USER MOD reduce.3.24.130724 H: found=0, std=0, add=1031, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1027 hydrogens (5 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 126 LYS NZ :NH3+ 179:sc= 0.908 (180deg=0) USER MOD Set 1.2: A 127 LYS NZ :NH3+ 173:sc= 0.223 (180deg=0.176) USER MOD Set 1.3: A 128 ASN :FLIP amide:sc= 0.771 F(o=-2.4,f=1.9) USER MOD Set 2.1: A 83 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 113 SER OG : rot -96:sc= -3.59! USER MOD Set 2.3: A 116 HIS : no HD1:sc= -10.8! C(o=-14!,f=-22!) USER MOD Set 3.1: A 88 TYR OH : rot 180:sc= -3.83! USER MOD Set 3.2: A 90 SER OG : rot -108:sc= 1.48 USER MOD Set 4.1: A 75 THR OG1 : rot -76:sc= 1.05 USER MOD Set 4.2: A 77 GLN : amide:sc= -4.79! C(o=-3.7!,f=-9.5!) USER MOD Set 5.1: A 55 HIS : no HE2:sc= -4.13! C(o=-4.4!,f=-13!) USER MOD Set 5.2: A 57 GLN : amide:sc= -0.248 K(o=-4.4,f=-15!) USER MOD Single : A 24 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0377) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= -7.38! (180deg=-7.38!) USER MOD Single : A 29 TYR OH : rot -63:sc= 1.12 USER MOD Single : A 30 CYS SG : rot -27:sc= -0.432 USER MOD Single : A 31 SER OG : rot 124:sc= -4.21! USER MOD Single : A 32 ASN :FLIP amide:sc= -1.08 F(o=-4.6!,f=-1.1) USER MOD Single : A 35 HIS : no HD1:sc= -3.96 K(o=-4,f=-5.5!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot -63:sc= -5.29! USER MOD Single : A 52 SER OG : rot 68:sc= 1.04 USER MOD Single : A 54 GLN :FLIP amide:sc= -4.27! C(o=-5.5!,f=-4.3!) USER MOD Single : A 59 GLN : amide:sc= -1.12 K(o=-1.1,f=-3.3) USER MOD Single : A 61 SER OG : rot -57:sc= 0.959 USER MOD Single : A 64 SER OG : rot 75:sc= 0.823 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ -148:sc= -1.99 (180deg=-4.09!) USER MOD Single : A 72 SER OG : rot 37:sc= -1.39! USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl -157:sc= -5.41! (180deg=-8.04!) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 THR OG1 : rot 67:sc= 0.767 USER MOD Single : A 94 ASN :FLIP amide:sc= -0.811 F(o=-4.1!,f=-0.81) USER MOD Single : A 97 CYS SG : rot 48:sc= -1.64 USER MOD Single : A 106 ASN : amide:sc= -0.227 K(o=-0.23,f=-2.4!) USER MOD Single : A 107 HIS :FLIP no HD1:sc= -2.72! C(o=-3.3!,f=-2.7!) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 ASN :FLIP amide:sc= -2.05 F(o=-4.9!,f=-2) USER MOD Single : A 110 THR OG1 : rot 110:sc= -3.21! USER MOD Single : A 111 TYR OH : rot -159:sc= -5.04! USER MOD Single : A 114 LYS NZ :NH3+ -124:sc= -0.451 (180deg=-3.93!) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN :FLIP amide:sc= -0.156 F(o=-0.75,f=-0.16) USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 CYS SG : rot -160:sc= -2.29! USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot -14:sc= -0.371! USER MOD Single : A 138 HIS : no HD1:sc= -1.32 K(o=-1.3,f=-2.3!) USER MOD Single : A 139 TYR OH : rot -142:sc= 0.127 USER MOD Single : A 141 GLN : amide:sc= -2.37! C(o=-2.4!,f=-5.9!) USER MOD Single : A 142 LYS NZ :NH3+ 155:sc= -0.893! (180deg=-1.85!) USER MOD Single : A 152 SER OG : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 24 -10.900 -5.506 14.510 1.00 0.00 N ATOM 2 CA LYS A 24 -10.550 -5.194 13.135 1.00 0.00 C ATOM 3 C LYS A 24 -9.700 -6.328 12.559 1.00 0.00 C ATOM 4 O LYS A 24 -8.473 -6.237 12.534 1.00 0.00 O ATOM 5 CB LYS A 24 -9.882 -3.820 13.050 1.00 0.00 C ATOM 6 CG LYS A 24 -10.926 -2.701 13.069 1.00 0.00 C ATOM 7 CD LYS A 24 -10.999 -2.043 14.448 1.00 0.00 C ATOM 8 CE LYS A 24 -11.972 -0.863 14.441 1.00 0.00 C ATOM 9 NZ LYS A 24 -13.368 -1.342 14.328 1.00 0.00 N ATOM 0 HA LYS A 24 -11.448 -5.125 12.520 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -9.193 -3.694 13.885 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -9.290 -3.755 12.137 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -10.675 -1.952 12.318 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -11.903 -3.105 12.803 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -11.317 -2.777 15.189 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -10.008 -1.700 14.744 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -11.854 -0.281 15.355 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -11.741 -0.199 13.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -14.020 -0.540 14.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -13.512 -1.774 13.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -13.553 -2.049 15.068 1.00 0.00 H new ATOM 23 N PRO A 25 -10.403 -7.398 12.100 1.00 0.00 N ATOM 24 CA PRO A 25 -9.725 -8.548 11.526 1.00 0.00 C ATOM 25 C PRO A 25 -9.212 -8.236 10.119 1.00 0.00 C ATOM 26 O PRO A 25 -9.878 -8.538 9.130 1.00 0.00 O ATOM 27 CB PRO A 25 -10.757 -9.664 11.548 1.00 0.00 C ATOM 28 CG PRO A 25 -12.106 -8.981 11.700 1.00 0.00 C ATOM 29 CD PRO A 25 -11.856 -7.540 12.113 1.00 0.00 C ATOM 0 HA PRO A 25 -8.835 -8.835 12.086 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -10.717 -10.251 10.630 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -10.572 -10.351 12.374 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -12.660 -9.018 10.762 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -12.711 -9.493 12.448 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -12.328 -6.842 11.422 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -12.265 -7.335 13.102 1.00 0.00 H new ATOM 37 N LYS A 26 -8.031 -7.636 10.073 1.00 0.00 N ATOM 38 CA LYS A 26 -7.421 -7.280 8.804 1.00 0.00 C ATOM 39 C LYS A 26 -6.095 -6.564 9.063 1.00 0.00 C ATOM 40 O LYS A 26 -6.042 -5.610 9.838 1.00 0.00 O ATOM 41 CB LYS A 26 -8.398 -6.473 7.947 1.00 0.00 C ATOM 42 CG LYS A 26 -7.653 -5.638 6.904 1.00 0.00 C ATOM 43 CD LYS A 26 -6.752 -6.519 6.037 1.00 0.00 C ATOM 44 CE LYS A 26 -5.416 -5.828 5.756 1.00 0.00 C ATOM 45 NZ LYS A 26 -4.501 -6.743 5.038 1.00 0.00 N ATOM 0 H LYS A 26 -7.481 -7.388 10.895 1.00 0.00 H new ATOM 0 HA LYS A 26 -7.192 -8.176 8.227 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -9.093 -7.148 7.448 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -8.992 -5.819 8.585 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -8.371 -5.114 6.273 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -7.052 -4.878 7.403 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.575 -7.470 6.539 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -7.254 -6.744 5.096 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.582 -4.930 5.161 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -4.960 -5.510 6.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -3.599 -6.259 4.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -4.329 -7.588 5.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -4.931 -7.026 4.135 1.00 0.00 H new ATOM 59 N LEU A 27 -5.056 -7.052 8.401 1.00 0.00 N ATOM 60 CA LEU A 27 -3.733 -6.470 8.551 1.00 0.00 C ATOM 61 C LEU A 27 -2.850 -6.915 7.383 1.00 0.00 C ATOM 62 O LEU A 27 -2.682 -8.110 7.148 1.00 0.00 O ATOM 63 CB LEU A 27 -3.151 -6.807 9.925 1.00 0.00 C ATOM 64 CG LEU A 27 -2.060 -7.880 9.947 1.00 0.00 C ATOM 65 CD1 LEU A 27 -0.806 -7.401 9.211 1.00 0.00 C ATOM 66 CD2 LEU A 27 -1.751 -8.319 11.379 1.00 0.00 C ATOM 0 H LEU A 27 -5.104 -7.844 7.760 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.789 -5.382 8.513 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -2.743 -5.894 10.359 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -3.965 -7.132 10.573 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.431 -8.756 9.415 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.046 -8.182 9.241 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -1.056 -7.178 8.174 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.422 -6.502 9.693 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -0.973 -9.082 11.366 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.408 -7.461 11.957 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.652 -8.728 11.837 1.00 0.00 H new ATOM 78 N LEU A 28 -2.308 -5.928 6.683 1.00 0.00 N ATOM 79 CA LEU A 28 -1.447 -6.203 5.546 1.00 0.00 C ATOM 80 C LEU A 28 -0.003 -6.351 6.030 1.00 0.00 C ATOM 81 O LEU A 28 0.279 -6.185 7.216 1.00 0.00 O ATOM 82 CB LEU A 28 -1.627 -5.134 4.467 1.00 0.00 C ATOM 83 CG LEU A 28 -2.145 -5.628 3.114 1.00 0.00 C ATOM 84 CD1 LEU A 28 -3.422 -4.886 2.713 1.00 0.00 C ATOM 85 CD2 LEU A 28 -1.061 -5.524 2.040 1.00 0.00 C ATOM 0 H LEU A 28 -2.449 -4.938 6.882 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.725 -7.147 5.077 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -2.316 -4.378 4.844 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -0.668 -4.641 4.309 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.401 -6.683 3.211 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -3.770 -5.255 1.748 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -4.192 -5.055 3.465 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.215 -3.818 2.639 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -1.456 -5.881 1.089 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -0.750 -4.484 1.936 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.204 -6.132 2.328 1.00 0.00 H new ATOM 97 N TYR A 29 0.875 -6.662 5.087 1.00 0.00 N ATOM 98 CA TYR A 29 2.283 -6.834 5.402 1.00 0.00 C ATOM 99 C TYR A 29 3.103 -7.077 4.133 1.00 0.00 C ATOM 100 O TYR A 29 2.558 -7.475 3.105 1.00 0.00 O ATOM 101 CB TYR A 29 2.367 -8.074 6.295 1.00 0.00 C ATOM 102 CG TYR A 29 3.749 -8.729 6.321 1.00 0.00 C ATOM 103 CD1 TYR A 29 4.835 -8.029 6.804 1.00 0.00 C ATOM 104 CD2 TYR A 29 3.909 -10.021 5.862 1.00 0.00 C ATOM 105 CE1 TYR A 29 6.136 -8.646 6.829 1.00 0.00 C ATOM 106 CE2 TYR A 29 5.210 -10.638 5.887 1.00 0.00 C ATOM 107 CZ TYR A 29 6.259 -9.920 6.369 1.00 0.00 C ATOM 108 OH TYR A 29 7.488 -10.502 6.392 1.00 0.00 O ATOM 0 H TYR A 29 0.638 -6.799 4.104 1.00 0.00 H new ATOM 0 HA TYR A 29 2.680 -5.942 5.887 1.00 0.00 H new ATOM 0 HB2 TYR A 29 2.088 -7.797 7.312 1.00 0.00 H new ATOM 0 HB3 TYR A 29 1.636 -8.806 5.953 1.00 0.00 H new ATOM 0 HD1 TYR A 29 4.710 -7.018 7.163 1.00 0.00 H new ATOM 0 HD2 TYR A 29 3.059 -10.569 5.484 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.995 -8.109 7.205 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.349 -11.648 5.531 1.00 0.00 H new ATOM 0 HH TYR A 29 8.094 -10.010 5.800 1.00 0.00 H new ATOM 118 N CYS A 30 4.399 -6.829 4.248 1.00 0.00 N ATOM 119 CA CYS A 30 5.300 -7.016 3.124 1.00 0.00 C ATOM 120 C CYS A 30 5.635 -8.505 3.019 1.00 0.00 C ATOM 121 O CYS A 30 6.171 -9.092 3.958 1.00 0.00 O ATOM 122 CB CYS A 30 6.558 -6.155 3.257 1.00 0.00 C ATOM 123 SG CYS A 30 6.156 -4.402 2.919 1.00 0.00 S ATOM 0 H CYS A 30 4.847 -6.500 5.103 1.00 0.00 H new ATOM 0 HA CYS A 30 4.812 -6.689 2.206 1.00 0.00 H new ATOM 0 HB2 CYS A 30 6.972 -6.255 4.260 1.00 0.00 H new ATOM 0 HB3 CYS A 30 7.321 -6.502 2.561 1.00 0.00 H new ATOM 0 HG CYS A 30 5.133 -4.338 2.120 1.00 0.00 H new ATOM 129 N SER A 31 5.305 -9.074 1.869 1.00 0.00 N ATOM 130 CA SER A 31 5.565 -10.483 1.629 1.00 0.00 C ATOM 131 C SER A 31 6.802 -10.928 2.412 1.00 0.00 C ATOM 132 O SER A 31 6.696 -11.334 3.568 1.00 0.00 O ATOM 133 CB SER A 31 5.753 -10.763 0.137 1.00 0.00 C ATOM 134 OG SER A 31 7.022 -10.318 -0.334 1.00 0.00 O ATOM 0 H SER A 31 4.860 -8.584 1.093 1.00 0.00 H new ATOM 0 HA SER A 31 4.701 -11.053 1.972 1.00 0.00 H new ATOM 0 HB2 SER A 31 5.653 -11.833 -0.046 1.00 0.00 H new ATOM 0 HB3 SER A 31 4.963 -10.268 -0.427 1.00 0.00 H new ATOM 0 HG SER A 31 7.498 -11.067 -0.749 1.00 0.00 H new ATOM 140 N ASN A 32 7.946 -10.836 1.751 1.00 0.00 N ATOM 141 CA ASN A 32 9.202 -11.224 2.370 1.00 0.00 C ATOM 142 C ASN A 32 9.348 -10.502 3.712 1.00 0.00 C ATOM 143 O ASN A 32 8.435 -9.802 4.147 1.00 0.00 O ATOM 144 CB ASN A 32 10.393 -10.834 1.492 1.00 0.00 C ATOM 145 CG ASN A 32 11.497 -11.891 1.566 1.00 0.00 C ATOM 146 OD1 ASN A 32 12.530 -11.541 2.327 1.00 0.00 O flip ATOM 147 ND2 ASN A 32 11.416 -12.953 0.972 1.00 0.00 N flip ATOM 0 H ASN A 32 8.030 -10.498 0.792 1.00 0.00 H new ATOM 0 HA ASN A 32 9.192 -12.306 2.504 1.00 0.00 H new ATOM 0 HB2 ASN A 32 10.065 -10.717 0.459 1.00 0.00 H new ATOM 0 HB3 ASN A 32 10.786 -9.869 1.813 1.00 0.00 H new ATOM 0 HD21 ASN A 32 10.594 -13.158 0.404 1.00 0.00 H new ATOM 0 HD22 ASN A 32 12.170 -13.636 1.043 1.00 0.00 H new ATOM 154 N GLY A 33 10.504 -10.697 4.329 1.00 0.00 N ATOM 155 CA GLY A 33 10.781 -10.074 5.612 1.00 0.00 C ATOM 156 C GLY A 33 10.762 -8.548 5.496 1.00 0.00 C ATOM 157 O GLY A 33 11.717 -7.880 5.888 1.00 0.00 O ATOM 0 H GLY A 33 11.259 -11.277 3.964 1.00 0.00 H new ATOM 0 HA2 GLY A 33 10.040 -10.396 6.344 1.00 0.00 H new ATOM 0 HA3 GLY A 33 11.754 -10.402 5.977 1.00 0.00 H new ATOM 161 N GLY A 34 9.663 -8.042 4.956 1.00 0.00 N ATOM 162 CA GLY A 34 9.507 -6.608 4.783 1.00 0.00 C ATOM 163 C GLY A 34 8.869 -5.973 6.021 1.00 0.00 C ATOM 164 O GLY A 34 9.051 -6.460 7.136 1.00 0.00 O ATOM 0 H GLY A 34 8.872 -8.599 4.633 1.00 0.00 H new ATOM 0 HA2 GLY A 34 10.480 -6.153 4.596 1.00 0.00 H new ATOM 0 HA3 GLY A 34 8.889 -6.409 3.908 1.00 0.00 H new ATOM 168 N HIS A 35 8.136 -4.895 5.783 1.00 0.00 N ATOM 169 CA HIS A 35 7.471 -4.189 6.864 1.00 0.00 C ATOM 170 C HIS A 35 5.958 -4.381 6.749 1.00 0.00 C ATOM 171 O HIS A 35 5.489 -5.159 5.919 1.00 0.00 O ATOM 172 CB HIS A 35 7.881 -2.715 6.884 1.00 0.00 C ATOM 173 CG HIS A 35 9.363 -2.492 7.073 1.00 0.00 C ATOM 174 ND1 HIS A 35 10.323 -3.251 6.426 1.00 0.00 N ATOM 175 CD2 HIS A 35 10.038 -1.590 7.840 1.00 0.00 C ATOM 176 CE1 HIS A 35 11.519 -2.816 6.796 1.00 0.00 C ATOM 177 NE2 HIS A 35 11.340 -1.786 7.673 1.00 0.00 N ATOM 0 H HIS A 35 7.988 -4.494 4.857 1.00 0.00 H new ATOM 0 HA HIS A 35 7.784 -4.606 7.821 1.00 0.00 H new ATOM 0 HB2 HIS A 35 7.570 -2.249 5.949 1.00 0.00 H new ATOM 0 HB3 HIS A 35 7.343 -2.210 7.686 1.00 0.00 H new ATOM 0 HD2 HIS A 35 9.589 -0.842 8.476 1.00 0.00 H new ATOM 0 HE1 HIS A 35 12.468 -3.208 6.462 1.00 0.00 H new ATOM 0 HE2 HIS A 35 12.084 -1.255 8.125 1.00 0.00 H new ATOM 185 N PHE A 36 5.235 -3.659 7.593 1.00 0.00 N ATOM 186 CA PHE A 36 3.785 -3.741 7.596 1.00 0.00 C ATOM 187 C PHE A 36 3.158 -2.364 7.371 1.00 0.00 C ATOM 188 O PHE A 36 3.064 -1.561 8.298 1.00 0.00 O ATOM 189 CB PHE A 36 3.369 -4.259 8.975 1.00 0.00 C ATOM 190 CG PHE A 36 3.666 -5.743 9.198 1.00 0.00 C ATOM 191 CD1 PHE A 36 4.950 -6.164 9.351 1.00 0.00 C ATOM 192 CD2 PHE A 36 2.646 -6.641 9.243 1.00 0.00 C ATOM 193 CE1 PHE A 36 5.225 -7.541 9.558 1.00 0.00 C ATOM 194 CE2 PHE A 36 2.921 -8.019 9.451 1.00 0.00 C ATOM 195 CZ PHE A 36 4.205 -8.440 9.603 1.00 0.00 C ATOM 0 H PHE A 36 5.627 -3.014 8.279 1.00 0.00 H new ATOM 0 HA PHE A 36 3.448 -4.399 6.795 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.883 -3.677 9.740 1.00 0.00 H new ATOM 0 HB3 PHE A 36 2.301 -4.089 9.109 1.00 0.00 H new ATOM 0 HD1 PHE A 36 5.760 -5.451 9.315 1.00 0.00 H new ATOM 0 HD2 PHE A 36 1.626 -6.306 9.121 1.00 0.00 H new ATOM 0 HE1 PHE A 36 6.245 -7.875 9.680 1.00 0.00 H new ATOM 0 HE2 PHE A 36 2.111 -8.732 9.488 1.00 0.00 H new ATOM 0 HZ PHE A 36 4.415 -9.488 9.759 1.00 0.00 H new ATOM 205 N LEU A 37 2.743 -2.132 6.134 1.00 0.00 N ATOM 206 CA LEU A 37 2.128 -0.866 5.775 1.00 0.00 C ATOM 207 C LEU A 37 1.308 -0.349 6.959 1.00 0.00 C ATOM 208 O LEU A 37 0.761 -1.136 7.730 1.00 0.00 O ATOM 209 CB LEU A 37 1.320 -1.010 4.484 1.00 0.00 C ATOM 210 CG LEU A 37 1.769 -0.135 3.311 1.00 0.00 C ATOM 211 CD1 LEU A 37 1.101 -0.580 2.009 1.00 0.00 C ATOM 212 CD2 LEU A 37 1.520 1.346 3.606 1.00 0.00 C ATOM 0 H LEU A 37 2.821 -2.800 5.367 1.00 0.00 H new ATOM 0 HA LEU A 37 2.892 -0.118 5.564 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.358 -2.053 4.169 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.277 -0.781 4.704 1.00 0.00 H new ATOM 0 HG LEU A 37 2.844 -0.262 