USER MOD reduce.3.24.130724 H: found=0, std=0, add=1031, rem=0, adj=42 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 83 THR OG1 : rot 110:sc= -1.19 USER MOD Set 1.2: A 113 SER OG : rot -76:sc= -1.06 USER MOD Set 1.3: A 116 HIS : no HE2:sc= -7.54 K(o=-9.8,f=-15!) USER MOD Set 2.1: A 88 TYR OH : rot 180:sc= -0.192 USER MOD Set 2.2: A 90 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 72 SER OG : rot -62:sc= -1.08! USER MOD Set 3.2: A 75 THR OG1 : rot 180:sc= -0.595! USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ -148:sc= 0.191 (180deg=-0.241) USER MOD Single : A 29 TYR OH : rot -89:sc= 0.0208 USER MOD Single : A 30 CYS SG : rot -18:sc= -4.2! USER MOD Single : A 31 SER OG : rot -89:sc= -0.824! USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 HIS : no HE2:sc= -15.1! C(o=-15!,f=-16!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot -130:sc= -3.32! USER MOD Single : A 52 SER OG : rot -55:sc= 1.01 USER MOD Single : A 54 GLN : amide:sc= -2.3 X(o=-2.3,f=-2) USER MOD Single : A 55 HIS :FLIP no HD1:sc= -4.64 F(o=-6.1!,f=-4.6) USER MOD Single : A 57 GLN :FLIP amide:sc= -3.55 F(o=-5.5!,f=-3.5) USER MOD Single : A 59 GLN : amide:sc= -4.7! C(o=-4.7!,f=-10!) USER MOD Single : A 61 SER OG : rot -62:sc= 1.05 USER MOD Single : A 64 SER OG : rot 74:sc= 0.849 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ -175:sc= -1.99! (180deg=-2.08!) USER MOD Single : A 73 THR OG1 : rot 160:sc= -0.953 USER MOD Single : A 77 GLN : amide:sc= -0.0553 K(o=-0.055,f=-1.5) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 MET CE :methyl -138:sc= -1.33 (180deg=-3.5!) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 THR OG1 : rot 70:sc= 0.858 USER MOD Single : A 94 ASN :FLIP amide:sc= -0.472 F(o=-3.8!,f=-0.47) USER MOD Single : A 97 CYS SG : rot 117:sc= 0.614 USER MOD Single : A 106 ASN : amide:sc= -2.57 K(o=-2.6,f=-3.6!) USER MOD Single : A 107 HIS :FLIP no HD1:sc= -3.6! C(o=-5!,f=-3.6!) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 ASN : amide:sc= -2.61! C(o=-2.6!,f=-3.7!) USER MOD Single : A 110 THR OG1 : rot 56:sc= 0.00839 USER MOD Single : A 111 TYR OH : rot -148:sc= -5.14! USER MOD Single : A 114 LYS NZ :NH3+ -150:sc= -0.512 (180deg=-2.12!) USER MOD Single : A 115 LYS NZ :NH3+ 154:sc= -0.0344 (180deg=-0.339) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN :FLIP amide:sc= -0.087 F(o=-0.63,f=-0.087) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ -178:sc= 0.157 (180deg=0.156) USER MOD Single : A 128 ASN : amide:sc= -0.494 K(o=-0.49,f=-4.6!) USER MOD Single : A 130 SER OG : rot 26:sc= 1.1 USER MOD Single : A 131 CYS SG : rot 140:sc= -2.32! USER MOD Single : A 132 LYS NZ :NH3+ 166:sc= 0.793! (180deg=0.487!) USER MOD Single : A 137 THR OG1 : rot -75:sc= 0.267 USER MOD Single : A 138 HIS : no HD1:sc= -0.738 K(o=-0.74,f=-2.2!) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 SER OG : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot -63:sc= 0.646 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 24 -8.381 -4.442 14.934 1.00 0.00 N ATOM 2 CA LYS A 24 -7.418 -4.703 13.878 1.00 0.00 C ATOM 3 C LYS A 24 -7.777 -6.015 13.179 1.00 0.00 C ATOM 4 O LYS A 24 -7.057 -7.005 13.300 1.00 0.00 O ATOM 5 CB LYS A 24 -5.992 -4.672 14.432 1.00 0.00 C ATOM 6 CG LYS A 24 -5.829 -3.552 15.462 1.00 0.00 C ATOM 7 CD LYS A 24 -5.902 -4.103 16.888 1.00 0.00 C ATOM 8 CE LYS A 24 -4.612 -3.809 17.656 1.00 0.00 C ATOM 9 NZ LYS A 24 -4.685 -2.478 18.300 1.00 0.00 N ATOM 0 HA LYS A 24 -7.459 -3.917 13.124 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -5.756 -5.631 14.892 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.284 -4.527 13.616 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -4.873 -3.050 15.311 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -6.608 -2.804 15.317 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -6.750 -3.659 17.410 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -6.074 -5.179 16.858 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -4.449 -4.577 18.412 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -3.761 -3.845 16.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -3.802 -2.294 18.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -4.819 -1.747 17.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -5.486 -2.457 18.964 1.00 0.00 H new ATOM 23 N PRO A 25 -8.921 -5.981 12.444 1.00 0.00 N ATOM 24 CA PRO A 25 -9.385 -7.155 11.725 1.00 0.00 C ATOM 25 C PRO A 25 -8.544 -7.398 10.470 1.00 0.00 C ATOM 26 O PRO A 25 -8.312 -8.543 10.086 1.00 0.00 O ATOM 27 CB PRO A 25 -10.847 -6.876 11.417 1.00 0.00 C ATOM 28 CG PRO A 25 -11.023 -5.373 11.560 1.00 0.00 C ATOM 29 CD PRO A 25 -9.800 -4.827 12.278 1.00 0.00 C ATOM 0 HA PRO A 25 -9.283 -8.072 12.306 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -11.104 -7.205 10.410 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -11.500 -7.413 12.105 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -11.131 -4.906 10.581 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.929 -5.146 12.123 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -9.317 -4.042 11.696 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -10.068 -4.391 13.241 1.00 0.00 H new ATOM 37 N LYS A 26 -8.112 -6.301 9.865 1.00 0.00 N ATOM 38 CA LYS A 26 -7.302 -6.380 8.661 1.00 0.00 C ATOM 39 C LYS A 26 -5.915 -5.802 8.946 1.00 0.00 C ATOM 40 O LYS A 26 -5.781 -4.849 9.713 1.00 0.00 O ATOM 41 CB LYS A 26 -8.020 -5.708 7.489 1.00 0.00 C ATOM 42 CG LYS A 26 -7.023 -5.276 6.411 1.00 0.00 C ATOM 43 CD LYS A 26 -6.405 -6.491 5.717 1.00 0.00 C ATOM 44 CE LYS A 26 -4.953 -6.216 5.319 1.00 0.00 C ATOM 45 NZ LYS A 26 -4.838 -6.058 3.852 1.00 0.00 N ATOM 0 H LYS A 26 -8.308 -5.353 10.186 1.00 0.00 H new ATOM 0 HA LYS A 26 -7.159 -7.419 8.364 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -8.748 -6.397 7.061 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -8.574 -4.840 7.846 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -7.527 -4.650 5.675 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.236 -4.670 6.860 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.446 -7.354 6.382 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -6.987 -6.743 4.831 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -4.598 -5.314 5.817 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -4.317 -7.035 5.