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 127 LYS NZ :NH3+ -127:sc= 0.823 (180deg=0.0566) USER MOD Set 1.2: A 128 ASN :FLIP amide:sc= 0.709 F(o=-1.6,f=1.5) USER MOD Set 2.1: A 81 MET CE :methyl -150:sc= -1.78 (180deg=-3.4!) USER MOD Set 2.2: A 137 THR OG1 : rot 67:sc= 0.699 USER MOD Set 3.1: A 75 THR OG1 : rot 142:sc= -1.27 USER MOD Set 3.2: A 77 GLN : amide:sc= -0.404 K(o=-1.7,f=-4.4!) USER MOD Set 4.1: A 55 HIS :FLIP no HE2:sc= -8.06! C(o=-23!,f=-19!) USER MOD Set 4.2: A 57 GLN : amide:sc= -11.3! C(o=-19!,f=-24!) USER MOD Set 5.1: A 32 ASN :FLIP amide:sc= -0.933 F(o=-2.3,f=-0.93) USER MOD Set 5.2: A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 134:sc= -1.8 (180deg=-3.4!) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 CYS SG : rot 73:sc= -3.13! USER MOD Single : A 31 SER OG : rot 170:sc= -1.53 USER MOD Single : A 35 HIS : no HE2:sc= -5.5! C(o=-5.5!,f=-9.8!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot -140:sc= -3.51! USER MOD Single : A 52 SER OG : rot 68:sc= 1.08 USER MOD Single : A 54 GLN : amide:sc= -13.3! C(o=-13!,f=-22!) USER MOD Single : A 59 GLN : amide:sc= -0.989 X(o=-0.99,f=-0.51) USER MOD Single : A 61 SER OG : rot -63:sc= 1.04 USER MOD Single : A 64 SER OG : rot 70:sc= 0.483 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 161:sc= -8.54! (180deg=-10.4!) USER MOD Single : A 72 SER OG : rot 17:sc= -2.24! 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 83 THR OG1 : rot -106:sc= 0.137 USER MOD Single : A 88 TYR OH : rot 180:sc= -0.287 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 THR OG1 : rot 65:sc= 1.02 USER MOD Single : A 94 ASN :FLIP amide:sc= -0.898 F(o=-3.8!,f=-0.9) USER MOD Single : A 97 CYS SG : rot -44:sc= -9.5! USER MOD Single : A 106 ASN : amide:sc=-0.00173 X(o=-0.0017,f=0) USER MOD Single : A 107 HIS : no HD1:sc= -3.83! C(o=-3.8!,f=-3.4!) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 ASN :FLIP amide:sc= -6.08! C(o=-7.9!,f=-6.1!) USER MOD Single : A 110 THR OG1 : rot 47:sc= -0.548! USER MOD Single : A 111 TYR OH : rot 30:sc= -1.31 USER MOD Single : A 113 SER OG : rot 50:sc= -1.73 USER MOD Single : A 114 LYS NZ :NH3+ -163:sc= -0.0614 (180deg=-0.477) USER MOD Single : A 115 LYS NZ :NH3+ -146:sc= -2.13! (180deg=-3.68!) USER MOD Single : A 116 HIS : no HE2:sc= -15.9! C(o=-16!,f=-17!) USER MOD Single : A 119 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.315) USER MOD Single : A 120 ASN : amide:sc= -0.605 X(o=-0.61,f=-0.31) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot -42:sc= 0.328! USER MOD Single : A 131 CYS SG : rot 171:sc= -1.7 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 HIS : no HD1:sc= -3.11! C(o=-3.1!,f=-5.4!) USER MOD Single : A 139 TYR OH : rot 180:sc= -0.746 USER MOD Single : A 141 GLN :FLIP amide:sc= -0.153 F(o=-0.77,f=-0.15) 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 -10.835 -5.785 14.223 1.00 0.00 N ATOM 2 CA LYS A 24 -10.359 -5.386 12.909 1.00 0.00 C ATOM 3 C LYS A 24 -9.412 -6.458 12.367 1.00 0.00 C ATOM 4 O LYS A 24 -8.205 -6.239 12.282 1.00 0.00 O ATOM 5 CB LYS A 24 -9.739 -3.988 12.966 1.00 0.00 C ATOM 6 CG LYS A 24 -10.800 -2.929 13.271 1.00 0.00 C ATOM 7 CD LYS A 24 -11.038 -2.811 14.778 1.00 0.00 C ATOM 8 CE LYS A 24 -11.641 -1.450 15.132 1.00 0.00 C ATOM 9 NZ LYS A 24 -12.981 -1.618 15.738 1.00 0.00 N ATOM 0 HA LYS A 24 -11.191 -5.312 12.208 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -8.963 -3.961 13.731 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -9.257 -3.761 12.015 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -10.482 -1.965 12.873 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -11.733 -3.189 12.771 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -11.707 -3.606 15.108 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -10.096 -2.945 15.310 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -10.985 -0.924 15.826 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -11.715 -0.834 14.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.376 -0.685 15.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -13.609 -2.100 15.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -12.901 -2.187 16.605 1.00 0.00 H new ATOM 23 N PRO A 25 -10.011 -7.624 12.006 1.00 0.00 N ATOM 24 CA PRO A 25 -9.234 -8.731 11.474 1.00 0.00 C ATOM 25 C PRO A 25 -8.810 -8.460 10.029 1.00 0.00 C ATOM 26 O PRO A 25 -9.386 -9.016 9.095 1.00 0.00 O ATOM 27 CB PRO A 25 -10.136 -9.947 11.611 1.00 0.00 C ATOM 28 CG PRO A 25 -11.546 -9.403 11.780 1.00 0.00 C ATOM 29 CD PRO A 25 -11.438 -7.919 12.092 1.00 0.00 C ATOM 0 HA PRO A 25 -8.298 -8.884 12.011 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -10.067 -10.586 10.731 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -9.846 -10.554 12.469 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -12.128 -9.561 10.872 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -12.063 -9.926 12.585 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -12.009 -7.322 11.381 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -11.830 -7.694 13.084 1.00 0.00 H new ATOM 37 N LYS A 26 -7.807 -7.606 9.891 1.00 0.00 N ATOM 38 CA LYS A 26 -7.300 -7.254 8.575 1.00 0.00 C ATOM 39 C LYS A 26 -5.974 -6.507 8.728 1.00 0.00 C ATOM 40 O LYS A 26 -5.900 -5.504 9.437 1.00 0.00 O ATOM 41 CB LYS A 26 -8.355 -6.479 7.784 1.00 0.00 C ATOM 42 CG LYS A 26 -7.699 -5.515 6.793 1.00 0.00 C ATOM 43 CD LYS A 26 -6.762 -6.261 5.841 1.00 0.00 C ATOM 44 CE LYS A 26 -5.535 -5.412 5.503 1.00 0.00 C ATOM 45 NZ LYS A 26 -5.536 -5.049 4.068 1.00 0.00 N ATOM 0 H LYS A 26 -7.332 -7.147 10.668 1.00 0.00 H new ATOM 0 HA LYS A 26 -7.095 -8.152 7.993 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -8.997 -7.177 7.247 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -8.993 -5.922 8.470 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -8.468 -4.997 6.220 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -7.140 -4.754 7.337 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.445 -7.199 6.297 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -7.296 -6.516 4.925 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -5.531 -4.509 6.113 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -4.626 -5.963 5.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -5.317 -4.037 3.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -4.818 -5.611 3.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -6.473 -5.243 3.661 1.00 0.00 H new ATOM 59 N LEU A 27 -4.959 -7.024 8.051 1.00 0.00 N ATOM 60 CA LEU A 27 -3.639 -6.418 8.102 1.00 0.00 C ATOM 61 C LEU A 27 -2.805 -6.923 6.923 1.00 0.00 C ATOM 62 O LEU A 27 -2.925 -8.080 6.523 1.00 0.00 O ATOM 63 CB LEU A 27 -2.989 -6.665 9.465 1.00 0.00 C ATOM 64 CG LEU A 27 -2.102 -7.907 9.571 1.00 0.00 C ATOM 65 CD1 LEU A 27 -0.696 -7.624 9.039 1.00 0.00 C ATOM 66 CD2 LEU A 27 -2.076 -8.442 11.004 1.00 0.00 C ATOM 0 H LEU A 27 -5.024 -7.856 7.464 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.713 -5.335 8.001 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -2.389 -5.792 9.723 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -3.778 -6.742 10.213 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.532 -8.688 8.944 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.086 -8.523 9.126 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.756 -7.326 7.992 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.242 -6.820 9.619 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -1.438 -9.325 11.051 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.684 -7.675 11.672 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -3.087 -8.708 11.311 1.00 0.00 H new ATOM 78 N LEU A 28 -1.978 -6.029 6.399 1.00 0.00 N ATOM 79 CA LEU A 28 -1.125 -6.369 5.274 1.00 0.00 C ATOM 80 C LEU A 28 0.280 -6.694 5.785 1.00 0.00 C ATOM 81 O LEU A 28 0.695 -6.197 6.831 1.00 0.00 O ATOM 82 CB LEU A 28 -1.155 -5.257 4.223 1.00 0.00 C ATOM 83 CG LEU A 28 -1.418 -5.702 2.783 1.00 0.00 C ATOM 84 CD1 LEU A 28 -1.213 -4.543 1.805 1.00 0.00 C ATOM 85 CD2 LEU A 28 -0.562 -6.917 2.420 1.00 0.00 C ATOM 0 H LEU A 28 -1.881 -5.070 6.733 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.496 -7.262 4.771 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.923 -4.537 4.506 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -0.200 -4.732 4.251 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.461 -6.008 2.705 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -1.406 -4.886 0.789 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.900 -3.733 2.051 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -0.187 -4.183 1.877 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.768 -7.213 1.391 1.00 0.00 H new ATOM 0 HD22 LEU A 28 0.493 -6.662 2.520 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.800 -7.743 3.090 1.00 0.00 H new ATOM 97 N TYR A 29 0.975 -7.527 5.023 1.00 0.00 N ATOM 98 CA TYR A 29 2.324 -7.924 5.386 1.00 0.00 C ATOM 99 C TYR A 29 3.258 -7.865 4.175 1.00 0.00 C ATOM 100 O TYR A 29 2.822 -8.057 3.041 1.00 0.00 O ATOM 101 CB TYR A 29 2.223 -9.374 5.866 1.00 0.00 C ATOM 102 CG TYR A 29 3.576 -10.053 6.084 1.00 0.00 C ATOM 103 CD1 TYR A 29 4.453 -9.556 7.027 1.00 0.00 C ATOM 104 CD2 TYR A 29 3.920 -11.163 5.339 1.00 0.00 C ATOM 105 CE1 TYR A 29 5.727 -10.196 7.233 1.00 0.00 C ATOM 106 CE2 TYR A 29 5.193 -11.802 5.545 1.00 0.00 C ATOM 107 CZ TYR A 29 6.034 -11.287 6.482 1.00 0.00 C ATOM 108 OH TYR A 29 7.237 -11.891 6.676 1.00 0.00 O ATOM 0 H TYR A 29 0.628 -7.937 4.156 1.00 0.00 H new ATOM 0 HA TYR A 29 2.727 -7.258 6.149 1.00 0.00 H new ATOM 0 HB2 TYR A 29 1.661 -9.398 6.800 1.00 0.00 H new ATOM 0 HB3 TYR A 29 1.653 -9.949 5.136 1.00 0.00 H new ATOM 0 HD1 TYR A 29 4.184 -8.688 7.610 1.00 0.00 H new ATOM 0 HD2 TYR A 29 3.234 -11.552 4.601 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.423 -9.818 7.967 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.474 -12.671 4.969 1.00 0.00 H new ATOM 0 HH TYR A 29 7.319 -12.658 6.071 1.00 0.00 H new ATOM 118 N CYS A 30 4.524 -7.598 4.457 1.00 0.00 N ATOM 119 CA CYS A 30 5.523 -7.510 3.405 1.00 0.00 C ATOM 120 C CYS A 30 6.458 -8.715 3.529 1.00 0.00 C ATOM 121 O CYS A 30 6.735 -9.179 4.634 1.00 0.00 O ATOM 122 CB CYS A 30 6.287 -6.186 3.459 1.00 0.00 C ATOM 123 SG CYS A 30 6.590 -5.569 1.763 1.00 0.00 S ATOM 0 H CYS A 30 4.882 -7.440 5.399 1.00 0.00 H new ATOM 0 HA CYS A 30 5.033 -7.530 2.432 1.00 0.00 H new ATOM 0 HB2 CYS A 30 5.717 -5.450 4.026 1.00 0.00 H new ATOM 0 HB3 CYS A 30 7.235 -6.324 3.979 1.00 0.00 H new ATOM 0 HG CYS A 30 5.478 -5.124 1.258 1.00 0.00 H new ATOM 129 N SER A 31 6.919 -9.186 2.380 1.00 0.00 N ATOM 130 CA SER A 31 7.818 -10.328 2.347 1.00 0.00 C ATOM 131 C SER A 31 9.093 -10.013 3.132 1.00 0.00 C ATOM 132 O SER A 31 9.191 -10.331 4.317 1.00 0.00 O ATOM 133 CB SER A 31 8.164 -10.715 0.907 1.00 0.00 C ATOM 134 OG SER A 31 9.390 -11.436 0.828 1.00 0.00 O ATOM 0 H SER A 31 6.687 -8.798 1.465 1.00 0.00 H new ATOM 0 HA SER A 31 7.312 -11.175 2.811 1.00 0.00 H new ATOM 0 HB2 SER A 31 7.359 -11.321 0.491 1.00 0.00 H new ATOM 0 HB3 SER A 31 8.233 -9.815 0.296 1.00 0.00 H new ATOM 0 HG SER A 31 9.496 -11.803 -0.074 1.00 0.00 H new ATOM 140 N ASN A 32 10.038 -9.393 2.441 1.00 0.00 N ATOM 141 CA ASN A 32 11.302 -9.032 3.060 1.00 0.00 C ATOM 142 C ASN A 32 11.087 -7.839 3.993 1.00 0.00 C ATOM 143 O ASN A 32 10.421 -6.872 3.627 1.00 0.00 O ATOM 144 CB ASN A 32 12.335 -8.627 2.006 1.00 0.00 C ATOM 145 CG ASN A 32 13.758 -8.773 2.548 1.00 0.00 C ATOM 146 OD1 ASN A 32 14.501 -7.677 2.420 1.00 0.00 O flip ATOM 147 ND2 ASN A 32 14.156 -9.812 3.050 1.00 0.00 N flip ATOM 0 H ASN A 32 9.954 -9.131 1.459 1.00 0.00 H new ATOM 0 HA ASN A 32 11.667 -9.899 3.610 1.00 0.00 H new ATOM 0 HB2 ASN A 32 12.215 -9.247 1.117 1.00 0.00 H new ATOM 0 HB3 ASN A 32 12.163 -7.595 1.700 1.00 0.00 H new ATOM 0 HD21 ASN A 32 13.533 -10.617 3.117 1.00 0.00 H new ATOM 0 HD22 ASN A 32 15.111 -9.875 3.402 1.00 0.00 H new ATOM 154 N GLY A 33 11.663 -7.947 5.181 1.00 0.00 N ATOM 155 CA GLY A 33 11.542 -6.889 6.170 1.00 0.00 C ATOM 156 C GLY A 33 10.325 -7.116 7.070 1.00 0.00 C ATOM 157 O GLY A 33 10.291 -6.643 8.205 1.00 0.00 O ATOM 0 H GLY A 33 12.215 -8.751 5.481 1.00 0.00 H new ATOM 0 HA2 GLY A 33 12.446 -6.849 6.778 1.00 0.00 H new ATOM 0 HA3 GLY A 33 11.453 -5.926 5.668 1.00 0.00 H new ATOM 161 N GLY A 34 9.356 -7.839 6.529 1.00 0.00 N ATOM 162 CA GLY A 34 8.140 -8.134 7.268 1.00 0.00 C ATOM 163 C GLY A 34 7.420 -6.847 7.674 1.00 0.00 C ATOM 164 O GLY A 34 6.618 -6.848 8.608 1.00 0.00 O ATOM 0 H GLY A 34 9.388 -8.230 5.587 1.00 0.00 H new ATOM 0 HA2 GLY A 34 7.478 -8.748 6.657 1.00 0.00 H new ATOM 0 HA3 GLY A 34 8.383 -8.715 8.157 1.00 0.00 H new ATOM 168 N HIS A 35 7.730 -5.780 6.953 1.00 0.00 N ATOM 169 CA HIS A 35 7.122 -4.489 7.227 1.00 0.00 C ATOM 170 C HIS A 35 5.600 -4.609 7.136 1.00 0.00 C ATOM 171 O HIS A 35 5.082 -5.480 6.438 1.00 0.00 O ATOM 172 CB HIS A 35 7.688 -3.414 6.297 1.00 0.00 C ATOM 173 CG HIS A 35 9.153 -3.119 6.518 1.00 0.00 C ATOM 174 ND1 HIS A 35 10.163 -3.863 5.934 1.00 0.00 N ATOM 175 CD2 HIS A 35 9.765 -2.156 7.264 1.00 0.00 C ATOM 176 CE1 HIS A 35 11.328 -3.361 6.319 1.00 0.00 C ATOM 177 NE2 HIS A 35 11.079 -2.303 7.143 1.00 0.00 N ATOM 0 H HIS A 35 8.394 -5.783 6.179 1.00 0.00 H new ATOM 0 HA HIS A 35 7.367 -4.176 8.242 1.00 0.00 H new ATOM 0 HB2 HIS A 35 7.543 -3.729 5.264 1.00 0.00 H new ATOM 0 HB3 HIS A 35 7.118 -2.495 6.432 1.00 0.00 H new ATOM 0 HD1 HIS A 35 10.033 -4.662 5.313 1.00 0.00 H new ATOM 0 HD2 HIS A 35 9.266 -1.401 7.854 1.00 0.00 H new ATOM 0 HE1 HIS A 35 12.303 -3.726 6.031 1.00 0.00 H new ATOM 185 N PHE A 36 4.924 -3.722 7.852 1.00 0.00 N ATOM 186 CA PHE A 36 3.471 -3.717 7.861 1.00 0.00 C ATOM 187 C PHE A 36 2.926 -2.304 7.645 1.00 0.00 C ATOM 188 O PHE A 36 2.820 -1.525 8.591 1.00 0.00 O ATOM 189 CB PHE A 36 3.031 -4.217 9.238 1.00 0.00 C ATOM 190 CG PHE A 36 3.243 -5.717 9.453 1.00 0.00 C ATOM 191 CD1 PHE A 36 4.461 -6.183 9.839 1.00 0.00 C ATOM 192 CD2 PHE A 36 2.213 -6.584 9.260 1.00 0.00 C ATOM 193 CE1 PHE A 36 4.657 -7.575 10.038 1.00 0.00 C ATOM 194 CE2 PHE A 36 2.410 -7.976 9.459 1.00 0.00 C ATOM 195 CZ PHE A 36 3.628 -8.442 9.844 1.00 0.00 C ATOM 0 H PHE A 36 5.356 -3.001 8.430 1.00 0.00 H new ATOM 0 HA PHE A 36 3.091 -4.349 7.058 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.580 -3.670 10.004 1.00 0.00 H new ATOM 0 HB3 PHE A 36 1.975 -3.986 9.376 1.00 0.00 H new ATOM 0 HD1 PHE A 36 5.279 -5.495 9.994 1.00 0.00 H new ATOM 0 HD2 PHE A 36 1.245 -6.214 8.955 1.00 0.00 H new ATOM 0 HE1 PHE A 36 5.624 -7.945 10.344 1.00 0.00 H new ATOM 0 HE2 PHE A 36 1.592 -8.665 9.305 1.00 0.00 H new ATOM 0 HZ PHE A 36 3.778 -9.501 9.996 1.00 0.00 H new ATOM 205 N LEU A 37 2.593 -2.017 6.396 1.00 0.00 N ATOM 206 CA LEU A 37 2.061 -0.711 6.044 1.00 0.00 C ATOM 207 C LEU A 37 1.147 -0.218 7.168 1.00 0.00 C ATOM 208 O LEU A 37 0.586 -1.020 7.913 1.00 0.00 O ATOM 209 CB LEU A 37 1.379 -0.761 4.675 1.00 0.00 C ATOM 210 CG LEU A 37 2.004 0.110 3.583 1.00 0.00 C ATOM 211 CD1 LEU A 37 1.581 -0.368 2.192 1.00 0.00 C ATOM 212 CD2 LEU A 37 1.675 1.587 3.806 1.00 0.00 C ATOM 0 H LEU A 37 2.681 -2.666 5.614 1.00 0.00 H new ATOM 0 HA LEU A 37 2.868 0.015 5.946 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.376 -1.795 4.330 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.338 -0.463 4.799 1.00 0.00 H new ATOM 0 HG LEU A 37 3.088 0.009 3.643 1.00 0.00 H new ATOM 0 HD11 LEU A 37 2.039 0.268 1.434 1.00 0.00 H new ATOM 0 HD12 LEU A 37 1.907 -1.398 2.047 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.496 -0.315 2.103 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.131 