0.00 C ATOM 2440 CG LEU A 153 -14.933 19.178 -19.792 1.00 0.00 C ATOM 2441 CD1 LEU A 153 -15.239 19.758 -18.406 1.00 0.00 C ATOM 2442 CD2 LEU A 153 -14.413 20.293 -20.704 1.00 0.00 C ATOM 0 H LEU A 153 -12.448 16.136 -19.046 1.00 0.00 H new ATOM 0 HA LEU A 153 -14.812 17.204 -17.958 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -12.993 18.461 -19.158 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -13.541 17.777 -20.675 1.00 0.00 H new ATOM 0 HG LEU A 153 -15.845 18.751 -20.209 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -15.996 20.537 -18.497 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -15.609 18.967 -17.754 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -14.330 20.183 -17.980 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -15.166 21.077 -20.786 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -13.499 20.711 -20.283 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -14.204 19.886 -21.693 1.00 0.00 H new TER 2454 LEU A 153