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -3.910 -6.405 3.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -5.589 -6.605 3.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -4.935 -5.053 3.602 1.00 0.00 H new ATOM 59 N LEU A 27 -4.918 -6.402 8.314 1.00 0.00 N ATOM 60 CA LEU A 27 -3.545 -5.959 8.489 1.00 0.00 C ATOM 61 C LEU A 27 -2.706 -6.428 7.299 1.00 0.00 C ATOM 62 O LEU A 27 -2.654 -7.621 7.003 1.00 0.00 O ATOM 63 CB LEU A 27 -3.003 -6.419 9.844 1.00 0.00 C ATOM 64 CG LEU A 27 -2.025 -7.596 9.810 1.00 0.00 C ATOM 65 CD1 LEU A 27 -0.723 -7.207 9.109 1.00 0.00 C ATOM 66 CD2 LEU A 27 -1.777 -8.143 11.218 1.00 0.00 C ATOM 0 H LEU A 27 -5.033 -7.192 7.679 1.00 0.00 H new ATOM 0 HA LEU A 27 -3.495 -4.870 8.504 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -2.507 -5.574 10.321 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -3.847 -6.692 10.477 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.477 -8.399 9.227 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.046 -8.061 9.099 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.938 -6.902 8.085 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.255 -6.380 9.643 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -1.079 -8.978 11.166 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.356 -7.357 11.845 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.719 -8.484 11.647 1.00 0.00 H new ATOM 78 N LEU A 28 -2.069 -5.465 6.649 1.00 0.00 N ATOM 79 CA LEU A 28 -1.235 -5.765 5.498 1.00 0.00 C ATOM 80 C LEU A 28 0.214 -5.942 5.956 1.00 0.00 C ATOM 81 O LEU A 28 0.572 -5.543 7.063 1.00 0.00 O ATOM 82 CB LEU A 28 -1.411 -4.698 4.416 1.00 0.00 C ATOM 83 CG LEU A 28 -1.521 -5.212 2.979 1.00 0.00 C ATOM 84 CD1 LEU A 28 -2.316 -4.237 2.107 1.00 0.00 C ATOM 85 CD2 LEU A 28 -0.138 -5.506 2.395 1.00 0.00 C ATOM 0 H LEU A 28 -2.114 -4.477 6.898 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.543 -6.705 5.040 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -2.308 -4.122 4.644 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -0.567 -4.010 4.471 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.071 -6.153 2.994 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -2.379 -4.626 1.091 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -3.320 -4.121 2.514 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -1.815 -3.269 2.094 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.244 -5.870 1.373 1.00 0.00 H new ATOM 0 HD22 LEU A 28 0.458 -4.594 2.395 1.00 0.00 H new ATOM 0 HD23 LEU A 28 0.359 -6.264 3.000 1.00 0.00 H new ATOM 97 N TYR A 29 1.009 -6.541 5.081 1.00 0.00 N ATOM 98 CA TYR A 29 2.411 -6.776 5.382 1.00 0.00 C ATOM 99 C TYR A 29 3.237 -6.883 4.098 1.00 0.00 C ATOM 100 O TYR A 29 2.716 -7.261 3.050 1.00 0.00 O ATOM 101 CB TYR A 29 2.465 -8.114 6.122 1.00 0.00 C ATOM 102 CG TYR A 29 3.858 -8.745 6.165 1.00 0.00 C ATOM 103 CD1 TYR A 29 4.910 -8.058 6.738 1.00 0.00 C ATOM 104 CD2 TYR A 29 4.064 -10.001 5.631 1.00 0.00 C ATOM 105 CE1 TYR A 29 6.221 -8.652 6.778 1.00 0.00 C ATOM 106 CE2 TYR A 29 5.375 -10.595 5.672 1.00 0.00 C ATOM 107 CZ TYR A 29 6.389 -9.891 6.243 1.00 0.00 C ATOM 108 OH TYR A 29 7.627 -10.452 6.282 1.00 0.00 O ATOM 0 H TYR A 29 0.709 -6.871 4.164 1.00 0.00 H new ATOM 0 HA TYR A 29 2.820 -5.955 5.972 1.00 0.00 H new ATOM 0 HB2 TYR A 29 2.112 -7.968 7.143 1.00 0.00 H new ATOM 0 HB3 TYR A 29 1.776 -8.810 5.643 1.00 0.00 H new ATOM 0 HD1 TYR A 29 4.749 -7.075 7.156 1.00 0.00 H new ATOM 0 HD2 TYR A 29 3.242 -10.538 5.182 1.00 0.00 H new ATOM 0 HE1 TYR A 29 7.052 -8.125 7.223 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.549 -11.577 5.259 1.00 0.00 H new ATOM 0 HH TYR A 29 8.131 -10.188 5.484 1.00 0.00 H new ATOM 118 N CYS A 30 4.511 -6.543 4.222 1.00 0.00 N ATOM 119 CA CYS A 30 5.414 -6.596 3.085 1.00 0.00 C ATOM 120 C CYS A 30 6.018 -8.000 3.016 1.00 0.00 C ATOM 121 O CYS A 30 6.133 -8.680 4.034 1.00 0.00 O ATOM 122 CB CYS A 30 6.493 -5.514 3.168 1.00 0.00 C ATOM 123 SG CYS A 30 5.798 -3.897 2.665 1.00 0.00 S ATOM 0 H CYS A 30 4.940 -6.230 5.093 1.00 0.00 H new ATOM 0 HA CYS A 30 4.860 -6.394 2.168 1.00 0.00 H new ATOM 0 HB2 CYS A 30 6.880 -5.452 4.185 1.00 0.00 H new ATOM 0 HB3 CYS A 30 7.332 -5.775 2.523 1.00 0.00 H new ATOM 0 HG CYS A 30 4.698 -4.086 1.999 1.00 0.00 H new ATOM 129 N SER A 31 6.388 -8.391 1.806 1.00 0.00 N ATOM 130 CA SER A 31 6.977 -9.702 1.591 1.00 0.00 C ATOM 131 C SER A 31 8.223 -9.865 2.463 1.00 0.00 C ATOM 132 O SER A 31 8.405 -9.134 3.435 1.00 0.00 O ATOM 133 CB SER A 31 7.330 -9.912 0.117 1.00 0.00 C ATOM 134 OG SER A 31 8.732 -10.073 -0.079 1.00 0.00 O ATOM 0 H SER A 31 6.292 -7.823 0.964 1.00 0.00 H new ATOM 0 HA SER A 31 6.243 -10.457 1.872 1.00 0.00 H new ATOM 0 HB2 SER A 31 6.808 -10.792 -0.259 1.00 0.00 H new ATOM 0 HB3 SER A 31 6.978 -9.060 -0.465 1.00 0.00 H new ATOM 0 HG SER A 31 9.146 -9.196 -0.219 1.00 0.00 H new ATOM 140 N ASN A 32 9.050 -10.829 2.085 1.00 0.00 N ATOM 141 CA ASN A 32 10.274 -11.097 2.820 1.00 0.00 C ATOM 142 C ASN A 32 10.859 -9.777 3.326 1.00 0.00 C ATOM 143 O ASN A 32 10.711 -8.741 2.681 1.00 