2.185 3.017 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.594 1.726 3.788 1.00 0.00 H new ATOM 0 HD23 LEU A 37 2.065 1.905 4.773 1.00 0.00 H new ATOM 224 N ARG A 38 1.027 1.098 7.255 1.00 0.00 N ATOM 225 CA ARG A 38 0.192 1.708 8.275 1.00 0.00 C ATOM 226 C ARG A 38 -0.477 2.971 7.729 1.00 0.00 C ATOM 227 O ARG A 38 -0.044 3.519 6.717 1.00 0.00 O ATOM 228 CB ARG A 38 1.012 2.069 9.515 1.00 0.00 C ATOM 229 CG ARG A 38 2.397 2.588 9.124 1.00 0.00 C ATOM 230 CD ARG A 38 3.498 1.676 9.669 1.00 0.00 C ATOM 231 NE ARG A 38 3.709 1.941 11.110 1.00 0.00 N ATOM 232 CZ ARG A 38 4.327 3.028 11.591 1.00 0.00 C ATOM 233 NH1 ARG A 38 4.800 3.957 10.750 1.00 0.00 N ATOM 234 NH2 ARG A 38 4.473 3.185 12.914 1.00 0.00 N ATOM 0 H ARG A 38 1.495 1.760 6.635 1.00 0.00 H new ATOM 0 HA ARG A 38 -0.571 0.982 8.556 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.486 2.827 10.095 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.115 1.193 10.155 1.00 0.00 H new ATOM 0 HG2 ARG A 38 2.474 2.648 8.038 1.00 0.00 H new ATOM 0 HG3 ARG A 38 2.533 3.598 9.509 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.224 0.632 9.519 1.00 0.00 H new ATOM 0 HD3 ARG A 38 4.425 1.844 9.121 1.00 0.00 H new ATOM 0 HE ARG A 38 3.362 1.253 11.778 1.00 0.00 H new ATOM 0 HH11 ARG A 38 4.690 3.837 9.743 1.00 0.00 H new ATOM 0 HH12 ARG A 38 5.270 4.785 11.116 1.00 0.00 H new ATOM 0 HH21 ARG A 38 4.114 2.477 13.554 1.00 0.00 H new ATOM 0 HH22 ARG A 38 4.943 4.012 13.281 1.00 0.00 H new ATOM 248 N ILE A 39 -1.523 3.395 8.423 1.00 0.00 N ATOM 249 CA ILE A 39 -2.257 4.583 8.020 1.00 0.00 C ATOM 250 C ILE A 39 -2.437 5.501 9.231 1.00 0.00 C ATOM 251 O ILE A 39 -3.204 5.191 10.141 1.00 0.00 O ATOM 252 CB ILE A 39 -3.572 4.196 7.341 1.00 0.00 C ATOM 253 CG1 ILE A 39 -3.666 4.806 5.941 1.00 0.00 C ATOM 254 CG2 ILE A 39 -4.771 4.573 8.213 1.00 0.00 C ATOM 255 CD1 ILE A 39 -2.806 4.028 4.944 1.00 0.00 C ATOM 0 H ILE A 39 -1.880 2.937 9.262 1.00 0.00 H new ATOM 0 HA ILE A 39 -1.694 5.144 7.275 1.00 0.00 H new ATOM 0 HB ILE A 39 -3.589 3.113 7.222 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -4.704 4.805 5.609 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.342 5.846 5.971 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -5.693 4.287 7.707 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -4.704 4.052 9.168 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -4.771 5.649 8.386 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -2.891 4.483 3.957 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -1.765 4.052 5.266 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -3.148 2.994 4.898 1.00 0.00 H new ATOM 267 N LEU A 40 -1.717 6.613 9.202 1.00 0.00 N ATOM 268 CA LEU A 40 -1.788 7.578 10.286 1.00 0.00 C ATOM 269 C LEU A 40 -2.956 8.535 10.036 1.00 0.00 C ATOM 270 O LEU A 40 -3.211 8.923 8.897 1.00 0.00 O ATOM 271 CB LEU A 40 -0.442 8.284 10.463 1.00 0.00 C ATOM 272 CG LEU A 40 0.801 7.447 10.154 1.00 0.00 C ATOM 273 CD1 LEU A 40 1.981 8.339 9.765 1.00 0.00 C ATOM 274 CD2 LEU A 40 1.143 6.522 11.324 1.00 0.00 C ATOM 0 H LEU A 40 -1.082 6.867 8.445 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.985 7.074 11.232 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.430 9.166 9.823 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.372 8.636 11.492 1.00 0.00 H new ATOM 0 HG LEU A 40 0.581 6.813 9.295 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.851 7.718 9.551 1.00 0.00 H new ATOM 0 HD12 LEU A 40 1.722 8.919 8.879 1.00 0.00 H new ATOM 0 HD13 LEU A 40 2.212 9.016 10.587 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.030 5.938 11.079 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.336 7.119 12.215 1.00 0.00 H new ATOM 0 HD23 LEU A 40 0.306 5.849 11.512 1.00 0.00 H new ATOM 286 N PRO A 41 -3.651 8.896 11.148 1.00 0.00 N ATOM 287 CA PRO A 41 -4.786 9.799 11.060 1.00 0.00 C ATOM 288 C PRO A 41 -4.323 11.241 10.839 1.00 0.00 C ATOM 289 O PRO A 41 -5.122 12.172 10.920 1.00 0.00 O ATOM 290 CB PRO A 41 -5.540 9.611 12.366 1.00 0.00 C ATOM 291 CG PRO A 41 -4.556 8.961 13.326 1.00 0.00 C ATOM 292 CD PRO A 41 -3.377 8.455 12.512 1.00 0.00 C ATOM 0 HA PRO A 41 -5.431 9.583 10.208 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -5.892 10.567 12.755 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -6.419 8.982 12.223 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -4.223 9.679 14.075 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -5.031 8.139 13.861 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -2.437 8.866 12.880 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -3.294 7.370 12.568 1.00 0.00 H new ATOM 300 N ASP A 42 -3.034 11.379 10.565 1.00 0.00 N ATOM 301 CA ASP A 42 -2.456 12.691 10.332 1.00 0.00 C ATOM 302 C ASP A 42 -2.418 12.968 8.828 1.00 0.00 C ATOM 303 O ASP A 42 -2.509 14.118 8.402 1.00 0.00 O ATOM 304 CB ASP A 42 -1.022 12.764 10.862 1.00 0.00 C ATOM 305 CG ASP A 42 -0.623 14.111 11.467 1.00 0.00 C ATOM 306 OD1 ASP A 42 -0.463 15.064 10.673 1.00 0.00 O ATOM 307 OD2 ASP A 42 -0.488 14.159 12.708 1.00 0.00 O ATOM 0 H ASP A 42 -2.374 10.604 10.499 1.00 0.00 H new ATOM 0 HA ASP A 42 -3.071 13.426 10.851 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -0.891 11.990 11.618 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -0.337 12.532 10.046 1.00 0.00 H new ATOM 312 N GLY A 43 -2.282 11.893 8.065 1.00 0.00 N ATOM 313 CA GLY A 43 -2.231 12.005 6.617 1.00 0.00 C ATOM 314 C GLY A 43 -0.879 11.532 6.078 1.00 0.00 C ATOM 315 O GLY A 43 -0.500 11.872 4.958 1.00 0.00 O ATOM 0 H GLY A 43 -2.206 10.941 8.422 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -3.031 11.411 6.174 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -2.402 13.040 6.322 1.00 0.00 H new ATOM 319 N THR A 44 -0.190 10.755 6.900 1.00 0.00 N ATOM 320 CA THR A 44 1.111 10.232 6.520 1.00 0.00 C ATOM 321 C THR A 44 1.100 8.702 6.549 1.00 0.00 C ATOM 322 O THR A 44 0.646 8.099 7.520 1.00 0.00 O ATOM 323 CB THR A 44 2.159 10.850 7.448 1.00 0.00 C ATOM 324 OG1 THR A 44 2.558 12.042 6.777 1.00 0.00 O ATOM 325 CG2 THR A 44 3.441 10.017 7.521 1.00 0.00 C ATOM 0 H THR A 44 -0.508 10.475 7.828 1.00 0.00 H new ATOM 0 HA THR A 44 1.363 10.505 5.495 1.00 0.00 H new ATOM 0 HB THR A 44 1.739 10.958 8.448 1.00 0.00 H new ATOM 0 HG1 THR A 44 3.236 12.507 7.311 1.00 0.00 H new ATOM 0 HG21 THR A 44 4.151 10.500 8.193 1.00 0.00 H new ATOM 0 HG22 THR A 44 3.207 9.021 7.896 1.00 0.00 H new ATOM 0 HG23 THR A 44 3.880 9.936 6.526 1.00 0.00 H new ATOM 333 N VAL A 45 1.606 8.118 5.472 1.00 0.00 N ATOM 334 CA VAL A 45 1.660 6.670 5.362 1.00 0.00 C ATOM 335 C VAL A 45 3.112 6.207 5.489 1.00 0.00 C ATOM 336 O VAL A 45 4.035 7.017 5.409 1.00 0.00 O ATOM 337 CB VAL A 45 1.001 6.220 4.057 1.00 0.00 C ATOM 338 CG1 VAL A 45 1.001 7.349 3.024 1.00 0.00 C ATOM 339 CG2 VAL A 45 1.683 4.968 3.502 1.00 0.00 C ATOM 0 H VAL A 45 1.982 8.621 4.668 1.00 0.00 H new ATOM 0 HA VAL A 45 1.099 6.204 6.172 1.00 0.00 H new ATOM 0 HB VAL A 45 -0.036 5.967 4.276 1.00 0.00 H new ATOM 0 HG11 VAL A 45 0.527 7.002 2.106 1.00 0.00 H new ATOM 0 HG12 VAL A 45 0.449 8.202 3.418 1.00 0.00 H new ATOM 0 HG13 VAL A 45 2.027 7.648 2.812 1.00 0.00 H new ATOM 0 HG21 VAL A 45 1.195 4.669 2.574 1.00 0.00 H new ATOM 0 HG22 VAL A 45 2.734 5.182 3.307 1.00 0.00 H new ATOM 0 HG23 VAL A 45 1.606 4.159 4.229 1.00 0.00 H new ATOM 349 N ASP A 46 3.270 4.906 5.686 1.00 0.00 N ATOM 350 CA ASP A 46 4.595 4.326 5.825 1.00 0.00 C ATOM 351 C ASP A 46 4.463 2.840 6.163 1.00 0.00 C ATOM 352 O ASP A 46 3.369 2.280 6.102 1.00 0.00 O ATOM 353 CB ASP A 46 5.376 5.000 6.954 1.00 0.00 C ATOM 354 CG ASP A 46 4.547 5.916 7.857 1.00 0.00 C ATOM 355 OD1 ASP A 46 3.422 5.499 8.209 1.00 0.00 O ATOM 356 OD2 ASP A 46 5.056 7.013 8.174 1.00 0.00 O ATOM 0 H ASP A 46 2.502 4.237 5.753 1.00 0.00 H new ATOM 0 HA ASP A 46 5.126 4.469 4.884 1.00 0.00 H new ATOM 0 HB2 ASP A 46 5.835 4.227 7.570 1.00 0.00 H new ATOM 0 HB3 ASP A 46 6.187 5.583 6.517 1.00 0.00 H new ATOM 361 N GLY A 47 5.593 2.242 6.512 1.00 0.00 N ATOM 362 CA GLY A 47 5.617 0.832 6.860 1.00 0.00 C ATOM 363 C GLY A 47 6.353 0.606 8.183 1.00 0.00 C ATOM 364 O GLY A 47 7.222 1.393 8.556 1.00 0.00 O ATOM 0 H GLY A 47 6.499 2.709 6.561 1.00 0.00 H new ATOM 0 HA2 GLY A 47 4.597 0.456 6.938 1.00 0.00 H new ATOM 0 HA3 GLY A 47 6.106 0.266 6.067 1.00 0.00 H new ATOM 368 N THR A 48 5.979 -0.473 8.854 1.00 0.00 N ATOM 369 CA THR A 48 6.593 -0.812 10.127 1.00 0.00 C ATOM 370 C THR A 48 7.070 -2.266 10.118 1.00 0.00 C ATOM 371 O THR A 48 6.298 -3.175 9.816 1.00 0.00 O ATOM 372 CB THR A 48 5.581 -0.512 11.235 1.00 0.00 C ATOM 373 OG1 THR A 48 5.868 0.832 11.611 1.00 0.00 O ATOM 374 CG2 THR A 48 5.848 -1.320 12.506 1.00 0.00 C ATOM 0 H THR A 48 5.259 -1.124 8.541 1.00 0.00 H new ATOM 0 HA THR A 48 7.484 -0.211 10.309 1.00 0.00 H new ATOM 0 HB THR A 48 4.574 -0.725 10.875 1.00 0.00 H new ATOM 0 HG1 THR A 48 5.800 0.921 12.585 1.00 0.00 H new ATOM 0 HG21 THR A 48 5.102 -1.069 13.260 1.00 0.00 H new ATOM 0 HG22 THR A 48 5.791 -2.385 12.279 1.00 0.00 H new ATOM 0 HG23 THR A 48 6.842 -1.083 12.886 1.00 0.00 H new ATOM 382 N ARG A 49 8.340 -2.440 10.453 1.00 0.00 N ATOM 383 CA ARG A 49 8.929 -3.768 10.487 1.00 0.00 C ATOM 384 C ARG A 49 7.920 -4.783 11.028 1.00 0.00 C ATOM 385 O ARG A 49 7.742 -5.855 10.450 1.00 0.00 O ATOM 386 CB ARG A 49 10.184 -3.791 11.362 1.00 0.00 C ATOM 387 CG ARG A 49 10.924 -5.124 11.225 1.00 0.00 C ATOM 388 CD ARG A 49 10.953 -5.874 12.558 1.00 0.00 C ATOM 389 NE ARG A 49 11.815 -7.072 12.446 1.00 0.00 N ATOM 390 CZ ARG A 49 12.405 -7.674 13.488 1.00 0.00 C ATOM 391 NH1 ARG A 49 12.229 -7.193 14.726 1.00 0.00 N ATOM 392 NH2 ARG A 49 13.170 -8.756 13.291 1.00 0.00 N ATOM 0 H ARG A 49 8.977 -1.684 10.703 1.00 0.00 H new ATOM 0 HA ARG A 49 9.206 -4.034 9.467 1.00 0.00 H new ATOM 0 HB2 ARG A 49 10.845 -2.973 11.077 1.00 0.00 H new ATOM 0 HB3 ARG A 49 9.908 -3.630 12.404 1.00 0.00 H new ATOM 0 HG2 ARG A 49 10.436 -5.739 10.468 1.00 0.00 H new ATOM 0 HG3 ARG A 49 11.943 -4.945 10.882 1.00 0.00 H new ATOM 0 HD2 ARG A 49 11.327 -5.219 13.345 1.00 0.00 H new ATOM 0 HD3 ARG A 49 9.942 -6.168 12.841 1.00 0.00 H new ATOM 0 HE ARG A 49 11.970 -7.464 11.517 1.00 0.00 H new ATOM 0 HH11 ARG A 49 11.646 -6.369 14.875 1.00 0.00 H new ATOM 0 HH12 ARG A 49 12.678 -7.651 15.520 1.00 0.00 H new ATOM 0 HH21 ARG A 49 13.303 -9.121 12.348 1.00 0.00 H new ATOM 0 HH22 ARG A 49 13.619 -9.214 14.084 1.00 0.00 H new ATOM 406 N ASP A 50 7.285 -4.409 12.129 1.00 0.00 N ATOM 407 CA ASP A 50 6.299 -5.274 12.754 1.00 0.00 C ATOM 408 C ASP A 50 5.120 -4.427 13.239 1.00 0.00 C ATOM 409 O ASP A 50 5.264 -3.628 14.163 1.00 0.00 O ATOM 410 CB ASP A 50 6.890 -6.000 13.964 1.00 0.00 C ATOM 411 CG ASP A 50 7.179 -7.487 13.748 1.00 0.00 C ATOM 412 OD1 ASP A 50 8.253 -7.779 13.180 1.00 0.00 O ATOM 413 OD2 ASP A 50 6.319 -8.297 14.157 1.00 0.00 O ATOM 0 H ASP A 50 7.434 -3.519 12.604 1.00 0.00 H new ATOM 0 HA ASP A 50 5.978 -6.009 12.016 1.00 0.00 H new ATOM 0 HB2 ASP A 50 7.817 -5.503 14.250 1.00 0.00 H new ATOM 0 HB3 ASP A 50 6.201 -5.897 14.803 1.00 0.00 H new ATOM 418 N ARG A 51 3.981 -4.632 12.595 1.00 0.00 N ATOM 419 CA ARG A 51 2.778 -3.898 12.949 1.00 0.00 C ATOM 420 C ARG A 51 2.776 -3.573 14.445 1.00 0.00 C ATOM 421 O ARG A 51 2.723 -4.474 15.280 1.00 0.00 O ATOM 422 CB ARG A 51 1.521 -4.701 12.608 1.00 0.00 C ATOM 423 CG ARG A 51 1.523 -6.053 13.324 1.00 0.00 C ATOM 424 CD ARG A 51 1.421 -7.205 12.321 1.00 0.00 C ATOM 425 NE ARG A 51 0.409 -8.184 12.777 1.00 0.00 N ATOM 426 CZ ARG A 51 0.404 -9.477 12.426 1.00 0.00 C ATOM 427 NH1 ARG A 51 1.356 -9.955 11.614 1.00 0.00 N ATOM 428 NH2 ARG A 51 -0.555 -10.292 12.888 1.00 0.00 N ATOM 0 H ARG A 51 3.865 -5.296 11.830 1.00 0.00 H new ATOM 0 HA ARG A 51 2.772 -2.974 12.372 1.00 0.00 H new ATOM 0 HB2 ARG A 51 0.635 -4.135 12.895 1.00 0.00 H new ATOM 0 HB3 ARG A 51 1.465 -4.856 11.531 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.436 -6.157 13.911 1.00 0.00 H new ATOM 0 HG3 ARG A 51 0.688 -6.100 14.023 1.00 0.00 H new ATOM 0 HD2 ARG A 51 1.149 -6.820 11.338 1.00 0.00 H new ATOM 0 HD3 ARG A 51 2.390 -7.693 12.215 1.00 0.00 H new ATOM 0 HE ARG A 51 -0.331 -7.854 13.397 1.00 0.00 H new ATOM 0 HH11 ARG A 51 2.085 -9.335 11.263 1.00 0.00 H new ATOM 0 HH12 ARG A 51 1.352 -10.939 11.347 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -1.280 -9.928 13.506 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -0.560 -11.277 12.621 1.00 0.00 H new ATOM 442 N SER A 52 2.835 -2.282 14.737 1.00 0.00 N ATOM 443 CA SER A 52 2.841 -1.826 16.116 1.00 0.00 C ATOM 444 C SER A 52 2.728 -0.301 16.165 1.00 0.00 C ATOM 445 O SER A 52 3.652 0.379 16.609 1.00 0.00 O ATOM 446 CB SER A 52 4.105 -2.288 16.844 1.00 0.00 C ATOM 447 OG SER A 52 5.209 -1.420 16.600 1.00 0.00 O ATOM 0 H SER A 52 2.879 -1.537 14.041 1.00 0.00 H new ATOM 0 HA SER A 52 1.981 -2.264 16.623 1.00 0.00 H new ATOM 0 HB2 SER A 52 3.910 -2.334 17.915 1.00 0.00 H new ATOM 0 HB3 SER A 52 4.360 -3.298 16.523 1.00 0.00 H new ATOM 0 HG SER A 52 5.042 -0.551 17.022 1.00 0.00 H new ATOM 453 N ASP A 53 1.589 0.191 15.701 1.00 0.00 N ATOM 454 CA ASP A 53 1.343 1.623 15.686 1.00 0.00 C ATOM 455 C ASP A 53 -0.068 1.900 16.209 1.00 0.00 C ATOM 456 O ASP A 53 -0.761 0.984 16.649 1.00 0.00 O ATOM 457 CB ASP A 53 1.439 2.183 14.266 1.00 0.00 C ATOM 458 CG ASP A 53 2.107 3.556 14.155 1.00 0.00 C ATOM 459 OD1 ASP A 53 2.677 3.993 15.178 1.00 0.00 O ATOM 460 OD2 ASP A 53 2.032 4.136 13.051 1.00 0.00 O ATOM 0 H ASP A 53 0.826 -0.377 15.332 1.00 0.00 H new ATOM 0 HA ASP A 53 2.095 2.101 16.314 1.00 0.00 H new ATOM 0 HB2 ASP A 53 1.993 1.475 13.649 1.00 0.00 H new ATOM 0 HB3 ASP A 53 0.434 2.250 13.849 1.00 0.00 H new ATOM 465 N GLN A 54 -0.450 3.167 16.144 1.00 0.00 N ATOM 466 CA GLN A 54 -1.766 3.576 16.606 1.00 0.00 C ATOM 467 C GLN A 54 -2.853 2.969 15.716 1.00 0.00 C ATOM 468 O GLN A 54 -4.016 2.900 16.110 1.00 0.00 O ATOM 469 CB GLN A 54 -1.882 5.101 16.650 1.00 0.00 C ATOM 470 CG GLN A 54 -1.104 5.744 15.500 1.00 0.00 C ATOM 471 CD GLN A 54 -1.262 4.934 14.211 1.00 0.00 C ATOM 472 OE1 GLN A 54 -0.344 4.282 13.741 1.00 0.00 O ATOM 473 NE2 GLN A 54 -2.474 5.011 13.669 1.00 0.00 N ATOM 0 H GLN A 54 0.128 3.924 15.779 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.905 3.204 17.621 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.931 5.391 16.591 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -1.502 5.471 17.602 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -1.459 6.762 15.340 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -0.049 5.813 15.764 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -3.197 5.576 14.115 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -2.680 4.505 12.807 1.00 0.00 H new ATOM 482 N HIS A 55 -2.435 2.545 14.532 1.00 0.00 N ATOM 483 CA HIS A 55 -3.359 1.947 13.583 1.00 0.00 C ATOM 484 C HIS A 55 -2.637 1.688 12.259 1.00 0.00 C ATOM 485 O HIS A 55 -2.271 2.627 11.554 1.00 0.00 O ATOM 486 CB HIS A 55 -4.607 2.816 13.418 1.00 0.00 C ATOM 487 CG HIS A 55 -5.828 2.277 14.125 1.00 0.00 C ATOM 488 ND1 HIS A 55 -6.499 2.736 15.220 1.00 0.00 N flip ATOM 489 CD2 HIS A 55 -6.489 1.133 13.712 1.00 0.00 C flip ATOM 490 CE1 HIS A 55 -7.516 1.918 15.462 1.00 0.00 C flip ATOM 491 NE2 HIS A 55 -7.511 0.923 14.529 1.00 0.00 N flip ATOM 0 H HIS A 55 -1.469 2.604 14.208 1.00 0.00 H new ATOM 0 HA HIS A 55 -3.705 0.986 13.963 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -4.393 3.816 13.795 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -4.830 2.917 12.356 1.00 0.00 H new ATOM 0 HD1 HIS A 55 -6.260 3.567 15.761 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -6.218 