3.181 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.437 0.058 1.191 1.00 0.00 H new ATOM 0 HD12 LEU A 37 1.371 -1.615 1.797 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.019 -0.501 2.110 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.848 1.946 2.757 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.456 1.509 3.777 1.00 0.00 H new ATOM 0 HD23 LEU A 37 2.079 1.639 4.495 1.00 0.00 H new ATOM 224 N ARG A 38 1.249 0.970 7.066 1.00 0.00 N ATOM 225 CA ARG A 38 0.505 1.601 8.142 1.00 0.00 C ATOM 226 C ARG A 38 -0.056 2.948 7.682 1.00 0.00 C ATOM 227 O ARG A 38 0.565 3.640 6.876 1.00 0.00 O ATOM 228 CB ARG A 38 1.392 1.819 9.370 1.00 0.00 C ATOM 229 CG ARG A 38 2.489 2.845 9.080 1.00 0.00 C ATOM 230 CD ARG A 38 3.000 3.483 10.373 1.00 0.00 C ATOM 231 NE ARG A 38 3.436 2.430 11.318 1.00 0.00 N ATOM 232 CZ ARG A 38 4.169 2.663 12.415 1.00 0.00 C ATOM 233 NH1 ARG A 38 4.552 3.912 12.713 1.00 0.00 N ATOM 234 NH2 ARG A 38 4.520 1.647 13.215 1.00 0.00 N ATOM 0 H ARG A 38 1.705 1.619 6.425 1.00 0.00 H new ATOM 0 HA ARG A 38 -0.315 0.936 8.412 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.783 2.160 10.207 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.844 0.873 9.669 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.315 2.362 8.558 1.00 0.00 H new ATOM 0 HG3 ARG A 38 2.102 3.619 8.417 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.831 4.154 10.154 1.00 0.00 H new ATOM 0 HD3 ARG A 38 2.214 4.087 10.826 1.00 0.00 H new ATOM 0 HE ARG A 38 3.161 1.467 11.122 1.00 0.00 H new ATOM 0 HH11 ARG A 38 4.285 4.686 12.105 1.00 0.00 H new ATOM 0 HH12 ARG A 38 5.110 4.089 13.548 1.00 0.00 H new ATOM 0 HH21 ARG A 38 4.229 0.696 12.989 1.00 0.00 H new ATOM 0 HH22 ARG A 38 5.078 1.825 14.050 1.00 0.00 H new ATOM 248 N ILE A 39 -1.223 3.280 8.213 1.00 0.00 N ATOM 249 CA ILE A 39 -1.874 4.532 7.867 1.00 0.00 C ATOM 250 C ILE A 39 -2.121 5.343 9.140 1.00 0.00 C ATOM 251 O ILE A 39 -2.854 4.907 10.026 1.00 0.00 O ATOM 252 CB ILE A 39 -3.141 4.269 7.050 1.00 0.00 C ATOM 253 CG1 ILE A 39 -3.073 4.968 5.691 1.00 0.00 C ATOM 254 CG2 ILE A 39 -4.392 4.665 7.837 1.00 0.00 C ATOM 255 CD1 ILE A 39 -2.942 6.483 5.860 1.00 0.00 C ATOM 0 H ILE A 39 -1.735 2.703 8.881 1.00 0.00 H new ATOM 0 HA ILE A 39 -1.228 5.133 7.227 1.00 0.00 H new ATOM 0 HB ILE A 39 -3.207 3.198 6.857 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.224 4.587 5.124 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.969 4.739 5.115 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -5.279 4.468 7.234 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -4.442 4.083 8.757 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -4.348 5.726 8.081 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -2.896 6.956 4.879 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -3.805 6.864 6.406 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.032 6.710 6.415 1.00 0.00 H new ATOM 267 N LEU A 40 -1.495 6.510 9.191 1.00 0.00 N ATOM 268 CA LEU A 40 -1.637 7.386 10.341 1.00 0.00 C ATOM 269 C LEU A 40 -2.851 8.295 10.138 1.00 0.00 C ATOM 270 O LEU A 40 -3.110 8.750 9.025 1.00 0.00 O ATOM 271 CB LEU A 40 -0.335 8.147 10.599 1.00 0.00 C ATOM 272 CG LEU A 40 0.955 7.418 10.218 1.00 0.00 C ATOM 273 CD1 LEU A 40 2.077 8.413 9.911 1.00 0.00 C ATOM 274 CD2 LEU A 40 1.359 6.415 11.301 1.00 0.00 C ATOM 0 H LEU A 40 -0.888 6.869 8.454 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.822 6.803 11.243 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.373 9.088 10.050 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.288 8.398 11.659 1.00 0.00 H new ATOM 0 HG LEU A 40 0.770 6.850 9.306 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.983 7.869 9.643 1.00 0.00 H new ATOM 0 HD12 LEU A 40 1.779 9.053 9.080 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.270 9.027 10.791 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.279 5.911 11.005 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.520 6.941 12.242 1.00 0.00 H new ATOM 0 HD23 LEU A 40 0.566 5.678 11.428 1.00 0.00 H new ATOM 286 N PRO A 41 -3.581 8.538 11.259 1.00 0.00 N ATOM 287 CA PRO A 41 -4.761 9.385 11.214 1.00 0.00 C ATOM 288 C PRO A 41 -4.374 10.861 11.104 1.00 0.00 C ATOM 289 O PRO A 41 -5.229 11.739 11.198 1.00 0.00 O ATOM 290 CB PRO A 41 -5.524 9.064 12.489 1.00 0.00 C ATOM 291 CG PRO A 41 -4.521 8.400 13.419 1.00 0.00 C ATOM 292 CD PRO A 41 -3.304 8.016 12.594 1.00 0.00 C ATOM 0 HA PRO A 41 -5.380 9.197 10.337 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -5.933 9.969 12.938 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -6.365 8.402 12.285 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -4.238 9.079 14.223 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -4.959 7.518 13.886 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -2.393 8.449 13.007 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -3.163 6.935 12.575 1.00 0.00 H new ATOM 300 N ASP A 42 -3.083 11.087 10.907 1.00 0.00 N ATOM 301 CA ASP A 42 -2.572 12.442 10.784 1.00 0.00 C ATOM 302 C ASP A 42 -2.552 12.842 9.307 1.00 0.00 C ATOM 303 O ASP A 42 -2.679 14.020 8.978 1.00 0.00 O ATOM 304 CB ASP A 42 -1.143 12.542 11.320 1.00 0.00 C ATOM 305 CG ASP A 42 -0.810 13.854 12.034 1.00 0.00 C ATOM 306 OD1 ASP A 42 -1.103 14.914 11.438 1.00 0.00 O ATOM 307 OD2 ASP A 42 -0.271 13.768 13.158 1.00 0.00 O ATOM 0 H ASP A 42 -2.376 10.355 10.830 1.00 0.00 H new ATOM 0 HA ASP A 42 -3.221 13.101 11.361 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -0.972 11.716 12.011 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -0.449 12.412 10.489 1.00 0.00 H new ATOM 312 N GLY A 43 -2.391 11.838 8.457 1.00 0.00 N ATOM 313 CA GLY A 43 -2.352 12.071 7.023 1.00 0.00 C ATOM 314 C GLY A 43 -0.997 11.668 6.439 1.00 0.00 C ATOM 315 O GLY A 43 -0.638 12.094 5.342 1.00 0.00 O ATOM 0 H GLY A 43 -2.286 10.862 8.734 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -3.145 11.503 6.537 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -2.542 13.124 6.817 1.00 0.00 H new ATOM 319 N THR A 44 -0.281 10.850 7.197 1.00 0.00 N ATOM 320 CA THR A 44 1.027 10.385 6.768 1.00 0.00 C ATOM 321 C THR A 44 1.058 8.856 6.715 1.00 0.00 C ATOM 322 O THR A 44 0.472 8.190 7.567 1.00 0.00 O ATOM 323 CB THR A 44 2.074 10.981 7.711 1.00 0.00 C ATOM 324 OG1 THR A 44 2.436 12.213 7.093 1.00 0.00 O ATOM 325 CG2 THR A 44 3.374 10.175 7.726 1.00 0.00 C ATOM 0 H THR A 44 -0.582 10.497 8.106 1.00 0.00 H new ATOM 0 HA THR A 44 1.253 10.719 5.755 1.00 0.00 H new ATOM 0 HB THR A 44 1.667 11.031 8.721 1.00 0.00 H new ATOM 0 HG1 THR A 44 3.111 12.667 7.640 1.00 0.00 H new ATOM 0 HG21 THR A 44 4.083 10.641 8.411 1.00 0.00 H new ATOM 0 HG22 THR A 44 3.167 9.157 8.055 1.00 0.00 H new ATOM 0 HG23 THR A 44 3.800 10.153 6.723 1.00 0.00 H new ATOM 333 N VAL A 45 1.747 8.345 5.705 1.00 0.00 N ATOM 334 CA VAL A 45 1.862 6.907 5.530 1.00 0.00 C ATOM 335 C VAL A 45 3.311 6.482 5.771 1.00 0.00 C ATOM 336 O VAL A 45 4.202 7.326 5.867 1.00 0.00 O ATOM 337 CB VAL A 45 1.343 6.505 4.147 1.00 0.00 C ATOM 338 CG1 VAL A 45 0.939 5.030 4.120 1.00 0.00 C ATOM 339 CG2 VAL A 45 0.180 7.401 3.717 1.00 0.00 C ATOM 0 H VAL A 45 2.231 8.901 5.000 1.00 0.00 H new ATOM 0 HA VAL A 45 1.244 6.383 6.260 1.00 0.00 H new ATOM 0 HB VAL A 45 2.154 6.642 3.432 1.00 0.00 H new ATOM 0 HG11 VAL A 45 0.574 4.771 3.126 1.00 0.00 H new ATOM 0 HG12 VAL A 45 1.803 4.412 4.362 1.00 0.00 H new ATOM 0 HG13 VAL A 45 0.151 4.855 4.853 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -0.170 7.095 2.731 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -0.634 7.310 4.436 1.00 0.00 H new ATOM 0 HG23 VAL A 45 0.515 8.438 3.677 1.00 0.00 H new ATOM 349 N ASP A 46 3.504 5.175 5.863 1.00 0.00 N ATOM 350 CA ASP A 46 4.831 4.628 6.091 1.00 0.00 C ATOM 351 C ASP A 46 4.724 3.117 6.310 1.00 0.00 C ATOM 352 O ASP A 46 3.658 2.533 6.123 1.00 0.00 O ATOM 353 CB ASP A 46 5.472 5.242 7.337 1.00 0.00 C ATOM 354 CG ASP A 46 4.521 6.045 8.226 1.00 0.00 C ATOM 355 OD1 ASP A 46 3.359 5.603 8.358 1.00 0.00 O ATOM 356 OD2 ASP A 46 4.976 7.083 8.753 1.00 0.00 O ATOM 0 H ASP A 46 2.763 4.478 5.784 1.00 0.00 H new ATOM 0 HA ASP A 46 5.445 4.856 5.220 1.00 0.00 H new ATOM 0 HB2 ASP A 46 5.912 4.442 7.932 1.00 0.00 H new ATOM 0 HB3 ASP A 46 6.288 5.893 7.024 1.00 0.00 H new ATOM 361 N GLY A 47 5.844 2.528 6.702 1.00 0.00 N ATOM 362 CA GLY A 47 5.890 1.097 6.948 1.00 0.00 C ATOM 363 C GLY A 47 6.686 0.784 8.217 1.00 0.00 C ATOM 364 O GLY A 47 7.662 1.465 8.526 1.00 0.00 O ATOM 0 H GLY A 47 6.727 3.016 6.855 1.00 0.00 H new ATOM 0 HA2 GLY A 47 4.876 0.708 7.045 1.00 0.00 H new ATOM 0 HA3 GLY A 47 6.345 0.592 6.096 1.00 0.00 H new ATOM 368 N THR A 48 6.239 -0.248 8.918 1.00 0.00 N ATOM 369 CA THR A 48 6.897 -0.660 10.146 1.00 0.00 C ATOM 370 C THR A 48 7.359 -2.114 10.042 1.00 0.00 C ATOM 371 O THR A 48 6.565 -3.001 9.731 1.00 0.00 O ATOM 372 CB THR A 48 5.931 -0.411 11.306 1.00 0.00 C ATOM 373 OG1 THR A 48 5.330 0.844 10.995 1.00 0.00 O ATOM 374 CG2 THR A 48 6.657 -0.158 12.629 1.00 0.00 C ATOM 0 H THR A 48 5.429 -0.811 8.659 1.00 0.00 H new ATOM 0 HA THR A 48 7.801 -0.077 10.325 1.00 0.00 H new ATOM 0 HB THR A 48 5.267 -1.268 11.414 1.00 0.00 H new ATOM 0 HG1 THR A 48 6.017 1.543 10.988 1.00 0.00 H new ATOM 0 HG21 THR A 48 5.925 0.013 13.419 1.00 0.00 H new ATOM 0 HG22 THR A 48 7.267 -1.025 12.881 1.00 0.00 H new ATOM 0 HG23 THR A 48 7.297 0.719 12.531 1.00 0.00 H new ATOM 382 N ARG A 49 8.641 -2.315 10.308 1.00 0.00 N ATOM 383 CA ARG A 49 9.218 -3.647 10.248 1.00 0.00 C ATOM 384 C ARG A 49 8.232 -4.678 10.799 1.00 0.00 C ATOM 385 O ARG A 49 8.180 -5.810 10.321 1.00 0.00 O ATOM 386 CB ARG A 49 10.521 -3.719 11.047 1.00 0.00 C ATOM 387 CG ARG A 49 11.130 -5.121 10.977 1.00 0.00 C ATOM 388 CD ARG A 49 12.500 -5.158 11.657 1.00 0.00 C ATOM 389 NE ARG A 49 13.572 -5.086 10.640 1.00 0.00 N ATOM 390 CZ ARG A 49 14.827 -5.510 10.840 1.00 0.00 C ATOM 391 NH1 ARG A 49 15.176 -6.040 12.020 1.00 0.00 N ATOM 392 NH2 ARG A 49 15.734 -5.405 9.859 1.00 0.00 N ATOM 0 H ARG A 49 9.297 -1.577 10.566 1.00 0.00 H new ATOM 0 HA ARG A 49 9.433 -3.868 9.203 1.00 0.00 H new ATOM 0 HB2 ARG A 49 11.232 -2.990 10.657 1.00 0.00 H new ATOM 0 HB3 ARG A 49 10.330 -3.453 12.087 1.00 0.00 H new ATOM 0 HG2 ARG A 49 10.462 -5.836 11.457 1.00 0.00 H new ATOM 0 HG3 ARG A 49 11.229 -5.427 9.935 1.00 0.00 H new ATOM 0 HD2 ARG A 49 12.592 -4.325 12.354 1.00 0.00 H new ATOM 0 HD3 ARG A 49 12.601 -6.074 12.240 1.00 0.00 H new ATOM 0 HE ARG A 49 13.341 -4.689 9.729 1.00 0.00 H new ATOM 0 HH11 ARG A 49 14.486 -6.121 12.767 1.00 0.00 H new ATOM 0 HH12 ARG A 49 16.132 -6.363 12.171 1.00 0.00 H new ATOM 0 HH21 ARG A 49 15.469 -5.002 8.960 1.00 0.00 H new ATOM 0 HH22 ARG A 49 16.690 -5.728 10.011 1.00 0.00 H new ATOM 406 N ASP A 50 7.474 -4.250 11.797 1.00 0.00 N ATOM 407 CA ASP A 50 6.492 -5.122 12.419 1.00 0.00 C ATOM 408 C ASP A 50 5.312 -4.283 12.916 1.00 0.00 C ATOM 409 O ASP A 50 5.479 -3.420 13.776 1.00 0.00 O ATOM 410 CB ASP A 50 7.089 -5.856 13.621 1.00 0.00 C ATOM 411 CG ASP A 50 7.307 -7.357 13.419 1.00 0.00 C ATOM 412 OD1 ASP A 50 6.422 -7.980 12.793 1.00 0.00 O ATOM 413 OD2 ASP A 50 8.353 -7.848 13.895 1.00 0.00 O ATOM 0 H ASP A 50 7.520 -3.310 12.191 1.00 0.00 H new ATOM 0 HA ASP A 50 6.170 -5.851 11.675 1.00 0.00 H new ATOM 0 HB2 ASP A 50 8.045 -5.396 13.871 1.00 0.00 H new ATOM 0 HB3 ASP A 50 6.432 -5.712 14.479 1.00 0.00 H new ATOM 418 N ARG A 51 4.147 -4.566 12.352 1.00 0.00 N ATOM 419 CA ARG A 51 2.941 -3.849 12.727 1.00 0.00 C ATOM 420 C ARG A 51 2.955 -3.533 14.224 1.00 0.00 C ATOM 421 O ARG A 51 3.021 -4.439 15.053 1.00 0.00 O ATOM 422 CB ARG A 51 1.689 -4.664 12.397 1.00 0.00 C ATOM 423 CG ARG A 51 1.753 -6.051 13.040 1.00 0.00 C ATOM 424 CD ARG A 51 1.914 -7.141 11.979 1.00 0.00 C ATOM 425 NE ARG A 51 1.546 -8.458 12.545 1.00 0.00 N ATOM 426 CZ ARG A 51 2.316 -9.152 13.394 1.00 0.00 C ATOM 427 NH1 ARG A 51 3.501 -8.660 13.779 1.00 0.00 N ATOM 428 NH2 ARG A 51 1.901 -10.339 13.857 1.00 0.00 N ATOM 0 H ARG A 51 4.013 -5.282 11.638 1.00 0.00 H new ATOM 0 HA ARG A 51 2.917 -2.921 12.156 1.00 0.00 H new ATOM 0 HB2 ARG A 51 0.803 -4.136 12.750 1.00 0.00 H new ATOM 0 HB3 ARG A 51 1.590 -4.764 11.316 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.588 -6.093 13.739 1.00 0.00 H new ATOM 0 HG3 ARG A 51 0.845 -6.231 13.616 1.00 0.00 H new ATOM 0 HD2 ARG A 51 1.284 -6.917 11.118 1.00 0.00 H new ATOM 0 HD3 ARG A 51 2.944 -7.164 11.623 1.00 0.00 H new ATOM 0 HE ARG A 51 0.650 -8.863 12.272 1.00 0.00 H new ATOM 0 HH11 ARG A 51 3.817 -7.757 13.426 1.00 0.00 H new ATOM 0 HH12 ARG A 51 4.087 -9.188 14.425 1.00 0.00 H new ATOM 0 HH21 ARG A 51 0.999 -10.714 13.563 1.00 0.00 H new ATOM 0 HH22 ARG A 51 2.487 -10.868 14.503 1.00 0.00 H new ATOM 442 N SER A 52 2.891 -2.244 14.525 1.00 0.00 N ATOM 443 CA SER A 52 2.895 -1.797 15.908 1.00 0.00 C ATOM 444 C SER A 52 2.792 -0.272 15.965 1.00 0.00 C ATOM 445 O SER A 52 3.743 0.404 16.354 1.00 0.00 O ATOM 446 CB SER A 52 4.155 -2.271 16.636 1.00 0.00 C ATOM 447 OG SER A 52 5.267 -1.415 16.391 1.00 0.00 O ATOM 0 H SER A 52 2.836 -1.495 13.835 1.00 0.00 H new ATOM 0 HA SER A 52 2.031 -2.232 16.411 1.00 0.00 H new ATOM 0 HB2 SER A 52 3.960 -2.314 17.708 1.00 0.00 H new ATOM 0 HB3 SER A 52 4.400 -3.284 16.315 1.00 0.00 H new ATOM 0 HG SER A 52 5.109 -0.544 16.812 1.00 0.00 H new ATOM 453 N ASP A 53 1.628 0.225 15.572 1.00 0.00 N ATOM 454 CA ASP A 53 1.388 1.658 15.574 1.00 0.00 C ATOM 455 C ASP A 53 -0.042 1.931 16.046 1.00 0.00 C ATOM 456 O ASP A 53 -0.752 1.011 16.450 1.00 0.00 O ATOM 457 CB ASP A 53 1.542 2.245 14.169 1.00 0.00 C ATOM 458 CG ASP A 53 2.180 3.634 14.114 1.00 0.00 C ATOM 459 OD1 ASP A 53 2.736 4.044 15.156 1.00 0.00 O ATOM 460 OD2 ASP A 53 2.097 4.254 13.032 1.00 0.00 O ATOM 0 H ASP A 53 0.841 -0.339 15.250 1.00 0.00 H new ATOM 0 HA ASP A 53 2.117 2.120 16.240 1.00 0.00 H new ATOM 0 HB2 ASP A 53 2.144 1.561 13.570 1.00 0.00 H new ATOM 0 HB3 ASP A 53 0.558 2.295 13.703 1.00 0.00 H new ATOM 465 N GLN A 54 -0.421 3.199 15.980 1.00 0.00 N ATOM 466 CA GLN A 54 -1.753 3.604 16.396 1.00 0.00 C ATOM 467 C GLN A 54 -2.813 2.846 15.594 1.00 0.00 C ATOM 468 O GLN A 54 -3.841 2.448 16.139 1.00 0.00 O ATOM 469 CB GLN A 54 -1.936 5.116 16.254 1.00 0.00 C ATOM 470 CG GLN A 54 -1.260 5.633 14.982 1.00 0.00 C ATOM 471 CD GLN A 54 0.084 6.290 15.303 1.00 0.00 C ATOM 472 OE1 GLN A 54 1.032 6.051 14.401 1.00 0.00 O flip ATOM 473 NE2 GLN A 54 0.249 6.969 16.303 1.00 0.00 N flip ATOM 0 H GLN A 54 0.171 3.959 15.645 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.875 3.354 17.450 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.999 5.357 16.229 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -1.516 5.620 17.124 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -1.108 4.808 14.286 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -1.912 6.353 14.487 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -0.522 7.113 16.955 1.00 0.00 H new ATOM 0 HE22 GLN A 54 1.158 7.393 16.487 1.00 0.00 H new ATOM 482 N HIS A 55 -2.525 2.669 14.313 1.00 0.00 N ATOM 483 CA HIS A 55 -3.441 1.966 13.431 1.00 0.00 C ATOM 484 C HIS A 55 -2.791 1.780 12.059 1.00 0.00 C ATOM 485 O HIS A 55 -2.670 2.733 11.290 1.00 0.00 O ATOM 486 CB HIS A 55 -4.787 2.690 13.356 1.00 0.00 C ATOM 487 CG HIS A 55 -5.889 2.020 14.142 1.00 0.00 C ATOM 488 ND1 HIS A 55 -6.411 0.785 13.799 1.00 0.00 N ATOM 489 CD2 HIS A 55 -6.561 2.426 15.257 1.00 0.00 C ATOM 490 CE1 HIS A 55 -7.355 0.472 14.675 1.00 0.00 C ATOM 491 NE2 HIS A 55 -7.446 1.491 15.577 1.00 0.00 N ATOM 0 H HIS A 55 -1.671 3.000 13.865 1.00 0.00 H new ATOM 0 HA HIS A 55 -3.650 0.975 13.833 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -4.661 