0.00 O ATOM 144 CB ASN A 32 11.319 -11.766 1.926 1.00 0.00 C ATOM 145 CG ASN A 32 11.532 -13.227 2.329 1.00 0.00 C ATOM 146 OD1 ASN A 32 10.775 -14.114 1.970 1.00 0.00 O ATOM 147 ND2 ASN A 32 12.602 -13.427 3.093 1.00 0.00 N ATOM 0 H ASN A 32 8.896 -11.434 1.279 1.00 0.00 H new ATOM 0 HA ASN A 32 10.031 -11.762 3.649 1.00 0.00 H new ATOM 0 HB2 ASN A 32 10.999 -11.715 0.885 1.00 0.00 H new ATOM 0 HB3 ASN A 32 12.262 -11.225 1.996 1.00 0.00 H new ATOM 0 HD21 ASN A 32 12.830 -14.368 3.415 1.00 0.00 H new ATOM 0 HD22 ASN A 32 13.194 -12.640 3.357 1.00 0.00 H new ATOM 154 N GLY A 33 11.513 -9.859 4.476 1.00 0.00 N ATOM 155 CA GLY A 33 12.121 -8.684 5.075 1.00 0.00 C ATOM 156 C GLY A 33 11.359 -7.414 4.691 1.00 0.00 C ATOM 157 O GLY A 33 11.945 -6.468 4.168 1.00 0.00 O ATOM 0 H GLY A 33 11.635 -10.721 5.008 1.00 0.00 H new ATOM 0 HA2 GLY A 33 12.134 -8.790 6.160 1.00 0.00 H new ATOM 0 HA3 GLY A 33 13.158 -8.602 4.750 1.00 0.00 H new ATOM 161 N GLY A 34 10.062 -7.436 4.964 1.00 0.00 N ATOM 162 CA GLY A 34 9.213 -6.298 4.653 1.00 0.00 C ATOM 163 C GLY A 34 8.529 -5.764 5.913 1.00 0.00 C ATOM 164 O GLY A 34 8.438 -6.466 6.919 1.00 0.00 O ATOM 0 H GLY A 34 9.579 -8.223 5.397 1.00 0.00 H new ATOM 0 HA2 GLY A 34 9.810 -5.508 4.196 1.00 0.00 H new ATOM 0 HA3 GLY A 34 8.459 -6.591 3.922 1.00 0.00 H new ATOM 168 N HIS A 35 8.064 -4.527 5.816 1.00 0.00 N ATOM 169 CA HIS A 35 7.391 -3.891 6.936 1.00 0.00 C ATOM 170 C HIS A 35 5.879 -4.086 6.803 1.00 0.00 C ATOM 171 O HIS A 35 5.412 -4.727 5.863 1.00 0.00 O ATOM 172 CB HIS A 35 7.791 -2.418 7.045 1.00 0.00 C ATOM 173 CG HIS A 35 9.240 -2.201 7.408 1.00 0.00 C ATOM 174 ND1 HIS A 35 10.273 -2.925 6.838 1.00 0.00 N ATOM 175 CD2 HIS A 35 9.818 -1.334 8.289 1.00 0.00 C ATOM 176 CE1 HIS A 35 11.416 -2.505 7.359 1.00 0.00 C ATOM 177 NE2 HIS A 35 11.132 -1.519 8.258 1.00 0.00 N ATOM 0 H HIS A 35 8.140 -3.948 4.979 1.00 0.00 H new ATOM 0 HA HIS A 35 7.703 -4.362 7.868 1.00 0.00 H new ATOM 0 HB2 HIS A 35 7.588 -1.925 6.094 1.00 0.00 H new ATOM 0 HB3 HIS A 35 7.163 -1.936 7.794 1.00 0.00 H new ATOM 0 HD1 HIS A 35 10.171 -3.658 6.136 1.00 0.00 H new ATOM 0 HD2 HIS A 35 9.295 -0.619 8.907 1.00 0.00 H new ATOM 0 HE1 HIS A 35 12.400 -2.878 7.115 1.00 0.00 H new ATOM 185 N PHE A 36 5.156 -3.522 7.759 1.00 0.00 N ATOM 186 CA PHE A 36 3.706 -3.626 7.761 1.00 0.00 C ATOM 187 C PHE A 36 3.058 -2.253 7.575 1.00 0.00 C ATOM 188 O PHE A 36 2.919 -1.493 8.532 1.00 0.00 O ATOM 189 CB PHE A 36 3.300 -4.188 9.125 1.00 0.00 C ATOM 190 CG PHE A 36 3.551 -5.690 9.279 1.00 0.00 C ATOM 191 CD1 PHE A 36 4.819 -6.155 9.431 1.00 0.00 C ATOM 192 CD2 PHE A 36 2.505 -6.559 9.263 1.00 0.00 C ATOM 193 CE1 PHE A 36 5.052 -7.549 9.574 1.00 0.00 C ATOM 194 CE2 PHE A 36 2.738 -7.952 9.407 1.00 0.00 C ATOM 195 CZ PHE A 36 4.006 -8.418 9.559 1.00 0.00 C ATOM 0 H PHE A 36 5.547 -2.991 8.538 1.00 0.00 H new ATOM 0 HA PHE A 36 3.378 -4.267 6.943 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.848 -3.657 9.903 1.00 0.00 H new ATOM 0 HB3 PHE A 36 2.241 -3.988 9.288 1.00 0.00 H new ATOM 0 HD1 PHE A 36 5.649 -5.465 9.443 1.00 0.00 H new ATOM 0 HD2 PHE A 36 1.498 -6.190 9.141 1.00 0.00 H new ATOM 0 HE1 PHE A 36 6.060 -7.919 9.695 1.00 0.00 H new ATOM 0 HE2 PHE A 36 1.907 -8.642 9.396 1.00 0.00 H new ATOM 0 HZ PHE A 36 4.183 -9.478 9.668 1.00 0.00 H new ATOM 205 N LEU A 37 2.678 -1.977 6.336 1.00 0.00 N ATOM 206 CA LEU A 37 2.047 -0.708 6.012 1.00 0.00 C ATOM 207 C LEU A 37 1.100 -0.311 7.145 1.00 0.00 C ATOM 208 O LEU A 37 0.576 -1.170 7.852 1.00 0.00 O ATOM 209 CB LEU A 37 1.371 -0.781 4.642 1.00 0.00 C ATOM 210 CG LEU A 37 1.923 0.161 3.570 1.00 0.00 C ATOM 211 CD1 LEU A 37 1.461 -0.265 2.175 1.00 0.00 C ATOM 212 CD2 LEU A 37 1.555 1.614 3.876 1.00 0.00 C ATOM 0 H LEU A 37 2.795 -2.610 5.545 1.00 0.00 H new ATOM 0 HA LEU A 37 2.795 0.080 5.931 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.450 -1.804 4.274 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.309 -0.570 4.771 1.00 0.00 H new ATOM 0 HG LEU A 37 3.011 0.094 3.583 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.867 0.421 1.432 1.00 0.00 H new ATOM 0 HD12 LEU A 37 1.814 -1.275 1.968 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.372 -0.245 2.130 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.959 2.263 3.099 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.470 1.716 3.906 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.973 1.900 4.841 1.00 0.00 H new ATOM 224 N ARG A 38 0.909 0.993 7.284 1.00 0.00 N ATOM 225 CA ARG A 38 0.034 1.516 8.320 1.00 0.00 C ATOM 226 C ARG A 38 -0.767 2.705 7.787 1.00 0.00 C ATOM 227 O ARG A 38 -0.292 3.442 6.925 1.00 0.00 O ATOM 228 CB ARG A 38 0.835 1.957 9.546 1.00 0.00 C ATOM 229 CG ARG A 38 2.195 2.526 9.138 1.00 0.00 C ATOM 230 CD ARG A 38 3.333 1.618 9.608 1.00 0.00 C ATOM 231 NE ARG A 38 3.494 1.726 11.075 1.00 0.00 N ATOM 232 CZ ARG A 38 3.930 2.825 11.704 1.00 0.00 C ATOM 233 NH1 ARG A 38 4.253 3.918 10.999 1.00 0.00 N ATOM 234 NH2 ARG A 38 4.044 2.832 13.040 1.00 0.00 N ATOM 0 H ARG A 38 1.345 1.703 6.696 1.00 0.00 H new ATOM 0 HA ARG A 38 -0.647 0.717 8.614 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.274 2.709 10.100 1.00 0.00 H new ATOM 0 HB3 ARG A 38 0.978 1.109 10.216 1.00 0.00 H new ATOM 0 HG2 ARG A 38 2.237 2.636 8.054 1.00 0.00 H new ATOM 0 HG3 ARG A 38 2.319 3.521 9.564 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.122 0.585 9.332 1.00 0.00 H new ATOM 0 HD3 ARG A 38 4.262 1.898 9.110 1.00 0.00 H new ATOM 0 HE ARG A 38 3.258 0.912 11.643 1.00 0.00 H new ATOM 0 HH11 ARG A 38 4.167 3.913 9.983 1.00 0.00 H new ATOM 0 HH12 ARG A 38 4.585 4.755 11.479 1.00 0.00 H new ATOM 0 HH21 ARG A 38 3.799 2.000 13.577 1.00 0.00 H new ATOM 0 