0.517 12.868 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -8.230 2.023 16.265 1.00 0.00 H new ATOM 499 N ILE A 56 -2.456 0.410 11.961 1.00 0.00 N ATOM 500 CA ILE A 56 -1.785 0.016 10.734 1.00 0.00 C ATOM 501 C ILE A 56 -2.755 -0.785 9.862 1.00 0.00 C ATOM 502 O ILE A 56 -2.340 -1.446 8.912 1.00 0.00 O ATOM 503 CB ILE A 56 -0.485 -0.727 11.048 1.00 0.00 C ATOM 504 CG1 ILE A 56 -0.721 -2.237 11.126 1.00 0.00 C ATOM 505 CG2 ILE A 56 0.163 -0.182 12.323 1.00 0.00 C ATOM 506 CD1 ILE A 56 -1.840 -2.567 12.116 1.00 0.00 C ATOM 0 H ILE A 56 -2.762 -0.366 12.548 1.00 0.00 H new ATOM 0 HA ILE A 56 -1.492 0.896 10.161 1.00 0.00 H new ATOM 0 HB ILE A 56 0.214 -0.552 10.230 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.980 -2.620 10.139 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.198 -2.737 11.431 1.00 0.00 H new ATOM 0 HG21 ILE A 56 1.085 -0.727 12.524 1.00 0.00 H new ATOM 0 HG22 ILE A 56 0.388 0.877 12.193 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -0.522 -0.307 13.161 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -1.987 -3.646 12.152 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.567 -2.205 13.107 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.764 -2.085 11.795 1.00 0.00 H new ATOM 518 N GLN A 57 -4.029 -0.698 10.217 1.00 0.00 N ATOM 519 CA GLN A 57 -5.061 -1.406 9.479 1.00 0.00 C ATOM 520 C GLN A 57 -5.081 -0.945 8.020 1.00 0.00 C ATOM 521 O GLN A 57 -4.774 0.209 7.726 1.00 0.00 O ATOM 522 CB GLN A 57 -6.431 -1.217 10.133 1.00 0.00 C ATOM 523 CG GLN A 57 -6.466 -1.850 11.525 1.00 0.00 C ATOM 524 CD GLN A 57 -7.876 -1.794 12.118 1.00 0.00 C ATOM 525 OE1 GLN A 57 -8.864 -1.637 11.420 1.00 0.00 O ATOM 526 NE2 GLN A 57 -7.912 -1.931 13.440 1.00 0.00 N ATOM 0 H GLN A 57 -4.370 -0.148 11.006 1.00 0.00 H new ATOM 0 HA GLN A 57 -4.829 -2.471 9.500 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -6.659 -0.154 10.207 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -7.202 -1.665 9.506 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -6.134 -2.886 11.466 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -5.770 -1.329 12.183 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -7.046 -2.059 13.963 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -8.806 -1.908 13.931 1.00 0.00 H new ATOM 535 N LEU A 58 -5.447 -1.871 7.145 1.00 0.00 N ATOM 536 CA LEU A 58 -5.512 -1.574 5.725 1.00 0.00 C ATOM 537 C LEU A 58 -6.636 -2.392 5.087 1.00 0.00 C ATOM 538 O LEU A 58 -7.268 -3.210 5.754 1.00 0.00 O ATOM 539 CB LEU A 58 -4.146 -1.790 5.069 1.00 0.00 C ATOM 540 CG LEU A 58 -3.083 -0.731 5.368 1.00 0.00 C ATOM 541 CD1 LEU A 58 -1.999 -1.288 6.293 1.00 0.00 C ATOM 542 CD2 LEU A 58 -2.496 -0.164 4.074 1.00 0.00 C ATOM 0 H LEU A 58 -5.701 -2.827 7.393 1.00 0.00 H new ATOM 0 HA LEU A 58 -5.754 -0.523 5.567 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.763 -2.760 5.385 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -4.287 -1.839 3.989 1.00 0.00 H new ATOM 0 HG LEU A 58 -3.562 0.095 5.894 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.256 -0.515 6.490 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -2.450 -1.605 7.233 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -1.517 -2.142 5.816 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -1.743 0.587 4.314 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.036 -0.968 3.500 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -3.290 0.294 3.485 1.00 0.00 H new ATOM 554 N GLN A 59 -6.852 -2.143 3.804 1.00 0.00 N ATOM 555 CA GLN A 59 -7.890 -2.846 3.070 1.00 0.00 C ATOM 556 C GLN A 59 -7.829 -2.483 1.585 1.00 0.00 C ATOM 557 O GLN A 59 -7.554 -1.336 1.234 1.00 0.00 O ATOM 558 CB GLN A 59 -9.273 -2.546 3.651 1.00 0.00 C ATOM 559 CG GLN A 59 -10.264 -3.662 3.313 1.00 0.00 C ATOM 560 CD GLN A 59 -10.669 -4.434 4.570 1.00 0.00 C ATOM 561 OE1 GLN A 59 -11.407 -3.954 5.414 1.00 0.00 O ATOM 562 NE2 GLN A 59 -10.147 -5.655 4.646 1.00 0.00 N ATOM 0 H GLN A 59 -6.326 -1.464 3.254 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.715 -3.917 3.170 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -9.200 -2.435 4.733 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -9.639 -1.598 3.257 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -11.150 -3.236 2.842 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -9.816 -4.345 2.591 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -9.536 -5.996 3.904 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -10.358 -6.251 5.447 1.00 0.00 H new ATOM 571 N LEU A 60 -8.089 -3.480 0.753 1.00 0.00 N ATOM 572 CA LEU A 60 -8.067 -3.280 -0.686 1.00 0.00 C ATOM 573 C LEU A 60 -9.492 -3.386 -1.234 1.00 0.00 C ATOM 574 O LEU A 60 -10.370 -3.950 -0.583 1.00 0.00 O ATOM 575 CB LEU A 60 -7.082 -4.246 -1.347 1.00 0.00 C ATOM 576 CG LEU A 60 -5.902 -4.695 -0.482 1.00 0.00 C ATOM 577 CD1 LEU A 60 -5.335 -6.028 -0.978 1.00 0.00 C ATOM 578 CD2 LEU A 60 -4.829 -3.607 -0.411 1.00 0.00 C ATOM 0 H LEU A 60 -8.316 -4.430 1.048 1.00 0.00 H new ATOM 0 HA LEU A 60 -7.706 -2.280 -0.925 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.631 -5.132 -1.666 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.688 -3.773 -2.247 1.00 0.00 H new ATOM 0 HG LEU A 60 -6.264 -4.856 0.533 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -4.498 -6.325 -0.346 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -6.111 -6.792 -0.935 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -4.992 -5.917 -2.007 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.002 -3.952 0.210 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -4.464 -3.390 -1.415 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -5.256 -2.703 0.023 1.00 0.00 H new ATOM 590 N SER A 61 -9.677 -2.834 -2.424 1.00 0.00 N ATOM 591 CA SER A 61 -10.980 -2.859 -3.066 1.00 0.00 C ATOM 592 C SER A 61 -10.816 -3.040 -4.576 1.00 0.00 C ATOM 593 O SER A 61 -11.376 -2.276 -5.361 1.00 0.00 O ATOM 594 CB SER A 61 -11.766 -1.581 -2.767 1.00 0.00 C ATOM 595 OG SER A 61 -12.838 -1.386 -3.685 1.00 0.00 O ATOM 0 H SER A 61 -8.946 -2.367 -2.960 1.00 0.00 H new ATOM 0 HA SER A 61 -11.543 -3.702 -2.665 1.00 0.00 H new ATOM 0 HB2 SER A 61 -12.162 -1.628 -1.752 1.00 0.00 H new ATOM 0 HB3 SER A 61 -11.094 -0.724 -2.808 1.00 0.00 H new ATOM 0 HG SER A 61 -12.478 -1.270 -4.589 1.00 0.00 H new ATOM 601 N ALA A 62 -10.045 -4.055 -4.938 1.00 0.00 N ATOM 602 CA ALA A 62 -9.801 -4.346 -6.340 1.00 0.00 C ATOM 603 C ALA A 62 -11.094 -4.143 -7.132 1.00 0.00 C ATOM 604 O ALA A 62 -12.121 -4.741 -6.814 1.00 0.00 O ATOM 605 CB ALA A 62 -9.249 -5.766 -6.478 1.00 0.00 C ATOM 0 H ALA A 62 -9.581 -4.686 -4.284 1.00 0.00 H new ATOM 0 HA ALA A 62 -9.055 -3.665 -6.749 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -9.066 -5.985 -7.530 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -8.315 -5.849 -5.922 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -9.972 -6.478 -6.080 1.00 0.00 H new ATOM 611 N GLU A 63 -11.002 -3.299 -8.149 1.00 0.00 N ATOM 612 CA GLU A 63 -12.152 -3.010 -8.988 1.00 0.00 C ATOM 613 C GLU A 63 -11.902 -3.499 -10.417 1.00 0.00 C ATOM 614 O GLU A 63 -12.762 -3.355 -11.285 1.00 0.00 O ATOM 615 CB GLU A 63 -12.483 -1.516 -8.970 1.00 0.00 C ATOM 616 CG GLU A 63 -11.479 -0.722 -9.809 1.00 0.00 C ATOM 617 CD GLU A 63 -12.187 0.050 -10.924 1.00 0.00 C ATOM 618 OE1 GLU A 63 -13.365 0.408 -10.708 1.00 0.00 O ATOM 619 OE2 GLU A 63 -11.533 0.265 -11.968 1.00 0.00 O ATOM 0 H GLU A 63 -10.148 -2.806 -8.411 1.00 0.00 H new ATOM 0 HA GLU A 63 -13.013 -3.544 -8.587 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -13.490 -1.358 -9.356 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.474 -1.150 -7.943 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.934 -0.027 -9.170 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.744 -1.401 -10.242 1.00 0.00 H new ATOM 626 N SER A 64 -10.722 -4.066 -10.616 1.00 0.00 N ATOM 627 CA SER A 64 -10.348 -4.577 -11.924 1.00 0.00 C ATOM 628 C SER A 64 -8.843 -4.844 -11.971 1.00 0.00 C ATOM 629 O SER A 64 -8.125 -4.544 -11.018 1.00 0.00 O ATOM 630 CB SER A 64 -10.750 -3.601 -13.032 1.00 0.00 C ATOM 631 OG SER A 64 -11.891 -4.054 -13.754 1.00 0.00 O ATOM 0 H SER A 64 -10.012 -4.183 -9.893 1.00 0.00 H new ATOM 0 HA SER A 64 -10.881 -5.513 -12.091 1.00 0.00 H new ATOM 0 HB2 SER A 64 -10.961 -2.625 -12.596 1.00 0.00 H new ATOM 0 HB3 SER A 64 -9.915 -3.469 -13.720 1.00 0.00 H new ATOM 0 HG SER A 64 -12.684 -3.999 -13.181 1.00 0.00 H new ATOM 637 N VAL A 65 -8.408 -5.404 -13.090 1.00 0.00 N ATOM 638 CA VAL A 65 -7.000 -5.715 -13.274 1.00 0.00 C ATOM 639 C VAL A 65 -6.220 -4.416 -13.486 1.00 0.00 C ATOM 640 O VAL A 65 -6.767 -3.432 -13.982 1.00 0.00 O ATOM 641 CB VAL A 65 -6.830 -6.709 -14.424 1.00 0.00 C ATOM 642 CG1 VAL A 65 -7.220 -8.123 -13.989 1.00 0.00 C ATOM 643 CG2 VAL A 65 -7.633 -6.272 -15.651 1.00 0.00 C ATOM 0 H VAL A 65 -9.006 -5.651 -13.879 1.00 0.00 H new ATOM 0 HA VAL A 65 -6.595 -6.196 -12.384 1.00 0.00 H new ATOM 0 HB VAL A 65 -5.776 -6.722 -14.701 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -7.090 -8.810 -14.825 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -6.586 -8.437 -13.160 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -8.263 -8.131 -13.672 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -7.494 -6.996 -16.454 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.690 -6.215 -15.392 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -7.287 -5.293 -15.982 1.00 0.00 H new ATOM 653 N GLY A 66 -4.953 -4.455 -13.101 1.00 0.00 N ATOM 654 CA GLY A 66 -4.091 -3.294 -13.242 1.00 0.00 C ATOM 655 C GLY A 66 -4.760 -2.042 -12.669 1.00 0.00 C ATOM 656 O GLY A 66 -4.438 -0.924 -13.069 1.00 0.00 O ATOM 0 H GLY A 66 -4.502 -5.273 -12.691 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -3.146 -3.473 -12.729 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -3.857 -3.136 -14.295 1.00 0.00 H new ATOM 660 N GLU A 67 -5.678 -2.272 -11.742 1.00 0.00 N ATOM 661 CA GLU A 67 -6.394 -1.177 -11.110 1.00 0.00 C ATOM 662 C GLU A 67 -7.187 -1.687 -9.905 1.00 0.00 C ATOM 663 O GLU A 67 -8.201 -2.364 -10.065 1.00 0.00 O ATOM 664 CB GLU A 67 -7.312 -0.473 -12.111 1.00 0.00 C ATOM 665 CG GLU A 67 -7.147 1.046 -12.031 1.00 0.00 C ATOM 666 CD GLU A 67 -8.060 1.751 -13.037 1.00 0.00 C ATOM 667 OE1 GLU A 67 -7.989 1.376 -14.227 1.00 0.00 O ATOM 668 OE2 GLU A 67 -8.809 2.648 -12.592 1.00 0.00 O ATOM 0 H GLU A 67 -5.943 -3.201 -11.413 1.00 0.00 H new ATOM 0 HA GLU A 67 -5.665 -0.447 -10.758 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.085 -0.814 -13.121 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.349 -0.741 -11.910 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -7.379 1.388 -11.022 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -6.109 1.313 -12.227 1.00 0.00 H new ATOM 675 N VAL A 68 -6.694 -1.342 -8.724 1.00 0.00 N ATOM 676 CA VAL A 68 -7.343 -1.756 -7.492 1.00 0.00 C ATOM 677 C VAL A 68 -7.454 -0.555 -6.551 1.00 0.00 C ATOM 678 O VAL A 68 -6.753 0.440 -6.724 1.00 0.00 O ATOM 679 CB VAL A 68 -6.588 -2.934 -6.873 1.00 0.00 C ATOM 680 CG1 VAL A 68 -6.327 -4.026 -7.913 1.00 0.00 C ATOM 681 CG2 VAL A 68 -5.281 -2.469 -6.228 1.00 0.00 C ATOM 0 H VAL A 68 -5.852 -0.780 -8.595 1.00 0.00 H new ATOM 0 HA VAL A 68 -8.356 -2.106 -7.692 1.00 0.00 H new ATOM 0 HB VAL A 68 -7.216 -3.360 -6.090 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -5.789 -4.851 -7.447 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -7.277 -4.388 -8.307 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.729 -3.617 -8.727 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.764 -3.325 -5.796 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.647 -2.006 -6.984 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.500 -1.744 -5.444 1.00 0.00 H new ATOM 691 N TYR A 69 -8.340 -0.689 -5.575 1.00 0.00 N ATOM 692 CA TYR A 69 -8.552 0.373 -4.606 1.00 0.00 C ATOM 693 C TYR A 69 -8.062 -0.046 -3.218 1.00 0.00 C ATOM 694 O TYR A 69 -7.842 -1.230 -2.964 1.00 0.00 O ATOM 695 CB TYR A 69 -10.064 0.600 -4.553 1.00 0.00 C ATOM 696 CG TYR A 69 -10.579 1.602 -5.588 1.00 0.00 C ATOM 697 CD1 TYR A 69 -10.932 1.171 -6.850 1.00 0.00 C ATOM 698 CD2 TYR A 69 -10.690 2.938 -5.259 1.00 0.00 C ATOM 699 CE1 TYR A 69 -11.417 2.114 -7.824 1.00 0.00 C ATOM 700 CE2 TYR A 69 -11.174 3.882 -6.233 1.00 0.00 C ATOM 701 CZ TYR A 69 -11.514 3.423 -7.467 1.00 0.00 C ATOM 702 OH TYR A 69 -11.972 4.314 -8.387 1.00 0.00 O ATOM 0 H TYR A 69 -8.919 -1.517 -5.434 1.00 0.00 H new ATOM 0 HA TYR A 69 -8.005 1.270 -4.894 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -10.570 -0.354 -4.703 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -10.334 0.951 -3.557 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -10.845 0.126 -7.108 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -10.414 3.275 -4.271 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -11.697 1.789 -8.815 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -11.265 4.930 -5.989 1.00 0.00 H new ATOM 0 HH TYR A 69 -11.989 5.211 -7.993 1.00 0.00 H new ATOM 712 N ILE A 70 -7.906 0.947 -2.356 1.00 0.00 N ATOM 713 CA ILE A 70 -7.446 0.697 -1.000 1.00 0.00 C ATOM 714 C ILE A 70 -8.110 1.695 -0.049 1.00 0.00 C ATOM 715 O ILE A 70 -8.115 2.897 -0.309 1.00 0.00 O ATOM 716 CB ILE A 70 -5.917 0.714 -0.941 1.00 0.00 C ATOM 717 CG1 ILE A 70 -5.322 -0.376 -1.833 1.00 0.00 C ATOM 718 CG2 ILE A 70 -5.424 0.606 0.503 1.00 0.00 C ATOM 719 CD1 ILE A 70 -3.807 -0.473 -1.644 1.00 0.00 C ATOM 0 H ILE A 70 -8.090 1.927 -2.570 1.00 0.00 H new ATOM 0 HA ILE A 70 -7.743 -0.300 -0.674 1.00 0.00 H new ATOM 0 HB ILE A 70 -5.570 1.672 -1.329 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.783 -1.335 -1.598 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -5.549 -0.160 -2.877 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.334 0.620 0.517 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.806 1.447 1.082 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -5.780 -0.327 0.940 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.409 -1.256 -2.290 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.346 0.480 -1.903 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -3.585 -0.713 -0.604 1.00 0.00 H new ATOM 731 N LYS A 71 -8.653 1.159 1.034 1.00 0.00 N ATOM 732 CA LYS A 71 -9.318 1.987 2.026 1.00 0.00 C ATOM 733 C LYS A 71 -8.930 1.509 3.427 1.00 0.00 C ATOM 734 O LYS A 71 -9.418 0.480 3.892 1.00 0.00 O ATOM 735 CB LYS A 71 -10.828 2.009 1.780 1.00 0.00 C ATOM 736 CG LYS A 71 -11.438 3.338 2.231 1.00 0.00 C ATOM 737 CD LYS A 71 -12.193 3.175 3.552 1.00 0.00 C ATOM 738 CE LYS A 71 -11.223 3.104 4.733 1.00 0.00 C ATOM 739 NZ LYS A 71 -10.142 4.103 4.577 1.00 0.00 N ATOM 0 H LYS A 71 -8.646 0.161 1.246 1.00 0.00 H new ATOM 0 HA LYS A 71 -8.989 3.023 1.940 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -11.030 1.853 0.720 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -11.300 1.187 2.318 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -10.651 4.083 2.348 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -12.117 3.710 1.463 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -12.878 4.012 3.689 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -12.799 2.269 3.519 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -11.761 3.284 5.664 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -10.795 2.104 4.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -9.690 4.272 5.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -9.434 3.746 3.