3.709 13.722 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -5.092 2.762 12.312 1.00 0.00 H new ATOM 0 HD1 HIS A 55 -6.119 0.213 13.007 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -6.400 3.352 15.789 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -7.948 -0.431 14.675 1.00 0.00 H new ATOM 499 N ILE A 56 -2.388 0.546 11.792 1.00 0.00 N ATOM 500 CA ILE A 56 -1.753 0.223 10.526 1.00 0.00 C ATOM 501 C ILE A 56 -2.721 -0.596 9.669 1.00 0.00 C ATOM 502 O ILE A 56 -2.317 -1.202 8.678 1.00 0.00 O ATOM 503 CB ILE A 56 -0.407 -0.466 10.762 1.00 0.00 C ATOM 504 CG1 ILE A 56 -0.572 -1.986 10.821 1.00 0.00 C ATOM 505 CG2 ILE A 56 0.279 0.086 12.013 1.00 0.00 C ATOM 506 CD1 ILE A 56 -1.625 -2.383 11.857 1.00 0.00 C ATOM 0 H ILE A 56 -2.489 -0.242 12.431 1.00 0.00 H new ATOM 0 HA ILE A 56 -1.526 1.133 9.971 1.00 0.00 H new ATOM 0 HB ILE A 56 0.243 -0.246 9.915 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.862 -2.362 9.840 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.382 -2.450 11.071 1.00 0.00 H new ATOM 0 HG21 ILE A 56 1.233 -0.420 12.158 1.00 0.00 H new ATOM 0 HG22 ILE A 56 0.450 1.156 11.892 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -0.357 -0.083 12.882 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -1.723 -3.468 11.879 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.320 -2.026 12.841 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.584 -1.938 11.591 1.00 0.00 H new ATOM 518 N GLN A 57 -3.979 -0.587 10.083 1.00 0.00 N ATOM 519 CA GLN A 57 -5.008 -1.321 9.365 1.00 0.00 C ATOM 520 C GLN A 57 -4.952 -0.991 7.872 1.00 0.00 C ATOM 521 O GLN A 57 -4.565 0.113 7.491 1.00 0.00 O ATOM 522 CB GLN A 57 -6.394 -1.027 9.941 1.00 0.00 C ATOM 523 CG GLN A 57 -6.855 -2.155 10.866 1.00 0.00 C ATOM 524 CD GLN A 57 -6.207 -2.032 12.246 1.00 0.00 C ATOM 525 OE1 GLN A 57 -5.301 -1.246 12.467 1.00 0.00 O ATOM 526 NE2 GLN A 57 -6.721 -2.851 13.160 1.00 0.00 N ATOM 0 H GLN A 57 -4.310 -0.083 10.906 1.00 0.00 H new ATOM 0 HA GLN A 57 -4.819 -2.387 9.488 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -6.371 -0.087 10.492 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -7.110 -0.903 9.129 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -7.940 -2.127 10.966 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -6.600 -3.119 10.425 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -7.479 -3.485 12.908 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -6.357 -2.845 14.113 1.00 0.00 H new ATOM 535 N LEU A 58 -5.345 -1.968 7.068 1.00 0.00 N ATOM 536 CA LEU A 58 -5.345 -1.794 5.625 1.00 0.00 C ATOM 537 C LEU A 58 -6.494 -2.602 5.019 1.00 0.00 C ATOM 538 O LEU A 58 -7.097 -3.434 5.695 1.00 0.00 O ATOM 539 CB LEU A 58 -3.973 -2.144 5.044 1.00 0.00 C ATOM 540 CG LEU A 58 -2.906 -1.051 5.139 1.00 0.00 C ATOM 541 CD1 LEU A 58 -1.668 -1.558 5.880 1.00 0.00 C ATOM 542 CD2 LEU A 58 -2.560 -0.501 3.754 1.00 0.00 C ATOM 0 H LEU A 58 -5.665 -2.882 7.388 1.00 0.00 H new ATOM 0 HA LEU A 58 -5.518 -0.749 5.366 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.601 -3.033 5.553 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -4.102 -2.408 3.994 1.00 0.00 H new ATOM 0 HG LEU A 58 -3.314 -0.224 5.721 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -0.925 -0.762 5.934 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -1.947 -1.863 6.889 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -1.248 -2.411 5.346 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -1.800 0.274 3.850 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.179 -1.307 3.127 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -3.454 -0.077 3.297 1.00 0.00 H new ATOM 554 N GLN A 59 -6.762 -2.329 3.750 1.00 0.00 N ATOM 555 CA GLN A 59 -7.828 -3.020 3.045 1.00 0.00 C ATOM 556 C GLN A 59 -7.830 -2.625 1.567 1.00 0.00 C ATOM 557 O GLN A 59 -7.846 -1.439 1.238 1.00 0.00 O ATOM 558 CB GLN A 59 -9.186 -2.737 3.690 1.00 0.00 C ATOM 559 CG GLN A 59 -10.202 -3.822 3.330 1.00 0.00 C ATOM 560 CD GLN A 59 -9.991 -5.075 4.182 1.00 0.00 C ATOM 561 OE1 GLN A 59 -9.110 -5.883 3.937 1.00 0.00 O ATOM 562 NE2 GLN A 59 -10.846 -5.192 5.194 1.00 0.00 N ATOM 0 H GLN A 59 -6.259 -1.639 3.192 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.647 -4.093 3.114 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -9.074 -2.684 4.773 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -9.554 -1.766 3.360 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -11.213 -3.443 3.479 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -10.109 -4.076 2.274 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -11.560 -4.479 5.343 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -10.787 -5.994 5.821 1.00 0.00 H new ATOM 571 N LEU A 60 -7.813 -3.640 0.716 1.00 0.00 N ATOM 572 CA LEU A 60 -7.813 -3.413 -0.719 1.00 0.00 C ATOM 573 C LEU A 60 -9.252 -3.453 -1.238 1.00 0.00 C ATOM 574 O LEU A 60 -10.145 -3.962 -0.562 1.00 0.00 O ATOM 575 CB LEU A 60 -6.880 -4.403 -1.418 1.00 0.00 C ATOM 576 CG LEU A 60 -5.381 -4.158 -1.231 1.00 0.00 C ATOM 577 CD1 LEU A 60 -4.651 -5.460 -0.893 1.00 0.00 C ATOM 578 CD2 LEU A 60 -4.781 -3.467 -2.457 1.00 0.00 C ATOM 0 H LEU A 60 -7.799 -4.622 0.993 1.00 0.00 H new ATOM 0 HA LEU A 60 -7.419 -2.423 -0.948 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.112 -5.406 -1.059 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -7.100 -4.388 -2.485 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.248 -3.484 -0.384 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -3.587 -5.258 -0.765 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -5.055 -5.875 0.030 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -4.790 -6.176 -1.703 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -3.715 -3.305 -2.298 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -4.925 -4.096 -3.336 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -5.275 -2.508 -2.612 1.00 0.00 H new ATOM 590 N SER A 61 -9.432 -2.911 -2.433 1.00 0.00 N ATOM 591 CA SER A 61 -10.747 -2.879 -3.050 1.00 0.00 C ATOM 592 C SER A 61 -10.620 -3.065 -4.564 1.00 0.00 C ATOM 593 O SER A 61 -11.158 -2.275 -5.337 1.00 0.00 O ATOM 594 CB SER A 61 -11.471 -1.568 -2.736 1.00 0.00 C ATOM 595 OG SER A 61 -12.533 -1.311 -3.652 1.00 0.00 O ATOM 0 H SER A 61 -8.689 -2.490 -2.991 1.00 0.00 H new ATOM 0 HA SER A 61 -11.338 -3.697 -2.638 1.00 0.00 H new ATOM 0 HB2 SER A 61 -11.869 -1.608 -1.722 1.00 0.00 H new ATOM 0 HB3 SER A 61 -10.758 -0.744 -2.767 1.00 0.00 H new ATOM 0 HG SER A 61 -12.180 -1.296 -4.566 1.00 0.00 H new ATOM 601 N ALA A 62 -9.906 -4.116 -4.940 1.00 0.00 N ATOM 602 CA ALA A 62 -9.701 -4.416 -6.347 1.00 0.00 C ATOM 603 C ALA A 62 -10.992 -4.132 -7.118 1.00 0.00 C ATOM 604 O ALA A 62 -12.054 -4.647 -6.768 1.00 0.00 O ATOM 605 CB ALA A 62 -9.240 -5.867 -6.497 1.00 0.00 C ATOM 0 H ALA A 62 -9.462 -4.770 -4.295 1.00 0.00 H new ATOM 0 HA ALA A 62 -8.921 -3.780 -6.765 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -9.086 -6.093 -7.552 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -8.305 -6.010 -5.955 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -10.000 -6.534 -6.090 1.00 0.00 H new ATOM 611 N GLU A 63 -10.859 -3.314 -8.151 1.00 0.00 N ATOM 612 CA GLU A 63 -12.001 -2.956 -8.974 1.00 0.00 C ATOM 613 C GLU A 63 -11.796 -3.444 -10.410 1.00 0.00 C ATOM 614 O GLU A 63 -12.666 -3.266 -11.260 1.00 0.00 O ATOM 615 CB GLU A 63 -12.251 -1.447 -8.939 1.00 0.00 C ATOM 616 CG GLU A 63 -11.228 -0.702 -9.799 1.00 0.00 C ATOM 617 CD GLU A 63 -11.915 0.050 -10.941 1.00 0.00 C ATOM 618 OE1 GLU A 63 -12.098 -0.580 -12.005 1.00 0.00 O ATOM 619 OE2 GLU A 63 -12.241 1.237 -10.724 1.00 0.00 O ATOM 0 H GLU A 63 -9.977 -2.889 -8.437 1.00 0.00 H new ATOM 0 HA GLU A 63 -12.885 -3.447 -8.567 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -13.258 -1.233 -9.298 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.196 -1.089 -7.911 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.670 0.001 -9.180 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.506 -1.410 -10.207 1.00 0.00 H new ATOM 626 N SER A 64 -10.639 -4.050 -10.635 1.00 0.00 N ATOM 627 CA SER A 64 -10.308 -4.565 -11.952 1.00 0.00 C ATOM 628 C SER A 64 -8.791 -4.696 -12.097 1.00 0.00 C ATOM 629 O SER A 64 -8.056 -3.738 -11.860 1.00 0.00 O ATOM 630 CB SER A 64 -10.871 -3.664 -13.053 1.00 0.00 C ATOM 631 OG SER A 64 -12.084 -4.179 -13.596 1.00 0.00 O ATOM 0 H SER A 64 -9.919 -4.196 -9.927 1.00 0.00 H new ATOM 0 HA SER A 64 -10.763 -5.550 -12.058 1.00 0.00 H new ATOM 0 HB2 SER A 64 -11.049 -2.667 -12.650 1.00 0.00 H new ATOM 0 HB3 SER A 64 -10.133 -3.559 -13.849 1.00 0.00 H new ATOM 0 HG SER A 64 -12.816 -4.027 -12.963 1.00 0.00 H new ATOM 637 N VAL A 65 -8.366 -5.889 -12.486 1.00 0.00 N ATOM 638 CA VAL A 65 -6.949 -6.157 -12.665 1.00 0.00 C ATOM 639 C VAL A 65 -6.278 -4.932 -13.292 1.00 0.00 C ATOM 640 O VAL A 65 -6.879 -4.244 -14.114 1.00 0.00 O ATOM 641 CB VAL A 65 -6.757 -7.431 -13.490 1.00 0.00 C ATOM 642 CG1 VAL A 65 -6.680 -8.663 -12.587 1.00 0.00 C ATOM 643 CG2 VAL A 65 -7.869 -7.582 -14.531 1.00 0.00 C ATOM 0 H VAL A 65 -8.978 -6.681 -12.682 1.00 0.00 H new ATOM 0 HA VAL A 65 -6.469 -6.334 -11.702 1.00 0.00 H new ATOM 0 HB VAL A 65 -5.809 -7.347 -14.022 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.543 -9.555 -13.199 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -5.838 -8.560 -11.902 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.604 -8.753 -12.015 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -7.709 -8.495 -15.104 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.834 -7.634 -14.027 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -7.856 -6.725 -15.204 1.00 0.00 H new ATOM 653 N GLY A 66 -5.041 -4.699 -12.878 1.00 0.00 N ATOM 654 CA GLY A 66 -4.282 -3.570 -13.388 1.00 0.00 C ATOM 655 C GLY A 66 -4.769 -2.258 -12.769 1.00 0.00 C ATOM 656 O GLY A 66 -4.315 -1.181 -13.153 1.00 0.00 O ATOM 0 H GLY A 66 -4.546 -5.273 -12.195 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -3.224 -3.709 -13.168 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.378 -3.522 -14.473 1.00 0.00 H new ATOM 660 N GLU A 67 -5.686 -2.391 -11.823 1.00 0.00 N ATOM 661 CA GLU A 67 -6.239 -1.230 -11.147 1.00 0.00 C ATOM 662 C GLU A 67 -7.092 -1.666 -9.954 1.00 0.00 C ATOM 663 O GLU A 67 -8.209 -2.150 -10.130 1.00 0.00 O ATOM 664 CB GLU A 67 -7.050 -0.367 -12.116 1.00 0.00 C ATOM 665 CG GLU A 67 -6.661 1.108 -11.994 1.00 0.00 C ATOM 666 CD GLU A 67 -7.228 1.922 -13.159 1.00 0.00 C ATOM 667 OE1 GLU A 67 -7.462 1.306 -14.221 1.00 0.00 O ATOM 668 OE2 GLU A 67 -7.413 3.142 -12.961 1.00 0.00 O ATOM 0 H GLU A 67 -6.060 -3.286 -11.508 1.00 0.00 H new ATOM 0 HA GLU A 67 -5.414 -0.623 -10.775 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -6.884 -0.707 -13.138 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.114 -0.484 -11.910 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -7.032 1.509 -11.051 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -5.575 1.201 -11.975 1.00 0.00 H new ATOM 675 N VAL A 68 -6.533 -1.478 -8.768 1.00 0.00 N ATOM 676 CA VAL A 68 -7.229 -1.846 -7.546 1.00 0.00 C ATOM 677 C VAL A 68 -7.293 -0.633 -6.616 1.00 0.00 C ATOM 678 O VAL A 68 -6.639 0.379 -6.863 1.00 0.00 O ATOM 679 CB VAL A 68 -6.551 -3.058 -6.903 1.00 0.00 C ATOM 680 CG1 VAL A 68 -6.588 -4.268 -7.838 1.00 0.00 C ATOM 681 CG2 VAL A 68 -5.115 -2.727 -6.489 1.00 0.00 C ATOM 0 H VAL A 68 -5.606 -1.076 -8.627 1.00 0.00 H new ATOM 0 HA VAL A 68 -8.255 -2.142 -7.765 1.00 0.00 H new ATOM 0 HB VAL A 68 -7.108 -3.315 -6.002 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -6.100 -5.115 -7.356 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -7.624 -4.525 -8.060 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -6.067 -4.028 -8.765 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.656 -3.605 -6.035 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.542 -2.431 -7.368 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.123 -1.909 -5.769 1.00 0.00 H new ATOM 691 N TYR A 69 -8.089 -0.774 -5.566 1.00 0.00 N ATOM 692 CA TYR A 69 -8.247 0.297 -4.598 1.00 0.00 C ATOM 693 C TYR A 69 -7.755 -0.135 -3.215 1.00 0.00 C ATOM 694 O TYR A 69 -7.507 -1.318 -2.982 1.00 0.00 O ATOM 695 CB TYR A 69 -9.749 0.581 -4.525 1.00 0.00 C ATOM 696 CG TYR A 69 -10.240 1.602 -5.553 1.00 0.00 C ATOM 697 CD1 TYR A 69 -10.618 1.185 -6.813 1.00 0.00 C ATOM 698 CD2 TYR A 69 -10.304 2.940 -5.221 1.00 0.00 C ATOM 699 CE1 TYR A 69 -11.080 2.147 -7.781 1.00 0.00 C ATOM 700 CE2 TYR A 69 -10.766 3.901 -6.189 1.00 0.00 C ATOM 701 CZ TYR A 69 -11.131 3.457 -7.421 1.00 0.00 C ATOM 702 OH TYR A 69 -11.567 4.365 -8.335 1.00 0.00 O ATOM 0 H TYR A 69 -8.631 -1.614 -5.365 1.00 0.00 H new ATOM 0 HA TYR A 69 -7.669 1.172 -4.897 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -10.292 -0.353 -4.668 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -9.992 0.941 -3.525 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -10.568 0.138 -7.073 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -10.008 3.266 -4.235 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -11.379 1.834 -8.771 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -10.821 4.951 -5.942 1.00 0.00 H new ATOM 0 HH TYR A 69 -11.551 5.261 -7.939 1.00 0.00 H new ATOM 712 N ILE A 70 -7.627 0.846 -2.334 1.00 0.00 N ATOM 713 CA ILE A 70 -7.168 0.581 -0.981 1.00 0.00 C ATOM 714 C ILE A 70 -7.852 1.552 -0.016 1.00 0.00 C ATOM 715 O ILE A 70 -7.839 2.763 -0.235 1.00 0.00 O ATOM 716 CB ILE A 70 -5.640 0.623 -0.915 1.00 0.00 C ATOM 717 CG1 ILE A 70 -5.026 -0.538 -1.699 1.00 0.00 C ATOM 718 CG2 ILE A 70 -5.155 0.656 0.535 1.00 0.00 C ATOM 719 CD1 ILE A 70 -3.506 -0.390 -1.797 1.00 0.00 C ATOM 0 H ILE A 70 -7.833 1.825 -2.531 1.00 0.00 H new ATOM 0 HA ILE A 70 -7.449 -0.426 -0.674 1.00 0.00 H new ATOM 0 HB ILE A 70 -5.302 1.545 -1.388 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.272 -1.481 -1.212 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -5.457 -0.574 -2.700 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.066 0.686 0.554 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.551 1.542 1.031 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -5.503 -0.236 1.055 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.094 -1.228 -2.359 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.263 0.543 -2.306 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -3.076 -0.379 -0.795 1.00 0.00 H new ATOM 731 N LYS A 71 -8.434 0.985 1.030 1.00 0.00 N ATOM 732 CA LYS A 71 -9.122 1.785 2.029 1.00 0.00 C ATOM 733 C LYS A 71 -8.678 1.344 3.425 1.00 0.00 C ATOM 734 O LYS A 71 -9.111 0.304 3.918 1.00 0.00 O ATOM 735 CB LYS A 71 -10.636 1.721 1.817 1.00 0.00 C ATOM 736 CG LYS A 71 -11.318 2.984 2.347 1.00 0.00 C ATOM 737 CD LYS A 71 -12.189 2.667 3.565 1.00 0.00 C ATOM 738 CE LYS A 71 -11.357 2.664 4.848 1.00 0.00 C ATOM 739 NZ LYS A 71 -12.176 3.108 5.998 1.00 0.00 N ATOM 0 H LYS A 71 -8.443 -0.019 1.208 1.00 0.00 H new ATOM 0 HA LYS A 71 -8.853 2.836 1.926 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -10.853 1.604 0.755 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -11.041 0.845 2.324 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -10.564 3.723 2.617 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -11.931 3.427 1.562 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -12.988 3.404 3.647 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -12.665 1.695 3.433 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -10.970 1.662 5.035 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -10.496 3.322 4.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -11.573 3.609 6.