HH22 ARG A 38 4.376 3.669 13.519 1.00 0.00 H new ATOM 248 N ILE A 39 -1.970 2.855 8.324 1.00 0.00 N ATOM 249 CA ILE A 39 -2.842 3.943 7.913 1.00 0.00 C ATOM 250 C ILE A 39 -3.232 4.769 9.141 1.00 0.00 C ATOM 251 O ILE A 39 -3.946 4.284 10.018 1.00 0.00 O ATOM 252 CB ILE A 39 -4.039 3.402 7.129 1.00 0.00 C ATOM 253 CG1 ILE A 39 -4.218 4.158 5.811 1.00 0.00 C ATOM 254 CG2 ILE A 39 -5.309 3.428 7.982 1.00 0.00 C ATOM 255 CD1 ILE A 39 -2.936 4.115 4.977 1.00 0.00 C ATOM 0 H ILE A 39 -2.361 2.242 9.039 1.00 0.00 H new ATOM 0 HA ILE A 39 -2.320 4.614 7.230 1.00 0.00 H new ATOM 0 HB ILE A 39 -3.841 2.360 6.878 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -5.040 3.720 5.245 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -4.489 5.194 6.015 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -6.145 3.038 7.401 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -5.164 2.811 8.869 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -5.523 4.453 8.284 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.090 4.659 4.045 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -2.122 4.576 5.537 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.682 3.079 4.754 1.00 0.00 H new ATOM 267 N LEU A 40 -2.747 6.001 9.163 1.00 0.00 N ATOM 268 CA LEU A 40 -3.036 6.899 10.269 1.00 0.00 C ATOM 269 C LEU A 40 -4.297 7.704 9.949 1.00 0.00 C ATOM 270 O LEU A 40 -4.503 8.115 8.808 1.00 0.00 O ATOM 271 CB LEU A 40 -1.817 7.766 10.588 1.00 0.00 C ATOM 272 CG LEU A 40 -0.453 7.153 10.260 1.00 0.00 C ATOM 273 CD1 LEU A 40 0.590 8.243 10.002 1.00 0.00 C ATOM 274 CD2 LEU A 40 -0.010 6.183 11.357 1.00 0.00 C ATOM 0 H LEU A 40 -2.156 6.399 8.433 1.00 0.00 H new ATOM 0 HA LEU A 40 -3.241 6.332 11.177 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.911 8.705 10.043 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.837 8.010 11.650 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.550 6.576 9.340 1.00 0.00 H new ATOM 0 HD11 LEU A 40 1.550 7.781 9.771 1.00 0.00 H new ATOM 0 HD12 LEU A 40 0.272 8.859 9.161 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.692 8.867 10.890 1.00 0.00 H new ATOM 0 HD21 LEU A 40 0.962 5.762 11.099 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.065 6.716 12.305 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -0.741 5.380 11.449 1.00 0.00 H new ATOM 286 N PRO A 41 -5.129 7.912 11.005 1.00 0.00 N ATOM 287 CA PRO A 41 -6.364 8.661 10.848 1.00 0.00 C ATOM 288 C PRO A 41 -6.085 10.161 10.729 1.00 0.00 C ATOM 289 O PRO A 41 -7.011 10.970 10.728 1.00 0.00 O ATOM 290 CB PRO A 41 -7.197 8.307 12.069 1.00 0.00 C ATOM 291 CG PRO A 41 -6.221 7.744 13.090 1.00 0.00 C ATOM 292 CD PRO A 41 -4.917 7.441 12.370 1.00 0.00 C ATOM 0 HA PRO A 41 -6.896 8.406 9.932 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -7.709 9.186 12.461 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -7.966 7.576 11.819 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -6.055 8.460 13.895 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -6.625 6.840 13.546 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -4.077 7.953 12.840 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -4.692 6.375 12.390 1.00 0.00 H new ATOM 300 N ASP A 42 -4.804 10.485 10.632 1.00 0.00 N ATOM 301 CA ASP A 42 -4.391 11.873 10.513 1.00 0.00 C ATOM 302 C ASP A 42 -4.267 12.239 9.032 1.00 0.00 C ATOM 303 O ASP A 42 -4.484 13.389 8.653 1.00 0.00 O ATOM 304 CB ASP A 42 -3.029 12.101 11.171 1.00 0.00 C ATOM 305 CG ASP A 42 -2.866 13.452 11.871 1.00 0.00 C ATOM 306 OD1 ASP A 42 -2.932 14.474 11.154 1.00 0.00 O ATOM 307 OD2 ASP A 42 -2.680 13.432 13.107 1.00 0.00 O ATOM 0 H ASP A 42 -4.039 9.811 10.633 1.00 0.00 H new ATOM 0 HA ASP A 42 -5.140 12.491 11.009 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -2.857 11.309 11.899 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -2.255 12.008 10.410 1.00 0.00 H new ATOM 312 N GLY A 43 -3.919 11.239 8.236 1.00 0.00 N ATOM 313 CA GLY A 43 -3.764 11.441 6.805 1.00 0.00 C ATOM 314 C GLY A 43 -2.316 11.200 6.371 1.00 0.00 C ATOM 315 O GLY A 43 -1.853 11.782 5.391 1.00 0.00 O ATOM 0 H GLY A 43 -3.740 10.287 8.554 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -4.427 10.765 6.265 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -4.062 12.456 6.543 1.00 0.00 H new ATOM 319 N THR A 44 -1.643 10.341 7.122 1.00 0.00 N ATOM 320 CA THR A 44 -0.258 10.015 6.826 1.00 0.00 C ATOM 321 C THR A 44 -0.089 8.504 6.660 1.00 0.00 C ATOM 322 O THR A 44 -0.907 7.726 7.149 1.00 0.00 O ATOM 323 CB THR A 44 0.613 10.605 7.937 1.00 0.00 C ATOM 324 OG1 THR A 44 0.650 12.000 7.646 1.00 0.00 O ATOM 325 CG2 THR A 44 2.075 10.164 7.832 1.00 0.00 C ATOM 0 H THR A 44 -2.030 9.861 7.934 1.00 0.00 H new ATOM 0 HA THR A 44 0.057 10.451 5.878 1.00 0.00 H new ATOM 0 HB THR A 44 0.213 10.309 8.907 1.00 0.00 H new ATOM 0 HG1 THR A 44 1.193 12.460 8.319 1.00 0.00 H new ATOM 0 HG21 THR A 44 2.649 10.611 8.644 1.00 0.00 H new ATOM 0 HG22 THR A 44 2.133 9.078 7.901 1.00 0.00 H new ATOM 0 HG23 THR A 44 2.485 10.489 6.876 1.00 0.00 H new ATOM 333 N VAL A 45 0.978 8.132 5.968 1.00 0.00 N ATOM 334 CA VAL A 45 1.265 6.728 5.731 1.00 0.00 C ATOM 335 C VAL A 45 2.713 6.434 6.126 1.00 0.00 C ATOM 336 O VAL A 45 3.489 7.353 6.384 1.00 0.00 O ATOM 337 CB VAL A 45 0.957 6.369 4.275 1.00 0.00 C ATOM 338 CG1 VAL A 45 0.712 4.867 4.121 1.00 0.00 C ATOM 339 CG2 VAL A 45 -0.233 7.175 3.752 1.00 0.00 C ATOM 0 H VAL A 45 1.655 8.779 5.564 1.00 0.00 H new ATOM 0 HA VAL A 45 0.625 6.098 6.349 1.00 0.00 H new ATOM 0 HB VAL A 45 1.828 6.630 3.674 1.00 0.00 H new ATOM 0 HG11 VAL A 45 0.495 4.639 3.077 1.00 0.00 H new ATOM 0 HG12 VAL A 45 1.600 4.319 4.435 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -0.135 