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -10.542 4.994 4.219 1.00 0.00 H new ATOM 753 N SER A 72 -8.057 2.278 4.059 1.00 0.00 N ATOM 754 CA SER A 72 -7.598 1.946 5.397 1.00 0.00 C ATOM 755 C SER A 72 -8.778 1.951 6.371 1.00 0.00 C ATOM 756 O SER A 72 -8.973 2.915 7.110 1.00 0.00 O ATOM 757 CB SER A 72 -6.517 2.922 5.867 1.00 0.00 C ATOM 758 OG SER A 72 -5.670 2.345 6.857 1.00 0.00 O ATOM 0 H SER A 72 -7.655 3.131 3.669 1.00 0.00 H new ATOM 0 HA SER A 72 -7.161 0.948 5.371 1.00 0.00 H new ATOM 0 HB2 SER A 72 -5.916 3.235 5.014 1.00 0.00 H new ATOM 0 HB3 SER A 72 -6.988 3.818 6.271 1.00 0.00 H new ATOM 0 HG SER A 72 -5.773 1.370 6.848 1.00 0.00 H new ATOM 764 N THR A 73 -9.533 0.863 6.341 1.00 0.00 N ATOM 765 CA THR A 73 -10.688 0.730 7.213 1.00 0.00 C ATOM 766 C THR A 73 -10.307 1.058 8.658 1.00 0.00 C ATOM 767 O THR A 73 -9.860 0.184 9.399 1.00 0.00 O ATOM 768 CB THR A 73 -11.252 -0.682 7.038 1.00 0.00 C ATOM 769 OG1 THR A 73 -12.479 -0.657 7.762 1.00 0.00 O ATOM 770 CG2 THR A 73 -10.414 -1.740 7.760 1.00 0.00 C ATOM 0 H THR A 73 -9.368 0.066 5.727 1.00 0.00 H new ATOM 0 HA THR A 73 -11.469 1.443 6.947 1.00 0.00 H new ATOM 0 HB THR A 73 -11.305 -0.923 5.976 1.00 0.00 H new ATOM 0 HG1 THR A 73 -12.913 -1.533 7.700 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.857 -2.724 7.604 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.399 -1.732 7.364 1.00 0.00 H new ATOM 0 HG23 THR A 73 -10.389 -1.518 8.827 1.00 0.00 H new ATOM 778 N GLU A 74 -10.497 2.320 9.014 1.00 0.00 N ATOM 779 CA GLU A 74 -10.179 2.774 10.357 1.00 0.00 C ATOM 780 C GLU A 74 -10.108 4.302 10.398 1.00 0.00 C ATOM 781 O GLU A 74 -10.675 4.929 11.291 1.00 0.00 O ATOM 782 CB GLU A 74 -8.872 2.151 10.852 1.00 0.00 C ATOM 783 CG GLU A 74 -9.136 1.131 11.961 1.00 0.00 C ATOM 784 CD GLU A 74 -9.764 1.801 13.184 1.00 0.00 C ATOM 785 OE1 GLU A 74 -9.356 2.946 13.475 1.00 0.00 O ATOM 786 OE2 GLU A 74 -10.637 1.154 13.801 1.00 0.00 O ATOM 0 H GLU A 74 -10.867 3.042 8.396 1.00 0.00 H new ATOM 0 HA GLU A 74 -10.975 2.448 11.027 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.359 1.666 10.022 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.210 2.933 11.223 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.798 0.349 11.590 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -8.201 0.648 12.246 1.00 0.00 H new ATOM 793 N THR A 75 -9.407 4.856 9.420 1.00 0.00 N ATOM 794 CA THR A 75 -9.254 6.298 9.333 1.00 0.00 C ATOM 795 C THR A 75 -10.125 6.860 8.208 1.00 0.00 C ATOM 796 O THR A 75 -10.541 8.016 8.258 1.00 0.00 O ATOM 797 CB THR A 75 -7.765 6.607 9.161 1.00 0.00 C ATOM 798 OG1 THR A 75 -7.357 5.758 8.091 1.00 0.00 O ATOM 799 CG2 THR A 75 -6.928 6.135 10.351 1.00 0.00 C ATOM 0 H THR A 75 -8.939 4.332 8.681 1.00 0.00 H new ATOM 0 HA THR A 75 -9.599 6.787 10.244 1.00 0.00 H new ATOM 0 HB THR A 75 -7.630 7.680 9.025 1.00 0.00 H new ATOM 0 HG1 THR A 75 -6.715 6.233 7.523 1.00 0.00 H new ATOM 0 HG21 THR A 75 -5.880 6.379 10.178 1.00 0.00 H new ATOM 0 HG22 THR A 75 -7.271 6.633 11.258 1.00 0.00 H new ATOM 0 HG23 THR A 75 -7.036 5.056 10.467 1.00 0.00 H new ATOM 807 N GLY A 76 -10.376 6.014 7.219 1.00 0.00 N ATOM 808 CA GLY A 76 -11.190 6.411 6.083 1.00 0.00 C ATOM 809 C GLY A 76 -10.345 7.125 5.026 1.00 0.00 C ATOM 810 O GLY A 76 -10.821 8.047 4.365 1.00 0.00 O ATOM 0 H GLY A 76 -10.030 5.055 7.181 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -11.661 5.532 5.644 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -11.992 7.069 6.418 1.00 0.00 H new ATOM 814 N GLN A 77 -9.107 6.670 4.898 1.00 0.00 N ATOM 815 CA GLN A 77 -8.192 7.254 3.932 1.00 0.00 C ATOM 816 C GLN A 77 -7.889 6.252 2.816 1.00 0.00 C ATOM 817 O GLN A 77 -7.357 5.173 3.073 1.00 0.00 O ATOM 818 CB GLN A 77 -6.904 7.724 4.612 1.00 0.00 C ATOM 819 CG GLN A 77 -6.908 9.242 4.804 1.00 0.00 C ATOM 820 CD GLN A 77 -6.348 9.622 6.176 1.00 0.00 C ATOM 821 OE1 GLN A 77 -5.968 8.782 6.974 1.00 0.00 O ATOM 822 NE2 GLN A 77 -6.320 10.932 6.404 1.00 0.00 N ATOM 0 H GLN A 77 -8.716 5.904 5.447 1.00 0.00 H new ATOM 0 HA GLN A 77 -8.670 8.128 3.489 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -6.798 7.232 5.579 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -6.043 7.432 4.010 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -6.313 9.713 4.021 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -7.925 9.622 4.704 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -6.654 11.581 5.691 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -5.964 11.288 7.291 1.00 0.00 H new ATOM 831 N TYR A 78 -8.240 6.645 1.601 1.00 0.00 N ATOM 832 CA TYR A 78 -8.012 5.795 0.444 1.00 0.00 C ATOM 833 C TYR A 78 -6.560 5.889 -0.028 1.00 0.00 C ATOM 834 O TYR A 78 -6.170 6.872 -0.656 1.00 0.00 O ATOM 835 CB TYR A 78 -8.930 6.327 -0.658 1.00 0.00 C ATOM 836 CG TYR A 78 -10.390 5.893 -0.516 1.00 0.00 C ATOM 837 CD1 TYR A 78 -10.812 4.701 -1.070 1.00 0.00 C ATOM 838 CD2 TYR A 78 -11.285 6.692 0.166 1.00 0.00 C ATOM 839 CE1 TYR A 78 -12.187 4.292 -0.937 1.00 0.00 C ATOM 840 CE2 TYR A 78 -12.659 6.283 0.299 1.00 0.00 C ATOM 841 CZ TYR A 78 -13.042 5.103 -0.259 1.00 0.00 C ATOM 842 OH TYR A 78 -14.340 4.717 -0.133 1.00 0.00 O ATOM 0 H TYR A 78 -8.681 7.541 1.392 1.00 0.00 H new ATOM 0 HA TYR A 78 -8.214 4.752 0.688 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -8.884 7.416 -0.660 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -8.554 5.990 -1.624 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -10.112 4.075 -1.603 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -10.955 7.624 0.600 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -12.531 3.362 -1.366 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -13.370 6.899 0.830 1.00 0.00 H new ATOM 0 HH TYR A 78 -14.834 5.393 0.376 1.00 0.00 H new ATOM 852 N LEU A 79 -5.799 4.853 0.293 1.00 0.00 N ATOM 853 CA LEU A 79 -4.398 4.806 -0.091 1.00 0.00 C ATOM 854 C LEU A 79 -4.239 5.389 -1.496 1.00 0.00 C ATOM 855 O LEU A 79 -5.113 5.221 -2.344 1.00 0.00 O ATOM 856 CB LEU A 79 -3.851 3.384 0.051 1.00 0.00 C ATOM 857 CG LEU A 79 -2.397 3.268 0.514 1.00 0.00 C ATOM 858 CD1 LEU A 79 -2.130 4.176 1.716 1.00 0.00 C ATOM 859 CD2 LEU A 79 -2.029 1.811 0.803 1.00 0.00 C ATOM 0 H LEU A 79 -6.126 4.040 0.815 1.00 0.00 H new ATOM 0 HA LEU A 79 -3.798 5.422 0.579 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.481 2.843 0.757 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.946 2.881 -0.912 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.752 3.609 -0.296 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.090 4.074 2.025 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.327 5.212 1.440 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.783 3.890 2.541 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.991 1.756 1.130 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -2.678 1.421 1.587 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.156 1.217 -0.102 1.00 0.00 H new ATOM 871 N ALA A 80 -3.116 6.063 -1.699 1.00 0.00 N ATOM 872 CA ALA A 80 -2.831 6.672 -2.987 1.00 0.00 C ATOM 873 C ALA A 80 -1.357 7.080 -3.038 1.00 0.00 C ATOM 874 O ALA A 80 -0.608 6.834 -2.094 1.00 0.00 O ATOM 875 CB ALA A 80 -3.773 7.856 -3.211 1.00 0.00 C ATOM 0 H ALA A 80 -2.393 6.201 -0.993 1.00 0.00 H new ATOM 0 HA ALA A 80 -3.004 5.961 -3.795 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.559 8.313 -4.177 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.806 7.508 -3.195 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.626 8.592 -2.421 1.00 0.00 H new ATOM 881 N MET A 81 -0.986 7.698 -4.150 1.00 0.00 N ATOM 882 CA MET A 81 0.385 8.143 -4.337 1.00 0.00 C ATOM 883 C MET A 81 0.431 9.471 -5.094 1.00 0.00 C ATOM 884 O MET A 81 0.445 9.489 -6.324 1.00 0.00 O ATOM 885 CB MET A 81 1.164 7.082 -5.117 1.00 0.00 C ATOM 886 CG MET A 81 2.501 6.774 -4.438 1.00 0.00 C ATOM 887 SD MET A 81 3.777 6.567 -5.669 1.00 0.00 S ATOM 888 CE MET A 81 5.083 5.899 -4.652 1.00 0.00 C ATOM 0 H MET A 81 -1.611 7.901 -4.930 1.00 0.00 H new ATOM 0 HA MET A 81 0.837 8.290 -3.356 1.00 0.00 H new ATOM 0 HB2 MET A 81 0.571 6.171 -5.190 1.00 0.00 H new ATOM 0 HB3 MET A 81 1.340 7.430 -6.135 1.00 0.00 H new ATOM 0 HG2 MET A 81 2.768 7.583 -3.758 1.00 0.00 H new ATOM 0 HG3 MET A 81 2.413 5.869 -3.837 1.00 0.00 H new ATOM 0 HE1 MET A 81 6.049 6.192 -5.062 1.00 0.00 H new ATOM 0 HE2 MET A 81 4.987 6.284 -3.637 1.00 0.00 H new ATOM 0 HE3 MET A 81 5.011 4.812 -4.635 1.00 0.00 H new ATOM 898 N ASP A 82 0.454 10.552 -4.328 1.00 0.00 N ATOM 899 CA ASP A 82 0.499 11.882 -4.911 1.00 0.00 C ATOM 900 C ASP A 82 1.518 11.900 -6.052 1.00 0.00 C ATOM 901 O ASP A 82 2.320 10.976 -6.188 1.00 0.00 O ATOM 902 CB ASP A 82 0.930 12.923 -3.876 1.00 0.00 C ATOM 903 CG ASP A 82 0.223 12.822 -2.524 1.00 0.00 C ATOM 904 OD1 ASP A 82 -0.999 13.082 -2.502 1.00 0.00 O ATOM 905 OD2 ASP A 82 0.920 12.486 -1.542 1.00 0.00 O ATOM 0 H ASP A 82 0.442 10.534 -3.308 1.00 0.00 H new ATOM 0 HA ASP A 82 -0.500 12.125 -5.273 1.00 0.00 H new ATOM 0 HB2 ASP A 82 2.004 12.830 -3.715 1.00 0.00 H new ATOM 0 HB3 ASP A 82 0.754 13.917 -4.288 1.00 0.00 H new ATOM 910 N THR A 83 1.454 12.960 -6.844 1.00 0.00 N ATOM 911 CA THR A 83 2.361 13.110 -7.969 1.00 0.00 C ATOM 912 C THR A 83 3.811 13.164 -7.482 1.00 0.00 C ATOM 913 O THR A 83 4.741 13.030 -8.275 1.00 0.00 O ATOM 914 CB THR A 83 1.938 14.352 -8.755 1.00 0.00 C ATOM 915 OG1 THR A 83 1.457 15.248 -7.757 1.00 0.00 O ATOM 916 CG2 THR A 83 0.719 14.095 -9.644 1.00 0.00 C ATOM 0 H THR A 83 0.788 13.724 -6.729 1.00 0.00 H new ATOM 0 HA THR A 83 2.307 12.251 -8.637 1.00 0.00 H new ATOM 0 HB THR A 83 2.771 14.693 -9.370 1.00 0.00 H new ATOM 0 HG1 THR A 83 0.479 15.292 -7.801 1.00 0.00 H new ATOM 0 HG21 THR A 83 0.460 15.008 -10.180 1.00 0.00 H new ATOM 0 HG22 THR A 83 0.951 13.307 -10.361 1.00 0.00 H new ATOM 0 HG23 THR A 83 -0.124 13.786 -9.026 1.00 0.00 H new ATOM 924 N ASP A 84 3.957 13.361 -6.180 1.00 0.00 N ATOM 925 CA ASP A 84 5.277 13.435 -5.578 1.00 0.00 C ATOM 926 C ASP A 84 5.761 12.022 -5.247 1.00 0.00 C ATOM 927 O ASP A 84 6.784 11.851 -4.584 1.00 0.00 O ATOM 928 CB ASP A 84 5.245 14.240 -4.277 1.00 0.00 C ATOM 929 CG ASP A 84 5.886 15.627 -4.360 1.00 0.00 C ATOM 930 OD1 ASP A 84 6.750 15.801 -5.247 1.00 0.00 O ATOM 931 OD2 ASP A 84 5.499 16.481 -3.534 1.00 0.00 O ATOM 0 H ASP A 84 3.183 13.472 -5.525 1.00 0.00 H new ATOM 0 HA ASP A 84 5.945 13.923 -6.288 1.00 0.00 H new ATOM 0 HB2 ASP A 84 4.207 14.354 -3.963 1.00 0.00 H new ATOM 0 HB3 ASP A 84 5.752 13.668 -3.500 1.00 0.00 H new ATOM 936 N GLY A 85 5.005 11.044 -5.724 1.00 0.00 N ATOM 937 CA GLY A 85 5.344 9.651 -5.487 1.00 0.00 C ATOM 938 C GLY A 85 5.431 9.355 -3.989 1.00 0.00 C ATOM 939 O GLY A 85 6.166 8.462 -3.571 1.00 0.00 O ATOM 0 H GLY A 85 4.158 11.189 -6.274 1.00 0.00 H new ATOM 0 HA2 GLY A 85 4.593 9.007 -5.945 1.00 0.00 H new ATOM 0 HA3 GLY A 85 6.297 9.419 -5.963 1.00 0.00 H new ATOM 943 N LEU A 86 4.671 10.122 -3.221 1.00 0.00 N ATOM 944 CA LEU A 86 4.653 9.954 -1.778 1.00 0.00 C ATOM 945 C LEU A 86 3.303 9.371 -1.354 1.00 0.00 C ATOM 946 O LEU A 86 2.285 10.059 -1.400 1.00 0.00 O ATOM 947 CB LEU A 86 5.002 11.270 -1.080 1.00 0.00 C ATOM 948 CG LEU A 86 5.511 11.152 0.358 1.00 0.00 C ATOM 949 CD1 LEU A 86 5.764 12.534 0.964 1.00 0.00 C ATOM 950 CD2 LEU A 86 4.554 10.318 1.211 1.00 0.00 C ATOM 0 H LEU A 86 4.063 10.862 -3.571 1.00 0.00 H new ATOM 0 HA LEU A 86 5.419 9.244 -1.468 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.760 11.782 -1.672 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.116 11.904 -1.080 1.00 0.00 H new ATOM 0 HG LEU A 86 6.467 10.628 0.341 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.125 12.422 1.986 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.512 13.060 0.370 1.00 0.00 H new ATOM 0 HD13 LEU A 86 4.836 13.105 0.967 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.939 10.250 2.228 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.573 10.792 1.226 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.467 9.317 0.788 1.00 0.00 H new ATOM 962 N LEU A 87 3.340 8.110 -0.950 1.00 0.00 N ATOM 963 CA LEU A 87 2.132 7.428 -0.518 1.00 0.00 C ATOM 964 C LEU A 87 1.272 8.392 0.302 1.00 0.00 C ATOM 965 O LEU A 87 1.780 9.095 1.174 1.00 0.00 O ATOM 966 CB LEU A 87 2.483 6.136 0.223 1.00 0.00 C ATOM 967 CG LEU A 87 2.331 4.841 -0.579 1.00 0.00 C ATOM 968 CD1 LEU A 87 3.250 4.842 -1.801 1.00 0.00 C ATOM 969 CD2 LEU A 87 2.559 3.616 0.310 1.00 0.00 C ATOM 0 H LEU A 87 4.187 7.543 -0.913 1.00 0.00 H new ATOM 0 HA LEU A 87 1.538 7.124 -1.380 1.00 0.00 H new ATOM 0 HB2 LEU A 87 3.514 6.207 0.569 1.00 0.00 H new ATOM 0 HB3 LEU A 87 1.854 6.067 1.110 1.00 0.00 H new ATOM 0 HG LEU A 87 1.307 4.785 -0.947 1.00 0.00 H new ATOM 0 HD11 LEU A 87 3.122 3.911 -2.353 1.00 0.00 H new ATOM 0 HD12 LEU A 87 2.997 5.684 -2.446 1.00 0.00 H new ATOM 0 HD13 LEU A 87 4.287 4.932 -1.477 1.00 0.00 H new ATOM 0 HD21 LEU A 87 2.445 2.709 -0.284 1.00 0.00 H new ATOM 0 HD22 LEU A 87 3.565 3.652 0.728 1.00 0.00 H new ATOM 0 HD23 LEU A 87 1.829 3.613 1.120 1.00 0.00 H new ATOM 981 N TYR A 88 -0.016 8.395 -0.008 1.00 0.00 N ATOM 982 CA TYR A 88 -0.951 9.262 0.689 1.00 0.00 C ATOM 983 C TYR A 88 -2.397 8.861 0.389 1.00 0.00 C ATOM 984 O TYR A 88 -2.683 8.295 -0.665 1.00 0.00 O ATOM 985 CB TYR A 88 -0.703 10.671 0.149 1.00 0.00 C ATOM 986 CG TYR A 88 -1.734 11.133 -0.884 1.00 0.00 C ATOM 987 CD1 TYR A 88 -1.772 10.544 -2.131 1.00 0.00 C ATOM 988 CD2 TYR A 88 -2.625 12.137 -0.567 1.00 0.00 C ATOM 989 CE1 TYR A 88 -2.742 10.979 -3.103 1.00 0.00 C ATOM 990 CE2 TYR A 88 -3.595 12.572 -1.538 1.00 0.00 C ATOM 991 CZ TYR A 88 -3.606 11.971 -2.758 1.00 0.00 C ATOM 992 OH TYR A 88 -4.522 12.381 -3.676 1.00 0.00 O ATOM 0 H TYR A 88 -0.434 7.811 -0.732 1.00 0.00 H new ATOM 0 HA TYR A 88 -0.805 9.196 1.767 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -0.700 11.373 0.983 1.00 0.00 H new ATOM 0 HB3 TYR A 88 0.289 10.707 -0.302 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -1.075 9.757 -2.378 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -2.595 12.597 0.410 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -2.782 10.528 -4.083 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -4.298 13.358 -1.303 1.00 0.00 H new ATOM 0 HH TYR A 88 -5.073 13.094 -3.292 1.00 0.00 H new ATOM 1002 N GLY A 89 -3.272 9.170 1.336 1.00 0.00 N ATOM 1003 CA GLY A 89 -4.681 8.850 1.186 1.00 0.00 C ATOM 1004 C GLY A 89 -5.537 10.118 1.210 1.00 0.00 C ATOM 1005 O GLY A 89 -5.364 10.972 2.077 1.00 0.00 O ATOM 0 H GLY A 89 -3.032 9.639 2.210 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -4.839 8.318 0.248 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -4.993 8.181 1.988 1.00 0.00 H new ATOM 1009 N SER A 90 -6.442 10.200 0.246 1.00 0.00 N ATOM 1010 CA SER A 90 -7.326 11.349 0.145 1.00 0.00 C ATOM 1011 C SER A 90 -8.785 10.894 0.207 1.00 0.00 C ATOM 1012 O SER A 90 -9.079 9.712 0.034 1.00 0.00 O ATOM 1013 CB SER A 90 -7.068 12.130 -1.145 1.00 0.00 C ATOM 1014 OG SER A 90 -7.429 13.503 -1.019 1.00 0.00 O ATOM 0 H SER A 90 -6.582 9.489 -0.472 1.00 0.00 H new ATOM 0 HA SER A 90 -7.123 12.012 0.986 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.013 12.055 -1.409 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.634 11.680 -1.961 1.00 0.00 H new ATOM 0 HG SER A 90 -7.248 13.968 -1.863 1.00 0.00 H new ATOM 1020 N GLN A 91 -9.662 11.856 0.456 1.00 0.00 N ATOM 1021 CA GLN A 91 -11.083 11.569 0.543 1.00 0.00 C ATOM 1022 C GLN A 91 -11.687 11.445 -0.857 1.00 0.00 C ATOM 1023 O GLN A 91 -12.895 11.262 -1.003 1.00 0.00 O ATOM 1024 CB GLN A 91 -11.809 12.640 1.360 1.00 0.00 C ATOM 1025 CG GLN A 91 -13.185 12.146 1.811 1.00 0.00 C ATOM 1026 CD GLN A 91 -14.159 13.314 1.981 1.00 0.00 C ATOM 