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -12.926 3.747 5.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -12.606 2.280 6.458 1.00 0.00 H new ATOM 753 N SER A 72 -7.819 2.157 4.022 1.00 0.00 N ATOM 754 CA SER A 72 -7.310 1.864 5.351 1.00 0.00 C ATOM 755 C SER A 72 -8.459 1.863 6.362 1.00 0.00 C ATOM 756 O SER A 72 -8.645 2.832 7.096 1.00 0.00 O ATOM 757 CB SER A 72 -6.238 2.873 5.766 1.00 0.00 C ATOM 758 OG SER A 72 -5.443 2.394 6.847 1.00 0.00 O ATOM 0 H SER A 72 -7.462 3.019 3.609 1.00 0.00 H new ATOM 0 HA SER A 72 -6.850 0.876 5.331 1.00 0.00 H new ATOM 0 HB2 SER A 72 -5.596 3.091 4.913 1.00 0.00 H new ATOM 0 HB3 SER A 72 -6.714 3.810 6.054 1.00 0.00 H new ATOM 0 HG SER A 72 -5.297 1.430 6.744 1.00 0.00 H new ATOM 764 N THR A 73 -9.199 0.764 6.368 1.00 0.00 N ATOM 765 CA THR A 73 -10.324 0.624 7.277 1.00 0.00 C ATOM 766 C THR A 73 -9.892 0.933 8.712 1.00 0.00 C ATOM 767 O THR A 73 -9.137 0.171 9.314 1.00 0.00 O ATOM 768 CB THR A 73 -10.899 -0.784 7.105 1.00 0.00 C ATOM 769 OG1 THR A 73 -12.249 -0.663 7.542 1.00 0.00 O ATOM 770 CG2 THR A 73 -10.281 -1.791 8.076 1.00 0.00 C ATOM 0 H THR A 73 -9.041 -0.038 5.758 1.00 0.00 H new ATOM 0 HA THR A 73 -11.111 1.342 7.046 1.00 0.00 H new ATOM 0 HB THR A 73 -10.736 -1.120 6.081 1.00 0.00 H new ATOM 0 HG1 THR A 73 -12.698 -1.531 7.463 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.724 -2.773 7.912 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.205 -1.845 7.908 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.473 -1.473 9.101 1.00 0.00 H new ATOM 778 N GLU A 74 -10.390 2.051 9.218 1.00 0.00 N ATOM 779 CA GLU A 74 -10.065 2.470 10.570 1.00 0.00 C ATOM 780 C GLU A 74 -10.461 3.933 10.783 1.00 0.00 C ATOM 781 O GLU A 74 -11.011 4.285 11.825 1.00 0.00 O ATOM 782 CB GLU A 74 -8.580 2.256 10.869 1.00 0.00 C ATOM 783 CG GLU A 74 -8.126 3.123 12.045 1.00 0.00 C ATOM 784 CD GLU A 74 -8.977 2.850 13.287 1.00 0.00 C ATOM 785 OE1 GLU A 74 -9.614 1.774 13.315 1.00 0.00 O ATOM 786 OE2 GLU A 74 -8.973 3.723 14.181 1.00 0.00 O ATOM 0 H GLU A 74 -11.017 2.680 8.716 1.00 0.00 H new ATOM 0 HA GLU A 74 -10.635 1.854 11.266 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.399 1.205 11.096 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -7.989 2.497 9.985 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -7.078 2.922 12.266 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -8.198 4.176 11.774 1.00 0.00 H new ATOM 793 N THR A 75 -10.166 4.744 9.778 1.00 0.00 N ATOM 794 CA THR A 75 -10.485 6.161 9.842 1.00 0.00 C ATOM 795 C THR A 75 -10.687 6.726 8.435 1.00 0.00 C ATOM 796 O THR A 75 -10.091 7.741 8.078 1.00 0.00 O ATOM 797 CB THR A 75 -9.372 6.861 10.624 1.00 0.00 C ATOM 798 OG1 THR A 75 -9.604 8.248 10.391 1.00 0.00 O ATOM 799 CG2 THR A 75 -7.987 6.609 10.025 1.00 0.00 C ATOM 0 H THR A 75 -9.710 4.448 8.915 1.00 0.00 H new ATOM 0 HA THR A 75 -11.426 6.332 10.365 1.00 0.00 H new ATOM 0 HB THR A 75 -9.387 6.520 11.659 1.00 0.00 H new ATOM 0 HG1 THR A 75 -9.299 8.484 9.490 1.00 0.00 H new ATOM 0 HG21 THR A 75 -7.234 7.128 10.618 1.00 0.00 H new ATOM 0 HG22 THR A 75 -7.778 5.539 10.029 1.00 0.00 H new ATOM 0 HG23 THR A 75 -7.961 6.980 9.000 1.00 0.00 H new ATOM 807 N GLY A 76 -11.530 6.044 7.673 1.00 0.00 N ATOM 808 CA GLY A 76 -11.818 6.465 6.313 1.00 0.00 C ATOM 809 C GLY A 76 -10.570 7.041 5.641 1.00 0.00 C ATOM 810 O GLY A 76 -10.357 8.252 5.652 1.00 0.00 O ATOM 0 H GLY A 76 -12.023 5.203 7.972 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.187 5.617 5.736 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -12.610 7.214 6.320 1.00 0.00 H new ATOM 814 N GLN A 77 -9.777 6.145 5.072 1.00 0.00 N ATOM 815 CA GLN A 77 -8.555 6.548 4.397 1.00 0.00 C ATOM 816 C GLN A 77 -8.327 5.688 3.153 1.00 0.00 C ATOM 817 O GLN A 77 -8.333 4.460 3.233 1.00 0.00 O ATOM 818 CB GLN A 77 -7.355 6.473 5.343 1.00 0.00 C ATOM 819 CG GLN A 77 -6.915 7.871 5.783 1.00 0.00 C ATOM 820 CD GLN A 77 -6.768 7.946 7.304 1.00 0.00 C ATOM 821 OE1 GLN A 77 -6.199 7.075 7.942 1.00 0.00 O ATOM 822 NE2 GLN A 77 -7.311 9.031 7.848 1.00 0.00 N ATOM 0 H GLN A 77 -9.957 5.141 5.065 1.00 0.00 H new ATOM 0 HA GLN A 77 -8.663 7.586 4.082 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -7.614 5.877 6.218 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -6.527 5.967 4.847 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -5.966 8.123 5.309 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -7.645 8.608 5.448 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -7.773 9.722 7.256 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -7.266 9.173 8.857 1.00 0.00 H new ATOM 831 N TYR A 78 -8.132 6.366 2.031 1.00 0.00 N ATOM 832 CA TYR A 78 -7.903 5.678 0.771 1.00 0.00 C ATOM 833 C TYR A 78 -6.457 5.860 0.303 1.00 0.00 C ATOM 834 O TYR A 78 -6.078 6.940 -0.146 1.00 0.00 O ATOM 835 CB TYR A 78 -8.841 6.333 -0.244 1.00 0.00 C ATOM 836 CG TYR A 78 -10.284 5.829 -0.173 1.00 0.00 C ATOM 837 CD1 TYR A 78 -10.654 4.698 -0.873 1.00 0.00 C ATOM 838 CD2 TYR A 78 -11.215 6.504 0.589 1.00 0.00 C ATOM 839 CE1 TYR A 78 -12.012 4.223 -0.806 1.00 0.00 C ATOM 840 CE2 TYR A 78 -12.573 6.030 0.655 1.00 0.00 C ATOM 841 CZ TYR A 78 -12.904 4.912 -0.046 1.00 0.00 C ATOM 842 OH TYR A 78 -14.187 4.464 0.017 1.00 0.00 O ATOM 0 H TYR A 78 -8.128 7.384 1.968 1.00 0.00 H new ATOM 0 HA TYR A 78 -8.085 4.609 0.879 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -8.835 7.411 -0.085 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -8.454 6.156 -1.248 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -9.926 4.170 -1.470 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -10.925 7.389 1.136 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -12.315 3.339 -1.348 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -13.312 6.550 1.247 1.00 0.00 H new ATOM 0 HH TYR A 78 -14.711 5.054 0.598 1.00 0.00 H new ATOM 852 N LEU A 79 -5.691 4.786 0.424 1.00 0.00 N ATOM 853 CA LEU A 79 -4.295 4.813 0.019 1.00 0.00 C ATOM 854 C LEU A 79 -4.192 5.374 -1.401 1.00 0.00 C ATOM 855 O LEU A 79 -5.081 5.158 -2.224 1.00 0.00 O ATOM 856 CB LEU A 79 -3.663 3.429 0.181 1.00 0.00 C ATOM 857 CG LEU A 79 -2.223 3.406 0.696 1.00 0.00 C ATOM 858 CD1 LEU A 79 -2.056 4.334 1.901 1.00 0.00 C ATOM 859 CD2 LEU A 79 -1.774 1.977 1.007 1.00 0.00 C ATOM 0 H LEU A 79 -6.010 3.892 0.797 1.00 0.00 H new ATOM 0 HA LEU A 79 -3.723 5.477 0.667 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.282 2.847 0.864 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.691 2.923 -0.784 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.573 3.783 -0.093 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.023 4.299 2.247 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.307 5.355 1.612 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.719 4.011 2.704 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.747 1.990 1.371 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -2.424 1.549 1.770 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -1.831 1.373 0.102 1.00 0.00 H new ATOM 871 N ALA A 80 -3.100 6.083 -1.645 1.00 0.00 N ATOM 872 CA ALA A 80 -2.869 6.676 -2.951 1.00 0.00 C ATOM 873 C ALA A 80 -1.396 7.068 -3.075 1.00 0.00 C ATOM 874 O ALA A 80 -0.595 6.776 -2.188 1.00 0.00 O ATOM 875 CB ALA A 80 -3.808 7.868 -3.144 1.00 0.00 C ATOM 0 H ALA A 80 -2.365 6.260 -0.960 1.00 0.00 H new ATOM 0 HA ALA A 80 -3.087 5.958 -3.742 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.635 8.313 -4.124 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.842 7.531 -3.076 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.617 8.611 -2.369 1.00 0.00 H new ATOM 881 N MET A 81 -1.082 7.725 -4.183 1.00 0.00 N ATOM 882 CA MET A 81 0.281 8.160 -4.434 1.00 0.00 C ATOM 883 C MET A 81 0.304 9.408 -5.319 1.00 0.00 C ATOM 884 O MET A 81 -0.128 9.365 -6.470 1.00 0.00 O ATOM 885 CB MET A 81 1.059 7.034 -5.118 1.00 0.00 C ATOM 886 CG MET A 81 2.309 6.665 -4.316 1.00 0.00 C ATOM 887 SD MET A 81 2.908 5.062 -4.822 1.00 0.00 S ATOM 888 CE MET A 81 4.662 5.388 -4.871 1.00 0.00 C ATOM 0 H MET A 81 -1.749 7.966 -4.916 1.00 0.00 H new ATOM 0 HA MET A 81 0.746 8.406 -3.479 1.00 0.00 H new ATOM 0 HB2 MET A 81 0.419 6.158 -5.225 1.00 0.00 H new ATOM 0 HB3 MET A 81 1.346 7.344 -6.123 1.00 0.00 H new ATOM 0 HG2 MET A 81 3.084 7.416 -4.468 1.00 0.00 H new ATOM 0 HG3 MET A 81 2.078 6.656 -3.251 1.00 0.00 H new ATOM 0 HE1 MET A 81 5.147 4.671 -5.534 1.00 0.00 H new ATOM 0 HE2 MET A 81 4.834 6.399 -5.241 1.00 0.00 H new ATOM 0 HE3 MET A 81 5.078 5.294 -3.868 1.00 0.00 H new ATOM 898 N ASP A 82 0.812 10.490 -4.749 1.00 0.00 N ATOM 899 CA ASP A 82 0.897 11.748 -5.472 1.00 0.00 C ATOM 900 C ASP A 82 2.080 11.696 -6.440 1.00 0.00 C ATOM 901 O ASP A 82 2.803 10.702 -6.489 1.00 0.00 O ATOM 902 CB ASP A 82 1.121 12.920 -4.514 1.00 0.00 C ATOM 903 CG ASP A 82 -0.029 13.189 -3.541 1.00 0.00 C ATOM 904 OD1 ASP A 82 -1.183 13.215 -4.020 1.00 0.00 O ATOM 905 OD2 ASP A 82 0.273 13.362 -2.340 1.00 0.00 O ATOM 0 H ASP A 82 1.169 10.522 -3.794 1.00 0.00 H new ATOM 0 HA ASP A 82 -0.042 11.894 -6.007 1.00 0.00 H new ATOM 0 HB2 ASP A 82 2.027 12.731 -3.938 1.00 0.00 H new ATOM 0 HB3 ASP A 82 1.298 13.821 -5.101 1.00 0.00 H new ATOM 910 N THR A 83 2.240 12.778 -7.187 1.00 0.00 N ATOM 911 CA THR A 83 3.323 12.869 -8.151 1.00 0.00 C ATOM 912 C THR A 83 4.673 12.683 -7.456 1.00 0.00 C ATOM 913 O THR A 83 5.683 12.430 -8.111 1.00 0.00 O ATOM 914 CB THR A 83 3.195 14.206 -8.883 1.00 0.00 C ATOM 915 OG1 THR A 83 2.025 14.054 -9.682 1.00 0.00 O ATOM 916 CG2 THR A 83 4.316 14.427 -9.901 1.00 0.00 C ATOM 0 H THR A 83 1.637 13.600 -7.144 1.00 0.00 H new ATOM 0 HA THR A 83 3.261 12.071 -8.891 1.00 0.00 H new ATOM 0 HB THR A 83 3.200 15.019 -8.157 1.00 0.00 H new ATOM 0 HG1 THR A 83 1.867 14.877 -10.190 1.00 0.00 H new ATOM 0 HG21 THR A 83 4.177 15.390 -10.392 1.00 0.00 H new ATOM 0 HG22 THR A 83 5.279 14.415 -9.390 1.00 0.00 H new ATOM 0 HG23 THR A 83 4.292 13.633 -10.647 1.00 0.00 H new ATOM 924 N ASP A 84 4.647 12.818 -6.138 1.00 0.00 N ATOM 925 CA ASP A 84 5.857 12.668 -5.347 1.00 0.00 C ATOM 926 C ASP A 84 6.013 11.204 -4.934 1.00 0.00 C ATOM 927 O ASP A 84 6.856 10.877 -4.099 1.00 0.00 O ATOM 928 CB ASP A 84 5.790 13.514 -4.073 1.00 0.00 C ATOM 929 CG ASP A 84 4.547 13.287 -3.211 1.00 0.00 C ATOM 930 OD1 ASP A 84 4.038 12.146 -3.238 1.00 0.00 O ATOM 931 OD2 ASP A 84 4.133 14.261 -2.545 1.00 0.00 O ATOM 0 H ASP A 84 3.808 13.029 -5.598 1.00 0.00 H new ATOM 0 HA ASP A 84 6.700 12.996 -5.955 1.00 0.00 H new ATOM 0 HB2 ASP A 84 6.674 13.307 -3.470 1.00 0.00 H new ATOM 0 HB3 ASP A 84 5.833 14.567 -4.351 1.00 0.00 H new ATOM 936 N GLY A 85 5.188 10.360 -5.537 1.00 0.00 N ATOM 937 CA GLY A 85 5.224 8.938 -5.242 1.00 0.00 C ATOM 938 C GLY A 85 5.236 8.691 -3.732 1.00 0.00 C ATOM 939 O GLY A 85 5.679 7.639 -3.275 1.00 0.00 O ATOM 0 H GLY A 85 4.490 10.634 -6.229 1.00 0.00 H new ATOM 0 HA2 GLY A 85 4.358 8.449 -5.687 1.00 0.00 H new ATOM 0 HA3 GLY A 85 6.110 8.492 -5.694 1.00 0.00 H new ATOM 943 N LEU A 86 4.745 9.679 -2.999 1.00 0.00 N ATOM 944 CA LEU A 86 4.693 9.583 -1.550 1.00 0.00 C ATOM 945 C LEU A 86 3.314 9.074 -1.126 1.00 0.00 C ATOM 946 O LEU A 86 2.337 9.820 -1.158 1.00 0.00 O ATOM 947 CB LEU A 86 5.080 10.917 -0.910 1.00 0.00 C ATOM 948 CG LEU A 86 5.681 10.838 0.495 1.00 0.00 C ATOM 949 CD1 LEU A 86 5.832 12.233 1.106 1.00 0.00 C ATOM 950 CD2 LEU A 86 4.862 9.906 1.390 1.00 0.00 C ATOM 0 H LEU A 86 4.379 10.551 -3.382 1.00 0.00 H new ATOM 0 HA LEU A 86 5.425 8.860 -1.190 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.796 11.416 -1.563 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.193 11.549 -0.869 1.00 0.00 H new ATOM 0 HG LEU A 86 6.681 10.411 0.415 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.261 12.148 2.104 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.489 12.836 0.479 1.00 0.00 H new ATOM 0 HD13 LEU A 86 4.854 12.710 1.171 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.311 9.868 2.383 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.841 10.280 1.467 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.850 8.905 0.959 1.00 0.00 H new ATOM 962 N LEU A 87 3.279 7.807 -0.739 1.00 0.00 N ATOM 963 CA LEU A 87 2.036 7.190 -0.309 1.00 0.00 C ATOM 964 C LEU A 87 1.239 8.191 0.531 1.00 0.00 C ATOM 965 O LEU A 87 1.745 8.718 1.521 1.00 0.00 O ATOM 966 CB LEU A 87 2.314 5.868 0.409 1.00 0.00 C ATOM 967 CG LEU A 87 2.349 4.620 -0.474 1.00 0.00 C ATOM 968 CD1 LEU A 87 3.752 4.388 -1.040 1.00 0.00 C ATOM 969 CD2 LEU A 87 1.827 3.397 0.283 1.00 0.00 C ATOM 0 H LEU A 87 4.092 7.191 -0.714 1.00 0.00 H new ATOM 0 HA LEU A 87 1.420 6.934 -1.171 1.00 0.00 H new ATOM 0 HB2 LEU A 87 3.271 5.951 0.924 1.00 0.00 H new ATOM 0 HB3 LEU A 87 1.551 5.726 1.175 1.00 0.00 H new ATOM 0 HG LEU A 87 1.683 4.783 -1.321 1.00 0.00 H new ATOM 0 HD11 LEU A 87 3.749 3.494 -1.664 1.00 0.00 H new ATOM 0 HD12 LEU A 87 4.049 5.248 -1.639 1.00 0.00 H new ATOM 0 HD13 LEU A 87 4.458 4.256 -0.220 1.00 0.00 H new ATOM 0 HD21 LEU A 87 1.863 2.524 -0.368 1.00 0.00 H new ATOM 0 HD22 LEU A 87 2.448 3.221 1.161 1.00 0.00 H new ATOM 0 HD23 LEU A 87 0.798 3.575 0.596 1.00 0.00 H new ATOM 981 N TYR A 88 0.005 8.422 0.106 1.00 0.00 N ATOM 982 CA TYR A 88 -0.866 9.349 0.807 1.00 0.00 C ATOM 983 C TYR A 88 -2.330 8.917 0.696 1.00 0.00 C ATOM 984 O TYR A 88 -2.660 8.025 -0.085 1.00 0.00 O ATOM 985 CB TYR A 88 -0.691 10.700 0.111 1.00 0.00 C ATOM 986 CG TYR A 88 -1.606 10.900 -1.099 1.00 0.00 C ATOM 987 CD1 TYR A 88 -1.312 10.280 -2.296 1.00 0.00 C ATOM 988 CD2 TYR A 88 -2.725 11.700 -0.993 1.00 0.00 C ATOM 989 CE1 TYR A 88 -2.173 10.467 -3.435 1.00 0.00 C ATOM 990 CE2 TYR A 88 -3.586 11.888 -2.132 1.00 0.00 C ATOM 991 CZ TYR A 88 -3.268 11.262 -3.297 1.00 0.00 C ATOM 992 OH TYR A 88 -4.081 11.440 -4.372 1.00 0.00 O ATOM 0 H TYR A 88 -0.412 7.983 -0.715 1.00 0.00 H new ATOM 0 HA TYR A 88 -0.612 9.388 1.866 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -0.880 11.496 0.832 1.00 0.00 H new ATOM 0 HB3 TYR A 88 0.346 10.800 -0.210 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -0.436 9.654 -2.379 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -2.955 12.185 -0.056 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -1.954 9.987 -4.377 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -4.465 12.512 -2.063 1.00 0.00 H new ATOM 0 HH TYR A 88 -4.823 12.031 -4.127 1.00 0.00 H new ATOM 1002 N GLY A 89 -3.168 9.570 1.487 1.00 0.00 N ATOM 1003 CA GLY A 89 -4.589 9.264 1.487 1.00 0.00 C ATOM 1004 C GLY A 89 -5.408 10.464 1.008 1.00 0.00 C ATOM 1005 O GLY A 89 -5.040 11.611 1.260 1.00 0.00 O ATOM 0 H GLY A 89 -2.891 10.310 2.132 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -4.780 8.407 0.841 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -4.904 8.982 2.492 1.00 0.00 H new ATOM 1009 N SER A 90 -6.502 10.159 0.326 1.00 0.00 N ATOM 1010 CA SER A 90 -7.376 11.199 -0.190 1.00 0.00 C ATOM 1011 C SER A 90 -8.837 10.759 -0.075 1.00 0.00 C ATOM 1012 O SER A 90 -9.147 9.578 -0.221 1.00 0.00 O ATOM 1013 CB SER A 90 -7.036 11.533 -1.644 1.00 0.00 C ATOM 1014 OG SER A 90 -6.331 10.473 -2.284 1.00 0.00 O ATOM 0 H SER A 90 -6.803 9.207 0.119 1.00 0.00 H new ATOM 0 HA SER A 90 -7.226 12.099 0.406 1.00 0.00 H new ATOM 0 HB2 SER A 90 -7.955 11.741 -2.193 1.00 0.00 H new ATOM 0 HB3 SER A 90 -6.433 12.441 -1.676 1.00 0.00 H new ATOM 0 HG SER A 90 -5.395 10.733 -2.412 1.00 0.00 H new ATOM 1020 N GLN A 91 -9.696 11.734 0.187 1.00 0.00 N ATOM 1021 CA GLN A 91 -11.117 11.462 0.324 1.00 0.00 C ATOM 1022 C GLN A 91 -11.763 11.310 -1.054 1.00 0.00 C ATOM 1023 O GLN A 91 -12.975 11.126 -1.159 1.00 0.00 O ATOM 1024 CB GLN A 91 -11.809 