4.571 4.740 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -0.431 6.901 2.716 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -1.113 6.960 4.358 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -0.005 8.239 3.809 1.00 0.00 H new ATOM 349 N ASP A 46 3.034 5.149 6.160 1.00 0.00 N ATOM 350 CA ASP A 46 4.376 4.722 6.518 1.00 0.00 C ATOM 351 C ASP A 46 4.412 3.195 6.618 1.00 0.00 C ATOM 352 O ASP A 46 3.455 2.523 6.238 1.00 0.00 O ATOM 353 CB ASP A 46 4.792 5.294 7.875 1.00 0.00 C ATOM 354 CG ASP A 46 3.664 5.952 8.672 1.00 0.00 C ATOM 355 OD1 ASP A 46 2.524 5.451 8.562 1.00 0.00 O ATOM 356 OD2 ASP A 46 3.967 6.942 9.373 1.00 0.00 O ATOM 0 H ASP A 46 2.388 4.390 5.945 1.00 0.00 H new ATOM 0 HA ASP A 46 5.060 5.081 5.749 1.00 0.00 H new ATOM 0 HB2 ASP A 46 5.220 4.491 8.475 1.00 0.00 H new ATOM 0 HB3 ASP A 46 5.581 6.029 7.716 1.00 0.00 H new ATOM 361 N GLY A 47 5.526 2.693 7.130 1.00 0.00 N ATOM 362 CA GLY A 47 5.699 1.259 7.284 1.00 0.00 C ATOM 363 C GLY A 47 6.422 0.931 8.592 1.00 0.00 C ATOM 364 O GLY A 47 7.153 1.763 9.126 1.00 0.00 O ATOM 0 H GLY A 47 6.318 3.254 7.444 1.00 0.00 H new ATOM 0 HA2 GLY A 47 4.726 0.768 7.269 1.00 0.00 H new ATOM 0 HA3 GLY A 47 6.267 0.865 6.441 1.00 0.00 H new ATOM 368 N THR A 48 6.193 -0.283 9.069 1.00 0.00 N ATOM 369 CA THR A 48 6.813 -0.731 10.304 1.00 0.00 C ATOM 370 C THR A 48 7.350 -2.155 10.145 1.00 0.00 C ATOM 371 O THR A 48 6.612 -3.062 9.765 1.00 0.00 O ATOM 372 CB THR A 48 5.784 -0.592 11.428 1.00 0.00 C ATOM 373 OG1 THR A 48 5.730 0.810 11.677 1.00 0.00 O ATOM 374 CG2 THR A 48 6.276 -1.187 12.749 1.00 0.00 C ATOM 0 H THR A 48 5.586 -0.971 8.622 1.00 0.00 H new ATOM 0 HA THR A 48 7.677 -0.117 10.558 1.00 0.00 H new ATOM 0 HB THR A 48 4.856 -1.081 11.133 1.00 0.00 H new ATOM 0 HG1 THR A 48 5.826 0.975 12.638 1.00 0.00 H new ATOM 0 HG21 THR A 48 5.508 -1.062 13.513 1.00 0.00 H new ATOM 0 HG22 THR A 48 6.485 -2.248 12.615 1.00 0.00 H new ATOM 0 HG23 THR A 48 7.186 -0.675 13.062 1.00 0.00 H new ATOM 382 N ARG A 49 8.632 -2.306 10.444 1.00 0.00 N ATOM 383 CA ARG A 49 9.277 -3.604 10.339 1.00 0.00 C ATOM 384 C ARG A 49 8.295 -4.717 10.713 1.00 0.00 C ATOM 385 O ARG A 49 8.193 -5.721 10.011 1.00 0.00 O ATOM 386 CB ARG A 49 10.502 -3.686 11.251 1.00 0.00 C ATOM 387 CG ARG A 49 11.577 -4.591 10.646 1.00 0.00 C ATOM 388 CD ARG A 49 11.573 -5.969 11.311 1.00 0.00 C ATOM 389 NE ARG A 49 12.872 -6.642 11.090 1.00 0.00 N ATOM 390 CZ ARG A 49 13.283 -7.112 9.904 1.00 0.00 C ATOM 391 NH1 ARG A 49 12.498 -6.984 8.825 1.00 0.00 N ATOM 392 NH2 ARG A 49 14.478 -7.709 9.797 1.00 0.00 N ATOM 0 H ARG A 49 9.241 -1.551 10.759 1.00 0.00 H new ATOM 0 HA ARG A 49 9.599 -3.731 9.305 1.00 0.00 H new ATOM 0 HB2 ARG A 49 10.909 -2.687 11.409 1.00 0.00 H new ATOM 0 HB3 ARG A 49 10.207 -4.069 12.228 1.00 0.00 H new ATOM 0 HG2 ARG A 49 11.405 -4.700 9.575 1.00 0.00 H new ATOM 0 HG3 ARG A 49 12.557 -4.128 10.766 1.00 0.00 H new ATOM 0 HD2 ARG A 49 11.385 -5.865 12.380 1.00 0.00 H new ATOM 0 HD3 ARG A 49 10.765 -6.576 10.903 1.00 0.00 H new ATOM 0 HE ARG A 49 13.494 -6.755 11.891 1.00 0.00 H new ATOM 0 HH11 ARG A 49 11.589 -6.529 8.907 1.00 0.00 H new ATOM 0 HH12 ARG A 49 12.810 -7.341 7.922 1.00 0.00 H new ATOM 0 HH21 ARG A 49 15.075 -7.806 10.618 1.00 0.00 H new ATOM 0 HH22 ARG A 49 14.790 -8.067 8.894 1.00 0.00 H new ATOM 406 N ASP A 50 7.598 -4.499 11.819 1.00 0.00 N ATOM 407 CA ASP A 50 6.629 -5.471 12.295 1.00 0.00 C ATOM 408 C ASP A 50 5.419 -4.735 12.876 1.00 0.00 C ATOM 409 O ASP A 50 5.560 -3.935 13.800 1.00 0.00 O ATOM 410 CB ASP A 50 7.224 -6.347 13.399 1.00 0.00 C ATOM 411 CG ASP A 50 8.046 -7.540 12.905 1.00 0.00 C ATOM 412 OD1 ASP A 50 7.886 -7.885 11.714 1.00 0.00 O ATOM 413 OD2 ASP A 50 8.816 -8.078 13.729 1.00 0.00 O ATOM 0 H ASP A 50 7.685 -3.664 12.398 1.00 0.00 H new ATOM 0 HA ASP A 50 6.340 -6.100 11.453 1.00 0.00 H new ATOM 0 HB2 ASP A 50 7.857 -5.726 14.033 1.00 0.00 H new ATOM 0 HB3 ASP A 50 6.412 -6.718 14.025 1.00 0.00 H new ATOM 418 N ARG A 51 4.259 -5.032 12.311 1.00 0.00 N ATOM 419 CA ARG A 51 3.026 -4.409 12.762 1.00 0.00 C ATOM 420 C ARG A 51 3.080 -4.152 14.269 1.00 0.00 C ATOM 421 O ARG A 51 2.799 -5.047 15.065 1.00 0.00 O ATOM 422 CB ARG A 51 1.815 -5.290 12.445 1.00 0.00 C ATOM 423 CG ARG A 51 1.941 -6.657 13.120 1.00 0.00 C ATOM 424 CD ARG A 51 1.848 -7.787 12.092 1.00 0.00 C ATOM 425 NE ARG A 51 1.103 -8.931 12.663 1.00 0.00 N ATOM 426 CZ ARG A 51 1.237 -10.197 12.246 1.00 0.00 C ATOM 427 NH1 ARG A 51 2.086 -10.489 11.251 1.00 0.00 N ATOM 428 NH2 ARG A 51 0.520 -11.172 12.823 1.00 0.00 N ATOM 0 H ARG A 51 4.146 -5.696 11.545 1.00 0.00 H new ATOM 0 HA ARG A 51 2.921 -3.462 12.232 1.00 0.00 H new ATOM 0 HB2 ARG A 51 0.903 -4.797 12.782 1.00 0.00 H new ATOM 0 HB3 ARG A 51 1.727 -5.420 11.366 1.00 0.00 H new ATOM 0 HG2 ARG A 51 2.892 -6.719 13.649 1.00 0.00 H new ATOM 0 HG3 ARG A 51 1.154 -6.773 13.865 1.00 0.00 H new ATOM 0 HD2 ARG A 51 1.348 -7.430 11.191 1.00 0.00 H new ATOM 0 HD3 ARG A 51 2.848 -8.105 11.797 1.00 0.00 H new ATOM 0 HE ARG A 51 0.447 -8.744 13.421 1.00 0.00 H new ATOM 0 HH11 ARG A 51 2.630 -9.747 10.811 1.00 0.00 H new ATOM 0 HH12 ARG A 51 2.188 -11.453 10.934 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -0.127 -10.950 13.579 1.00 0.00 H new ATOM 0 HH22 ARG A 51 0.622 -12.136 12.506 1.00 0.00 H new ATOM 442 N SER A 52 3.444 -2.926 14.615 1.00 0.00 N ATOM 443 CA SER A 52 3.540 -2.541 16.013 1.00 0.00 C ATOM 444 C SER A 52 3.074 -1.094 16.190 1.00 0.00 C ATOM 445 O SER A 52 3.768 -0.286 16.804 1.00 0.00 O ATOM 446 CB SER A 52 4.969 -2.706 16.534 1.00 0.00 C ATOM 447 OG SER A 52 5.208 -1.918 17.697 1.00 0.00 O ATOM 0 H SER A 52 3.676 -2.187 13.952 1.00 0.00 H new ATOM 0 HA SER A 52 