1027 OE1 GLN A 91 -14.444 13.763 3.079 1.00 0.00 O ATOM 1028 NE2 GLN A 91 -14.651 13.778 0.836 1.00 0.00 N ATOM 0 H GLN A 91 -9.415 12.835 0.600 1.00 0.00 H new ATOM 0 HA GLN A 91 -11.210 10.617 1.058 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -11.210 12.906 2.231 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -11.921 13.545 0.762 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -13.580 11.442 1.079 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -13.091 11.607 2.753 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -14.370 13.355 -0.049 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -15.310 14.557 0.842 1.00 0.00 H new ATOM 1037 N THR A 92 -10.819 11.550 -1.853 1.00 0.00 N ATOM 1038 CA THR A 92 -11.251 11.451 -3.236 1.00 0.00 C ATOM 1039 C THR A 92 -10.632 10.221 -3.902 1.00 0.00 C ATOM 1040 O THR A 92 -9.559 10.307 -4.498 1.00 0.00 O ATOM 1041 CB THR A 92 -10.897 12.765 -3.937 1.00 0.00 C ATOM 1042 OG1 THR A 92 -9.493 12.670 -4.161 1.00 0.00 O ATOM 1043 CG2 THR A 92 -11.046 13.978 -3.017 1.00 0.00 C ATOM 0 H THR A 92 -9.818 11.703 -1.729 1.00 0.00 H new ATOM 0 HA THR A 92 -12.330 11.310 -3.304 1.00 0.00 H new ATOM 0 HB THR A 92 -11.534 12.893 -4.812 1.00 0.00 H new ATOM 0 HG1 THR A 92 -9.310 11.934 -4.781 1.00 0.00 H new ATOM 0 HG21 THR A 92 -10.783 14.884 -3.563 1.00 0.00 H new ATOM 0 HG22 THR A 92 -12.078 14.049 -2.673 1.00 0.00 H new ATOM 0 HG23 THR A 92 -10.384 13.867 -2.158 1.00 0.00 H new ATOM 1051 N PRO A 93 -11.353 9.075 -3.776 1.00 0.00 N ATOM 1052 CA PRO A 93 -10.886 7.829 -4.359 1.00 0.00 C ATOM 1053 C PRO A 93 -11.082 7.825 -5.876 1.00 0.00 C ATOM 1054 O PRO A 93 -12.201 7.664 -6.361 1.00 0.00 O ATOM 1055 CB PRO A 93 -11.683 6.742 -3.655 1.00 0.00 C ATOM 1056 CG PRO A 93 -12.888 7.439 -3.044 1.00 0.00 C ATOM 1057 CD PRO A 93 -12.628 8.936 -3.078 1.00 0.00 C ATOM 0 HA PRO A 93 -9.816 7.675 -4.219 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -11.994 5.968 -4.357 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -11.083 6.253 -2.887 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -13.793 7.196 -3.601 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -13.045 7.102 -2.019 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -13.425 9.465 -3.601 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -12.576 9.352 -2.072 1.00 0.00 H new ATOM 1065 N ASN A 94 -9.977 8.006 -6.584 1.00 0.00 N ATOM 1066 CA ASN A 94 -10.013 8.026 -8.036 1.00 0.00 C ATOM 1067 C ASN A 94 -8.780 7.302 -8.583 1.00 0.00 C ATOM 1068 O ASN A 94 -8.004 6.729 -7.820 1.00 0.00 O ATOM 1069 CB ASN A 94 -9.993 9.460 -8.568 1.00 0.00 C ATOM 1070 CG ASN A 94 -11.308 10.178 -8.258 1.00 0.00 C ATOM 1071 OD1 ASN A 94 -11.512 10.398 -6.962 1.00 0.00 O flip ATOM 1072 ND2 ASN A 94 -12.086 10.511 -9.137 1.00 0.00 N flip ATOM 0 H ASN A 94 -9.051 8.140 -6.179 1.00 0.00 H new ATOM 0 HA ASN A 94 -10.932 7.535 -8.357 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -9.162 10.006 -8.121 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -9.825 9.450 -9.645 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -11.868 10.312 -10.113 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -12.954 10.989 -8.895 1.00 0.00 H new ATOM 1079 N GLU A 95 -8.640 7.352 -9.899 1.00 0.00 N ATOM 1080 CA GLU A 95 -7.515 6.708 -10.556 1.00 0.00 C ATOM 1081 C GLU A 95 -6.259 6.820 -9.690 1.00 0.00 C ATOM 1082 O GLU A 95 -5.487 5.868 -9.584 1.00 0.00 O ATOM 1083 CB GLU A 95 -7.277 7.304 -11.945 1.00 0.00 C ATOM 1084 CG GLU A 95 -7.898 6.424 -13.033 1.00 0.00 C ATOM 1085 CD GLU A 95 -8.926 7.207 -13.851 1.00 0.00 C ATOM 1086 OE1 GLU A 95 -8.724 8.433 -13.994 1.00 0.00 O ATOM 1087 OE2 GLU A 95 -9.892 6.563 -14.315 1.00 0.00 O ATOM 0 H GLU A 95 -9.286 7.828 -10.528 1.00 0.00 H new ATOM 0 HA GLU A 95 -7.751 5.652 -10.685 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -7.705 8.305 -11.993 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -6.206 7.407 -12.122 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.115 6.047 -13.691 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -8.376 5.557 -12.576 1.00 0.00 H new ATOM 1094 N GLU A 96 -6.093 7.991 -9.092 1.00 0.00 N ATOM 1095 CA GLU A 96 -4.944 8.239 -8.238 1.00 0.00 C ATOM 1096 C GLU A 96 -4.950 7.277 -7.048 1.00 0.00 C ATOM 1097 O GLU A 96 -3.968 6.578 -6.806 1.00 0.00 O ATOM 1098 CB GLU A 96 -4.915 9.694 -7.768 1.00 0.00 C ATOM 1099 CG GLU A 96 -3.873 9.893 -6.664 1.00 0.00 C ATOM 1100 CD GLU A 96 -3.714 11.375 -6.322 1.00 0.00 C ATOM 1101 OE1 GLU A 96 -4.733 12.093 -6.418 1.00 0.00 O ATOM 1102 OE2 GLU A 96 -2.577 11.757 -5.970 1.00 0.00 O ATOM 0 H GLU A 96 -6.735 8.778 -9.182 1.00 0.00 H new ATOM 0 HA GLU A 96 -4.039 8.062 -8.818 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -4.687 10.347 -8.610 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -5.900 9.981 -7.399 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -4.172 9.340 -5.773 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -2.915 9.485 -6.986 1.00 0.00 H new ATOM 1109 N CYS A 97 -6.068 7.274 -6.336 1.00 0.00 N ATOM 1110 CA CYS A 97 -6.214 6.410 -5.177 1.00 0.00 C ATOM 1111 C CYS A 97 -6.028 4.961 -5.631 1.00 0.00 C ATOM 1112 O CYS A 97 -5.419 4.159 -4.925 1.00 0.00 O ATOM 1113 CB CYS A 97 -7.560 6.622 -4.481 1.00 0.00 C ATOM 1114 SG CYS A 97 -8.861 5.651 -5.326 1.00 0.00 S ATOM 0 H CYS A 97 -6.881 7.856 -6.540 1.00 0.00 H new ATOM 0 HA CYS A 97 -5.453 6.658 -4.437 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -7.490 6.320 -3.436 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -7.821 7.680 -4.490 1.00 0.00 H new ATOM 0 HG CYS A 97 -8.731 5.779 -6.613 1.00 0.00 H new ATOM 1120 N LEU A 98 -6.563 4.670 -6.808 1.00 0.00 N ATOM 1121 CA LEU A 98 -6.463 3.331 -7.364 1.00 0.00 C ATOM 1122 C LEU A 98 -5.004 2.873 -7.319 1.00 0.00 C ATOM 1123 O LEU A 98 -4.118 3.643 -6.952 1.00 0.00 O ATOM 1124 CB LEU A 98 -7.079 3.286 -8.764 1.00 0.00 C ATOM 1125 CG LEU A 98 -8.483 2.685 -8.859 1.00 0.00 C ATOM 1126 CD1 LEU A 98 -9.241 3.251 -10.062 1.00 0.00 C ATOM 1127 CD2 LEU A 98 -8.425 1.156 -8.886 1.00 0.00 C ATOM 0 H LEU A 98 -7.067 5.338 -7.392 1.00 0.00 H new ATOM 0 HA LEU A 98 -7.038 2.625 -6.765 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.113 4.302 -9.158 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.416 2.714 -9.413 1.00 0.00 H new ATOM 0 HG LEU A 98 -9.038 2.970 -7.965 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -10.236 2.808 -10.107 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -9.330 4.333 -9.960 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.698 3.016 -10.977 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.436 0.755 -8.954 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.846 0.829 -9.750 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -7.951 0.794 -7.974 1.00 0.00 H new ATOM 1139 N PHE A 99 -4.799 1.620 -7.698 1.00 0.00 N ATOM 1140 CA PHE A 99 -3.463 1.049 -7.706 1.00 0.00 C ATOM 1141 C PHE A 99 -3.339 -0.043 -8.770 1.00 0.00 C ATOM 1142 O PHE A 99 -4.072 -1.031 -8.739 1.00 0.00 O ATOM 1143 CB PHE A 99 -3.234 0.429 -6.326 1.00 0.00 C ATOM 1144 CG PHE A 99 -2.186 1.157 -5.483 1.00 0.00 C ATOM 1145 CD1 PHE A 99 -1.017 1.561 -6.050 1.00 0.00 C ATOM 1146 CD2 PHE A 99 -2.422 1.402 -4.166 1.00 0.00 C ATOM 1147 CE1 PHE A 99 -0.044 2.237 -5.267 1.00 0.00 C ATOM 1148 CE2 PHE A 99 -1.450 2.078 -3.383 1.00 0.00 C ATOM 1149 CZ PHE A 99 -0.281 2.482 -3.950 1.00 0.00 C ATOM 0 H PHE A 99 -5.536 0.984 -8.002 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.729 1.823 -7.932 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.179 0.418 -5.783 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -2.927 -0.609 -6.452 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -0.829 1.368 -7.096 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.350 1.082 -3.716 1.00 0.00 H new ATOM 0 HE1 PHE A 99 0.884 2.557 -5.717 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -1.638 2.272 -2.337 1.00 0.00 H new ATOM 0 HZ PHE A 99 0.458 2.997 -3.355 1.00 0.00 H new ATOM 1159 N LEU A 100 -2.407 0.171 -9.687 1.00 0.00 N ATOM 1160 CA LEU A 100 -2.178 -0.783 -10.758 1.00 0.00 C ATOM 1161 C LEU A 100 -1.750 -2.124 -10.159 1.00 0.00 C ATOM 1162 O LEU A 100 -0.583 -2.313 -9.820 1.00 0.00 O ATOM 1163 CB LEU A 100 -1.183 -0.219 -11.774 1.00 0.00 C ATOM 1164 CG LEU A 100 -1.776 0.253 -13.104 1.00 0.00 C ATOM 1165 CD1 LEU A 100 -1.066 1.511 -13.605 1.00 0.00 C ATOM 1166 CD2 LEU A 100 -1.755 -0.870 -14.143 1.00 0.00 C ATOM 0 H LEU A 100 -1.802 0.992 -9.710 1.00 0.00 H new ATOM 0 HA LEU A 100 -3.099 -0.961 -11.312 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.661 0.620 -11.314 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.435 -0.984 -11.984 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.820 0.518 -12.938 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -1.507 1.825 -14.551 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -1.177 2.309 -12.870 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.007 1.297 -13.751 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -2.182 -0.508 -15.078 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.727 -1.189 -14.313 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.341 -1.714 -13.779 1.00 0.00 H new ATOM 1178 N GLU A 101 -2.719 -3.022 -10.046 1.00 0.00 N ATOM 1179 CA GLU A 101 -2.457 -4.340 -9.493 1.00 0.00 C ATOM 1180 C GLU A 101 -2.412 -5.384 -10.610 1.00 0.00 C ATOM 1181 O GLU A 101 -3.167 -5.298 -11.577 1.00 0.00 O ATOM 1182 CB GLU A 101 -3.502 -4.709 -8.439 1.00 0.00 C ATOM 1183 CG GLU A 101 -2.982 -5.812 -7.514 1.00 0.00 C ATOM 1184 CD GLU A 101 -4.138 -6.617 -6.917 1.00 0.00 C ATOM 1185 OE1 GLU A 101 -4.995 -7.057 -7.714 1.00 0.00 O ATOM 1186 OE2 GLU A 101 -4.139 -6.775 -5.677 1.00 0.00 O ATOM 0 H GLU A 101 -3.686 -2.862 -10.328 1.00 0.00 H new ATOM 0 HA GLU A 101 -1.484 -4.320 -9.001 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -3.758 -3.827 -7.851 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -4.417 -5.042 -8.930 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -2.321 -6.476 -8.070 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -2.390 -5.370 -6.713 1.00 0.00 H new ATOM 1193 N ARG A 102 -1.518 -6.348 -10.440 1.00 0.00 N ATOM 1194 CA ARG A 102 -1.365 -7.408 -11.422 1.00 0.00 C ATOM 1195 C ARG A 102 -1.032 -8.730 -10.727 1.00 0.00 C ATOM 1196 O ARG A 102 -1.927 -9.432 -10.259 1.00 0.00 O ATOM 1197 CB ARG A 102 -0.258 -7.074 -12.424 1.00 0.00 C ATOM 1198 CG ARG A 102 0.789 -6.151 -11.798 1.00 0.00 C ATOM 1199 CD ARG A 102 0.589 -4.705 -12.255 1.00 0.00 C ATOM 1200 NE ARG A 102 1.854 -3.949 -12.111 1.00 0.00 N ATOM 1201 CZ ARG A 102 2.814 -3.907 -13.045 1.00 0.00 C ATOM 1202 NH1 ARG A 102 2.661 -4.578 -14.195 1.00 0.00 N ATOM 1203 NH2 ARG A 102 3.929 -3.196 -12.828 1.00 0.00 N ATOM 0 H ARG A 102 -0.893 -6.417 -9.637 1.00 0.00 H new ATOM 0 HA ARG A 102 -2.309 -7.503 -11.959 1.00 0.00 H new ATOM 0 HB2 ARG A 102 0.219 -7.993 -12.764 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -0.690 -6.596 -13.303 1.00 0.00 H new ATOM 0 HG2 ARG A 102 0.723 -6.205 -10.711 1.00 0.00 H new ATOM 0 HG3 ARG A 102 1.788 -6.488 -12.074 1.00 0.00 H new ATOM 0 HD2 ARG A 102 0.260 -4.685 -13.294 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -0.196 -4.233 -11.664 1.00 0.00 H new ATOM 0 HE ARG A 102 2.004 -3.428 -11.247 1.00 0.00 H new ATOM 0 HH11 ARG A 102 1.813 -5.121 -14.360 1.00 0.00 H new ATOM 0 HH12 ARG A 102 3.392 -4.546 -14.906 1.00 0.00 H new ATOM 0 HH21 ARG A 102 4.047 -2.687 -11.952 1.00 0.00 H new ATOM 0 HH22 ARG A 102 4.660 -3.164 -13.539 1.00 0.00 H new ATOM 1217 N LEU A 103 0.258 -9.030 -10.683 1.00 0.00 N ATOM 1218 CA LEU A 103 0.719 -10.256 -10.053 1.00 0.00 C ATOM 1219 C LEU A 103 2.242 -10.346 -10.178 1.00 0.00 C ATOM 1220 O LEU A 103 2.774 -10.420 -11.285 1.00 0.00 O ATOM 1221 CB LEU A 103 -0.018 -11.466 -10.631 1.00 0.00 C ATOM 1222 CG LEU A 103 0.436 -12.835 -10.120 1.00 0.00 C ATOM 1223 CD1 LEU A 103 -0.510 -13.356 -9.036 1.00 0.00 C ATOM 1224 CD2 LEU A 103 0.588 -13.827 -11.274 1.00 0.00 C ATOM 0 H LEU A 103 0.998 -8.446 -11.073 1.00 0.00 H new ATOM 0 HA LEU A 103 0.485 -10.249 -8.988 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.081 -11.355 -10.417 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.093 -11.450 -11.715 1.00 0.00 H new ATOM 0 HG LEU A 103 1.419 -12.721 -9.662 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -0.165 -14.330 -8.690 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -0.524 -12.658 -8.199 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.515 -13.452 -9.446 1.00 0.00 H new ATOM 0 HD21 LEU A 103 0.912 -14.792 -10.884 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.369 -13.943 -11.782 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.330 -13.454 -11.979 1.00 0.00 H new ATOM 1236 N GLU A 104 2.899 -10.337 -9.028 1.00 0.00 N ATOM 1237 CA GLU A 104 4.350 -10.417 -8.995 1.00 0.00 C ATOM 1238 C GLU A 104 4.799 -11.876 -8.886 1.00 0.00 C ATOM 1239 O GLU A 104 5.725 -12.298 -9.578 1.00 0.00 O ATOM 1240 CB GLU A 104 4.919 -9.581 -7.848 1.00 0.00 C ATOM 1241 CG GLU A 104 6.348 -10.013 -7.511 1.00 0.00 C ATOM 1242 CD GLU A 104 6.351 -11.292 -6.672 1.00 0.00 C ATOM 1243 OE1 GLU A 104 5.300 -11.568 -6.054 1.00 0.00 O ATOM 1244 OE2 GLU A 104 7.404 -11.965 -6.667 1.00 0.00 O ATOM 0 H GLU A 104 2.454 -10.276 -8.112 1.00 0.00 H new ATOM 0 HA GLU A 104 4.738 -10.007 -9.927 1.00 0.00 H new ATOM 0 HB2 GLU A 104 4.909 -8.526 -8.122 1.00 0.00 H new ATOM 0 HB3 GLU A 104 4.286 -9.687 -6.967 1.00 0.00 H new ATOM 0 HG2 GLU A 104 6.909 -10.176 -8.431 1.00 0.00 H new ATOM 0 HG3 GLU A 104 6.854 -9.216 -6.967 1.00 0.00 H new ATOM 1251 N GLU A 105 4.121 -12.606 -8.013 1.00 0.00 N ATOM 1252 CA GLU A 105 4.439 -14.009 -7.804 1.00 0.00 C ATOM 1253 C GLU A 105 3.169 -14.858 -7.885 1.00 0.00 C ATOM 1254 O GLU A 105 2.776 -15.292 -8.967 1.00 0.00 O ATOM 1255 CB GLU A 105 5.153 -14.217 -6.467 1.00 0.00 C ATOM 1256 CG GLU A 105 5.304 -15.706 -6.152 1.00 0.00 C ATOM 1257 CD GLU A 105 4.670 -16.048 -4.802 1.00 0.00 C ATOM 1258 OE1 GLU A 105 3.625 -15.435 -4.495 1.00 0.00 O ATOM 1259 OE2 GLU A 105 5.246 -16.913 -4.107 1.00 0.00 O ATOM 0 H GLU A 105 3.353 -12.253 -7.442 1.00 0.00 H new ATOM 0 HA GLU A 105 5.118 -14.329 -8.594 1.00 0.00 H new ATOM 0 HB2 GLU A 105 6.136 -13.747 -6.499 1.00 0.00 H new ATOM 0 HB3 GLU A 105 4.591 -13.728 -5.671 1.00 0.00 H new ATOM 0 HG2 GLU A 105 4.835 -16.297 -6.938 1.00 0.00 H new ATOM 0 HG3 GLU A 105 6.361 -15.973 -6.140 1.00 0.00 H new ATOM 1266 N ASN A 106 2.562 -15.070 -6.727 1.00 0.00 N ATOM 1267 CA ASN A 106 1.344 -15.860 -6.653 1.00 0.00 C ATOM 1268 C ASN A 106 0.864 -15.914 -5.201 1.00 0.00 C ATOM 1269 O ASN A 106 0.738 -16.994 -4.626 1.00 0.00 O ATOM 1270 CB ASN A 106 1.589 -17.294 -7.124 1.00 0.00 C ATOM 1271 CG ASN A 106 0.318 -17.898 -7.726 1.00 0.00 C ATOM 1272 OD1 ASN A 106 -0.355 -18.719 -7.124 1.00 0.00 O ATOM 1273 ND2 ASN A 106 0.029 -17.448 -8.943 1.00 0.00 N ATOM 0 H ASN A 106 2.891 -14.708 -5.832 1.00 0.00 H new ATOM 0 HA ASN A 106 0.598 -15.392 -7.296 1.00 0.00 H new ATOM 0 HB2 ASN A 106 2.388 -17.306 -7.865 1.00 0.00 H new ATOM 0 HB3 ASN A 106 1.924 -17.904 -6.285 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -0.799 -17.790 -9.430 1.00 0.00 H new ATOM 0 HD22 ASN A 106 0.635 -16.760 -9.390 1.00 0.00 H new ATOM 1280 N HIS A 107 0.610 -14.736 -4.651 1.00 0.00 N ATOM 1281 CA HIS A 107 0.146 -14.637 -3.277 1.00 0.00 C ATOM 1282 C HIS A 107 -0.063 -13.166 -2.912 1.00 0.00 C ATOM 1283 O HIS A 107 -1.061 -12.814 -2.285 1.00 0.00 O ATOM 1284 CB HIS A 107 1.107 -15.353 -2.326 1.00 0.00 C ATOM 1285 CG HIS A 