12.559 1.136 1.00 0.00 C ATOM 1025 CG GLN A 91 -13.147 12.068 1.692 1.00 0.00 C ATOM 1026 CD GLN A 91 -13.908 13.206 2.374 1.00 0.00 C ATOM 1027 OE1 GLN A 91 -13.975 13.303 3.588 1.00 0.00 O ATOM 1028 NE2 GLN A 91 -14.477 14.060 1.527 1.00 0.00 N ATOM 0 H GLN A 91 -9.435 12.713 0.308 1.00 0.00 H new ATOM 0 HA GLN A 91 -11.237 10.524 0.866 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -11.163 12.872 1.956 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -11.972 13.434 0.507 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -13.751 11.655 0.884 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -12.975 11.262 2.405 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -14.382 13.920 0.521 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -15.008 14.854 1.884 1.00 0.00 H new ATOM 1037 N THR A 92 -10.926 11.392 -2.078 1.00 0.00 N ATOM 1038 CA THR A 92 -11.400 11.266 -3.445 1.00 0.00 C ATOM 1039 C THR A 92 -10.788 10.032 -4.111 1.00 0.00 C ATOM 1040 O THR A 92 -9.685 10.096 -4.651 1.00 0.00 O ATOM 1041 CB THR A 92 -11.084 12.571 -4.178 1.00 0.00 C ATOM 1042 OG1 THR A 92 -9.689 12.484 -4.456 1.00 0.00 O ATOM 1043 CG2 THR A 92 -11.207 13.797 -3.271 1.00 0.00 C ATOM 0 H THR A 92 -9.921 11.544 -1.988 1.00 0.00 H new ATOM 0 HA THR A 92 -12.479 11.112 -3.476 1.00 0.00 H new ATOM 0 HB THR A 92 -11.756 12.681 -5.029 1.00 0.00 H new ATOM 0 HG1 THR A 92 -9.528 11.763 -5.099 1.00 0.00 H new ATOM 0 HG21 THR A 92 -10.972 14.696 -3.841 1.00 0.00 H new ATOM 0 HG22 THR A 92 -12.225 13.866 -2.888 1.00 0.00 H new ATOM 0 HG23 THR A 92 -10.511 13.704 -2.437 1.00 0.00 H new ATOM 1051 N PRO A 93 -11.550 8.907 -4.047 1.00 0.00 N ATOM 1052 CA PRO A 93 -11.094 7.660 -4.637 1.00 0.00 C ATOM 1053 C PRO A 93 -11.215 7.698 -6.162 1.00 0.00 C ATOM 1054 O PRO A 93 -12.301 7.504 -6.707 1.00 0.00 O ATOM 1055 CB PRO A 93 -11.958 6.584 -3.999 1.00 0.00 C ATOM 1056 CG PRO A 93 -13.170 7.305 -3.431 1.00 0.00 C ATOM 1057 CD PRO A 93 -12.861 8.794 -3.415 1.00 0.00 C ATOM 0 HA PRO A 93 -10.038 7.467 -4.449 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -12.257 5.837 -4.734 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -11.413 6.059 -3.215 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -14.053 7.105 -4.038 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -13.389 6.950 -2.424 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -13.614 9.361 -3.962 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -12.845 9.184 -2.397 1.00 0.00 H new ATOM 1065 N ASN A 94 -10.086 7.950 -6.807 1.00 0.00 N ATOM 1066 CA ASN A 94 -10.051 8.015 -8.258 1.00 0.00 C ATOM 1067 C ASN A 94 -8.810 7.282 -8.768 1.00 0.00 C ATOM 1068 O ASN A 94 -8.085 6.665 -7.989 1.00 0.00 O ATOM 1069 CB ASN A 94 -9.977 9.465 -8.742 1.00 0.00 C ATOM 1070 CG ASN A 94 -11.270 10.217 -8.423 1.00 0.00 C ATOM 1071 OD1 ASN A 94 -11.503 10.364 -7.122 1.00 0.00 O flip ATOM 1072 ND2 ASN A 94 -12.007 10.636 -9.300 1.00 0.00 N flip ATOM 0 H ASN A 94 -9.188 8.112 -6.351 1.00 0.00 H new ATOM 0 HA ASN A 94 -10.962 7.554 -8.638 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -9.134 9.967 -8.268 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -9.797 9.484 -9.817 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -11.768 10.489 -10.281 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -12.862 11.134 -9.053 1.00 0.00 H new ATOM 1079 N GLU A 95 -8.602 7.373 -10.074 1.00 0.00 N ATOM 1080 CA GLU A 95 -7.460 6.726 -10.697 1.00 0.00 C ATOM 1081 C GLU A 95 -6.243 6.793 -9.773 1.00 0.00 C ATOM 1082 O GLU A 95 -5.420 5.878 -9.757 1.00 0.00 O ATOM 1083 CB GLU A 95 -7.151 7.352 -12.058 1.00 0.00 C ATOM 1084 CG GLU A 95 -7.764 6.529 -13.193 1.00 0.00 C ATOM 1085 CD GLU A 95 -9.166 7.032 -13.540 1.00 0.00 C ATOM 1086 OE1 GLU A 95 -9.247 8.143 -14.108 1.00 0.00 O ATOM 1087 OE2 GLU A 95 -10.126 6.294 -13.229 1.00 0.00 O ATOM 0 H GLU A 95 -9.205 7.885 -10.717 1.00 0.00 H new ATOM 0 HA GLU A 95 -7.707 5.678 -10.864 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -7.540 8.370 -12.091 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -6.072 7.419 -12.195 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.125 6.586 -14.074 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -7.812 5.480 -12.901 1.00 0.00 H new ATOM 1094 N GLU A 96 -6.165 7.884 -9.026 1.00 0.00 N ATOM 1095 CA GLU A 96 -5.062 8.082 -8.102 1.00 0.00 C ATOM 1096 C GLU A 96 -5.106 7.031 -6.990 1.00 0.00 C ATOM 1097 O GLU A 96 -4.210 6.195 -6.886 1.00 0.00 O ATOM 1098 CB GLU A 96 -5.081 9.497 -7.520 1.00 0.00 C ATOM 1099 CG GLU A 96 -3.849 9.747 -6.648 1.00 0.00 C ATOM 1100 CD GLU A 96 -3.317 11.168 -6.845 1.00 0.00 C ATOM 1101 OE1 GLU A 96 -4.030 11.954 -7.507 1.00 0.00 O ATOM 1102 OE2 GLU A 96 -2.210 11.437 -6.330 1.00 0.00 O ATOM 0 H GLU A 96 -6.849 8.641 -9.042 1.00 0.00 H new ATOM 0 HA GLU A 96 -4.128 7.963 -8.651 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -5.112 10.227 -8.329 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -5.985 9.639 -6.928 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -4.104 9.592 -5.600 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -3.071 9.026 -6.897 1.00 0.00 H new ATOM 1109 N CYS A 97 -6.157 7.109 -6.188 1.00 0.00 N ATOM 1110 CA CYS A 97 -6.329 6.175 -5.088 1.00 0.00 C ATOM 1111 C CYS A 97 -6.091 4.760 -5.617 1.00 0.00 C ATOM 1112 O CYS A 97 -5.530 3.918 -4.918 1.00 0.00 O ATOM 1113 CB CYS A 97 -7.707 6.317 -4.436 1.00 0.00 C ATOM 1114 SG CYS A 97 -8.086 4.826 -3.445 1.00 0.00 S ATOM 0 H CYS A 97 -6.898 7.804 -6.278 1.00 0.00 H new ATOM 0 HA CYS A 97 -5.604 6.395 -4.304 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -7.728 7.202 -3.800 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -8.469 6.458 -5.203 1.00 0.00 H new ATOM 0 HG CYS A 97 -7.069 4.538 -2.688 1.00 0.00 H new ATOM 1120 N LEU A 98 -6.529 4.542 -6.849 1.00 0.00 N ATOM 1121 CA LEU A 98 -6.370 3.243 -7.480 1.00 0.00 C ATOM 1122 C LEU A 98 -4.904 2.812 -7.390 1.00 0.00 C ATOM 1123 O LEU A 98 -4.051 3.589 -6.965 1.00 0.00 O ATOM 1124 CB LEU A 98 -6.915 3.271 -8.909 1.00 0.00 C ATOM 1125 CG LEU A 98 -8.288 2.627 -9.116 1.00 0.00 C ATOM 1126 CD1 LEU A 98 -8.904 3.066 -10.446 1.00 0.00 C ATOM 1127 CD2 LEU A 98 -8.202 1.104 -9.000 1.00 0.00 C ATOM 0 H LEU A 98 -6.994 5.243 -7.426 1.00 0.00 H new ATOM 0 HA LEU A 98 -6.957 2.490 -6.954 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -6.970 4.309 -9.236 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.199 2.770 -9.560 1.00 0.00 H new ATOM 0 HG LEU A 98 -8.951 2.974 -8.323 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -9.879 2.594 -10.569 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -9.022 4.150 -10.452 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.251 2.767 -11.266 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.191 0.671 -9.151 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.518 0.720 -9.757 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -7.836 0.835 -8.009 1.00 0.00 H new ATOM 1139 N PHE A 99 -4.658 1.576 -7.796 1.00 0.00 N ATOM 1140 CA PHE A 99 -3.311 1.032 -7.767 1.00 0.00 C ATOM 1141 C PHE A 99 -3.147 -0.086 -8.798 1.00 0.00 C ATOM 1142 O PHE A 99 -3.745 -1.153 -8.661 1.00 0.00 O ATOM 1143 CB PHE A 99 -3.092 0.455 -6.367 1.00 0.00 C ATOM 1144 CG PHE A 99 -2.064 1.222 -5.531 1.00 0.00 C ATOM 1145 CD1 PHE A 99 -0.886 1.610 -6.090 1.00 0.00 C ATOM 1146 CD2 PHE A 99 -2.329 1.516 -4.230 1.00 0.00 C ATOM 1147 CE1 PHE A 99 0.067 2.321 -5.315 1.00 0.00 C ATOM 1148 CE2 PHE A 99 -1.375 2.227 -3.455 1.00 0.00 C ATOM 1149 CZ PHE A 99 -0.197 2.615 -4.014 1.00 0.00 C ATOM 0 H PHE A 99 -5.369 0.935 -8.147 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.589 1.814 -8.003 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.044 0.447 -5.836 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -2.769 -0.582 -6.459 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -0.676 1.377 -7.123 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.265 1.209 -3.786 1.00 0.00 H new ATOM 0 HE1 PHE A 99 1.002 2.629 -5.759 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -1.585 2.460 -2.421 1.00 0.00 H new ATOM 0 HZ PHE A 99 0.528 3.156 -3.425 1.00 0.00 H new ATOM 1159 N LEU A 100 -2.336 0.196 -9.806 1.00 0.00 N ATOM 1160 CA LEU A 100 -2.086 -0.773 -10.859 1.00 0.00 C ATOM 1161 C LEU A 100 -1.723 -2.121 -10.232 1.00 0.00 C ATOM 1162 O LEU A 100 -0.604 -2.307 -9.758 1.00 0.00 O ATOM 1163 CB LEU A 100 -1.032 -0.245 -11.835 1.00 0.00 C ATOM 1164 CG LEU A 100 -1.515 0.030 -13.260 1.00 0.00 C ATOM 1165 CD1 LEU A 100 -0.654 1.100 -13.934 1.00 0.00 C ATOM 1166 CD2 LEU A 100 -1.571 -1.261 -14.079 1.00 0.00 C ATOM 0 H LEU A 100 -1.843 1.082 -9.916 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.987 -0.930 -11.453 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.619 0.678 -11.428 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.216 -0.966 -11.882 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.531 0.421 -13.207 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -1.019 1.276 -14.946 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -0.710 2.026 -13.362 1.00 0.00 H new ATOM 0 HD13 LEU A 100 0.381 0.761 -13.975 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.917 -1.037 -15.088 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.577 -1.705 -14.127 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.259 -1.962 -13.606 1.00 0.00 H new ATOM 1178 N GLU A 101 -2.691 -3.025 -10.249 1.00 0.00 N ATOM 1179 CA GLU A 101 -2.488 -4.350 -9.687 1.00 0.00 C ATOM 1180 C GLU A 101 -1.895 -5.288 -10.740 1.00 0.00 C ATOM 1181 O GLU A 101 -2.267 -5.226 -11.911 1.00 0.00 O ATOM 1182 CB GLU A 101 -3.794 -4.913 -9.124 1.00 0.00 C ATOM 1183 CG GLU A 101 -3.524 -5.844 -7.940 1.00 0.00 C ATOM 1184 CD GLU A 101 -4.476 -7.042 -7.957 1.00 0.00 C ATOM 1185 OE1 GLU A 101 -4.289 -7.903 -8.844 1.00 0.00 O ATOM 1186 OE2 GLU A 101 -5.369 -7.070 -7.083 1.00 0.00 O ATOM 0 H GLU A 101 -3.618 -2.866 -10.643 1.00 0.00 H new ATOM 0 HA GLU A 101 -1.781 -4.269 -8.862 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -4.441 -4.095 -8.808 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -4.326 -5.456 -9.905 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -2.492 -6.194 -7.976 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -3.642 -5.294 -7.006 1.00 0.00 H new ATOM 1193 N ARG A 102 -0.983 -6.135 -10.287 1.00 0.00 N ATOM 1194 CA ARG A 102 -0.336 -7.084 -11.175 1.00 0.00 C ATOM 1195 C ARG A 102 0.316 -8.208 -10.367 1.00 0.00 C ATOM 1196 O ARG A 102 1.540 -8.322 -10.330 1.00 0.00 O ATOM 1197 CB ARG A 102 0.730 -6.398 -12.032 1.00 0.00 C ATOM 1198 CG ARG A 102 1.180 -5.081 -11.398 1.00 0.00 C ATOM 1199 CD ARG A 102 1.492 -4.034 -12.469 1.00 0.00 C ATOM 1200 NE ARG A 102 2.849 -3.482 -12.257 1.00 0.00 N ATOM 1201 CZ ARG A 102 3.968 -4.025 -12.756 1.00 0.00 C ATOM 1202 NH1 ARG A 102 3.898 -5.138 -13.500 1.00 0.00 N ATOM 1203 NH2 ARG A 102 5.156 -3.456 -12.512 1.00 0.00 N ATOM 0 H ARG A 102 -0.677 -6.183 -9.315 1.00 0.00 H new ATOM 0 HA ARG A 102 -1.102 -7.499 -11.830 1.00 0.00 H new ATOM 0 HB2 ARG A 102 1.588 -7.060 -12.151 1.00 0.00 H new ATOM 0 HB3 ARG A 102 0.333 -6.209 -13.029 1.00 0.00 H new ATOM 0 HG2 ARG A 102 0.399 -4.707 -10.736 1.00 0.00 H new ATOM 0 HG3 ARG A 102 2.064 -5.253 -10.784 1.00 0.00 H new ATOM 0 HD2 ARG A 102 1.424 -4.484 -13.460 1.00 0.00 H new ATOM 0 HD3 ARG A 102 0.754 -3.232 -12.431 1.00 0.00 H new ATOM 0 HE ARG A 102 2.938 -2.635 -11.696 1.00 0.00 H new ATOM 0 HH11 ARG A 102 2.993 -5.571 -13.686 1.00 0.00 H new ATOM 0 HH12 ARG A 102 4.749 -5.552 -13.880 1.00 0.00 H new ATOM 0 HH21 ARG A 102 5.209 -2.609 -11.946 1.00 0.00 H new ATOM 0 HH22 ARG A 102 6.007 -3.870 -12.892 1.00 0.00 H new ATOM 1217 N LEU A 103 -0.532 -9.011 -9.741 1.00 0.00 N ATOM 1218 CA LEU A 103 -0.054 -10.122 -8.936 1.00 0.00 C ATOM 1219 C LEU A 103 1.370 -10.483 -9.366 1.00 0.00 C ATOM 1220 O LEU A 103 1.562 -11.243 -10.314 1.00 0.00 O ATOM 1221 CB LEU A 103 -1.033 -11.296 -9.006 1.00 0.00 C ATOM 1222 CG LEU A 103 -1.683 -11.707 -7.684 1.00 0.00 C ATOM 1223 CD1 LEU A 103 -2.343 -13.083 -7.802 1.00 0.00 C ATOM 1224 CD2 LEU A 103 -0.673 -11.652 -6.536 1.00 0.00 C ATOM 0 H LEU A 103 -1.547 -8.914 -9.775 1.00 0.00 H new ATOM 0 HA LEU A 103 -0.008 -9.838 -7.885 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.823 -11.043 -9.713 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.506 -12.159 -9.413 1.00 0.00 H new ATOM 0 HG LEU A 103 -2.471 -10.990 -7.454 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.798 -13.351 -6.848 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -3.111 -13.053 -8.575 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.591 -13.826 -8.067 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.161 -11.949 -5.608 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.153 -12.332 -6.745 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.291 -10.636 -6.436 1.00 0.00 H new ATOM 1236 N GLU A 104 2.331 -9.921 -8.648 1.00 0.00 N ATOM 1237 CA GLU A 104 3.731 -10.173 -8.943 1.00 0.00 C ATOM 1238 C GLU A 104 3.987 -11.678 -9.054 1.00 0.00 C ATOM 1239 O GLU A 104 4.507 -12.150 -10.064 1.00 0.00 O ATOM 1240 CB GLU A 104 4.638 -9.540 -7.886 1.00 0.00 C ATOM 1241 CG GLU A 104 5.827 -10.448 -7.567 1.00 0.00 C ATOM 1242 CD GLU A 104 6.627 -10.768 -8.832 1.00 0.00 C ATOM 1243 OE1 GLU A 104 6.134 -10.405 -9.922 1.00 0.00 O ATOM 1244 OE2 GLU A 104 7.713 -11.368 -8.680 1.00 0.00 O ATOM 0 H GLU A 104 2.167 -9.292 -7.862 1.00 0.00 H new ATOM 0 HA GLU A 104 3.968 -9.711 -9.901 1.00 0.00 H new ATOM 0 HB2 GLU A 104 4.998 -8.575 -8.242 1.00 0.00 H new ATOM 0 HB3 GLU A 104 4.066 -9.351 -6.977 1.00 0.00 H new ATOM 0 HG2 GLU A 104 6.474 -9.963 -6.836 1.00 0.00 H new ATOM 0 HG3 GLU A 104 5.471 -11.373 -7.113 1.00 0.00 H new ATOM 1251 N GLU A 105 3.609 -12.389 -8.002 1.00 0.00 N ATOM 1252 CA GLU A 105 3.791 -13.831 -7.969 1.00 0.00 C ATOM 1253 C GLU A 105 2.434 -14.537 -7.982 1.00 0.00 C ATOM 1254 O GLU A 105 1.795 -14.643 -9.027 1.00 0.00 O ATOM 1255 CB GLU A 105 4.617 -14.251 -6.752 1.00 0.00 C ATOM 1256 CG GLU A 105 4.694 -15.775 -6.641 1.00 0.00 C ATOM 1257 CD GLU A 105 4.363 -16.240 -5.222 1.00 0.00 C ATOM 1258 OE1 GLU A 105 3.422 -15.658 -4.640 1.00 0.00 O ATOM 1259 OE2 GLU A 105 5.058 -17.165 -4.751 1.00 0.00 O ATOM 0 H GLU A 105 3.178 -11.994 -7.166 1.00 0.00 H new ATOM 0 HA GLU A 105 4.342 -14.129 -8.861 1.00 0.00 H new ATOM 0 HB2 GLU A 105 5.622 -13.837 -6.830 1.00 0.00 H new ATOM 0 HB3 GLU A 105 4.172 -13.839 -5.846 1.00 0.00 H new ATOM 0 HG2 GLU A 105 4.000 -16.230 -7.348 1.00 0.00 H new ATOM 0 HG3 GLU A 105 5.694 -16.113 -6.914 1.00 0.00 H new ATOM 1266 N ASN A 106 2.035 -15.003 -6.808 1.00 0.00 N ATOM 1267 CA ASN A 106 0.765 -15.697 -6.671 1.00 0.00 C ATOM 1268 C ASN A 106 0.137 -15.340 -5.322 1.00 0.00 C ATOM 1269 O ASN A 106 -0.432 -16.200 -4.651 1.00 0.00 O ATOM 1270 CB ASN A 106 0.959 -17.214 -6.715 1.00 0.00 C ATOM 1271 CG ASN A 106 -0.218 -17.898 -7.413 1.00 0.00 C ATOM 1272 OD1 ASN A 106 -0.974 -17.288 -8.152 1.00 0.00 O ATOM 1273 ND2 ASN A 106 -0.331 -19.194 -7.139 1.00 0.00 N ATOM 0 H ASN A 106 2.568 -14.914 -5.943 1.00 0.00 H new ATOM 0 HA ASN A 106 0.123 -15.391 -7.497 1.00 0.00 H new ATOM 0 HB2 ASN A 106 1.885 -17.451 -7.240 1.00 0.00 H new ATOM 0 HB3 ASN A 106 1.060 -17.601 -5.701 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -1.085 -19.740 -7.556 1.00 0.00 H new ATOM 0 HD22 ASN A 106 0.336 -19.643 -6.512 1.00 0.00 H new ATOM 1280 N HIS A 107 0.260 -14.070 -4.966 1.00 0.00 N ATOM 1281 CA HIS A 107 -0.289 -13.589 -3.709 1.00 0.00 C ATOM 1282 C HIS A 107 0.004 -12.094 -3.561 1.00 0.00 C ATOM 1283 O HIS A 107 -0.885 -11.316 -3.218 1.00 0.00 