2.893 -3.199 16.594 1.00 0.00 H new ATOM 0 HB2 SER A 52 5.152 -3.756 16.764 1.00 0.00 H new ATOM 0 HB3 SER A 52 5.675 -2.423 15.753 1.00 0.00 H new ATOM 0 HG SER A 52 4.997 -0.980 17.506 1.00 0.00 H new ATOM 453 N ASP A 53 1.902 -0.812 15.640 1.00 0.00 N ATOM 454 CA ASP A 53 1.336 0.523 15.730 1.00 0.00 C ATOM 455 C ASP A 53 -0.054 0.441 16.364 1.00 0.00 C ATOM 456 O ASP A 53 -0.454 -0.612 16.857 1.00 0.00 O ATOM 457 CB ASP A 53 1.186 1.152 14.343 1.00 0.00 C ATOM 458 CG ASP A 53 1.636 2.611 14.242 1.00 0.00 C ATOM 459 OD1 ASP A 53 2.501 2.995 15.058 1.00 0.00 O ATOM 460 OD2 ASP A 53 1.103 3.308 13.352 1.00 0.00 O ATOM 0 H ASP A 53 1.329 -1.485 15.131 1.00 0.00 H new ATOM 0 HA ASP A 53 2.008 1.134 16.333 1.00 0.00 H new ATOM 0 HB2 ASP A 53 1.759 0.561 13.629 1.00 0.00 H new ATOM 0 HB3 ASP A 53 0.140 1.089 14.043 1.00 0.00 H new ATOM 465 N GLN A 54 -0.752 1.567 16.331 1.00 0.00 N ATOM 466 CA GLN A 54 -2.088 1.636 16.897 1.00 0.00 C ATOM 467 C GLN A 54 -3.115 1.094 15.901 1.00 0.00 C ATOM 468 O GLN A 54 -4.059 0.407 16.288 1.00 0.00 O ATOM 469 CB GLN A 54 -2.433 3.067 17.316 1.00 0.00 C ATOM 470 CG GLN A 54 -1.907 4.079 16.297 1.00 0.00 C ATOM 471 CD GLN A 54 -0.537 4.618 16.716 1.00 0.00 C ATOM 472 OE1 GLN A 54 -0.282 4.904 17.874 1.00 0.00 O ATOM 473 NE2 GLN A 54 0.326 4.740 15.712 1.00 0.00 N ATOM 0 H GLN A 54 -0.417 2.439 15.921 1.00 0.00 H new ATOM 0 HA GLN A 54 -2.115 1.014 17.792 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -3.514 3.171 17.412 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -2.004 3.276 18.296 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -1.832 3.608 15.317 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -2.613 4.904 16.201 1.00 0.00 H new ATOM 0 HE21 GLN A 54 0.047 4.482 14.765 1.00 0.00 H new ATOM 0 HE22 GLN A 54 1.267 5.091 15.888 1.00 0.00 H new ATOM 482 N HIS A 55 -2.897 1.424 14.636 1.00 0.00 N ATOM 483 CA HIS A 55 -3.791 0.979 13.581 1.00 0.00 C ATOM 484 C HIS A 55 -3.038 0.946 12.250 1.00 0.00 C ATOM 485 O HIS A 55 -2.867 1.979 11.604 1.00 0.00 O ATOM 486 CB HIS A 55 -5.047 1.851 13.530 1.00 0.00 C ATOM 487 CG HIS A 55 -4.839 3.258 14.039 1.00 0.00 C ATOM 488 ND1 HIS A 55 -5.568 4.005 14.917 1.00 0.00 N flip ATOM 489 CD2 HIS A 55 -3.778 4.050 13.639 1.00 0.00 C flip ATOM 490 CE1 HIS A 55 -4.982 5.189 15.047 1.00 0.00 C flip ATOM 491 NE2 HIS A 55 -3.872 5.219 14.255 1.00 0.00 N flip ATOM 0 H HIS A 55 -2.114 1.995 14.318 1.00 0.00 H new ATOM 0 HA HIS A 55 -4.131 -0.035 13.791 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -5.404 1.897 12.501 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -5.832 1.375 14.118 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -3.004 3.764 12.942 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -5.327 5.996 15.676 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -3.228 6.003 14.155 1.00 0.00 H new ATOM 499 N ILE A 56 -2.609 -0.251 11.879 1.00 0.00 N ATOM 500 CA ILE A 56 -1.878 -0.433 10.636 1.00 0.00 C ATOM 501 C ILE A 56 -2.712 -1.287 9.680 1.00 0.00 C ATOM 502 O ILE A 56 -2.177 -1.881 8.745 1.00 0.00 O ATOM 503 CB ILE A 56 -0.485 -1.000 10.912 1.00 0.00 C ATOM 504 CG1 ILE A 56 -0.511 -2.530 10.939 1.00 0.00 C ATOM 505 CG2 ILE A 56 0.101 -0.415 12.198 1.00 0.00 C ATOM 506 CD1 ILE A 56 -1.587 -3.043 11.897 1.00 0.00 C ATOM 0 H ILE A 56 -2.754 -1.105 12.417 1.00 0.00 H new ATOM 0 HA ILE A 56 -1.714 0.527 10.146 1.00 0.00 H new ATOM 0 HB ILE A 56 0.172 -0.703 10.095 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -0.700 -2.912 9.936 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.464 -2.909 11.245 1.00 0.00 H new ATOM 0 HG21 ILE A 56 1.092 -0.835 12.370 1.00 0.00 H new ATOM 0 HG22 ILE A 56 0.178 0.668 12.103 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -0.548 -0.660 13.038 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -1.584 -4.133 11.897 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.381 -2.679 12.904 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.564 -2.683 11.574 1.00 0.00 H new ATOM 518 N GLN A 57 -4.010 -1.323 9.946 1.00 0.00 N ATOM 519 CA GLN A 57 -4.922 -2.095 9.121 1.00 0.00 C ATOM 520 C GLN A 57 -5.099 -1.426 7.756 1.00 0.00 C ATOM 521 O GLN A 57 -5.387 -0.232 7.679 1.00 0.00 O ATOM 522 CB GLN A 57 -6.271 -2.280 9.820 1.00 0.00 C ATOM 523 CG GLN A 57 -6.081 -2.758 11.260 1.00 0.00 C ATOM 524 CD GLN A 57 -6.622 -1.730 12.256 1.00 0.00 C ATOM 525 OE1 GLN A 57 -5.949 -1.680 13.402 1.00 0.00 O flip ATOM 526 NE2 GLN A 57 -7.587 -1.029 12.000 1.00 0.00 N flip ATOM 0 H GLN A 57 -4.451 -0.829 10.722 1.00 0.00 H new ATOM 0 HA GLN A 57 -4.492 -3.084 8.966 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -6.819 -1.338 9.815 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -6.874 -3.003 9.270 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -6.592 -3.710 11.401 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -5.022 -2.933 11.452 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -8.058 -1.119 11.100 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -7.923 -0.353 12.686 1.00 0.00 H new ATOM 535 N LEU A 58 -4.920 -2.224 6.714 1.00 0.00 N ATOM 536 CA LEU A 58 -5.056 -1.724 5.356 1.00 0.00 C ATOM 537 C LEU A 58 -5.969 -2.659 4.562 1.00 0.00 C ATOM 538 O LEU A 58 -5.797 -3.877 4.596 1.00 0.00 O ATOM 539 CB LEU A 58 -3.679 -1.521 4.719 1.00 0.00 C ATOM 540 CG LEU A 58 -2.967 -0.212 5.065 1.00 0.00 C ATOM 541 CD1 LEU A 58 -1.761 -0.467 5.972 1.00 0.00 C ATOM 542 CD2 LEU A 58 -2.579 0.553 3.798 1.00 0.00 C ATOM 0 H LEU A 58 -4.682 -3.213 6.782 1.00 0.00 H new ATOM 0 HA LEU A 58 -5.529 -0.742 5.357 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.037 -2.350 5.016 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -3.790 -1.576 3.636 1.00 0.00 H new ATOM 0 HG LEU A 58 -3.661 0.418 5.621 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.273 0.480 6.203 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -2.094 -0.938 6.897 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -1.056 -1.124 5.463 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.075 1.479 4.072 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -1.910 -0.059 3.194 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -3.476 0.785 3.224 1.00 0.00 H new ATOM 554 N GLN A 59 -6.920 -2.055 3.865 1.00 0.00 N ATOM 555 CA GLN A 59 -7.861 -2.819 3.063 1.00 0.00 C ATOM 556 C GLN A 59 -7.763 -2.407 1.593 1.00 0.00 C ATOM 557 O GLN A 59 -7.358 -1.287 1.285 1.00 0.00 O ATOM 558 CB GLN A 59 -9.289 -2.652 3.586 1.00 0.00 C ATOM 559 CG GLN A 59 -10.236 -3.654 2.923 1.00 0.00 C ATOM 560 CD GLN A 59 -9.609 -5.049 2.870 1.00 0.00 C ATOM 561 OE1 GLN A 59 -9.311 -5.583 1.814 1.00 0.00 O ATOM 562 NE2 GLN A 59 -9.425 -5.605 4.064 1.00 0.00 N ATOM 0 H GLN A 59 -7.059 -1.045 3.839 1.00 0.00 H new ATOM 0 HA GLN A 59 -7.602 -3.875 3.142 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -9.303 -2.793 4.667 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -9.635 -1.637 3.392 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -11.174 -3.694 3.476 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -10.475 -3.320 1.913 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -9.697 -5.102 4.908 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -9.011 -6.535 4.135 1.00 0.00 H new ATOM 571 N LEU A 60 -8.140 -3.334 0.725 1.00 0.00 N ATOM 572 CA LEU A 60 -8.099 -3.081 -0.705 1.00 0.00 C ATOM 573 C LEU A 60 -9.513 -3.193 -1.278 1.00 0.00 C ATOM 574 O LEU A 60 -10.413 -3.717 -0.623 1.00 0.00 O ATOM 575 CB LEU A 60 -7.085 -4.004 -1.384 1.00 0.00 C ATOM 576 CG LEU A 60 -6.219 -4.851 -0.450 1.00 0.00 C ATOM 577 CD1 LEU A 60 -7.058 -5.913 0.263 1.00 0.00 C ATOM 578 CD2 LEU A 60 -5.038 -5.466 -1.204 1.00 0.00 C ATOM 0 H LEU A 60 -8.475 -4.262 0.985 1.00 0.00 H new ATOM 0 HA LEU A 60 -7.753 -2.066 -0.903 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -7.625 -4.674 -2.054 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.427 -3.395 -2.004 1.00 0.00 H new ATOM 0 HG LEU A 60 -5.806 -4.197 0.318 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -6.418 -6.501 0.921 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -7.835 -5.427 0.853 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -7.519 -6.569 -0.476 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.439 -6.063 -0.517 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.410 -6.102 -2.007 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -4.422 -4.672 -1.626 1.00 0.00 H new ATOM 590 N SER A 61 -9.665 -2.693 -2.496 1.00 0.00 N ATOM 591 CA SER A 61 -10.954 -2.730 -3.165 1.00 0.00 C ATOM 592 C SER A 61 -10.758 -2.934 -4.668 1.00 0.00 C ATOM 593 O SER A 61 -11.294 -2.178 -5.477 1.00 0.00 O ATOM 594 CB SER A 61 -11.748 -1.449 -2.903 1.00 0.00 C ATOM 595 OG SER A 61 -12.803 -1.271 -3.845 1.00 0.00 O ATOM 0 H SER A 61 -8.916 -2.260 -3.037 1.00 0.00 H new ATOM 0 HA SER A 61 -11.524 -3.567 -2.762 1.00 0.00 H new ATOM 0 HB2 SER A 61 -12.163 -1.480 -1.896 1.00 0.00 H new ATOM 0 HB3 SER A 61 -11.076 -0.592 -2.945 1.00 0.00 H new ATOM 0 HG SER A 61 -12.426 -1.180 -4.745 1.00 0.00 H new ATOM 601 N ALA A 62 -9.987 -3.960 -4.998 1.00 0.00 N ATOM 602 CA ALA A 62 -9.714 -4.274 -6.390 1.00 0.00 C ATOM 603 C ALA A 62 -10.985 -4.063 -7.215 1.00 0.00 C ATOM 604 O ALA A 62 -12.030 -4.633 -6.908 1.00 0.00 O ATOM 605 CB ALA A 62 -9.180 -5.704 -6.496 1.00 0.00 C ATOM 0 H ALA A 62 -9.543 -4.585 -4.325 1.00 0.00 H new ATOM 0 HA ALA A 62 -8.948 -3.610 -6.790 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -8.975 -5.939 -7.540 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -8.261 -5.793 -5.917 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -9.923 -6.400 -6.106 1.00 0.00 H new ATOM 611 N GLU A 63 -10.853 -3.243 -8.247 1.00 0.00 N ATOM 612 CA GLU A 63 -11.977 -2.949 -9.119 1.00 0.00 C ATOM 613 C GLU A 63 -11.721 -3.505 -10.522 1.00 0.00 C ATOM 614 O GLU A 63 -12.585 -3.423 -11.393 1.00 0.00 O ATOM 615 CB GLU A 63 -12.257 -1.446 -9.167 1.00 0.00 C ATOM 616 CG GLU A 63 -11.046 -0.680 -9.705 1.00 0.00 C ATOM 617 CD GLU A 63 -11.482 0.448 -10.642 1.00 0.00 C ATOM 618 OE1 GLU A 63 -12.644 0.888 -10.498 1.00 0.00 O ATOM 619 OE2 GLU A 63 -10.645 0.845 -11.480 1.00 0.00 O ATOM 0 H GLU A 63 -9.984 -2.773 -8.499 1.00 0.00 H new ATOM 0 HA GLU A 63 -12.863 -3.437 -8.713 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -13.124 -1.254 -9.799 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.505 -1.086 -8.168 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -10.474 -0.267 -8.874 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.385 -1.365 -10.237 1.00 0.00 H new ATOM 626 N SER A 64 -10.529 -4.057 -10.696 1.00 0.00 N ATOM 627 CA SER A 64 -10.148 -4.626 -11.977 1.00 0.00 C ATOM 628 C SER A 64 -8.623 -4.667 -12.099 1.00 0.00 C ATOM 629 O SER A 64 -7.939 -3.731 -11.688 1.00 0.00 O ATOM 630 CB SER A 64 -10.752 -3.828 -13.135 1.00 0.00 C ATOM 631 OG SER A 64 -11.926 -4.446 -13.654 1.00 0.00 O ATOM 0 H SER A 64 -9.815 -4.122 -9.971 1.00 0.00 H new ATOM 0 HA SER A 64 -10.537 -5.643 -12.029 1.00 0.00 H new ATOM 0 HB2 SER A 64 -10.993 -2.821 -12.795 1.00 0.00 H new ATOM 0 HB3 SER A 64 -10.013 -3.728 -13.930 1.00 0.00 H new ATOM 0 HG SER A 64 -12.666 -4.324 -13.023 1.00 0.00 H new ATOM 637 N VAL A 65 -8.136 -5.760 -12.666 1.00 0.00 N ATOM 638 CA VAL A 65 -6.705 -5.936 -12.847 1.00 0.00 C ATOM 639 C VAL A 65 -6.104 -4.644 -13.404 1.00 0.00 C ATOM 640 O VAL A 65 -6.686 -4.014 -14.286 1.00 0.00 O ATOM 