107 0.737 -16.790 -2.046 1.00 0.00 C ATOM 1286 ND1 HIS A 107 -0.441 -17.151 -1.416 1.00 0.00 N ATOM 1287 CD2 HIS A 107 1.401 -17.950 -2.318 1.00 0.00 C ATOM 1288 CE1 HIS A 107 -0.474 -18.472 -1.317 1.00 0.00 C ATOM 1289 NE2 HIS A 107 0.669 -18.965 -1.876 1.00 0.00 N ATOM 0 H HIS A 107 0.716 -13.842 -5.131 1.00 0.00 H new ATOM 0 HA HIS A 107 -0.815 -15.141 -3.176 1.00 0.00 H new ATOM 0 HB2 HIS A 107 2.111 -15.323 -2.750 1.00 0.00 H new ATOM 0 HB3 HIS A 107 1.143 -14.807 -1.383 1.00 0.00 H new ATOM 0 HD2 HIS A 107 2.359 -18.029 -2.809 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -1.266 -19.056 -0.872 1.00 0.00 H new ATOM 0 HE2 HIS A 107 0.920 -19.951 -1.943 1.00 0.00 H new ATOM 1297 N TYR A 108 0.894 -12.346 -3.320 1.00 0.00 N ATOM 1298 CA TYR A 108 0.827 -10.921 -3.044 1.00 0.00 C ATOM 1299 C TYR A 108 0.086 -10.180 -4.159 1.00 0.00 C ATOM 1300 O TYR A 108 -0.741 -10.766 -4.856 1.00 0.00 O ATOM 1301 CB TYR A 108 2.276 -10.432 -2.997 1.00 0.00 C ATOM 1302 CG TYR A 108 3.280 -11.502 -2.567 1.00 0.00 C ATOM 1303 CD1 TYR A 108 3.523 -11.721 -1.226 1.00 0.00 C ATOM 1304 CD2 TYR A 108 3.944 -12.248 -3.519 1.00 0.00 C ATOM 1305 CE1 TYR A 108 4.468 -12.728 -0.820 1.00 0.00 C ATOM 1306 CE2 TYR A 108 4.890 -13.256 -3.113 1.00 0.00 C ATOM 1307 CZ TYR A 108 5.105 -13.446 -1.784 1.00 0.00 C ATOM 1308 OH TYR A 108 5.998 -14.398 -1.401 1.00 0.00 O ATOM 0 H TYR A 108 1.720 -12.641 -3.840 1.00 0.00 H new ATOM 0 HA TYR A 108 0.293 -10.735 -2.112 1.00 0.00 H new ATOM 0 HB2 TYR A 108 2.556 -10.061 -3.983 1.00 0.00 H new ATOM 0 HB3 TYR A 108 2.342 -9.589 -2.309 1.00 0.00 H new ATOM 0 HD1 TYR A 108 3.004 -11.136 -0.481 1.00 0.00 H new ATOM 0 HD2 TYR A 108 3.755 -12.076 -4.568 1.00 0.00 H new ATOM 0 HE1 TYR A 108 4.667 -12.909 0.226 1.00 0.00 H new ATOM 0 HE2 TYR A 108 5.416 -13.847 -3.848 1.00 0.00 H new ATOM 0 HH TYR A 108 6.375 -14.831 -2.195 1.00 0.00 H new ATOM 1318 N ASN A 109 0.410 -8.902 -4.294 1.00 0.00 N ATOM 1319 CA ASN A 109 -0.213 -8.076 -5.313 1.00 0.00 C ATOM 1320 C ASN A 109 0.550 -6.755 -5.430 1.00 0.00 C ATOM 1321 O ASN A 109 0.016 -5.695 -5.106 1.00 0.00 O ATOM 1322 CB ASN A 109 -1.664 -7.753 -4.949 1.00 0.00 C ATOM 1323 CG ASN A 109 -2.608 -8.858 -5.427 1.00 0.00 C ATOM 1324 OD1 ASN A 109 -2.740 -8.922 -6.749 1.00 0.00 O flip ATOM 1325 ND2 ASN A 109 -3.179 -9.603 -4.647 1.00 0.00 N flip ATOM 0 H ASN A 109 1.096 -8.419 -3.714 1.00 0.00 H new ATOM 0 HA ASN A 109 -0.191 -8.627 -6.253 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -1.754 -7.635 -3.869 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -1.953 -6.803 -5.399 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -3.033 -9.499 -3.643 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -3.802 -10.330 -4.999 1.00 0.00 H new ATOM 1332 N THR A 110 1.787 -6.862 -5.893 1.00 0.00 N ATOM 1333 CA THR A 110 2.629 -5.689 -6.056 1.00 0.00 C ATOM 1334 C THR A 110 1.936 -4.654 -6.945 1.00 0.00 C ATOM 1335 O THR A 110 1.947 -4.776 -8.169 1.00 0.00 O ATOM 1336 CB THR A 110 3.982 -6.150 -6.601 1.00 0.00 C ATOM 1337 OG1 THR A 110 3.658 -6.808 -7.823 1.00 0.00 O ATOM 1338 CG2 THR A 110 4.615 -7.248 -5.743 1.00 0.00 C ATOM 0 H THR A 110 2.226 -7.743 -6.160 1.00 0.00 H new ATOM 0 HA THR A 110 2.800 -5.189 -5.102 1.00 0.00 H new ATOM 0 HB THR A 110 4.660 -5.298 -6.659 1.00 0.00 H new ATOM 0 HG1 THR A 110 3.042 -6.250 -8.342 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.573 -7.539 -6.173 1.00 0.00 H new ATOM 0 HG22 THR A 110 4.770 -6.875 -4.731 1.00 0.00 H new ATOM 0 HG23 THR A 110 3.953 -8.113 -5.713 1.00 0.00 H new ATOM 1346 N TYR A 111 1.349 -3.660 -6.295 1.00 0.00 N ATOM 1347 CA TYR A 111 0.652 -2.606 -7.012 1.00 0.00 C ATOM 1348 C TYR A 111 1.635 -1.555 -7.534 1.00 0.00 C ATOM 1349 O TYR A 111 2.849 -1.736 -7.443 1.00 0.00 O ATOM 1350 CB TYR A 111 -0.283 -1.950 -5.994 1.00 0.00 C ATOM 1351 CG TYR A 111 -0.986 -2.943 -5.066 1.00 0.00 C ATOM 1352 CD1 TYR A 111 -0.380 -3.334 -3.889 1.00 0.00 C ATOM 1353 CD2 TYR A 111 -2.225 -3.447 -5.405 1.00 0.00 C ATOM 1354 CE1 TYR A 111 -1.042 -4.268 -3.015 1.00 0.00 C ATOM 1355 CE2 TYR A 111 -2.886 -4.381 -4.532 1.00 0.00 C ATOM 1356 CZ TYR A 111 -2.262 -4.746 -3.380 1.00 0.00 C ATOM 1357 OH TYR A 111 -2.887 -5.628 -2.555 1.00 0.00 O ATOM 0 H TYR A 111 1.342 -3.562 -5.280 1.00 0.00 H new ATOM 0 HA TYR A 111 0.117 -3.015 -7.869 1.00 0.00 H new ATOM 0 HB2 TYR A 111 0.290 -1.247 -5.390 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -1.037 -1.371 -6.528 1.00 0.00 H new ATOM 0 HD1 TYR A 111 0.590 -2.940 -3.624 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -2.699 -3.140 -6.326 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -0.580 -4.582 -2.091 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -3.856 -4.783 -4.786 1.00 0.00 H new ATOM 0 HH TYR A 111 -2.623 -5.452 -1.628 1.00 0.00 H new ATOM 1367 N ILE A 112 1.075 -0.481 -8.069 1.00 0.00 N ATOM 1368 CA ILE A 112 1.887 0.598 -8.605 1.00 0.00 C ATOM 1369 C ILE A 112 1.021 1.849 -8.769 1.00 0.00 C ATOM 1370 O ILE A 112 0.033 1.833 -9.502 1.00 0.00 O ATOM 1371 CB ILE A 112 2.580 0.157 -9.896 1.00 0.00 C ATOM 1372 CG1 ILE A 112 4.076 -0.066 -9.666 1.00 0.00 C ATOM 1373 CG2 ILE A 112 2.316 1.152 -11.028 1.00 0.00 C ATOM 1374 CD1 ILE A 112 4.727 -0.721 -10.886 1.00 0.00 C ATOM 0 H ILE A 112 0.068 -0.334 -8.143 1.00 0.00 H new ATOM 0 HA ILE A 112 2.688 0.852 -7.911 1.00 0.00 H new ATOM 0 HB ILE A 112 2.155 -0.799 -10.203 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.562 0.887 -9.458 1.00 0.00 H new ATOM 0 HG13 ILE A 112 4.223 -0.696 -8.789 1.00 0.00 H new ATOM 0 HG21 ILE A 112 2.820 0.815 -11.934 1.00 0.00 H new ATOM 0 HG22 ILE A 112 1.244 1.217 -11.212 1.00 0.00 H new ATOM 0 HG23 ILE A 112 2.696 2.134 -10.746 1.00 0.00 H new ATOM 0 HD11 ILE A 112 5.790 -0.868 -10.696 1.00 0.00 H new ATOM 0 HD12 ILE A 112 4.255 -1.685 -11.076 1.00 0.00 H new ATOM 0 HD13 ILE A 112 4.600 -0.077 -11.756 1.00 0.00 H new ATOM 1386 N SER A 113 1.424 2.903 -8.074 1.00 0.00 N ATOM 1387 CA SER A 113 0.697 4.160 -8.133 1.00 0.00 C ATOM 1388 C SER A 113 0.132 4.372 -9.539 1.00 0.00 C ATOM 1389 O SER A 113 0.858 4.764 -10.451 1.00 0.00 O ATOM 1390 CB SER A 113 1.595 5.335 -7.740 1.00 0.00 C ATOM 1391 OG SER A 113 1.059 6.583 -8.169 1.00 0.00 O ATOM 0 H SER A 113 2.244 2.912 -7.468 1.00 0.00 H new ATOM 0 HA SER A 113 -0.126 4.112 -7.420 1.00 0.00 H new ATOM 0 HB2 SER A 113 1.722 5.348 -6.658 1.00 0.00 H new ATOM 0 HB3 SER A 113 2.585 5.197 -8.175 1.00 0.00 H new ATOM 0 HG SER A 113 0.121 6.649 -7.893 1.00 0.00 H new ATOM 1397 N LYS A 114 -1.159 4.103 -9.670 1.00 0.00 N ATOM 1398 CA LYS A 114 -1.830 4.260 -10.949 1.00 0.00 C ATOM 1399 C LYS A 114 -1.666 5.702 -11.434 1.00 0.00 C ATOM 1400 O LYS A 114 -1.867 5.991 -12.612 1.00 0.00 O ATOM 1401 CB LYS A 114 -3.288 3.808 -10.848 1.00 0.00 C ATOM 1402 CG LYS A 114 -3.889 3.579 -12.237 1.00 0.00 C ATOM 1403 CD LYS A 114 -5.362 3.990 -12.272 1.00 0.00 C ATOM 1404 CE LYS A 114 -6.003 3.622 -13.611 1.00 0.00 C ATOM 1405 NZ LYS A 114 -5.355 4.365 -14.716 1.00 0.00 N ATOM 0 H LYS A 114 -1.758 3.777 -8.911 1.00 0.00 H new ATOM 0 HA LYS A 114 -1.372 3.617 -11.700 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -3.348 2.888 -10.266 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.870 4.561 -10.316 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.330 4.151 -12.978 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -3.795 2.528 -12.509 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.899 3.499 -11.461 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -5.447 5.064 -12.107 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -5.911 2.550 -13.783 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -7.068 3.851 -13.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -5.965 4.336 -15.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -5.207 5.354 -14.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -4.438 3.928 -14.937 1.00 0.00 H new ATOM 1419 N LYS A 115 -1.301 6.568 -10.500 1.00 0.00 N ATOM 1420 CA LYS A 115 -1.107 7.973 -10.817 1.00 0.00 C ATOM 1421 C LYS A 115 0.361 8.213 -11.173 1.00 0.00 C ATOM 1422 O LYS A 115 0.742 9.325 -11.534 1.00 0.00 O ATOM 1423 CB LYS A 115 -1.616 8.855 -9.675 1.00 0.00 C ATOM 1424 CG LYS A 115 -2.609 9.899 -10.189 1.00 0.00 C ATOM 1425 CD LYS A 115 -2.545 11.176 -9.349 1.00 0.00 C ATOM 1426 CE LYS A 115 -1.394 12.075 -9.803 1.00 0.00 C ATOM 1427 NZ LYS A 115 -1.915 13.341 -10.366 1.00 0.00 N ATOM 0 H LYS A 115 -1.134 6.324 -9.524 1.00 0.00 H new ATOM 0 HA LYS A 115 -1.696 8.252 -11.691 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.095 8.235 -8.917 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -0.775 9.354 -9.194 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -2.389 10.133 -11.231 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -3.619 9.491 -10.160 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -3.488 11.717 -9.431 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -2.416 10.918 -8.298 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -0.737 12.288 -8.960 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.794 11.557 -10.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -1.295 13.659 -11.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -2.875 13.188 -10.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -1.941 14.067 -9.622 1.00 0.00 H new ATOM 1441 N HIS A 116 1.146 7.152 -11.057 1.00 0.00 N ATOM 1442 CA HIS A 116 2.564 7.233 -11.362 1.00 0.00 C ATOM 1443 C HIS A 116 3.073 5.862 -11.811 1.00 0.00 C ATOM 1444 O HIS A 116 4.175 5.455 -11.448 1.00 0.00 O ATOM 1445 CB HIS A 116 3.345 7.794 -10.172 1.00 0.00 C ATOM 1446 CG HIS A 116 3.671 9.264 -10.289 1.00 0.00 C ATOM 1447 ND1 HIS A 116 4.942 9.729 -10.580 1.00 0.00 N ATOM 1448 CD2 HIS A 116 2.880 10.366 -10.152 1.00 0.00 C ATOM 1449 CE1 HIS A 116 4.905 11.053 -10.614 1.00 0.00 C ATOM 1450 NE2 HIS A 116 3.626 11.446 -10.347 1.00 0.00 N ATOM 0 H HIS A 116 0.827 6.231 -10.756 1.00 0.00 H new ATOM 0 HA HIS A 116 2.722 7.928 -12.187 1.00 0.00 H new ATOM 0 HB2 HIS A 116 2.767 7.632 -9.262 1.00 0.00 H new ATOM 0 HB3 HIS A 116 4.274 7.234 -10.064 1.00 0.00 H new ATOM 0 HD1 HIS A 116 5.767 9.151 -10.741 1.00 0.00 H new ATOM 0 HD2 HIS A 116 1.824 10.361 -9.923 1.00 0.00 H new ATOM 0 HE1 HIS A 116 5.741 11.706 -10.817 1.00 0.00 H new ATOM 1458 N ALA A 117 2.244 5.187 -12.595 1.00 0.00 N ATOM 1459 CA ALA A 117 2.596 3.869 -13.097 1.00 0.00 C ATOM 1460 C ALA A 117 3.587 4.017 -14.253 1.00 0.00 C ATOM 1461 O ALA A 117 4.040 3.022 -14.818 1.00 0.00 O ATOM 1462 CB ALA A 117 1.325 3.124 -13.510 1.00 0.00 C ATOM 0 H ALA A 117 1.331 5.528 -12.895 1.00 0.00 H new ATOM 0 HA ALA A 117 3.082 3.279 -12.320 1.00 0.00 H new ATOM 0 HB1 ALA A 117 1.589 2.136 -13.886 1.00 0.00 H new ATOM 0 HB2 ALA A 117 0.667 3.020 -12.647 1.00 0.00 H new ATOM 0 HB3 ALA A 117 0.812 3.685 -14.291 1.00 0.00 H new ATOM 1468 N GLU A 118 3.895 5.266 -14.571 1.00 0.00 N ATOM 1469 CA GLU A 118 4.825 5.556 -15.649 1.00 0.00 C ATOM 1470 C GLU A 118 6.267 5.447 -15.150 1.00 0.00 C ATOM 1471 O GLU A 118 7.170 5.122 -15.919 1.00 0.00 O ATOM 1472 CB GLU A 118 4.555 6.938 -16.248 1.00 0.00 C ATOM 1473 CG GLU A 118 5.758 7.430 -17.054 1.00 0.00 C ATOM 1474 CD GLU A 118 5.313 8.328 -18.211 1.00 0.00 C ATOM 1475 OE1 GLU A 118 4.201 8.080 -18.726 1.00 0.00 O ATOM 1476 OE2 GLU A 118 6.095 9.241 -18.554 1.00 0.00 O ATOM 0 H GLU A 118 3.517 6.089 -14.101 1.00 0.00 H new ATOM 0 HA GLU A 118 4.678 4.819 -16.438 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.675 6.894 -16.890 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.332 7.647 -15.450 1.00 0.00 H new ATOM 0 HG2 GLU A 118 6.437 7.980 -16.402 1.00 0.00 H new ATOM 0 HG3 GLU A 118 6.313 6.577 -17.444 1.00 0.00 H new ATOM 1483 N LYS A 119 6.438 5.724 -13.866 1.00 0.00 N ATOM 1484 CA LYS A 119 7.755 5.661 -13.256 1.00 0.00 C ATOM 1485 C LYS A 119 7.882 4.361 -12.460 1.00 0.00 C ATOM 1486 O LYS A 119 8.921 4.097 -11.857 1.00 0.00 O ATOM 1487 CB LYS A 119 8.022 6.919 -12.427 1.00 0.00 C ATOM 1488 CG LYS A 119 9.296 7.625 -12.895 1.00 0.00 C ATOM 1489 CD LYS A 119 9.407 9.022 -12.281 1.00 0.00 C ATOM 1490 CE LYS A 119 10.869 9.396 -12.029 1.00 0.00 C ATOM 1491 NZ LYS A 119 10.971 10.789 -11.540 1.00 0.00 N ATOM 0 H LYS A 119 5.686 5.993 -13.231 1.00 0.00 H new ATOM 0 HA LYS A 119 8.530 5.642 -14.023 1.00 0.00 H new ATOM 0 HB2 LYS A 119 7.174 7.599 -12.509 1.00 0.00 H new ATOM 0 HB3 LYS A 119 8.116 6.652 -11.374 1.00 0.00 H new ATOM 0 HG2 LYS A 119 10.167 7.032 -12.618 1.00 0.00 H new ATOM 0 HG3 LYS A 119 9.295 7.701 -13.982 1.00 0.00 H new ATOM 0 HD2 LYS A 119 8.951 9.753 -12.948 1.00 0.00 H new ATOM 0 HD3 LYS A 119 8.852 9.056 -11.343 1.00 0.00 H new ATOM 0 HE2 LYS A 119 11.304 8.715 -11.298 1.00 0.00 H new ATOM 0 HE3 LYS A 119 11.443 9.284 -12.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 11.892 11.186 -11.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 10.209 11.360 -11.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 10.883 10.800 -10.504 1.00 0.00 H new ATOM 1505 N ASN A 120 6.810 3.583 -12.483 1.00 0.00 N ATOM 1506 CA ASN A 120 6.788 2.317 -11.771 1.00 0.00 C ATOM 1507 C ASN A 120 6.877 2.581 -10.267 1.00 0.00 C ATOM 1508 O ASN A 120 7.387 1.751 -9.516 1.00 0.00 O ATOM 1509 CB ASN A 120 7.978 1.441 -12.168 1.00 0.00 C ATOM 1510 CG ASN A 120 7.511 0.184 -12.906 1.00 0.00 C ATOM 1511 OD1 ASN A 120 8.007 -0.910 -12.696 1.00 0.00 O ATOM 1512 ND2 ASN A 120 6.532 0.402 -13.779 1.00 0.00 N ATOM 0 H ASN A 120 5.950 3.805 -12.984 1.00 0.00 H new ATOM 0 HA ASN A 120 5.861 1.803 -12.026 1.00 0.00 H new ATOM 0 HB2 ASN A 120 8.657 2.009 -12.804 1.00 0.00 H new ATOM 0 HB3 ASN A 120 8.538 1.157 -11.277 1.00 0.00 H new ATOM 0 HD21 ASN A 120 6.151 -0.373 -14.322 1.00 0.00 H new ATOM 0 HD22 ASN A 120 6.162 1.344 -13.906 1.00 0.00 H new ATOM 1519 N TRP A 121 6.374 3.742 -9.871 1.00 0.00 N ATOM 1520 CA TRP A 121 6.391 4.126 -8.470 1.00 0.00 C ATOM 1521 C TRP A 121 5.504 3.145 -7.700 1.00 0.00 C ATOM 1522 O TRP A 121 4.361 3.461 -7.374 1.00 0.00 O ATOM 1523 CB TRP A 121 5.961 5.584 -8.296 1.00 0.00 C ATOM 1524 CG TRP A 121 7.051 6.600 -8.645 1.00 0.00 C ATOM 1525 CD1 TRP A 121 8.300 6.358 -9.066 1.00 0.00 C ATOM 1526 CD2 TRP A 121 6.937 8.037 -8.586 1.00 0.00 C ATOM 1527 NE1 TRP A 121 8.996 7.530 -9.282 1.00 0.00 N ATOM 1528 CE2 TRP A 121 8.141 8.583 -8.980 1.00 0.00 C ATOM 1529 CE3 TRP A 121 5.852 8.849 -8.212 1.00 0.00 C ATOM 1530 CZ2 TRP A 121 8.375 9.962 -9.038 1.00 0.00 C ATOM 1531 CZ3 TRP A 121 6.102 10.225 -8.275 1.00 0.00 C ATOM 1532 CH2 TRP A 121 7.309 10.791 -8.670 1.00 0.00 C ATOM 0 H TRP A 121 5.952 4.429 -10.496 1.00 0.00 H new ATOM 0 HA TRP A 121 7.402 4.071 -8.067 1.00 0.00 H new ATOM 0 HB2 TRP A 121 5.089 5.772 -8.922 1.00 0.00 H new ATOM 0 HB3 TRP A 121 5.651 5.740 -7.263 1.00 0.00 H new ATOM 0 HD1 TRP A 121 8.710 5.370 -9.217 1.00 0.00 H new ATOM 0 HE1 TRP A 121 9.961 7.609 -9.604 1.00 0.00 H new ATOM 0 HE3 TRP A 121 4.901 8.443 -7.901 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 9.327 10.365 -9.350 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 5.301 10.894 -7.997 1.00 0.00 H new ATOM 0 HH2 TRP A 121 7.423 11.865 -8.693 1.00 0.00 H new ATOM 1543 N PHE A 122 6.064 1.975 -7.433 1.00 0.00 N ATOM 1544 CA PHE A 122 5.338 0.946 -6.708 1.00 0.00 C ATOM 1545 C PHE A 122 4.804 1.485 -5.379 1.00 0.00 C ATOM 1546 O PHE A 122 4.870 2.685 -5.120 1.00 0.00 O ATOM 1547 CB PHE A 122 6.328 -0.186 -6.425 1.00 0.00 C ATOM 1548 CG PHE A 122 6.388 -1.249 -7.524 1.00 0.00 C ATOM 1549 CD1 PHE A 122 7.194 -1.067 -8.604 1.00 0.00 C ATOM 1550 CD2 PHE A 122 5.635 -2.377 -7.420 1.00 0.00 C ATOM 1551 CE1 