O ATOM 1284 CB HIS A 107 0.238 -14.415 -2.534 1.00 0.00 C ATOM 1285 CG HIS A 107 -0.657 -15.568 -2.145 1.00 0.00 C ATOM 1286 ND1 HIS A 107 -1.991 -15.769 -2.349 1.00 0.00 N flip ATOM 1287 CD2 HIS A 107 -0.194 -16.678 -1.461 1.00 0.00 C flip ATOM 1288 CE1 HIS A 107 -2.324 -16.940 -1.820 1.00 0.00 C flip ATOM 1289 NE2 HIS A 107 -1.212 -17.505 -1.269 1.00 0.00 N flip ATOM 0 H HIS A 107 0.732 -13.359 -5.525 1.00 0.00 H new ATOM 0 HA HIS A 107 -1.372 -13.715 -3.709 1.00 0.00 H new ATOM 0 HB2 HIS A 107 1.224 -14.803 -2.789 1.00 0.00 H new ATOM 0 HB3 HIS A 107 0.367 -13.761 -1.672 1.00 0.00 H new ATOM 0 HD2 HIS A 107 0.823 -16.843 -1.138 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -3.313 -17.374 -1.825 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -1.171 -18.406 -0.793 1.00 0.00 H new ATOM 1297 N TYR A 108 1.252 -11.739 -3.827 1.00 0.00 N ATOM 1298 CA TYR A 108 1.672 -10.351 -3.727 1.00 0.00 C ATOM 1299 C TYR A 108 1.080 -9.516 -4.864 1.00 0.00 C ATOM 1300 O TYR A 108 1.423 -9.714 -6.029 1.00 0.00 O ATOM 1301 CB TYR A 108 3.197 -10.362 -3.858 1.00 0.00 C ATOM 1302 CG TYR A 108 3.881 -11.483 -3.073 1.00 0.00 C ATOM 1303 CD1 TYR A 108 3.339 -11.921 -1.881 1.00 0.00 C ATOM 1304 CD2 TYR A 108 5.040 -12.056 -3.555 1.00 0.00 C ATOM 1305 CE1 TYR A 108 3.983 -12.975 -1.142 1.00 0.00 C ATOM 1306 CE2 TYR A 108 5.684 -13.110 -2.816 1.00 0.00 C ATOM 1307 CZ TYR A 108 5.124 -13.518 -1.646 1.00 0.00 C ATOM 1308 OH TYR A 108 5.732 -14.514 -0.947 1.00 0.00 O ATOM 0 H TYR A 108 1.986 -12.388 -4.112 1.00 0.00 H new ATOM 0 HA TYR A 108 1.336 -9.915 -2.786 1.00 0.00 H new ATOM 0 HB2 TYR A 108 3.460 -10.457 -4.911 1.00 0.00 H new ATOM 0 HB3 TYR A 108 3.588 -9.403 -3.517 1.00 0.00 H new ATOM 0 HD1 TYR A 108 2.432 -11.473 -1.503 1.00 0.00 H new ATOM 0 HD2 TYR A 108 5.464 -11.713 -4.487 1.00 0.00 H new ATOM 0 HE1 TYR A 108 3.570 -13.327 -0.208 1.00 0.00 H new ATOM 0 HE2 TYR A 108 6.592 -13.567 -3.183 1.00 0.00 H new ATOM 0 HH TYR A 108 6.535 -14.807 -1.426 1.00 0.00 H new ATOM 1318 N ASN A 109 0.201 -8.599 -4.486 1.00 0.00 N ATOM 1319 CA ASN A 109 -0.442 -7.733 -5.460 1.00 0.00 C ATOM 1320 C ASN A 109 0.403 -6.472 -5.650 1.00 0.00 C ATOM 1321 O ASN A 109 -0.117 -5.358 -5.590 1.00 0.00 O ATOM 1322 CB ASN A 109 -1.831 -7.305 -4.983 1.00 0.00 C ATOM 1323 CG ASN A 109 -2.876 -8.373 -5.311 1.00 0.00 C ATOM 1324 OD1 ASN A 109 -2.892 -8.741 -6.589 1.00 0.00 O flip ATOM 1325 ND2 ASN A 109 -3.620 -8.833 -4.459 1.00 0.00 N flip ATOM 0 H ASN A 109 -0.081 -8.437 -3.519 1.00 0.00 H new ATOM 0 HA ASN A 109 -0.537 -8.286 -6.394 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -1.812 -7.128 -3.908 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -2.108 -6.363 -5.456 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -3.555 -8.506 -3.495 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -4.306 -9.544 -4.711 1.00 0.00 H new ATOM 1332 N THR A 110 1.691 -6.688 -5.874 1.00 0.00 N ATOM 1333 CA THR A 110 2.612 -5.582 -6.072 1.00 0.00 C ATOM 1334 C THR A 110 1.966 -4.499 -6.939 1.00 0.00 C ATOM 1335 O THR A 110 1.924 -4.621 -8.162 1.00 0.00 O ATOM 1336 CB THR A 110 3.905 -6.145 -6.666 1.00 0.00 C ATOM 1337 OG1 THR A 110 3.467 -7.213 -7.503 1.00 0.00 O ATOM 1338 CG2 THR A 110 4.782 -6.830 -5.616 1.00 0.00 C ATOM 0 H THR A 110 2.118 -7.613 -5.923 1.00 0.00 H new ATOM 0 HA THR A 110 2.856 -5.096 -5.127 1.00 0.00 H new ATOM 0 HB THR A 110 4.467 -5.340 -7.139 1.00 0.00 H new ATOM 0 HG1 THR A 110 3.598 -6.967 -8.443 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.686 -7.212 -6.090 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.053 -6.111 -4.843 1.00 0.00 H new ATOM 0 HG23 THR A 110 4.232 -7.656 -5.166 1.00 0.00 H new ATOM 1346 N TYR A 111 1.479 -3.464 -6.271 1.00 0.00 N ATOM 1347 CA TYR A 111 0.837 -2.360 -6.964 1.00 0.00 C ATOM 1348 C TYR A 111 1.861 -1.296 -7.365 1.00 0.00 C ATOM 1349 O TYR A 111 3.032 -1.387 -7.001 1.00 0.00 O ATOM 1350 CB TYR A 111 -0.150 -1.752 -5.967 1.00 0.00 C ATOM 1351 CG TYR A 111 -0.920 -2.786 -5.144 1.00 0.00 C ATOM 1352 CD1 TYR A 111 -0.377 -3.283 -3.977 1.00 0.00 C ATOM 1353 CD2 TYR A 111 -2.158 -3.223 -5.570 1.00 0.00 C ATOM 1354 CE1 TYR A 111 -1.102 -4.257 -3.202 1.00 0.00 C ATOM 1355 CE2 TYR A 111 -2.884 -4.197 -4.795 1.00 0.00 C ATOM 1356 CZ TYR A 111 -2.320 -4.666 -3.650 1.00 0.00 C ATOM 1357 OH TYR A 111 -3.005 -5.586 -2.919 1.00 0.00 O ATOM 0 H TYR A 111 1.516 -3.366 -5.256 1.00 0.00 H new ATOM 0 HA TYR A 111 0.349 -2.710 -7.874 1.00 0.00 H new ATOM 0 HB2 TYR A 111 0.394 -1.095 -5.288 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.863 -1.131 -6.510 1.00 0.00 H new ATOM 0 HD1 TYR A 111 0.592 -2.942 -3.644 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -2.583 -2.835 -6.484 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -0.688 -4.653 -2.287 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -3.854 -4.547 -5.116 1.00 0.00 H new ATOM 0 HH TYR A 111 -3.668 -6.028 -3.489 1.00 0.00 H new ATOM 1367 N ILE A 112 1.381 -0.310 -8.109 1.00 0.00 N ATOM 1368 CA ILE A 112 2.239 0.771 -8.563 1.00 0.00 C ATOM 1369 C ILE A 112 1.386 2.010 -8.844 1.00 0.00 C ATOM 1370 O ILE A 112 0.355 1.921 -9.508 1.00 0.00 O ATOM 1371 CB ILE A 112 3.081 0.321 -9.759 1.00 0.00 C ATOM 1372 CG1 ILE A 112 4.504 -0.035 -9.324 1.00 0.00 C ATOM 1373 CG2 ILE A 112 3.067 1.375 -10.868 1.00 0.00 C ATOM 1374 CD1 ILE A 112 5.239 -0.800 -10.427 1.00 0.00 C ATOM 0 H ILE A 112 0.409 -0.237 -8.409 1.00 0.00 H new ATOM 0 HA ILE A 112 2.952 1.043 -7.785 1.00 0.00 H new ATOM 0 HB ILE A 112 2.634 -0.584 -10.170 1.00 0.00 H new ATOM 0 HG12 ILE A 112 5.052 0.875 -9.080 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.471 -0.639 -8.417 1.00 0.00 H new ATOM 0 HG21 ILE A 112 3.673 1.030 -11.706 1.00 0.00 H new ATOM 0 HG22 ILE A 112 2.043 1.537 -11.203 1.00 0.00 H new ATOM 0 HG23 ILE A 112 3.475 2.311 -10.486 1.00 0.00 H new ATOM 0 HD11 ILE A 112 6.248 -1.041 -10.092 1.00 0.00 H new ATOM 0 HD12 ILE A 112 4.701 -1.721 -10.651 1.00 0.00 H new ATOM 0 HD13 ILE A 112 5.292 -0.183 -11.324 1.00 0.00 H new ATOM 1386 N SER A 113 1.849 3.137 -8.324 1.00 0.00 N ATOM 1387 CA SER A 113 1.141 4.393 -8.510 1.00 0.00 C ATOM 1388 C SER A 113 0.518 4.440 -9.906 1.00 0.00 C ATOM 1389 O SER A 113 1.206 4.718 -10.888 1.00 0.00 O ATOM 1390 CB SER A 113 2.075 5.587 -8.305 1.00 0.00 C ATOM 1391 OG SER A 113 1.363 6.820 -8.260 1.00 0.00 O ATOM 0 H SER A 113 2.705 3.207 -7.774 1.00 0.00 H new ATOM 0 HA SER A 113 0.349 4.453 -7.763 1.00 0.00 H new ATOM 0 HB2 SER A 113 2.632 5.456 -7.377 1.00 0.00 H new ATOM 0 HB3 SER A 113 2.805 5.619 -9.114 1.00 0.00 H new ATOM 0 HG SER A 113 1.375 7.237 -9.147 1.00 0.00 H new ATOM 1397 N LYS A 114 -0.777 4.165 -9.951 1.00 0.00 N ATOM 1398 CA LYS A 114 -1.501 4.173 -11.211 1.00 0.00 C ATOM 1399 C LYS A 114 -1.563 5.603 -11.750 1.00 0.00 C ATOM 1400 O LYS A 114 -1.679 5.812 -12.956 1.00 0.00 O ATOM 1401 CB LYS A 114 -2.874 3.518 -11.045 1.00 0.00 C ATOM 1402 CG LYS A 114 -3.171 2.565 -12.205 1.00 0.00 C ATOM 1403 CD LYS A 114 -4.359 3.061 -13.031 1.00 0.00 C ATOM 1404 CE LYS A 114 -4.636 2.126 -14.210 1.00 0.00 C ATOM 1405 NZ LYS A 114 -3.471 2.083 -15.122 1.00 0.00 N ATOM 0 H LYS A 114 -1.344 3.935 -9.135 1.00 0.00 H new ATOM 0 HA LYS A 114 -0.976 3.574 -11.955 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.909 2.971 -10.103 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.644 4.288 -10.996 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -2.291 2.477 -12.843 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.384 1.569 -11.817 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.244 3.126 -12.398 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -4.156 4.066 -13.400 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -4.855 1.123 -13.843 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -5.518 2.467 -14.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -3.772 2.344 -16.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -2.747 2.753 -14.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -3.074 1.122 -15.133 1.00 0.00 H new ATOM 1419 N LYS A 115 -1.484 6.552 -10.828 1.00 0.00 N ATOM 1420 CA LYS A 115 -1.530 7.957 -11.195 1.00 0.00 C ATOM 1421 C LYS A 115 -0.289 8.306 -12.020 1.00 0.00 C ATOM 1422 O LYS A 115 -0.217 9.378 -12.618 1.00 0.00 O ATOM 1423 CB LYS A 115 -1.706 8.831 -9.952 1.00 0.00 C ATOM 1424 CG LYS A 115 -2.462 10.118 -10.288 1.00 0.00 C ATOM 1425 CD LYS A 115 -1.690 11.348 -9.807 1.00 0.00 C ATOM 1426 CE LYS A 115 -1.014 12.064 -10.978 1.00 0.00 C ATOM 1427 NZ LYS A 115 -1.997 12.886 -11.720 1.00 0.00 N ATOM 0 H LYS A 115 -1.388 6.375 -9.828 1.00 0.00 H new ATOM 0 HA LYS A 115 -2.398 8.157 -11.823 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.248 8.276 -9.187 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -0.729 9.077 -9.535 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -2.619 10.181 -11.365 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -3.447 10.097 -9.822 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -2.370 12.033 -9.301 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -0.938 11.047 -9.077 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -0.207 12.697 -10.608 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.563 11.332 -11.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -1.522 13.365 -12.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -2.753 12.274 -12.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -2.408 13.597 -11.081 1.00 0.00 H new ATOM 1441 N HIS A 116 0.658 7.379 -12.026 1.00 0.00 N ATOM 1442 CA HIS A 116 1.892 7.574 -12.767 1.00 0.00 C ATOM 1443 C HIS A 116 2.793 6.349 -12.596 1.00 0.00 C ATOM 1444 O HIS A 116 3.819 6.418 -11.920 1.00 0.00 O ATOM 1445 CB HIS A 116 2.577 8.877 -12.349 1.00 0.00 C ATOM 1446 CG HIS A 116 2.150 9.387 -10.993 1.00 0.00 C ATOM 1447 ND1 HIS A 116 2.099 8.579 -9.870 1.00 0.00 N ATOM 1448 CD2 HIS A 116 1.756 10.630 -10.592 1.00 0.00 C ATOM 1449 CE1 HIS A 116 1.691 9.313 -8.845 1.00 0.00 C ATOM 1450 NE2 HIS A 116 1.478 10.583 -9.295 1.00 0.00 N ATOM 0 H HIS A 116 0.595 6.490 -11.529 1.00 0.00 H new ATOM 0 HA HIS A 116 1.670 7.673 -13.830 1.00 0.00 H new ATOM 0 HB2 HIS A 116 3.656 8.723 -12.345 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.367 9.642 -13.096 1.00 0.00 H new ATOM 0 HD2 HIS A 116 1.683 11.504 -11.223 1.00 0.00 H new ATOM 0 HE1 HIS A 116 1.552 8.967 -7.832 1.00 0.00 H new ATOM 0 HE2 HIS A 116 1.158 11.368 -8.728 1.00 0.00 H new ATOM 1458 N ALA A 117 2.378 5.257 -13.219 1.00 0.00 N ATOM 1459 CA ALA A 117 3.134 4.019 -13.144 1.00 0.00 C ATOM 1460 C ALA A 117 4.277 4.062 -14.161 1.00 0.00 C ATOM 1461 O ALA A 117 5.087 3.139 -14.229 1.00 0.00 O ATOM 1462 CB ALA A 117 2.196 2.832 -13.373 1.00 0.00 C ATOM 0 H ALA A 117 1.527 5.204 -13.779 1.00 0.00 H new ATOM 0 HA ALA A 117 3.576 3.899 -12.155 1.00 0.00 H new ATOM 0 HB1 ALA A 117 2.764 1.903 -13.317 1.00 0.00 H new ATOM 0 HB2 ALA A 117 1.419 2.829 -12.608 1.00 0.00 H new ATOM 0 HB3 ALA A 117 1.736 2.917 -14.357 1.00 0.00 H new ATOM 1468 N GLU A 118 4.306 5.144 -14.925 1.00 0.00 N ATOM 1469 CA GLU A 118 5.337 5.320 -15.934 1.00 0.00 C ATOM 1470 C GLU A 118 6.720 5.354 -15.281 1.00 0.00 C ATOM 1471 O GLU A 118 7.731 5.142 -15.948 1.00 0.00 O ATOM 1472 CB GLU A 118 5.088 6.586 -16.757 1.00 0.00 C ATOM 1473 CG GLU A 118 6.358 7.022 -17.489 1.00 0.00 C ATOM 1474 CD GLU A 118 6.018 7.821 -18.749 1.00 0.00 C ATOM 1475 OE1 GLU A 118 5.719 7.168 -19.772 1.00 0.00 O ATOM 1476 OE2 GLU A 118 6.064 9.067 -18.660 1.00 0.00 O ATOM 0 H GLU A 118 3.632 5.908 -14.866 1.00 0.00 H new ATOM 0 HA GLU A 118 5.300 4.470 -16.615 1.00 0.00 H new ATOM 0 HB2 GLU A 118 4.292 6.404 -17.479 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.747 7.388 -16.103 1.00 0.00 H new ATOM 0 HG2 GLU A 118 6.975 7.628 -16.825 1.00 0.00 H new ATOM 0 HG3 GLU A 118 6.946 6.145 -17.758 1.00 0.00 H new ATOM 1483 N LYS A 119 6.720 5.622 -13.983 1.00 0.00 N ATOM 1484 CA LYS A 119 7.962 5.687 -13.232 1.00 0.00 C ATOM 1485 C LYS A 119 8.140 4.391 -12.438 1.00 0.00 C ATOM 1486 O LYS A 119 9.139 4.219 -11.741 1.00 0.00 O ATOM 1487 CB LYS A 119 8.001 6.948 -12.368 1.00 0.00 C ATOM 1488 CG LYS A 119 9.151 7.866 -12.787 1.00 0.00 C ATOM 1489 CD LYS A 119 8.970 9.271 -12.210 1.00 0.00 C ATOM 1490 CE LYS A 119 9.551 10.329 -13.151 1.00 0.00 C ATOM 1491 NZ LYS A 119 8.806 11.601 -13.023 1.00 0.00 N ATOM 0 H LYS A 119 5.879 5.797 -13.433 1.00 0.00 H new ATOM 0 HA LYS A 119 8.813 5.767 -13.909 1.00 0.00 H new ATOM 0 HB2 LYS A 119 7.055 7.482 -12.455 1.00 0.00 H new ATOM 0 HB3 LYS A 119 8.115 6.671 -11.320 1.00 0.00 H new ATOM 0 HG2 LYS A 119 10.098 7.448 -12.445 1.00 0.00 H new ATOM 0 HG3 LYS A 119 9.201 7.919 -13.875 1.00 0.00 H new ATOM 0 HD2 LYS A 119 7.910 9.467 -12.046 1.00 0.00 H new ATOM 0 HD3 LYS A 119 9.460 9.335 -11.238 1.00 0.00 H new ATOM 0 HE2 LYS A 119 10.603 10.492 -12.919 1.00 0.00 H new ATOM 0 HE3 LYS A 119 9.503 9.974 -14.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 9.213 12.308 -13.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 7.807 11.444 -13.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 8.874 11.946 -12.044 1.00 0.00 H new ATOM 1505 N ASN A 120 7.157 3.513 -12.570 1.00 0.00 N ATOM 1506 CA ASN A 120 7.193 2.239 -11.873 1.00 0.00 C ATOM 1507 C ASN A 120 7.027 2.479 -10.372 1.00 0.00 C ATOM 1508 O ASN A 120 7.302 1.593 -9.564 1.00 0.00 O ATOM 1509 CB ASN A 120 8.529 1.528 -12.094 1.00 0.00 C ATOM 1510 CG ASN A 120 8.343 0.255 -12.922 1.00 0.00 C ATOM 1511 OD1 ASN A 120 7.483 0.384 -13.927 1.00 0.00 O flip ATOM 1512 ND2 ASN A 120 8.942 -0.777 -12.664 1.00 0.00 N flip ATOM 0 H ASN A 120 6.330 3.659 -13.150 1.00 0.00 H new ATOM 0 HA ASN A 120 6.386 1.618 -12.263 1.00 0.00 H new ATOM 0 HB2 ASN A 120 9.222 2.198 -12.602 1.00 0.00 H new ATOM 0 HB3 ASN A 120 8.975 1.278 -11.132 1.00 0.00 H new ATOM 0 HD21 ASN A 120 9.589 -0.808 -11.876 1.00 0.00 H new ATOM 0 HD22 ASN A 120 8.795 -1.609 -13.236 1.00 0.00 H new ATOM 1519 N TRP A 121 6.578 3.681 -10.043 1.00 0.00 N ATOM 1520 CA TRP A 121 6.372 4.048 -8.652 1.00 0.00 C ATOM 1521 C TRP A 121 5.523 2.958 -7.995 1.00 0.00 C ATOM 1522 O TRP A 121 4.335 2.832 -8.287 1.00 0.00 O ATOM 1523 CB TRP A 121 5.748 5.441 -8.539 1.00 0.00 C ATOM 1524 CG TRP A 121 6.703 6.582 -8.896 1.00 0.00 C ATOM 1525 CD1 TRP A 121 8.039 6.539 -8.995 1.00 0.00 C ATOM 1526 CD2 TRP A 121 6.339 7.945 -9.199 1.00 0.00 C ATOM 1527 NE1 TRP A 121 8.560 7.770 -9.338 1.00 0.00 N ATOM 1528 CE2 TRP A 121 7.494 8.652 -9.466 1.00 0.00 C ATOM 1529 CE3 TRP A 121 5.076 8.560 -9.246 1.00 0.00 C ATOM 1530 CZ2 TRP A 121 7.500 10.012 -9.798 1.00 0.00 C ATOM 1531 CZ3 TRP A 121 5.099 9.920 -9.579 1.00 0.00 C ATOM 1532 CH2 TRP A 121 6.253 10.646 -9.851 1.00 0.00 C ATOM 0 H TRP A 121 6.351 4.413 -10.716 1.00 0.00 H new ATOM 0 HA TRP A 121 7.324 4.112 -8.125 1.00 0.00 H new ATOM 0 HB2 TRP A 121 4.877 5.492 -9.193 1.00 0.00 H new ATOM 0 HB3 TRP A 121 5.390 5.586 -7.520 1.00 0.00 H new ATOM 0 HD1 TRP A 121 8.633 5.653 -8.827 1.00 0.00 H new ATOM 0 HE1 TRP A 121 9.546 7.992 -9.473 1.00 0.00 H new ATOM 0 HE3 TRP A 121 4.160 8.026 -9.041 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 8.418 10.544 -10.002 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 4.154 10.441 -9.628 1.00 0.00 H new ATOM 0 HH2 TRP A 121 6.188 11.694 -10.102 1.00 0.00 H new ATOM 1543 N PHE A 122 6.166 2.197 -7.122 1.00 0.00 N ATOM 1544 CA PHE A 122 5.485 1.122 -6.422 1.00 0.00 C ATOM 1545 C PHE A 122 4.880 1.620 -5.108 1.00 0.00 C ATOM 1546 O PHE A 122 4.950 2.808 -4.799 1.00 0.00 O ATOM 1547 CB PHE A 122 6.536 0.053 -6.113 1.00 0.00 C ATOM 1548 CG PHE A 122 6.797 -0.915 -7.268 1.00 0.00 C ATOM 1549 CD1 PHE A 122 7.708 -0.600 -8.227 1.00 0.00 C ATOM 1550 CD2 PHE A 122 6.118 -2.091 -7.336 1.00 0.00 C ATOM 1551 CE1 PHE A 122 7.950 -1.498 -9.300 1.00 0.00 C ATOM 1552 CE2 PHE A 122 6.360 -2.990 -8.409 1.00 0.00 C ATOM 1553 CZ PHE A 122 7.271 -2.675 -9.368 1.00 0.00 C ATOM 0 H PHE A 122 7.152 2.304 -6.883 1.00 0.00 H new ATOM 0 HA PHE A 122 4.676 0.731 -7.038 1.00 0.00 H new ATOM 0 HB2 PHE A 122 7.472 0.544 -5.846 1.00 0.00 H new ATOM 0 HB3 PHE A 122 6.215 -0.516 -5.241 1.00 0.00 H new ATOM 0 HD1 PHE A 122 8.248 0.334 -8.173 1.00 0.00 H new ATOM 0 HD2 PHE A 122 5.395 -2.342 -6.574 1.00 0.00 H new ATOM 0 HE1 PHE A 122 8.673 -1.247 -10.062 1.00 0.00 H new ATOM 0 HE2 PHE A 122 5.820 -3.924 -8.463 1.00 0.00 H new ATOM 0 HZ PHE A 122 7.456 -3.359 -10.183 1.00 0.00 H new ATOM 1563 N VAL A 123 4.299 0.686 -4.369 1.00 0.00 N ATOM 1564 CA VAL A 123 3.682 1.015 -3.095 1.00 0.00 C ATOM 1565 C VAL A 123 4.406 0.265 -1.975 1.00 0.00 C ATOM 1566 O VAL A 123 3.839 0.043 -0.905 1.00 0.00 O ATOM 1567 CB VAL A 123 2.183 0.712 -3.147 1.00 0.00 C ATOM 1568 CG1 VAL A 123 1.932 -0.753 -3.510 1.00 0.00 C ATOM 1569 CG2 VAL A 123 1.506 1.073 -1.823 1.00 0.00 C ATOM 0 H VAL A 123 4.243 -0.299 -4.628 1.00 0.00 H new ATOM 0 HA VAL A 123 3.777 2.081 -2.887 1.00 0.00 H new ATOM 0 HB VAL A 123 1.742 1.330 -3.929 1.00 0.00 H new ATOM 0 HG11 VAL A 123 0.859 -0.942 -3.540 1.00 0.00 H new ATOM 0 HG12 VAL A 123 2.365 -0.965 -4.487 1.00 0.00 H new ATOM 0 HG13 VAL A 123 2.393 -1.397 -2.761 1.00 0.00 H new ATOM 0 HG21 VAL A 123 0.441 0.848 -1.886 1.00 0.00 H new ATOM 0 HG22 VAL A 123 1.953 0.492 -1.016 1.00 0.00 H new ATOM 0 HG23 VAL A 123 1.641 2.136 -1.623 1.00 0.00 H new ATOM 1579 N GLY A 124 5.646 -0.104 -2.257 1.00 0.00 N ATOM 1580 CA GLY A 124 6.453 -0.824 -1.286 1.00 0.00 C ATOM 1581 C GLY A 124 7.390 0.127 -0.539 1.00 0.00 C ATOM 1582 O GLY A 124 8.324 0.672 -1.125 1.00 0.00 O ATOM 0 H GLY A 124 6.113 0.082 -3.145 1.00 0.00 H new ATOM 0 HA2 GLY A 124 5.803 -1.334 -0.574 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.037 -1.593 -1.792 1.00 0.00 H new ATOM 1586 N LEU A 125 7.107 0.298 0.744 1.00 0.00 N ATOM 1587 CA LEU A 125 7.913 1.174 1.577 1.00 0.00 C ATOM 1588 C LEU A 125 9.338 0.624 1.659 1.00 0.00 C ATOM 1589 O LEU A 125 9.561 -0.454 2.208 1.00 0.00 O ATOM 1590 CB LEU A 125 7.251 1.372 2.943 1.00 0.00 C ATOM 1591 CG LEU A 125 5.723 1.436 2.945 1.00 0.00 C ATOM 1592 CD1 LEU A 125 5.125 0.235 3.681 1.00 0.00 C ATOM 1593 CD2 LEU A 125 5.230 2.765 3.521 1.00 0.00 C ATOM 0 H LEU A 125 6.331 -0.155 1.227 1.00 0.00 H new ATOM 0 HA LEU A 125 7.979 2.167 1.133 1.00 0.00 H new ATOM 0 HB2 LEU A 125 7.561 0.557 3.597 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.634 2.294 3.380 1.00 0.00 H new ATOM 0 HG LEU A 125 5.378 1.385 1.912 1.00 0.00 H new ATOM 0 HD11 LEU A 125 4.037 0.305 3.668 1.00 0.00 H new ATOM 0 HD12 LEU A 125 5.435 -0.686 3.187 1.00 0.00 H new ATOM 0 HD13 LEU A 125 5.476 0.229 4.713 1.00 0.00 H new ATOM 0 HD21 LEU A 125 4.140 2.784 3.511 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.585 2.871 4.546 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.613 3.588 2.917 1.00 0.00 H new ATOM 1605 N LYS A 126 10.266 1.390 1.104 1.00 0.00 N ATOM 1606 CA LYS A 126 11.664 0.993 1.107 1.00 0.00 C ATOM 1607 C LYS A 126 11.907 0.007 2.251 1.00 0.00 C ATOM 1608 O LYS A 126 11.823 0.376 3.422 1.00 0.00 O ATOM 1609 CB LYS A 126 12.571 2.225 1.154 1.00 0.00 C ATOM 1610 CG LYS A 126 13.843 2.001 0.333 1.00 0.00 C ATOM 1611 CD LYS A 126 15.017 1.616 1.235 1.00 0.00 C ATOM 1612 CE LYS A 126 16.324 1.567 0.443 1.00 0.00 C ATOM 1613 NZ LYS A 126 17.483 1.762 1.342 1.00 0.00 N ATOM 0 H LYS A 126 10.077 2.283 0.649 1.00 0.00 H new ATOM 0 HA LYS A 126 11.915 0.476 0.181 1.00 0.00 H new ATOM 0 HB2 LYS A 126 12.033 3.092 0.769 1.00 0.00 H new ATOM 0 HB3 LYS A 126 12.836 2.447 2.188 1.00 0.00 H new ATOM 0 HG2 LYS A 126 13.672 1.215 -0.402 1.00 0.00 H new ATOM 0 HG3 LYS A 126 14.087 2.908 -0.221 1.00 0.00 H new ATOM 0 HD2 LYS A 126 15.107 2.337 2.048 1.00 0.00 H new ATOM 0 HD3 LYS A 126 14.827 0.644 1.690 1.00 0.00 H new ATOM 0 HE2 LYS A 126 16.410 0.608 -0.068 1.00 0.00 H new ATOM 0 HE3 LYS A 126 16.319 2.339 -0.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 18.363 1.709 0.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 17.416 2.694 1.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 17.486 1.020 2.071 1.00 0.00 H new ATOM 1627 N LYS A 127 12.205 -1.227 1.873 1.00 0.00 N ATOM 1628 CA LYS A 127 12.461 -2.269 2.853 1.00 0.00 C ATOM 1629 C LYS A 127 13.666 -1.874 3.708 1.00 0.00 C ATOM 1630 O LYS A 127 14.684 -2.565 3.708 1.00 0.00 O ATOM 1631 CB LYS A 127 12.614 -3.627 2.164 1.00 0.00 C ATOM 1632 CG LYS A 127 13.673 -3.566 1.061 1.00 0.00 C ATOM 1633 CD LYS A 127 15.030 -4.049 1.577 1.00 0.00 C ATOM 1634 CE LYS A 127 16.058 -2.917 1.561 1.00 0.00 C ATOM 1635 NZ LYS A 127 17.102 -3.150 2.584 1.00 0.00 N ATOM 0 H LYS A 127 12.275 -1.529 0.901 1.00 0.00 H new ATOM 0 HA LYS A 127 11.612 -2.374 3.528 1.00 0.00 H new ATOM 0 HB2 LYS A 127 12.892 -4.382 2.899 1.00 0.00 H new ATOM 0 HB3 LYS A 127 11.658 -3.933 1.739 1.00 0.00 H new ATOM 0 HG2 LYS A 127 13.361 -4.182 0.217 1.00 0.00 H new ATOM 0 HG3 LYS A 127 13.762 -2.544 0.694 1.00 0.00 H new ATOM 0 HD2 LYS A 127 14.922 -4.432 2.592 1.00 0.00 H new ATOM 0 HD3 LYS A 127 15.384 -4.875 0.961 1.00 0.00 H new ATOM 0 HE2 LYS A 127 16.516 -2.848 0.574 1.00 0.00 H new ATOM 0 HE3 LYS A 127 15.562 -1.965 1.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 17.854 -2.438 2.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 16.682 -3.075 3.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 17.505 -4.100 2.458 1.00 0.00 H new ATOM 1649 N ASN A 128 13.511 -0.765 4.415 1.00 0.00 N ATOM 1650 CA ASN A 128 14.575 -0.270 5.273 1.00 0.00 C ATOM 1651 C ASN A 128 13.978 0.190 6.604 1.00 0.00 C ATOM 1652 O ASN A 128 14.547 -0.064 7.665 1.00 0.00 O ATOM 1653 CB ASN A 128 15.285 0.926 4.635 1.00 0.00 C ATOM 1654 CG ASN A 128 16.778 0.645 4.455 1.00 0.00 C ATOM 1655 OD1 ASN A 128 17.058 -0.163 3.437 1.00 0.00 O flip ATOM 1656 ND2 ASN A 128 17.620 1.131 5.192 1.00 0.00 N flip ATOM 0 H ASN A 128 12.665 -0.195 4.412 1.00 0.00 H new ATOM 0 HA ASN A 128 15.292 -1.078 5.422 1.00 0.00 H new ATOM 0 HB2 ASN A 128 14.834 1.148 3.668 1.00 0.00 H new ATOM 0 HB3 ASN A 128 15.150 1.809 5.260 1.00 0.00 H new ATOM 0 HD21 ASN A 128 17.336 1.744 5.956 1.00 0.00 H new ATOM 0 HD22 ASN A 128 18.608 0.924 5.044 1.00 0.00 H new ATOM 1663 N GLY A 129 12.839 0.860 6.506 1.00 0.00 N ATOM 1664 CA GLY A 129 12.158 1.357 7.689 1.00 0.00 C ATOM 1665 C GLY A 129 11.764 2.826 7.518 1.00 0.00 C ATOM 1666 O GLY A 129 12.046 3.653 8.384 1.00 0.00 O ATOM 0 H GLY A 129 12.371 1.070 5.625 1.00 0.00 H new ATOM 0 HA2 GLY A 129 11.268 0.758 7.879 1.00 0.00 H new ATOM 0 HA3 GLY A 129 12.806 1.249 8.559 1.00 0.00 H new ATOM 1670 N SER A 130 11.118 3.105 6.396 1.00 0.00 N ATOM 1671 CA SER A 130 10.683 4.459 6.100 1.00 0.00 C ATOM 1672 C SER A 130 10.204 4.550 4.650 1.00 0.00 C ATOM 1673 O SER A 130 10.889 4.093 3.737 1.00 0.00 O ATOM 1674 CB SER A 130 11.806 5.467 6.353 1.00 0.00 C ATOM 1675 OG SER A 130 11.679 6.625 5.532 1.00 0.00 O ATOM 0 H SER A 130 10.885 2.416 5.681 1.00 0.00 H new ATOM 0 HA SER A 130 9.855 4.705 6.765 1.00 0.00 H new ATOM 0 HB2 SER A 130 11.797 5.764 7.402 1.00 0.00 H new ATOM 0 HB3 SER A 130 12.769 4.992 6.164 1.00 0.00 H new ATOM 0 HG SER A 130 12.414 7.245 5.724 1.00 0.00 H new ATOM 1681 N CYS A 131 9.031 5.144 4.484 1.00 0.00 N ATOM 1682 CA CYS A 131 8.453 5.301 3.160 1.00 0.00 C ATOM 1683 C CYS A 131 9.529 5.863 2.229 1.00 0.00 C ATOM 1684 O CYS A 131 10.617 6.223 2.678 1.00 0.00 O ATOM 1685 CB CYS A 131 7.205 6.186 3.189 1.00 0.00 C ATOM 1686 SG CYS A 131 6.082 5.728 1.818 1.00 0.00 S ATOM 0 H CYS A 131 8.466 5.522 5.244 1.00 0.00 H new ATOM 0 HA CYS A 131 8.122 4.331 2.788 1.00 0.00 H new ATOM 0 HB2 CYS A 131 6.691 6.074 4.144 1.00 0.00 H new ATOM 0 HB3 CYS A 131 7.490 7.234 3.102 1.00 0.00 H new ATOM 0 HG CYS A 131 5.263 6.709 1.582 1.00 0.00 H new ATOM 1692 N LYS A 132 9.189 5.921 0.950 1.00 0.00 N ATOM 1693 CA LYS A 132 10.113 6.433 -0.048 1.00 0.00 C ATOM 1694 C LYS A 132 9.338 7.255 -1.080 1.00 0.00 C ATOM 1695 O LYS A 132 8.127 7.094 -1.225 1.00 0.00 O ATOM 1696 CB LYS A 132 10.929 5.292 -0.658 1.00 0.00 C ATOM 1697 CG LYS A 132 12.422 5.475 -0.377 1.00 0.00 C ATOM 1698 CD LYS A 132 12.689 5.570 1.126 1.00 0.00 C ATOM 1699 CE LYS A 132 14.150 5.244 1.445 1.00 0.00 C ATOM 1700 NZ LYS A 132 14.755 6.321 2.260 1.00 0.00 N ATOM 0 H LYS A 132 8.286 5.622 0.582 1.00 0.00 H new ATOM 0 HA LYS A 132 10.839 7.102 0.413 1.00 0.00 H new ATOM 0 HB2 LYS A 132 10.592 4.340 -0.248 1.00 0.00 H new ATOM 0 HB3 LYS A 132 10.760 5.254 -1.734 1.00 0.00 H new ATOM 0 HG2 LYS A 132 12.980 4.638 -0.797 1.00 0.00 H new ATOM 0 HG3 LYS A 132 12.781 6.378 -0.872 1.00 0.00 H new ATOM 0 HD2 LYS A 132 12.451 6.574 1.479 1.00 0.00 H new ATOM 0 HD3 LYS A 132 12.034 4.881 1.660 1.00 0.00 H new ATOM 0 HE2 LYS A 132 14.209 4.297 1.982 1.00 0.00 H new ATOM 0 HE3 LYS A 132 14.712 5.121 0.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 15.746 6.084 2.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 14.716 7.218 1.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 14.229 6.419 3.152 1.00 0.00 H new ATOM 1714 N ARG A 133 10.067 8.119 -1.770 1.00 0.00 N ATOM 1715 CA ARG A 133 9.464 8.966 -2.784 1.00 0.00 C ATOM 1716 C ARG A 133 9.391 8.225 -4.121 1.00 0.00 C ATOM 1717 O ARG A 133 10.056 7.208 -4.307 1.00 0.00 O ATOM 1718 CB ARG A 133 10.261 10.259 -2.968 1.00 0.00 C ATOM 1719 CG ARG A 133 11.718 9.958 -3.328 1.00 0.00 C ATOM 1720 CD ARG A 133 12.442 11.225 -3.788 1.00 0.00 C ATOM 1721 NE ARG A 133 13.801 10.886 -4.266 1.00 0.00 N ATOM 1722 CZ ARG A 133 14.551 11.691 -5.030 1.00 0.00 C ATOM 1723 NH1 ARG A 133 14.080 12.888 -5.407 1.00 0.00 N ATOM 1724 NH2 ARG A 133 15.774 11.301 -5.416 1.00 0.00 N ATOM 0 H ARG A 133 11.071 8.251 -1.647 1.00 0.00 H new ATOM 0 HA ARG A 133 8.458 9.218 -2.449 1.00 0.00 H new ATOM 0 HB2 ARG A 133 9.806 10.863 -3.753 1.00 0.00 H new ATOM 0 HB3 ARG A 133 10.223 10.847 -2.051 1.00 0.00 H new ATOM 0 HG2 ARG A 133 12.230 9.536 -2.463 1.00 0.00 H new ATOM 0 HG3 ARG A 133 11.754 9.207 -4.118 1.00 0.00 H new ATOM 0 HD2 ARG A 133 11.877 11.707 -4.585 1.00 0.00 H new ATOM 0 HD3 ARG A 133 12.504 11.937 -2.965 1.00 0.00 H new ATOM 0 HE ARG A 133 14.191 9.983 -3.997 1.00 0.00 H new ATOM 0 HH11 ARG A 133 13.150 13.186 -5.112 1.00 0.00 H new ATOM 0 HH12 ARG A 133 14.651 13.501 -5.989 1.00 0.00 H new ATOM 0 HH21 ARG A 133 16.134 10.391 -5.128 1.00 0.00 H new ATOM 0 HH22 ARG A 133 16.345 11.914 -5.998 1.00 0.00 H new ATOM 1738 N GLY A 134 8.578 8.765 -5.017 1.00 0.00 N ATOM 1739 CA GLY A 134 8.410 8.167 -6.331 1.00 0.00 C ATOM 1740 C GLY A 134 9.727 7.577 -6.837 1.00 0.00 C ATOM 1741 O GLY A 134 9.805 6.385 -7.132 1.00 0.00 O ATOM 0 H GLY A 134 8.029 9.610 -4.859 1.00 0.00 H new ATOM 0 HA2 GLY A 134 7.651 7.386 -6.285 1.00 0.00 H new ATOM 0 HA3 GLY A 134 8.051 8.919 -7.033 1.00 0.00 H new ATOM 1745 N PRO A 135 10.757 8.461 -6.925 1.00 0.00 N ATOM 1746 CA PRO A 135 12.067 8.040 -7.390 1.00 0.00 C ATOM 1747 C PRO A 135 12.801 7.239 -6.313 1.00 0.00 C ATOM 1748 O PRO A 135 13.889 7.620 -5.883 1.00 0.00 O ATOM 1749 CB PRO A 135 12.784 9.327 -7.765 1.00 0.00 C ATOM 1750 CG PRO A 135 12.029 10.444 -7.064 1.00 0.00 C ATOM 1751 CD PRO A 135 10.701 9.880 -6.584 1.00 0.00 C ATOM 0 HA PRO A 135 12.013 7.366 -8.245 1.00 0.00 H new ATOM 0 HB2 PRO A 135 13.826 9.300 -7.447 1.00 0.00 H new ATOM 0 HB3 PRO A 135 12.784 9.474 -8.845 1.00 0.00 H new ATOM 0 HG2 PRO A 135 12.607 10.826 -6.223 1.00 0.00 H new ATOM 0 HG3 PRO A 135 11.865 11.280 -7.745 1.00 0.00 H new ATOM 0 HD2 PRO A 135 10.574 10.025 -5.511 1.00 0.00 H new ATOM 0 HD3 PRO A 135 9.861 10.372 -7.074 1.00 0.00 H new ATOM 1759 N ARG A 136 12.176 6.144 -5.906 1.00 0.00 N ATOM 1760 CA ARG A 136 12.756 5.286 -4.887 1.00 0.00 C ATOM 1761 C ARG A 136 11.803 4.135 -4.557 1.00 0.00 C ATOM 1762 O ARG A 136 11.685 3.735 -3.400 1.00 0.00 O ATOM 1763 CB ARG A 136 13.055 6.073 -3.610 1.00 0.00 C ATOM 1764 CG ARG A 136 14.506 6.560 -3.593 1.00 0.00 C ATOM 1765 CD ARG A 136 15.273 5.958 -2.414 1.00 0.00 C ATOM 1766 NE ARG A 136 16.416 6.828 -2.057 1.00 0.00 N ATOM 1767 CZ ARG A 136 17.510 6.403 -1.410 1.00 0.00 C ATOM 1768 NH1 ARG A 136 17.616 5.118 -1.045 1.00 0.00 N ATOM 1769 NH2 ARG A 136 18.497 7.264 -1.127 1.00 0.00 N ATOM 0 H ARG A 136 11.273 5.831 -6.264 1.00 0.00 H new ATOM 0 HA ARG A 136 13.690 4.887 -5.282 1.00 0.00 H new ATOM 0 HB2 ARG A 136 12.380 6.926 -3.538 1.00 0.00 H new ATOM 0 HB3 ARG A 136 12.868 5.445 -2.739 1.00 0.00 H new ATOM 0 HG2 ARG A 136 14.996 6.287 -4.528 1.00 0.00 H new ATOM 0 HG3 ARG A 136 14.527 7.648 -3.528 1.00 0.00 H new ATOM 0 HD2 ARG A 136 14.609 5.846 -1.557 1.00 0.00 H new ATOM 0 HD3 ARG A 136 15.631 4.961 -2.673 1.00 0.00 H new ATOM 0 HE ARG A 136 16.368 7.812 -2.320 1.00 0.00 H new ATOM 0 HH11 ARG A 136 16.864 4.463 -1.260 1.00 0.00 H new ATOM 0 HH12 ARG A 136 18.449 4.795 -0.553 1.00 0.00 H new ATOM 0 HH21 ARG A 136 18.415 8.242 -1.404 1.00 0.00 H new ATOM 0 HH22 ARG A 136 19.330 6.941 -0.635 1.00 0.00 H new ATOM 1783 N THR A 137 11.148 3.635 -5.594 1.00 0.00 N ATOM 1784 CA THR A 137 10.210 2.538 -5.429 1.00 0.00 C ATOM 1785 C THR A 137 10.174 1.672 -6.690 1.00 0.00 C ATOM 1786 O THR A 137 9.539 2.035 -7.679 1.00 0.00 O ATOM 1787 CB THR A 137 8.848 3.132 -5.061 1.00 0.00 C ATOM 1788 OG1 THR A 137 8.288 3.518 -6.314 1.00 0.00 O ATOM 1789 CG2 THR A 137 8.972 4.447 -4.288 1.00 0.00 C ATOM 0 H THR A 137 11.248 3.970 -6.552 1.00 0.00 H new ATOM 0 HA THR A 137 10.519 1.871 -4.624 1.00 0.00 H new ATOM 0 HB THR A 137 8.287 2.412 -4.465 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.989 3.519 -6.999 1.00 0.00 H new ATOM 0 HG21 THR A 137 7.977 4.825 -4.052 1.00 0.00 H new ATOM 0 HG22 THR A 137 9.524 4.275 -3.364 1.00 0.00 H new ATOM 0 HG23 THR A 137 9.503 5.178 -4.897 1.00 0.00 H new ATOM 1797 N HIS A 138 10.865 0.544 -6.614 1.00 0.00 N ATOM 1798 CA HIS A 138 10.920 -0.376 -7.737 1.00 0.00 C ATOM 1799 C HIS A 138 10.934 -1.816 -7.220 1.00 0.00 C ATOM 1800 O HIS A 138 10.878 -2.047 -6.013 1.00 0.00 O ATOM 1801 CB HIS A 138 12.113 -0.060 -8.641 1.00 0.00 C ATOM 1802 CG HIS A 138 12.565 1.380 -8.579 1.00 0.00 C ATOM 1803 ND1 HIS A 138 13.173 1.928 -7.463 1.00 0.00 N ATOM 1804 CD2 HIS A 138 12.492 2.377 -9.507 1.00 0.00 C ATOM 1805 CE1 HIS A 138 13.448 3.198 -7.719 1.00 0.00 C ATOM 1806 NE2 HIS A 138 13.025 3.475 -8.985 1.00 0.00 N ATOM 0 H HIS A 138 11.391 0.247 -5.792 1.00 0.00 H new ATOM 0 HA HIS A 138 10.029 -0.256 -8.354 1.00 0.00 H new ATOM 0 HB2 HIS A 138 12.947 -0.704 -8.363 1.00 0.00 H new ATOM 0 HB3 HIS A 138 11.851 -0.304 -9.670 1.00 0.00 H new ATOM 0 HD2 HIS A 138 12.072 2.288 -10.498 1.00 0.00 H new ATOM 0 HE1 HIS A 138 13.924 3.893 -7.043 1.00 0.00 H new ATOM 0 HE2 HIS A 138 13.105 4.377 -9.454 1.00 0.00 H new ATOM 1814 N TYR A 139 11.008 -2.748 -8.159 1.00 0.00 N ATOM 1815 CA TYR A 139 11.029 -4.159 -7.814 1.00 0.00 C ATOM 1816 C TYR A 139 12.159 -4.465 -6.828 1.00 0.00 C ATOM 1817 O TYR A 139 12.655 -3.567 -6.149 1.00 0.00 O ATOM 1818 CB TYR A 139 11.293 -4.909 -9.121 1.00 0.00 C ATOM 1819 CG TYR A 139 10.152 -5.835 -9.547 1.00 0.00 C ATOM 1820 CD1 TYR A 139 8.846 -5.507 -9.244 1.00 0.00 C ATOM 1821 CD2 TYR A 139 10.429 -6.999 -10.235 1.00 0.00 C ATOM 1822 CE1 TYR A 139 7.773 -6.378 -9.645 1.00 0.00 C ATOM 1823 CE2 TYR A 139 9.355 -7.871 -10.637 1.00 0.00 C ATOM 1824 CZ TYR A 139 8.080 -7.517 -10.322 1.00 0.00 C ATOM 1825 OH TYR A 139 7.066 -8.340 -10.701 1.00 0.00 O ATOM 0 H TYR A 139 11.054 -2.553 -9.159 1.00 