PHE A 122 7.250 -2.053 -9.623 1.00 0.00 C ATOM 1552 CE2 PHE A 122 5.690 -3.364 -8.440 1.00 0.00 C ATOM 1553 CZ PHE A 122 6.497 -3.181 -9.519 1.00 0.00 C ATOM 0 H PHE A 122 7.012 1.716 -7.706 1.00 0.00 H new ATOM 0 HA PHE A 122 4.488 0.604 -7.299 1.00 0.00 H new ATOM 0 HB2 PHE A 122 7.322 0.240 -6.291 1.00 0.00 H new ATOM 0 HB3 PHE A 122 6.057 -0.665 -5.484 1.00 0.00 H new ATOM 0 HD1 PHE A 122 7.792 -0.171 -8.686 1.00 0.00 H new ATOM 0 HD2 PHE A 122 4.995 -2.522 -6.562 1.00 0.00 H new ATOM 0 HE1 PHE A 122 7.890 -1.908 -10.481 1.00 0.00 H new ATOM 0 HE2 PHE A 122 5.091 -4.259 -8.359 1.00 0.00 H new ATOM 0 HZ PHE A 122 6.540 -3.932 -10.294 1.00 0.00 H new ATOM 1563 N VAL A 123 4.288 0.570 -4.570 1.00 0.00 N ATOM 1564 CA VAL A 123 3.744 0.938 -3.275 1.00 0.00 C ATOM 1565 C VAL A 123 4.464 0.148 -2.181 1.00 0.00 C ATOM 1566 O VAL A 123 3.971 0.042 -1.059 1.00 0.00 O ATOM 1567 CB VAL A 123 2.229 0.728 -3.265 1.00 0.00 C ATOM 1568 CG1 VAL A 123 1.870 -0.699 -3.682 1.00 0.00 C ATOM 1569 CG2 VAL A 123 1.638 1.063 -1.894 1.00 0.00 C ATOM 0 H VAL A 123 4.236 -0.425 -4.787 1.00 0.00 H new ATOM 0 HA VAL A 123 3.913 1.996 -3.077 1.00 0.00 H new ATOM 0 HB VAL A 123 1.792 1.410 -3.994 1.00 0.00 H new ATOM 0 HG11 VAL A 123 0.787 -0.821 -3.666 1.00 0.00 H new ATOM 0 HG12 VAL A 123 2.242 -0.888 -4.689 1.00 0.00 H new ATOM 0 HG13 VAL A 123 2.325 -1.406 -2.988 1.00 0.00 H new ATOM 0 HG21 VAL A 123 0.560 0.905 -1.914 1.00 0.00 H new ATOM 0 HG22 VAL A 123 2.085 0.418 -1.138 1.00 0.00 H new ATOM 0 HG23 VAL A 123 1.848 2.105 -1.652 1.00 0.00 H new ATOM 1579 N GLY A 124 5.620 -0.388 -2.545 1.00 0.00 N ATOM 1580 CA GLY A 124 6.413 -1.166 -1.609 1.00 0.00 C ATOM 1581 C GLY A 124 7.373 -0.268 -0.826 1.00 0.00 C ATOM 1582 O GLY A 124 8.361 0.218 -1.374 1.00 0.00 O ATOM 0 H GLY A 124 6.026 -0.298 -3.476 1.00 0.00 H new ATOM 0 HA2 GLY A 124 5.754 -1.691 -0.917 1.00 0.00 H new ATOM 0 HA3 GLY A 124 6.978 -1.925 -2.149 1.00 0.00 H new ATOM 1586 N LEU A 125 7.049 -0.076 0.445 1.00 0.00 N ATOM 1587 CA LEU A 125 7.871 0.755 1.309 1.00 0.00 C ATOM 1588 C LEU A 125 9.272 0.149 1.409 1.00 0.00 C ATOM 1589 O LEU A 125 9.433 -0.977 1.877 1.00 0.00 O ATOM 1590 CB LEU A 125 7.189 0.956 2.664 1.00 0.00 C ATOM 1591 CG LEU A 125 5.668 0.797 2.680 1.00 0.00 C ATOM 1592 CD1 LEU A 125 5.270 -0.645 3.000 1.00 0.00 C ATOM 1593 CD2 LEU A 125 5.022 1.797 3.641 1.00 0.00 C ATOM 0 H LEU A 125 6.229 -0.481 0.897 1.00 0.00 H new ATOM 0 HA LEU A 125 7.985 1.752 0.884 1.00 0.00 H new ATOM 0 HB2 LEU A 125 7.616 0.246 3.372 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.434 1.954 3.027 1.00 0.00 H new ATOM 0 HG LEU A 125 5.291 1.020 1.682 1.00 0.00 H new ATOM 0 HD11 LEU A 125 4.183 -0.730 3.005 1.00 0.00 H new ATOM 0 HD12 LEU A 125 5.683 -1.313 2.244 1.00 0.00 H new ATOM 0 HD13 LEU A 125 5.660 -0.921 3.980 1.00 0.00 H new ATOM 0 HD21 LEU A 125 3.940 1.662 3.633 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.401 1.630 4.649 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.264 2.812 3.326 1.00 0.00 H new ATOM 1605 N LYS A 126 10.250 0.924 0.963 1.00 0.00 N ATOM 1606 CA LYS A 126 11.633 0.477 0.997 1.00 0.00 C ATOM 1607 C LYS A 126 11.787 -0.612 2.060 1.00 0.00 C ATOM 1608 O LYS A 126 11.579 -0.360 3.246 1.00 0.00 O ATOM 1609 CB LYS A 126 12.575 1.667 1.194 1.00 0.00 C ATOM 1610 CG LYS A 126 13.883 1.463 0.427 1.00 0.00 C ATOM 1611 CD LYS A 126 15.062 1.297 1.389 1.00 0.00 C ATOM 1612 CE LYS A 126 16.335 1.913 0.806 1.00 0.00 C ATOM 1613 NZ LYS A 126 17.372 2.046 1.853 1.00 0.00 N ATOM 0 H LYS A 126 10.113 1.858 0.576 1.00 0.00 H new ATOM 0 HA LYS A 126 11.913 0.032 0.042 1.00 0.00 H new ATOM 0 HB2 LYS A 126 12.088 2.581 0.854 1.00 0.00 H new ATOM 0 HB3 LYS A 126 12.788 1.795 2.255 1.00 0.00 H new ATOM 0 HG2 LYS A 126 13.802 0.582 -0.210 1.00 0.00 H new ATOM 0 HG3 LYS A 126 14.061 2.315 -0.229 1.00 0.00 H new ATOM 0 HD2 LYS A 126 14.828 1.771 2.342 1.00 0.00 H new ATOM 0 HD3 LYS A 126 15.225 0.238 1.591 1.00 0.00 H new ATOM 0 HE2 LYS A 126 16.708 1.290 -0.007 1.00 0.00 H new ATOM 0 HE3 LYS A 126 16.111 2.891 0.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 18.230 2.466 1.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 17.019 2.659 2.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 17.597 1.107 2.240 1.00 0.00 H new ATOM 1627 N LYS A 127 12.149 -1.799 1.597 1.00 0.00 N ATOM 1628 CA LYS A 127 12.334 -2.927 2.494 1.00 0.00 C ATOM 1629 C LYS A 127 13.472 -2.618 3.469 1.00 0.00 C ATOM 1630 O LYS A 127 14.487 -3.312 3.483 1.00 0.00 O ATOM 1631 CB LYS A 127 12.540 -4.217 1.697 1.00 0.00 C ATOM 1632 CG LYS A 127 13.683 -4.063 0.691 1.00 0.00 C ATOM 1633 CD LYS A 127 14.994 -4.605 1.263 1.00 0.00 C ATOM 1634 CE LYS A 127 16.033 -3.491 1.402 1.00 0.00 C ATOM 1635 NZ LYS A 127 17.071 -3.870 2.386 1.00 0.00 N ATOM 0 H LYS A 127 12.319 -2.004 0.612 1.00 0.00 H new ATOM 0 HA LYS A 127 11.437 -3.089 3.092 1.00 0.00 H new ATOM 0 HB2 LYS A 127 12.759 -5.039 2.379 1.00 0.00 H new ATOM 0 HB3 LYS A 127 11.620 -4.475 1.172 1.00 0.00 H new ATOM 0 HG2 LYS A 127 13.437 -4.594 -0.229 1.00 0.00 H new ATOM 0 HG3 LYS A 127 13.803 -3.012 0.430 1.00 0.00 H new ATOM 0 HD2 LYS A 127 14.810 -5.059 2.237 1.00 0.00 H new ATOM 0 HD3 LYS A 127 15.382 -5.390 0.613 1.00 0.00 H new ATOM 0 HE2 LYS A 127 16.495 -3.294 0.435 1.00 0.00 H new ATOM 0 HE3 LYS A 127 15.545 -2.568 1.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 17.163 -3.119 3.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 16.800 -4.759 2.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 17.981 -3.998 1.899 1.00 0.00 H new ATOM 1649 N ASN A 128 13.263 -1.576 4.260 1.00 0.00 N ATOM 1650 CA ASN A 128 14.259 -1.167 5.236 1.00 0.00 C ATOM 1651 C ASN A 128 13.556 -0.728 6.522 1.00 0.00 C ATOM 1652 O ASN A 128 13.983 -1.085 7.619 1.00 0.00 O ATOM 1653 CB ASN A 128 15.082 0.015 4.720 1.00 0.00 C ATOM 1654 CG ASN A 128 16.566 -0.347 4.632 1.00 0.00 C ATOM 1655 OD1 ASN A 128 16.813 -1.452 3.934 1.00 0.00 O flip ATOM 1656 ND2 ASN A 128 17.430 0.332 5.162 1.00 0.00 N flip ATOM 0 H ASN A 128 12.419 -1.003 4.245 1.00 0.00 H new ATOM 0 HA ASN A 128 14.920 -2.014 5.419 1.00 0.00 H new ATOM 0 HB2 ASN A 128 14.718 0.315 3.737 1.00 0.00 H new ATOM 0 HB3 ASN A 128 14.951 0.871 5.383 1.00 0.00 H new ATOM 0 HD21 ASN A 128 17.172 1.169 5.684 1.00 0.00 H new ATOM 0 HD22 ASN A 128 18.411 0.062 5.083 1.00 0.00 H new ATOM 1663 N GLY A 129 12.492 0.040 6.344 1.00 0.00 N ATOM 1664 CA GLY A 129 11.726 0.531 7.477 1.00 0.00 C ATOM 1665 C GLY A 129 11.529 2.046 7.390 1.00 0.00 C ATOM 1666 O GLY A 129 11.928 2.780 8.293 1.00 0.00 O ATOM 0 H GLY A 129 12.142 0.335 5.432 1.00 0.00 H new ATOM 0 HA2 GLY A 129 10.756 0.036 7.507 1.00 0.00 H new ATOM 0 HA3 GLY A 129 12.240 0.280 8.405 1.00 0.00 H new ATOM 1670 N SER A 130 10.913 2.469 6.296 1.00 0.00 N ATOM 1671 CA SER A 130 10.658 3.883 6.080 1.00 0.00 C ATOM 1672 C SER A 130 10.175 4.114 4.646 1.00 0.00 C ATOM 1673 O SER A 130 10.920 3.892 3.693 1.00 0.00 O ATOM 1674 CB SER A 130 11.910 4.717 6.359 1.00 0.00 C ATOM 1675 OG SER A 130 12.330 5.450 5.212 1.00 0.00 O ATOM 0 H SER A 130 10.583 1.857 5.550 1.00 0.00 H new ATOM 0 HA SER A 130 9.880 4.201 6.775 1.00 0.00 H new ATOM 0 HB2 SER A 130 11.710 5.408 7.178 1.00 0.00 H new ATOM 0 HB3 SER A 130 12.717 4.061 6.686 1.00 0.00 H new ATOM 0 HG SER A 130 12.263 4.880 4.417 1.00 0.00 H new ATOM 1681 N CYS A 131 8.932 4.558 4.539 1.00 0.00 N ATOM 1682 CA CYS A 131 8.341 4.822 3.239 1.00 0.00 C ATOM 1683 C CYS A 131 9.390 5.514 2.366 1.00 0.00 C ATOM 1684 O CYS A 131 10.323 6.128 2.880 1.00 0.00 O ATOM 1685 CB CYS A 131 7.060 5.651 3.357 1.00 0.00 C ATOM 1686 SG CYS A 131 5.806 5.038 2.173 1.00 0.00 S ATOM 0 H CYS A 131 8.317 4.742 5.332 1.00 0.00 H new ATOM 0 HA CYS A 131 8.045 3.882 2.774 1.00 0.00 H new ATOM 0 HB2 CYS A 131 6.671 5.592 4.374 1.00 0.00 H new ATOM 0 HB3 CYS A 131 7.277 6.701 3.159 1.00 0.00 H new ATOM 0 HG CYS A 131 4.666 5.615 2.411 1.00 0.00 H new ATOM 1692 N LYS A 132 9.201 5.391 1.060 1.00 0.00 N ATOM 1693 CA LYS A 132 10.119 5.997 0.111 1.00 0.00 C ATOM 1694 C LYS A 132 9.351 6.971 -0.785 1.00 0.00 C ATOM 1695 O LYS A 132 8.121 6.976 -0.791 1.00 0.00 O ATOM 1696 CB LYS A 132 10.879 4.918 -0.663 1.00 0.00 C ATOM 1697 CG LYS A 132 12.378 4.982 -0.366 1.00 0.00 C ATOM 1698 CD LYS A 132 12.637 5.019 1.142 1.00 0.00 C ATOM 1699 CE LYS A 132 13.995 4.402 1.480 1.00 0.00 C ATOM 1700 NZ LYS A 132 14.832 5.367 2.228 1.00 0.00 N ATOM 0 H LYS A 132 8.426 4.881 0.637 1.00 0.00 H new ATOM 0 HA LYS A 132 10.879 6.577 0.634 1.00 0.00 H new ATOM 0 HB2 LYS A 132 10.494 3.934 -0.395 1.00 0.00 H new ATOM 0 HB3 LYS A 132 10.711 5.046 -1.732 1.00 0.00 H new ATOM 0 HG2 LYS A 132 12.876 4.117 -0.803 1.00 0.00 H new ATOM 0 HG3 LYS A 132 12.808 5.868 -0.834 1.00 0.00 H new ATOM 0 HD2 LYS A 132 12.604 6.050 1.495 1.00 0.00 H new ATOM 0 HD3 LYS A 132 11.848 4.478 1.664 1.00 0.00 H new ATOM 0 HE2 LYS A 132 13.853 3.499 2.073 1.00 0.00 H new ATOM 0 HE3 LYS A 132 14.504 4.104 0.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 15.750 4.932 2.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 14.983 6.218 1.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 14.352 5.631 3.112 1.00 0.00 H new ATOM 1714 N ARG A 133 10.109 7.772 -1.519 1.00 0.00 N ATOM 1715 CA ARG A 133 9.514 8.749 -2.417 1.00 0.00 C ATOM 1716 C ARG A 133 9.436 8.185 -3.837 1.00 0.00 C ATOM 1717 O ARG A 133 10.073 7.179 -4.146 1.00 0.00 O ATOM 1718 CB ARG A 133 10.326 10.046 -2.435 1.00 0.00 C ATOM 1719 CG ARG A 133 11.805 9.764 -2.705 1.00 0.00 C ATOM 1720 CD ARG A 133 12.561 11.056 -3.021 1.00 0.00 C ATOM 1721 NE ARG A 133 13.938 10.742 -3.461 1.00 0.00 N ATOM 1722 CZ ARG A 133 14.707 11.576 -4.175 1.00 0.00 C ATOM 1723 NH1 ARG A 133 14.238 12.778 -4.534 1.00 0.00 N ATOM 1724 NH2 ARG A 133 15.946 11.206 -4.529 1.00 0.00 N ATOM 0 H ARG A 133 11.129 7.765 -1.511 1.00 0.00 H new ATOM 0 HA ARG A 133 8.510 8.967 -2.053 1.00 0.00 H new ATOM 0 HB2 ARG A 133 9.934 10.714 -3.202 1.00 0.00 H new ATOM 0 HB3 ARG A 133 10.219 10.560 -1.480 1.00 0.00 H new ATOM 0 HG2 ARG A 133 12.251 9.281 -1.836 1.00 0.00 H new ATOM 0 HG3 ARG A 133 11.900 9.069 -3.540 1.00 0.00 H new ATOM 0 HD2 ARG A 133 12.039 11.611 -3.800 1.00 0.00 H new ATOM 0 HD3 ARG A 133 12.589 11.696 -2.139 1.00 0.00 H new ATOM 0 HE ARG A 133 14.327 9.834 -3.205 1.00 0.00 H new ATOM 0 HH11 ARG A 133 13.295 13.059 -4.264 1.00 0.00 H new ATOM 0 HH12 ARG A 133 14.823 13.412 -5.077 1.00 0.00 H new ATOM 0 HH21 ARG A 133 16.303 10.291 -4.255 1.00 0.00 H new ATOM 0 HH22 ARG A 133 16.532 11.840 -5.072 1.00 0.00 H new ATOM 1738 N GLY A 134 8.649 8.858 -4.664 1.00 0.00 N ATOM 1739 CA GLY A 134 8.478 8.437 -6.044 1.00 0.00 C ATOM 1740 C GLY A 134 9.777 7.852 -6.603 1.00 0.00 C ATOM 1741 O GLY A 134 9.800 6.714 -7.067 1.00 0.00 O ATOM 0 H GLY A 134 8.123 9.692 -4.404 1.00 0.00 H new ATOM 0 HA2 GLY A 134 7.684 7.693 -6.105 1.00 0.00 H new ATOM 0 HA3 GLY A 134 8.166 9.287 -6.651 1.00 0.00 H new ATOM 1745 N PRO A 135 10.855 8.679 -6.538 1.00 0.00 N ATOM 1746 CA PRO A 135 12.154 8.256 -7.032 1.00 0.00 C ATOM 1747 C PRO A 135 12.811 7.267 -6.068 1.00 0.00 C ATOM 1748 O PRO A 135 13.931 7.491 -5.611 1.00 0.00 O ATOM 1749 CB PRO A 135 12.949 9.541 -7.199 1.00 0.00 C ATOM 1750 CG PRO A 135 12.234 10.586 -6.358 1.00 0.00 C ATOM 1751 CD PRO A 135 10.865 10.034 -5.995 1.00 0.00 C ATOM 0 HA PRO A 135 12.090 7.718 -7.978 1.00 0.00 H new ATOM 0 HB2 PRO A 135 13.978 9.409 -6.866 1.00 0.00 H new ATOM 0 HB3 PRO A 135 12.989 9.842 -8.246 1.00 0.00 H new ATOM 0 HG2 PRO A 135 12.807 10.809 -5.458 1.00 0.00 H new ATOM 0 HG3 PRO A 135 12.135 11.519 -6.912 1.00 0.00 H new ATOM 0 HD2 PRO A 135 10.714 10.029 -4.916 1.00 0.00 H new ATOM 0 HD3 PRO A 135 10.067 10.639 -6.426 1.00 0.00 H new ATOM 1759 N ARG A 136 12.087 6.194 -5.787 1.00 0.00 N ATOM 1760 CA ARG A 136 12.586 5.169 -4.885 1.00 0.00 C ATOM 1761 C ARG A 136 11.528 4.085 -4.676 1.00 0.00 C ATOM 1762 O ARG A 136 11.385 3.555 -3.575 1.00 0.00 O ATOM 1763 CB ARG A 136 12.969 5.767 -3.530 1.00 0.00 C ATOM 1764 CG ARG A 136 14.463 6.090 -3.474 1.00 0.00 C ATOM 1765 CD ARG A 136 15.168 5.243 -2.413 1.00 0.00 C ATOM 1766 NE ARG A 136 16.538 5.754 -2.184 1.00 0.00 N ATOM 1767 CZ ARG A 136 17.544 5.017 -1.695 1.00 0.00 C ATOM 1768 NH1 ARG A 136 17.339 3.730 -1.380 1.00 0.00 N ATOM 1769 NH2 ARG A 136 18.754 5.565 -1.521 1.00 0.00 N ATOM 0 H ARG A 136 11.159 6.012 -6.168 1.00 0.00 H new ATOM 0 HA ARG A 136 13.474 4.731 -5.340 1.00 0.00 H new ATOM 0 HB2 ARG A 136 12.391 6.674 -3.353 1.00 0.00 H new ATOM 0 HB3 ARG A 136 12.715 5.066 -2.735 1.00 0.00 H new ATOM 0 HG2 ARG A 136 14.915 5.908 -4.449 1.00 0.00 H new ATOM 0 HG3 ARG A 136 14.602 7.148 -3.251 1.00 0.00 H new ATOM 0 HD2 ARG A 136 14.602 5.267 -1.482 1.00 0.00 H new ATOM 0 HD3 ARG A 136 15.208 4.202 -2.735 1.00 0.00 H new ATOM 0 HE ARG A 136 16.728 6.730 -2.413 1.00 0.00 H new ATOM 0 HH11 ARG A 136 16.418 3.313 -1.513 1.00 0.00 H new ATOM 0 HH12 ARG A 136 18.104 3.168 -1.008 1.00 0.00 H new ATOM 0 HH21 ARG A 136 18.910 6.544 -1.761 1.00 0.00 H new ATOM 0 HH22 ARG A 136 19.520 5.003 -1.149 1.00 0.00 H new ATOM 1783 N THR A 137 10.812 3.786 -5.750 1.00 0.00 N ATOM 1784 CA THR A 137 9.771 2.774 -5.698 1.00 0.00 C ATOM 1785 C THR A 137 9.777 1.936 -6.978 1.00 0.00 C ATOM 1786 O THR A 137 9.128 2.292 -7.960 1.00 0.00 O ATOM 1787 CB THR A 137 8.438 3.480 -5.440 1.00 0.00 C ATOM 1788 OG1 THR A 137 8.764 4.866 -5.493 1.00 0.00 O ATOM 1789 CG2 THR A 137 7.932 3.270 -4.012 1.00 0.00 C ATOM 0 H THR A 137 10.933 4.227 -6.662 1.00 0.00 H new ATOM 0 HA THR A 137 9.945 2.069 -4.885 1.00 0.00 H new ATOM 0 HB THR A 137 7.692 3.117 -6.146 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.025 5.106 -6.407 1.00 0.00 H new ATOM 0 HG21 THR A 137 6.984 3.791 -3.882 1.00 0.00 H new ATOM 0 HG22 THR A 137 7.789 2.205 -3.830 1.00 0.00 H new ATOM 0 HG23 THR A 137 8.663 3.664 -3.305 1.00 0.00 H new ATOM 1797 N HIS A 138 10.518 0.839 -6.926 1.00 0.00 N ATOM 1798 CA HIS A 138 10.617 -0.052 -8.069 1.00 0.00 C ATOM 1799 C HIS A 138 10.818 -1.489 -7.584 1.00 0.00 C ATOM 1800 O HIS A 138 11.017 -1.724 -6.393 1.00 0.00 O ATOM 1801 CB HIS A 138 11.718 0.411 -9.025 1.00 0.00 C ATOM 1802 CG HIS A 138 11.719 1.898 -9.287 1.00 0.00 C ATOM 1803 ND1 HIS A 138 12.091 2.827 -8.332 1.00 0.00 N ATOM 1804 CD2 HIS A 138 11.389 2.606 -10.406 1.00 0.00 C ATOM 1805 CE1 HIS A 138 11.986 4.037 -8.862 1.00 0.00 C ATOM 1806 NE2 HIS A 138 11.551 3.898 -10.147 1.00 0.00 N ATOM 0 H HIS A 138 11.056 0.547 -6.110 1.00 0.00 H new ATOM 0 HA HIS A 138 9.688 -0.024 -8.638 1.00 0.00 H new ATOM 0 HB2 HIS A 138 12.686 0.124 -8.614 1.00 0.00 H new ATOM 0 HB3 HIS A 138 11.606 -0.115 -9.973 1.00 0.00 H new ATOM 0 HD2 HIS A 138 11.053 2.187 -11.343 1.00 0.00 H new ATOM 0 HE1 HIS A 138 12.206 4.970 -8.364 1.00 0.00 H new ATOM 0 HE2 HIS A 138 11.378 4.661 -10.801 1.00 0.00 H new ATOM 1814 N TYR A 139 10.761 -2.414 -8.531 1.00 0.00 N ATOM 1815 CA TYR A 139 10.935 -3.821 -8.215 1.00 0.00 C ATOM 1816 C TYR A 139 12.251 -4.058 -7.472 1.00 0.00 C ATOM 1817 O TYR A 139 12.864 -3.115 -6.973 1.00 0.00 O ATOM 1818 CB TYR A 139 10.983 -4.552 -9.558 1.00 0.00 C ATOM 1819 CG TYR A 139 9.932 -5.654 -9.705 1.00 0.00 C ATOM 1820 CD1 TYR A 139 8.666 -5.473 -9.188 1.00 0.00 C ATOM 1821 CD2 TYR A 139 10.251 -6.829 -10.355 1.00 0.00 C ATOM 1822 CE1 TYR A 139 7.676 -6.511 -9.326 1.00 0.00 C ATOM 1823 CE2 TYR A 139 9.262 -7.867 -10.494 1.00 0.00 C ATOM 1824 CZ TYR A 139 8.023 -7.656 -9.972 1.00 0.00 C ATOM 1825 OH TYR A 139 7.089 -8.636 -10.103 1.00 0.00 O ATOM 0 H TYR A 139 10.597 -2.216 -9.518 1.00 0.00 H new ATOM 0 HA TYR A 139 10.126 -4.173 -7.576 1.00 0.00 H new