0.00 H new ATOM 0 HA TYR A 139 10.090 -4.453 -7.345 1.00 0.00 H new ATOM 0 HB2 TYR A 139 11.474 -4.184 -9.914 1.00 0.00 H new ATOM 0 HB3 TYR A 139 12.204 -5.498 -9.013 1.00 0.00 H new ATOM 0 HD1 TYR A 139 8.629 -4.596 -8.706 1.00 0.00 H new ATOM 0 HD2 TYR A 139 11.451 -7.256 -10.472 1.00 0.00 H new ATOM 0 HE1 TYR A 139 6.747 -6.133 -9.414 1.00 0.00 H new ATOM 0 HE2 TYR A 139 9.558 -8.785 -11.176 1.00 0.00 H new ATOM 0 HH TYR A 139 7.348 -9.273 -10.602 1.00 0.00 H new ATOM 1835 N GLY A 140 12.531 -5.735 -6.780 1.00 0.00 N ATOM 1836 CA GLY A 140 13.593 -6.171 -5.888 1.00 0.00 C ATOM 1837 C GLY A 140 13.435 -5.544 -4.501 1.00 0.00 C ATOM 1838 O GLY A 140 14.390 -5.494 -3.727 1.00 0.00 O ATOM 0 H GLY A 140 12.116 -6.477 -7.344 1.00 0.00 H new ATOM 0 HA2 GLY A 140 13.579 -7.258 -5.804 1.00 0.00 H new ATOM 0 HA3 GLY A 140 14.561 -5.896 -6.307 1.00 0.00 H new ATOM 1842 N GLN A 141 12.223 -5.083 -4.229 1.00 0.00 N ATOM 1843 CA GLN A 141 11.929 -4.461 -2.949 1.00 0.00 C ATOM 1844 C GLN A 141 10.689 -5.101 -2.322 1.00 0.00 C ATOM 1845 O GLN A 141 9.579 -4.595 -2.477 1.00 0.00 O ATOM 1846 CB GLN A 141 11.748 -2.950 -3.102 1.00 0.00 C ATOM 1847 CG GLN A 141 13.082 -2.266 -3.405 1.00 0.00 C ATOM 1848 CD GLN A 141 12.898 -1.122 -4.404 1.00 0.00 C ATOM 1849 OE1 GLN A 141 12.198 -0.153 -4.156 1.00 0.00 O ATOM 1850 NE2 GLN A 141 13.562 -1.287 -5.544 1.00 0.00 N ATOM 0 H GLN A 141 11.433 -5.128 -4.873 1.00 0.00 H new ATOM 0 HA GLN A 141 12.776 -4.626 -2.283 1.00 0.00 H new ATOM 0 HB2 GLN A 141 11.039 -2.744 -3.904 1.00 0.00 H new ATOM 0 HB3 GLN A 141 11.323 -2.537 -2.187 1.00 0.00 H new ATOM 0 HG2 GLN A 141 13.515 -1.881 -2.482 1.00 0.00 H new ATOM 0 HG3 GLN A 141 13.785 -2.995 -3.807 1.00 0.00 H new ATOM 0 HE21 GLN A 141 14.130 -2.122 -5.687 1.00 0.00 H new ATOM 0 HE22 GLN A 141 13.503 -0.579 -6.276 1.00 0.00 H new ATOM 1859 N LYS A 142 10.920 -6.205 -1.626 1.00 0.00 N ATOM 1860 CA LYS A 142 9.835 -6.919 -0.974 1.00 0.00 C ATOM 1861 C LYS A 142 8.783 -5.916 -0.497 1.00 0.00 C ATOM 1862 O LYS A 142 7.603 -6.248 -0.399 1.00 0.00 O ATOM 1863 CB LYS A 142 10.378 -7.817 0.140 1.00 0.00 C ATOM 1864 CG LYS A 142 11.823 -7.449 0.485 1.00 0.00 C ATOM 1865 CD LYS A 142 12.224 -8.024 1.845 1.00 0.00 C ATOM 1866 CE LYS A 142 13.317 -7.176 2.498 1.00 0.00 C ATOM 1867 NZ LYS A 142 12.985 -6.904 3.915 1.00 0.00 N ATOM 0 H LYS A 142 11.842 -6.622 -1.499 1.00 0.00 H new ATOM 0 HA LYS A 142 9.341 -7.587 -1.679 1.00 0.00 H new ATOM 0 HB2 LYS A 142 9.752 -7.720 1.027 1.00 0.00 H new ATOM 0 HB3 LYS A 142 10.329 -8.860 -0.172 1.00 0.00 H new ATOM 0 HG2 LYS A 142 12.493 -7.829 -0.286 1.00 0.00 H new ATOM 0 HG3 LYS A 142 11.933 -6.365 0.498 1.00 0.00 H new ATOM 0 HD2 LYS A 142 11.352 -8.065 2.498 1.00 0.00 H new ATOM 0 HD3 LYS A 142 12.578 -9.047 1.721 1.00 0.00 H new ATOM 0 HE2 LYS A 142 14.274 -7.694 2.436 1.00 0.00 H new ATOM 0 HE3 LYS A 142 13.428 -6.236 1.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 13.859 -6.720 4.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 12.363 -6.072 3.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 12.499 -7.728 4.322 1.00 0.00 H new ATOM 1881 N ALA A 143 9.249 -4.709 -0.213 1.00 0.00 N ATOM 1882 CA ALA A 143 8.363 -3.655 0.251 1.00 0.00 C ATOM 1883 C ALA A 143 7.108 -3.627 -0.623 1.00 0.00 C ATOM 1884 O ALA A 143 5.998 -3.472 -0.117 1.00 0.00 O ATOM 1885 CB ALA A 143 9.110 -2.319 0.241 1.00 0.00 C ATOM 0 H ALA A 143 10.229 -4.437 -0.295 1.00 0.00 H new ATOM 0 HA ALA A 143 8.046 -3.844 1.277 1.00 0.00 H new ATOM 0 HB1 ALA A 143 8.446 -1.528 0.589 1.00 0.00 H new ATOM 0 HB2 ALA A 143 9.976 -2.381 0.900 1.00 0.00 H new ATOM 0 HB3 ALA A 143 9.441 -2.095 -0.773 1.00 0.00 H new ATOM 1891 N ILE A 144 7.327 -3.781 -1.921 1.00 0.00 N ATOM 1892 CA ILE A 144 6.227 -3.776 -2.871 1.00 0.00 C ATOM 1893 C ILE A 144 5.389 -5.042 -2.681 1.00 0.00 C ATOM 1894 O ILE A 144 4.171 -5.016 -2.854 1.00 0.00 O ATOM 1895 CB ILE A 144 6.751 -3.593 -4.297 1.00 0.00 C ATOM 1896 CG1 ILE A 144 7.442 -4.864 -4.794 1.00 0.00 C ATOM 1897 CG2 ILE A 144 7.663 -2.368 -4.393 1.00 0.00 C ATOM 1898 CD1 ILE A 144 7.860 -4.723 -6.259 1.00 0.00 C ATOM 0 H ILE A 144 8.249 -3.910 -2.337 1.00 0.00 H new ATOM 0 HA ILE A 144 5.569 -2.927 -2.687 1.00 0.00 H new ATOM 0 HB ILE A 144 5.900 -3.412 -4.954 1.00 0.00 H new ATOM 0 HG12 ILE A 144 8.319 -5.069 -4.180 1.00 0.00 H new ATOM 0 HG13 ILE A 144 6.769 -5.715 -4.684 1.00 0.00 H new ATOM 0 HG21 ILE A 144 8.022 -2.261 -5.417 1.00 0.00 H new ATOM 0 HG22 ILE A 144 7.105 -1.476 -4.109 1.00 0.00 H new ATOM 0 HG23 ILE A 144 8.513 -2.494 -3.722 1.00 0.00 H new ATOM 0 HD11 ILE A 144 8.349 -5.640 -6.588 1.00 0.00 H new ATOM 0 HD12 ILE A 144 6.978 -4.542 -6.873 1.00 0.00 H new ATOM 0 HD13 ILE A 144 8.551 -3.887 -6.361 1.00 0.00 H new ATOM 1910 N LEU A 145 6.075 -6.119 -2.329 1.00 0.00 N ATOM 1911 CA LEU A 145 5.409 -7.393 -2.114 1.00 0.00 C ATOM 1912 C LEU A 145 4.574 -7.317 -0.835 1.00 0.00 C ATOM 1913 O LEU A 145 5.120 -7.230 0.263 1.00 0.00 O ATOM 1914 CB LEU A 145 6.426 -8.536 -2.119 1.00 0.00 C ATOM 1915 CG LEU A 145 7.323 -8.631 -3.354 1.00 0.00 C ATOM 1916 CD1 LEU A 145 8.625 -9.368 -3.031 1.00 0.00 C ATOM 1917 CD2 LEU A 145 6.577 -9.272 -4.526 1.00 0.00 C ATOM 0 H LEU A 145 7.085 -6.136 -2.187 1.00 0.00 H new ATOM 0 HA LEU A 145 4.721 -7.607 -2.932 1.00 0.00 H new ATOM 0 HB2 LEU A 145 7.062 -8.434 -1.240 1.00 0.00 H new ATOM 0 HB3 LEU A 145 5.886 -9.477 -2.014 1.00 0.00 H new ATOM 0 HG LEU A 145 7.593 -7.620 -3.659 1.00 0.00 H new ATOM 0 HD11 LEU A 145 9.244 -9.422 -3.926 1.00 0.00 H new ATOM 0 HD12 LEU A 145 9.163 -8.831 -2.249 1.00 0.00 H new ATOM 0 HD13 LEU A 145 8.396 -10.377 -2.687 1.00 0.00 H new ATOM 0 HD21 LEU A 145 7.238 -9.327 -5.391 1.00 0.00 H new ATOM 0 HD22 LEU A 145 6.258 -10.277 -4.248 1.00 0.00 H new ATOM 0 HD23 LEU A 145 5.703 -8.669 -4.775 1.00 0.00 H new ATOM 1929 N PHE A 146 3.262 -7.354 -1.020 1.00 0.00 N ATOM 1930 CA PHE A 146 2.346 -7.291 0.106 1.00 0.00 C ATOM 1931 C PHE A 146 1.524 -8.577 0.217 1.00 0.00 C ATOM 1932 O PHE A 146 1.027 -9.089 -0.785 1.00 0.00 O ATOM 1933 CB PHE A 146 1.401 -6.116 -0.151 1.00 0.00 C ATOM 1934 CG PHE A 146 1.992 -4.752 0.207 1.00 0.00 C ATOM 1935 CD1 PHE A 146 2.728 -4.606 1.341 1.00 0.00 C ATOM 1936 CD2 PHE A 146 1.782 -3.684 -0.609 1.00 0.00 C ATOM 1937 CE1 PHE A 146 3.278 -3.339 1.673 1.00 0.00 C ATOM 1938 CE2 PHE A 146 2.331 -2.417 -0.277 1.00 0.00 C ATOM 1939 CZ PHE A 146 3.067 -2.272 0.857 1.00 0.00 C ATOM 0 H PHE A 146 2.812 -7.427 -1.933 1.00 0.00 H new ATOM 0 HA PHE A 146 2.905 -7.168 1.034 1.00 0.00 H new ATOM 0 HB2 PHE A 146 1.119 -6.113 -1.204 1.00 0.00 H new ATOM 0 HB3 PHE A 146 0.487 -6.266 0.423 1.00 0.00 H new ATOM 0 HD1 PHE A 146 2.894 -5.453 1.989 1.00 0.00 H new ATOM 0 HD2 PHE A 146 1.197 -3.800 -1.510 1.00 0.00 H new ATOM 0 HE1 PHE A 146 3.863 -3.223 2.573 1.00 0.00 H new ATOM 0 HE2 PHE A 146 2.164 -1.569 -0.925 1.00 0.00 H new ATOM 0 HZ PHE A 146 3.484 -1.309 1.110 1.00 0.00 H new ATOM 1949 N LEU A 147 1.406 -9.062 1.444 1.00 0.00 N ATOM 1950 CA LEU A 147 0.653 -10.278 1.699 1.00 0.00 C ATOM 1951 C LEU A 147 -0.353 -10.024 2.824 1.00 0.00 C ATOM 1952 O LEU A 147 0.017 -9.992 3.996 1.00 0.00 O ATOM 1953 CB LEU A 147 1.600 -11.448 1.974 1.00 0.00 C ATOM 1954 CG LEU A 147 0.986 -12.846 1.875 1.00 0.00 C ATOM 1955 CD1 LEU A 147 0.909 -13.509 3.251 1.00 0.00 C ATOM 1956 CD2 LEU A 147 -0.378 -12.798 1.184 1.00 0.00 C ATOM 0 H LEU A 147 1.819 -8.635 2.273 1.00 0.00 H new ATOM 0 HA LEU A 147 0.080 -10.563 0.816 1.00 0.00 H new ATOM 0 HB2 LEU A 147 2.433 -11.388 1.273 1.00 0.00 H new ATOM 0 HB3 LEU A 147 2.016 -11.326 2.974 1.00 0.00 H new ATOM 0 HG LEU A 147 1.638 -13.463 1.257 1.00 0.00 H new ATOM 0 HD11 LEU A 147 0.469 -14.501 3.153 1.00 0.00 H new ATOM 0 HD12 LEU A 147 1.912 -13.597 3.669 1.00 0.00 H new ATOM 0 HD13 LEU A 147 0.291 -12.902 3.913 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -0.792 -13.805 1.127 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -1.053 -12.160 1.755 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -0.262 -12.395 0.178 1.00 0.00 H new ATOM 1968 N PRO A 148 -1.638 -9.845 2.416 1.00 0.00 N ATOM 1969 CA PRO A 148 -2.700 -9.595 3.376 1.00 0.00 C ATOM 1970 C PRO A 148 -3.078 -10.876 4.122 1.00 0.00 C ATOM 1971 O PRO A 148 -3.235 -11.932 3.510 1.00 0.00 O ATOM 1972 CB PRO A 148 -3.846 -9.025 2.556 1.00 0.00 C ATOM 1973 CG PRO A 148 -3.557 -9.409 1.114 1.00 0.00 C ATOM 1974 CD PRO A 148 -2.113 -9.877 1.036 1.00 0.00 C ATOM 0 HA PRO A 148 -2.403 -8.898 4.159 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -4.802 -9.432 2.885 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -3.906 -7.942 2.668 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -4.233 -10.199 0.787 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -3.719 -8.558 0.453 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -2.044 -10.881 0.617 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -1.519 -9.223 0.397 1.00 0.00 H new ATOM 1982 N LEU A 149 -3.213 -10.742 5.433 1.00 0.00 N ATOM 1983 CA LEU A 149 -3.570 -11.876 6.269 1.00 0.00 C ATOM 1984 C LEU A 149 -4.693 -11.466 7.224 1.00 0.00 C ATOM 1985 O LEU A 149 -4.503 -11.446 8.439 1.00 0.00 O ATOM 1986 CB LEU A 149 -2.332 -12.430 6.977 1.00 0.00 C ATOM 1987 CG LEU A 149 -1.451 -11.402 7.690 1.00 0.00 C ATOM 1988 CD1 LEU A 149 -1.757 -11.365 9.189 1.00 0.00 C ATOM 1989 CD2 LEU A 149 0.030 -11.664 7.413 1.00 0.00 C ATOM 0 H LEU A 149 -3.082 -9.865 5.937 1.00 0.00 H new ATOM 0 HA LEU A 149 -3.953 -12.694 5.659 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -2.657 -13.170 7.708 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -1.722 -12.955 6.242 1.00 0.00 H new ATOM 0 HG LEU A 149 -1.683 -10.415 7.289 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -1.118 -10.627 9.673 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -2.802 -11.095 9.340 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -1.570 -12.347 9.623 1.00 0.00 H new ATOM 0 HD21 LEU A 149 0.634 -10.919 7.931 1.00 0.00 H new ATOM 0 HD22 LEU A 149 0.296 -12.659 7.769 1.00 0.00 H new ATOM 0 HD23 LEU A 149 0.216 -11.600 6.341 1.00 0.00 H new ATOM 2001 N PRO A 150 -5.869 -11.142 6.622 1.00 0.00 N ATOM 2002 CA PRO A 150 -7.023 -10.734 7.406 1.00 0.00 C ATOM 2003 C PRO A 150 -7.669 -11.936 8.097 1.00 0.00 C ATOM 2004 O PRO A 150 -7.100 -13.027 8.114 1.00 0.00 O ATOM 2005 CB PRO A 150 -7.950 -10.051 6.414 1.00 0.00 C ATOM 2006 CG PRO A 150 -7.499 -10.509 5.037 1.00 0.00 C ATOM 2007 CD PRO A 150 -6.131 -11.154 5.186 1.00 0.00 C ATOM 0 HA PRO A 150 -6.761 -10.056 8.219 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -8.989 -10.327 6.596 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -7.888 -8.967 6.504 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -8.212 -11.219 4.618 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -7.450 -9.664 4.351 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -6.127 -12.170 4.791 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -5.369 -10.597 4.640 1.00 0.00 H new ATOM 2015 N VAL A 151 -8.848 -11.697 8.651 1.00 0.00 N ATOM 2016 CA VAL A 151 -9.577 -12.747 9.342 1.00 0.00 C ATOM 2017 C VAL A 151 -11.049 -12.345 9.464 1.00 0.00 C ATOM 2018 O VAL A 151 -11.733 -12.755 10.400 1.00 0.00 O ATOM 2019 CB VAL A 151 -8.923 -13.035 10.695 1.00 0.00 C ATOM 2020 CG1 VAL A 151 -7.870 -14.138 10.571 1.00 0.00 C ATOM 2021 CG2 VAL A 151 -8.318 -11.764 11.293 1.00 0.00 C ATOM 0 H VAL A 151 -9.317 -10.791 8.636 1.00 0.00 H new ATOM 0 HA VAL A 151 -9.539 -13.676 8.773 1.00 0.00 H new ATOM 0 HB VAL A 151 -9.699 -13.388 11.374 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -7.420 -14.323 11.547 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -8.341 -15.052 10.209 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -7.097 -13.826 9.869 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -7.860 -11.997 12.254 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -7.561 -11.368 10.616 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -9.102 -11.020 11.435 1.00 0.00 H new ATOM 2031 N SER A 152 -11.492 -11.547 8.503 1.00 0.00 N ATOM 2032 CA SER A 152 -12.870 -11.085 8.491 1.00 0.00 C ATOM 2033 C SER A 152 -13.809 -12.231 8.872 1.00 0.00 C ATOM 2034 O SER A 152 -14.101 -13.099 8.051 1.00 0.00 O ATOM 2035 CB SER A 152 -13.249 -10.521 7.120 1.00 0.00 C ATOM 2036 OG SER A 152 -14.660 -10.394 6.967 1.00 0.00 O ATOM 0 H SER A 152 -10.922 -11.209 7.728 1.00 0.00 H new ATOM 0 HA SER A 152 -12.969 -10.284 9.224 1.00 0.00 H new ATOM 0 HB2 SER A 152 -12.781 -9.546 6.987 1.00 0.00 H new ATOM 0 HB3 SER A 152 -12.857 -11.172 6.339 1.00 0.00 H new ATOM 0 HG SER A 152 -14.861 -10.029 6.080 1.00 0.00 H new ATOM 2042 N SER A 153 -14.258 -12.196 10.118 1.00 0.00 N ATOM 2043 CA SER A 153 -15.158 -13.221 10.618 1.00 0.00 C ATOM 2044 C SER A 153 -16.166 -12.603 11.590 1.00 0.00 C ATOM 2045 O SER A 153 -16.023 -12.735 12.805 1.00 0.00 O ATOM 2046 CB SER A 153 -14.383 -14.349 11.302 1.00 0.00 C ATOM 2047 OG SER A 153 -15.251 -15.285 11.936 1.00 0.00 O ATOM 0 H SER A 153 -14.015 -11.474 10.796 1.00 0.00 H new ATOM 0 HA SER A 153 -15.695 -13.648 9.771 1.00 0.00 H new ATOM 0 HB2 SER A 153 -13.769 -14.866 10.565 1.00 0.00 H new ATOM 0 HB3 SER A 153 -13.704 -13.925 12.042 1.00 0.00 H new ATOM 0 HG SER A 153 -14.718 -15.990 12.360 1.00 0.00 H new ATOM 2053 N ASP A 154 -17.162 -11.942 11.019 1.00 0.00 N ATOM 2054 CA ASP A 154 -18.193 -11.304 11.820 1.00 0.00 C ATOM 2055 C ASP A 154 -19.551 -11.497 11.143 1.00 0.00 C ATOM 2056 O ASP A 154 -19.627 -12.026 10.035 1.00 0.00 O ATOM 2057 CB ASP A 154 -17.938 -9.801 11.949 1.00 0.00 C ATOM 2058 CG ASP A 154 -18.352 -9.187 13.288 1.00 0.00 C ATOM 2059 OD1 ASP A 154 -19.571 -8.974 13.462 1.00 0.00 O ATOM 2060 OD2 ASP A 154 -17.440 -8.946 14.107 1.00 0.00 O ATOM 0 H ASP A 154 -17.277 -11.834 10.011 1.00 0.00 H new ATOM 0 HA ASP A 154 -18.180 -11.758 12.811 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -16.876 -9.613 11.794 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -18.473 -9.287 11.150 1.00 0.00 H new TER 2065 ASP A 154 HETATM 2066 C1 NTS A 178 12.712 -11.623 -2.639 1.00 0.00 C HETATM 2067 C2 NTS A 178 13.534 -11.197 -1.596 1.00 0.00 C HETATM 2068 C3 NTS A 178 13.759 -9.838 -1.388 1.00 0.00 C HETATM 2069 C4 NTS A 178 13.159 -8.900 -2.226 1.00 0.00 C HETATM 2070 C5 NTS A 178 11.741 -8.372 -4.103 1.00 0.00 C HETATM 2071 C6 NTS A 178 10.916 -8.776 -5.151 1.00 0.00 C HETATM 2072 C7 NTS A 178 10.687 -10.134 -5.366 1.00 0.00 C HETATM 2073 C8 NTS A 178 11.281 -11.083 -4.534 1.00 0.00 C HETATM 2074 C9 NTS A 178 12.109 -10.684 -3.481 1.00 0.00 C HETATM 2075 C10 NTS A 178 12.335 -9.321 -3.271 1.00 0.00 C HETATM 2076 O11 NTS A 178 10.793 -13.844 -2.330 1.00 0.00 O HETATM 2077 O12 NTS A 178 13.656 -14.336 -1.887 1.00 0.00 O HETATM 2078 O13 NTS A 178 12.655 -13.827 -4.603 1.00 0.00 O HETATM 2079 O31 NTS A 178 14.572 -7.532 0.260 1.00 0.00 O HETATM 2080 O32 NTS A 178 16.553 -9.577 -0.467 1.00 0.00 O HETATM 2081 O33 NTS A 178 14.423 -10.209 1.467 1.00 0.00 O HETATM 2082 O61 NTS A 178 8.414 -7.971 -6.485 1.00 0.00 O HETATM 2083 O62 NTS A 178 10.991 -7.520 -7.823 1.00 0.00 O HETATM 2084 O63 NTS A 178 10.250 -5.915 -5.467 1.00 0.00 O HETATM 2085 S1 NTS A 178 12.457 -13.412 -2.862 1.00 0.00 S HETATM 2086 S3 NTS A 178 14.832 -9.290 -0.026 1.00 0.00 S HETATM 2087 S6 NTS A 178 10.143 -7.538 -6.236 1.00 0.00 S HETATM 0 H8 NTS A 178 11.098 -12.144 -4.706 1.00 0.00 H new HETATM 0 H7 NTS A 178 10.043 -10.455 -6.185 1.00 0.00 H new HETATM 0 H5 NTS A 178 11.923 -7.311 -3.933 1.00 0.00 H new HETATM 0 H4 NTS A 178 13.333 -7.836 -2.065 1.00 0.00 H new HETATM 0 H2 NTS A 178 14.003 -11.931 -0.940 1.00 0.00 H new