ATOM 0 HB2 TYR A 139 10.848 -3.826 -10.360 1.00 0.00 H new ATOM 0 HB3 TYR A 139 11.973 -4.989 -9.687 1.00 0.00 H new ATOM 0 HD1 TYR A 139 8.417 -4.553 -8.680 1.00 0.00 H new ATOM 0 HD2 TYR A 139 11.242 -6.970 -10.760 1.00 0.00 H new ATOM 0 HE1 TYR A 139 6.681 -6.382 -8.926 1.00 0.00 H new ATOM 0 HE2 TYR A 139 9.498 -8.791 -11.001 1.00 0.00 H new ATOM 0 HH TYR A 139 7.477 -9.395 -10.586 1.00 0.00 H new ATOM 1835 N GLY A 140 12.646 -5.321 -7.420 1.00 0.00 N ATOM 1836 CA GLY A 140 13.878 -5.694 -6.746 1.00 0.00 C ATOM 1837 C GLY A 140 13.782 -5.428 -5.242 1.00 0.00 C ATOM 1838 O GLY A 140 14.759 -5.599 -4.515 1.00 0.00 O ATOM 0 H GLY A 140 12.134 -6.100 -7.834 1.00 0.00 H new ATOM 0 HA2 GLY A 140 14.087 -6.750 -6.920 1.00 0.00 H new ATOM 0 HA3 GLY A 140 14.711 -5.131 -7.166 1.00 0.00 H new ATOM 1842 N GLN A 141 12.595 -5.014 -4.822 1.00 0.00 N ATOM 1843 CA GLN A 141 12.359 -4.723 -3.418 1.00 0.00 C ATOM 1844 C GLN A 141 11.078 -5.411 -2.941 1.00 0.00 C ATOM 1845 O GLN A 141 9.977 -4.997 -3.301 1.00 0.00 O ATOM 1846 CB GLN A 141 12.294 -3.214 -3.174 1.00 0.00 C ATOM 1847 CG GLN A 141 13.681 -2.579 -3.294 1.00 0.00 C ATOM 1848 CD GLN A 141 13.636 -1.323 -4.167 1.00 0.00 C ATOM 1849 OE1 GLN A 141 14.219 -1.467 -5.353 1.00 0.00 O flip ATOM 1850 NE2 GLN A 141 13.106 -0.291 -3.788 1.00 0.00 N flip ATOM 0 H GLN A 141 11.787 -4.873 -5.429 1.00 0.00 H new ATOM 0 HA GLN A 141 13.196 -5.116 -2.840 1.00 0.00 H new ATOM 0 HB2 GLN A 141 11.616 -2.755 -3.893 1.00 0.00 H new ATOM 0 HB3 GLN A 141 11.886 -3.020 -2.182 1.00 0.00 H new ATOM 0 HG2 GLN A 141 14.055 -2.324 -2.302 1.00 0.00 H new ATOM 0 HG3 GLN A 141 14.379 -3.299 -3.722 1.00 0.00 H new ATOM 0 HE21 GLN A 141 12.676 -0.248 -2.864 1.00 0.00 H new ATOM 0 HE22 GLN A 141 13.093 0.528 -4.395 1.00 0.00 H new ATOM 1859 N LYS A 142 11.265 -6.449 -2.139 1.00 0.00 N ATOM 1860 CA LYS A 142 10.139 -7.198 -1.610 1.00 0.00 C ATOM 1861 C LYS A 142 9.146 -6.229 -0.965 1.00 0.00 C ATOM 1862 O LYS A 142 8.011 -6.602 -0.669 1.00 0.00 O ATOM 1863 CB LYS A 142 10.624 -8.300 -0.666 1.00 0.00 C ATOM 1864 CG LYS A 142 11.865 -8.996 -1.229 1.00 0.00 C ATOM 1865 CD LYS A 142 11.857 -10.488 -0.892 1.00 0.00 C ATOM 1866 CE LYS A 142 13.279 -11.008 -0.668 1.00 0.00 C ATOM 1867 NZ LYS A 142 13.302 -11.997 0.433 1.00 0.00 N ATOM 0 H LYS A 142 12.180 -6.789 -1.843 1.00 0.00 H new ATOM 0 HA LYS A 142 9.610 -7.709 -2.414 1.00 0.00 H new ATOM 0 HB2 LYS A 142 10.853 -7.873 0.310 1.00 0.00 H new ATOM 0 HB3 LYS A 142 9.829 -9.031 -0.515 1.00 0.00 H new ATOM 0 HG2 LYS A 142 11.901 -8.864 -2.310 1.00 0.00 H new ATOM 0 HG3 LYS A 142 12.763 -8.532 -0.821 1.00 0.00 H new ATOM 0 HD2 LYS A 142 11.258 -10.659 0.003 1.00 0.00 H new ATOM 0 HD3 LYS A 142 11.386 -11.045 -1.702 1.00 0.00 H new ATOM 0 HE2 LYS A 142 13.654 -11.466 -1.584 1.00 0.00 H new ATOM 0 HE3 LYS A 142 13.944 -10.177 -0.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 14.274 -12.340 0.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 12.964 -11.549 1.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 12.684 -12.798 0.193 1.00 0.00 H new ATOM 1881 N ALA A 143 9.608 -5.004 -0.765 1.00 0.00 N ATOM 1882 CA ALA A 143 8.775 -3.979 -0.160 1.00 0.00 C ATOM 1883 C ALA A 143 7.415 -3.953 -0.861 1.00 0.00 C ATOM 1884 O ALA A 143 6.395 -3.669 -0.235 1.00 0.00 O ATOM 1885 CB ALA A 143 9.493 -2.629 -0.231 1.00 0.00 C ATOM 0 H ALA A 143 10.549 -4.698 -1.011 1.00 0.00 H new ATOM 0 HA ALA A 143 8.599 -4.200 0.893 1.00 0.00 H new ATOM 0 HB1 ALA A 143 8.868 -1.860 0.223 1.00 0.00 H new ATOM 0 HB2 ALA A 143 10.439 -2.691 0.306 1.00 0.00 H new ATOM 0 HB3 ALA A 143 9.684 -2.373 -1.273 1.00 0.00 H new ATOM 1891 N ILE A 144 7.445 -4.254 -2.151 1.00 0.00 N ATOM 1892 CA ILE A 144 6.227 -4.270 -2.943 1.00 0.00 C ATOM 1893 C ILE A 144 5.474 -5.577 -2.689 1.00 0.00 C ATOM 1894 O ILE A 144 4.249 -5.621 -2.786 1.00 0.00 O ATOM 1895 CB ILE A 144 6.545 -4.021 -4.419 1.00 0.00 C ATOM 1896 CG1 ILE A 144 7.274 -5.219 -5.032 1.00 0.00 C ATOM 1897 CG2 ILE A 144 7.329 -2.720 -4.599 1.00 0.00 C ATOM 1898 CD1 ILE A 144 7.954 -4.832 -6.347 1.00 0.00 C ATOM 0 H ILE A 144 8.293 -4.489 -2.667 1.00 0.00 H new ATOM 0 HA ILE A 144 5.566 -3.458 -2.641 1.00 0.00 H new ATOM 0 HB ILE A 144 5.604 -3.907 -4.957 1.00 0.00 H new ATOM 0 HG12 ILE A 144 8.019 -5.594 -4.330 1.00 0.00 H new ATOM 0 HG13 ILE A 144 6.566 -6.029 -5.209 1.00 0.00 H new ATOM 0 HG21 ILE A 144 7.542 -2.567 -5.657 1.00 0.00 H new ATOM 0 HG22 ILE A 144 6.739 -1.884 -4.223 1.00 0.00 H new ATOM 0 HG23 ILE A 144 8.266 -2.780 -4.045 1.00 0.00 H new ATOM 0 HD11 ILE A 144 8.465 -5.701 -6.762 1.00 0.00 H new ATOM 0 HD12 ILE A 144 7.204 -4.480 -7.055 1.00 0.00 H new ATOM 0 HD13 ILE A 144 8.679 -4.039 -6.162 1.00 0.00 H new ATOM 1910 N LEU A 145 6.239 -6.610 -2.367 1.00 0.00 N ATOM 1911 CA LEU A 145 5.660 -7.915 -2.098 1.00 0.00 C ATOM 1912 C LEU A 145 4.790 -7.833 -0.841 1.00 0.00 C ATOM 1913 O LEU A 145 5.278 -8.035 0.270 1.00 0.00 O ATOM 1914 CB LEU A 145 6.754 -8.982 -2.020 1.00 0.00 C ATOM 1915 CG LEU A 145 7.661 -9.103 -3.246 1.00 0.00 C ATOM 1916 CD1 LEU A 145 8.879 -9.978 -2.943 1.00 0.00 C ATOM 1917 CD2 LEU A 145 6.878 -9.610 -4.459 1.00 0.00 C ATOM 0 H LEU A 145 7.255 -6.569 -2.286 1.00 0.00 H new ATOM 0 HA LEU A 145 5.009 -8.219 -2.918 1.00 0.00 H new ATOM 0 HB2 LEU A 145 7.377 -8.772 -1.151 1.00 0.00 H new ATOM 0 HB3 LEU A 145 6.280 -9.948 -1.847 1.00 0.00 H new ATOM 0 HG LEU A 145 8.033 -8.109 -3.495 1.00 0.00 H new ATOM 0 HD11 LEU A 145 9.507 -10.047 -3.831 1.00 0.00 H new ATOM 0 HD12 LEU A 145 9.451 -9.535 -2.128 1.00 0.00 H new ATOM 0 HD13 LEU A 145 8.548 -10.975 -2.654 1.00 0.00 H new ATOM 0 HD21 LEU A 145 7.546 -9.687 -5.317 1.00 0.00 H new ATOM 0 HD22 LEU A 145 6.458 -10.591 -4.237 1.00 0.00 H new ATOM 0 HD23 LEU A 145 6.071 -8.914 -4.688 1.00 0.00 H new ATOM 1929 N PHE A 146 3.518 -7.535 -1.059 1.00 0.00 N ATOM 1930 CA PHE A 146 2.576 -7.424 0.042 1.00 0.00 C ATOM 1931 C PHE A 146 1.654 -8.643 0.101 1.00 0.00 C ATOM 1932 O PHE A 146 0.887 -8.891 -0.828 1.00 0.00 O ATOM 1933 CB PHE A 146 1.733 -6.173 -0.215 1.00 0.00 C ATOM 1934 CG PHE A 146 2.488 -4.859 -0.005 1.00 0.00 C ATOM 1935 CD1 PHE A 146 3.484 -4.787 0.918 1.00 0.00 C ATOM 1936 CD2 PHE A 146 2.164 -3.763 -0.742 1.00 0.00 C ATOM 1937 CE1 PHE A 146 4.185 -3.568 1.113 1.00 0.00 C ATOM 1938 CE2 PHE A 146 2.865 -2.544 -0.548 1.00 0.00 C ATOM 1939 CZ PHE A 146 3.861 -2.472 0.376 1.00 0.00 C ATOM 0 H PHE A 146 3.117 -7.367 -1.982 1.00 0.00 H new ATOM 0 HA PHE A 146 3.115 -7.364 0.988 1.00 0.00 H new ATOM 0 HB2 PHE A 146 1.357 -6.205 -1.238 1.00 0.00 H new ATOM 0 HB3 PHE A 146 0.865 -6.191 0.444 1.00 0.00 H new ATOM 0 HD1 PHE A 146 3.742 -5.657 1.503 1.00 0.00 H new ATOM 0 HD2 PHE A 146 1.373 -3.820 -1.475 1.00 0.00 H new ATOM 0 HE1 PHE A 146 4.976 -3.511 1.847 1.00 0.00 H new ATOM 0 HE2 PHE A 146 2.608 -1.674 -1.134 1.00 0.00 H new ATOM 0 HZ PHE A 146 4.394 -1.545 0.524 1.00 0.00 H new ATOM 1949 N LEU A 147 1.760 -9.373 1.201 1.00 0.00 N ATOM 1950 CA LEU A 147 0.945 -10.560 1.393 1.00 0.00 C ATOM 1951 C LEU A 147 -0.189 -10.243 2.371 1.00 0.00 C ATOM 1952 O LEU A 147 0.050 -10.054 3.563 1.00 0.00 O ATOM 1953 CB LEU A 147 1.815 -11.743 1.823 1.00 0.00 C ATOM 1954 CG LEU A 147 1.446 -13.100 1.221 1.00 0.00 C ATOM 1955 CD1 LEU A 147 1.688 -14.230 2.224 1.00 0.00 C ATOM 1956 CD2 LEU A 147 0.008 -13.096 0.699 1.00 0.00 C ATOM 0 H LEU A 147 2.398 -9.165 1.969 1.00 0.00 H new ATOM 0 HA LEU A 147 0.481 -10.860 0.453 1.00 0.00 H new ATOM 0 HB2 LEU A 147 2.850 -11.521 1.562 1.00 0.00 H new ATOM 0 HB3 LEU A 147 1.771 -11.825 2.909 1.00 0.00 H new ATOM 0 HG LEU A 147 2.098 -13.282 0.367 1.00 0.00 H new ATOM 0 HD11 LEU A 147 1.417 -15.183 1.770 1.00 0.00 H new ATOM 0 HD12 LEU A 147 2.741 -14.248 2.505 1.00 0.00 H new ATOM 0 HD13 LEU A 147 1.078 -14.065 3.112 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -0.228 -14.073 0.276 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -0.676 -12.880 1.520 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -0.097 -12.332 -0.071 1.00 0.00 H new ATOM 1968 N PRO A 148 -1.429 -10.193 1.816 1.00 0.00 N ATOM 1969 CA PRO A 148 -2.600 -9.902 2.626 1.00 0.00 C ATOM 1970 C PRO A 148 -2.992 -11.112 3.477 1.00 0.00 C ATOM 1971 O PRO A 148 -3.113 -12.223 2.965 1.00 0.00 O ATOM 1972 CB PRO A 148 -3.677 -9.503 1.630 1.00 0.00 C ATOM 1973 CG PRO A 148 -3.215 -10.030 0.282 1.00 0.00 C ATOM 1974 CD PRO A 148 -1.749 -10.412 0.408 1.00 0.00 C ATOM 0 HA PRO A 148 -2.426 -9.103 3.346 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -4.641 -9.929 1.906 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -3.803 -8.421 1.604 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -3.810 -10.894 -0.015 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -3.347 -9.272 -0.490 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -1.584 -11.451 0.121 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -1.123 -9.799 -0.240 1.00 0.00 H new ATOM 1982 N LEU A 149 -3.179 -10.854 4.764 1.00 0.00 N ATOM 1983 CA LEU A 149 -3.554 -11.907 5.691 1.00 0.00 C ATOM 1984 C LEU A 149 -4.710 -11.420 6.568 1.00 0.00 C ATOM 1985 O LEU A 149 -4.563 -11.298 7.783 1.00 0.00 O ATOM 1986 CB LEU A 149 -2.336 -12.380 6.487 1.00 0.00 C ATOM 1987 CG LEU A 149 -1.573 -11.297 7.253 1.00 0.00 C ATOM 1988 CD1 LEU A 149 -1.870 -11.374 8.752 1.00 0.00 C ATOM 1989 CD2 LEU A 149 -0.073 -11.372 6.961 1.00 0.00 C ATOM 0 H LEU A 149 -3.078 -9.931 5.186 1.00 0.00 H new ATOM 0 HA LEU A 149 -3.911 -12.783 5.148 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -2.664 -13.138 7.199 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -1.644 -12.867 5.799 1.00 0.00 H new ATOM 0 HG LEU A 149 -1.920 -10.324 6.905 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -1.315 -10.594 9.273 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -2.938 -11.234 8.919 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -1.568 -12.350 9.133 1.00 0.00 H new ATOM 0 HD21 LEU A 149 0.446 -10.592 7.518 1.00 0.00 H new ATOM 0 HD22 LEU A 149 0.308 -12.347 7.263 1.00 0.00 H new ATOM 0 HD23 LEU A 149 0.097 -11.230 5.894 1.00 0.00 H new ATOM 2001 N PRO A 150 -5.863 -11.149 5.900 1.00 0.00 N ATOM 2002 CA PRO A 150 -7.043 -10.679 6.606 1.00 0.00 C ATOM 2003 C PRO A 150 -7.715 -11.819 7.372 1.00 0.00 C ATOM 2004 O PRO A 150 -7.145 -12.901 7.508 1.00 0.00 O ATOM 2005 CB PRO A 150 -7.934 -10.082 5.528 1.00 0.00 C ATOM 2006 CG PRO A 150 -7.434 -10.654 4.211 1.00 0.00 C ATOM 2007 CD PRO A 150 -6.073 -11.282 4.462 1.00 0.00 C ATOM 0 HA PRO A 150 -6.809 -9.936 7.368 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -8.979 -10.343 5.696 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -7.873 -8.994 5.529 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -8.133 -11.398 3.828 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -7.359 -9.869 3.458 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -6.057 -12.328 4.154 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -5.292 -10.772 3.899 1.00 0.00 H new ATOM 2015 N VAL A 151 -8.917 -11.539 7.854 1.00 0.00 N ATOM 2016 CA VAL A 151 -9.672 -12.528 8.603 1.00 0.00 C ATOM 2017 C VAL A 151 -11.026 -11.937 9.000 1.00 0.00 C ATOM 2018 O VAL A 151 -11.493 -12.140 10.120 1.00 0.00 O ATOM 2019 CB VAL A 151 -8.856 -13.010 9.804 1.00 0.00 C ATOM 2020 CG1 VAL A 151 -8.102 -14.300 9.473 1.00 0.00 C ATOM 2021 CG2 VAL A 151 -7.895 -11.922 10.286 1.00 0.00 C ATOM 0 H VAL A 151 -9.387 -10.641 7.740 1.00 0.00 H new ATOM 0 HA VAL A 151 -9.868 -13.405 7.986 1.00 0.00 H new ATOM 0 HB VAL A 151 -9.551 -13.227 10.615 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -7.530 -14.621 10.344 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -8.815 -15.078 9.200 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -7.423 -14.121 8.639 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -7.327 -12.290 11.140 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -7.209 -11.659 9.481 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -8.463 -11.040 10.581 1.00 0.00 H new ATOM 2031 N SER A 152 -11.620 -11.216 8.059 1.00 0.00 N ATOM 2032 CA SER A 152 -12.911 -10.594 8.296 1.00 0.00 C ATOM 2033 C SER A 152 -13.865 -11.598 8.945 1.00 0.00 C ATOM 2034 O SER A 152 -14.317 -12.540 8.295 1.00 0.00 O ATOM 2035 CB SER A 152 -13.510 -10.056 6.995 1.00 0.00 C ATOM 2036 OG SER A 152 -14.900 -9.769 7.126 1.00 0.00 O ATOM 0 H SER A 152 -11.230 -11.049 7.131 1.00 0.00 H new ATOM 0 HA SER A 152 -12.766 -9.752 8.973 1.00 0.00 H new ATOM 0 HB2 SER A 152 -12.979 -9.151 6.698 1.00 0.00 H new ATOM 0 HB3 SER A 152 -13.364 -10.786 6.199 1.00 0.00 H new ATOM 0 HG SER A 152 -15.245 -9.426 6.275 1.00 0.00 H new ATOM 2042 N SER A 153 -14.143 -11.364 10.219 1.00 0.00 N ATOM 2043 CA SER A 153 -15.035 -12.237 10.963 1.00 0.00 C ATOM 2044 C SER A 153 -15.889 -11.413 11.928 1.00 0.00 C ATOM 2045 O SER A 153 -15.610 -11.366 13.125 1.00 0.00 O ATOM 2046 CB SER A 153 -14.250 -13.304 11.728 1.00 0.00 C ATOM 2047 OG SER A 153 -15.090 -14.072 12.587 1.00 0.00 O ATOM 0 H SER A 153 -13.766 -10.582 10.755 1.00 0.00 H new ATOM 0 HA SER A 153 -15.688 -12.744 10.253 1.00 0.00 H new ATOM 0 HB2 SER A 153 -13.754 -13.967 11.019 1.00 0.00 H new ATOM 0 HB3 SER A 153 -13.468 -12.826 12.318 1.00 0.00 H new ATOM 0 HG SER A 153 -14.552 -14.743 13.056 1.00 0.00 H new ATOM 2053 N ASP A 154 -16.914 -10.783 11.372 1.00 0.00 N ATOM 2054 CA ASP A 154 -17.810 -9.963 12.168 1.00 0.00 C ATOM 2055 C ASP A 154 -19.247 -10.165 11.682 1.00 0.00 C ATOM 2056 O ASP A 154 -19.479 -10.851 10.688 1.00 0.00 O ATOM 2057 CB ASP A 154 -17.469 -8.478 12.029 1.00 0.00 C ATOM 2058 CG ASP A 154 -17.686 -7.643 13.292 1.00 0.00 C ATOM 2059 OD1 ASP A 154 -18.863 -7.324 13.567 1.00 0.00 O ATOM 2060 OD2 ASP A 154 -16.670 -7.342 13.955 1.00 0.00 O ATOM 0 H ASP A 154 -17.143 -10.824 10.379 1.00 0.00 H new ATOM 0 HA ASP A 154 -17.702 -10.262 13.211 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -16.426 -8.387 11.727 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -18.072 -8.056 11.225 1.00 0.00 H new TER 2065 ASP A 154 HETATM 2066 C1 NTS A 178 14.477 -10.721 -3.964 1.00 0.00 C HETATM 2067 C2 NTS A 178 15.216 -10.023 -3.009 1.00 0.00 C HETATM 2068 C3 NTS A 178 14.898 -8.701 -2.703 1.00 0.00 C HETATM 2069 C4 NTS A 178 13.837 -8.075 -3.354 1.00 0.00 C HETATM 2070 C5 NTS A 178 12.035 -8.131 -4.956 1.00 0.00 C HETATM 2071 C6 NTS A 178 11.285 -8.811 -5.914 1.00 0.00 C HETATM 2072 C7 NTS A 178 11.597 -10.133 -6.225 1.00 0.00 C HETATM 2073 C8 NTS A 178 12.656 -10.771 -5.580 1.00 0.00 C HETATM 2074 C9 NTS A 178 13.412 -10.096 -4.619 1.00 0.00 C HETATM 2075 C10 NTS A 178 13.095 -8.770 -4.311 1.00 0.00 C HETATM 2076 O11 NTS A 178 13.642 -13.543 -3.731 1.00 0.00 O HETATM 2077 O12 NTS A 178 16.489 -12.855 -3.501 1.00 0.00 O HETATM 2078 O13 NTS A 178 15.134 -12.650 -6.100 1.00 0.00 O HETATM 2079 O31 NTS A 178 15.441 -6.048 -1.535 1.00 0.00 O HETATM 2080 O32 NTS A 178 17.620 -8.003 -1.794 1.00 0.00 O HETATM 2081 O33 NTS A 178 15.478 -8.434 0.181 1.00 0.00 O HETATM 2082 O61 NTS A 178 8.514 -7.850 -5.621 1.00 0.00 O HETATM 2083 O62 NTS A 178 9.418 -8.934 -8.199 1.00 0.00 O HETATM 2084 O63 NTS A 178 10.420 -6.328 -7.261 1.00 0.00 O HETATM 2085 S1 NTS A 178 14.941 -12.446 -4.322 1.00 0.00 S HETATM 2086 S3 NTS A 178 15.864 -7.796 -1.457 1.00 0.00 S HETATM 2087 S6 NTS A 178 9.906 -7.977 -6.756 1.00 0.00 S HETATM 0 H8 NTS A 178 12.896 -11.805 -5.828 1.00 0.00 H new HETATM 0 H7 NTS A 178 11.013 -10.669 -6.973 1.00 0.00 H new HETATM 0 H5 NTS A 178 11.793 -7.097 -4.710 1.00 0.00 H new HETATM 0 H4 NTS A 178 13.586 -7.041 -3.116 1.00 0.00 H new HETATM 0 H2 NTS A 178 16.046 -10.513 -2.500 1.00 0.00 H new