641 CB VAL A 65 -6.435 -7.152 -13.735 1.00 0.00 C ATOM 642 CG1 VAL A 65 -6.380 -8.436 -12.905 1.00 0.00 C ATOM 643 CG2 VAL A 65 -7.480 -7.262 -14.847 1.00 0.00 C ATOM 0 H VAL A 65 -8.707 -6.534 -13.007 1.00 0.00 H new ATOM 0 HA VAL A 65 -6.221 -6.135 -11.891 1.00 0.00 H new ATOM 0 HB VAL A 65 -5.461 -7.014 -14.204 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.187 -9.285 -13.561 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -5.582 -8.358 -12.167 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.332 -8.581 -12.395 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -7.265 -8.135 -15.464 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.471 -7.365 -14.406 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -7.449 -6.365 -15.465 1.00 0.00 H new ATOM 653 N GLY A 66 -4.947 -4.287 -12.866 1.00 0.00 N ATOM 654 CA GLY A 66 -4.261 -3.081 -13.298 1.00 0.00 C ATOM 655 C GLY A 66 -4.896 -1.836 -12.675 1.00 0.00 C ATOM 656 O GLY A 66 -4.467 -0.715 -12.946 1.00 0.00 O ATOM 0 H GLY A 66 -4.467 -4.812 -12.135 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -3.209 -3.136 -13.017 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.297 -3.007 -14.385 1.00 0.00 H new ATOM 660 N GLU A 67 -5.907 -2.074 -11.853 1.00 0.00 N ATOM 661 CA GLU A 67 -6.605 -0.986 -11.190 1.00 0.00 C ATOM 662 C GLU A 67 -7.307 -1.496 -9.930 1.00 0.00 C ATOM 663 O GLU A 67 -8.345 -2.150 -10.014 1.00 0.00 O ATOM 664 CB GLU A 67 -7.601 -0.315 -12.139 1.00 0.00 C ATOM 665 CG GLU A 67 -7.486 1.209 -12.066 1.00 0.00 C ATOM 666 CD GLU A 67 -8.271 1.873 -13.199 1.00 0.00 C ATOM 667 OE1 GLU A 67 -8.733 1.122 -14.085 1.00 0.00 O ATOM 668 OE2 GLU A 67 -8.392 3.116 -13.153 1.00 0.00 O ATOM 0 H GLU A 67 -6.260 -3.005 -11.631 1.00 0.00 H new ATOM 0 HA GLU A 67 -5.872 -0.235 -10.895 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.417 -0.649 -13.160 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.616 -0.620 -11.882 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -7.861 1.560 -11.105 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -6.438 1.501 -12.125 1.00 0.00 H new ATOM 675 N VAL A 68 -6.711 -1.176 -8.790 1.00 0.00 N ATOM 676 CA VAL A 68 -7.266 -1.594 -7.513 1.00 0.00 C ATOM 677 C VAL A 68 -7.423 -0.371 -6.607 1.00 0.00 C ATOM 678 O VAL A 68 -6.821 0.672 -6.855 1.00 0.00 O ATOM 679 CB VAL A 68 -6.392 -2.688 -6.896 1.00 0.00 C ATOM 680 CG1 VAL A 68 -6.127 -3.810 -7.901 1.00 0.00 C ATOM 681 CG2 VAL A 68 -5.080 -2.107 -6.364 1.00 0.00 C ATOM 0 H VAL A 68 -5.850 -0.633 -8.724 1.00 0.00 H new ATOM 0 HA VAL A 68 -8.257 -2.027 -7.649 1.00 0.00 H new ATOM 0 HB VAL A 68 -6.935 -3.115 -6.053 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -5.504 -4.574 -7.437 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -7.074 -4.253 -8.210 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.614 -3.404 -8.773 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.478 -2.906 -5.931 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -4.530 -1.641 -7.182 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -5.296 -1.360 -5.600 1.00 0.00 H new ATOM 691 N TYR A 69 -8.236 -0.541 -5.575 1.00 0.00 N ATOM 692 CA TYR A 69 -8.481 0.536 -4.630 1.00 0.00 C ATOM 693 C TYR A 69 -8.042 0.137 -3.219 1.00 0.00 C ATOM 694 O TYR A 69 -7.845 -1.044 -2.937 1.00 0.00 O ATOM 695 CB TYR A 69 -9.993 0.766 -4.635 1.00 0.00 C ATOM 696 CG TYR A 69 -10.464 1.784 -5.675 1.00 0.00 C ATOM 697 CD1 TYR A 69 -10.213 3.129 -5.487 1.00 0.00 C ATOM 698 CD2 TYR A 69 -11.140 1.359 -6.800 1.00 0.00 C ATOM 699 CE1 TYR A 69 -10.656 4.087 -6.466 1.00 0.00 C ATOM 700 CE2 TYR A 69 -11.584 2.318 -7.779 1.00 0.00 C ATOM 701 CZ TYR A 69 -11.320 3.634 -7.564 1.00 0.00 C ATOM 702 OH TYR A 69 -11.738 4.540 -8.488 1.00 0.00 O ATOM 0 H TYR A 69 -8.734 -1.408 -5.372 1.00 0.00 H new ATOM 0 HA TYR A 69 -7.922 1.428 -4.911 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -10.494 -0.184 -4.819 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -10.302 1.103 -3.646 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -9.685 3.462 -4.606 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -11.336 0.307 -6.947 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -10.466 5.142 -6.332 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -12.115 1.999 -8.664 1.00 0.00 H new ATOM 0 HH TYR A 69 -12.196 4.075 -9.219 1.00 0.00 H new ATOM 712 N ILE A 70 -7.903 1.145 -2.370 1.00 0.00 N ATOM 713 CA ILE A 70 -7.491 0.914 -0.996 1.00 0.00 C ATOM 714 C ILE A 70 -8.187 1.926 -0.083 1.00 0.00 C ATOM 715 O ILE A 70 -8.084 3.133 -0.296 1.00 0.00 O ATOM 716 CB ILE A 70 -5.966 0.932 -0.883 1.00 0.00 C ATOM 717 CG1 ILE A 70 -5.346 -0.243 -1.642 1.00 0.00 C ATOM 718 CG2 ILE A 70 -5.524 0.966 0.581 1.00 0.00 C ATOM 719 CD1 ILE A 70 -3.862 -0.394 -1.302 1.00 0.00 C ATOM 0 H ILE A 70 -8.068 2.123 -2.607 1.00 0.00 H new ATOM 0 HA ILE A 70 -7.800 -0.078 -0.668 1.00 0.00 H new ATOM 0 HB ILE A 70 -5.600 1.846 -1.350 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.875 -1.162 -1.391 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -5.463 -0.090 -2.715 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.435 0.978 0.632 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.920 1.862 1.060 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -5.901 0.082 1.096 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -3.446 -1.236 -1.855 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.331 0.518 -1.576 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -3.750 -0.571 -0.232 1.00 0.00 H new ATOM 731 N LYS A 71 -8.880 1.397 0.914 1.00 0.00 N ATOM 732 CA LYS A 71 -9.593 2.238 1.860 1.00 0.00 C ATOM 733 C LYS A 71 -9.219 1.826 3.285 1.00 0.00 C ATOM 734 O LYS A 71 -9.289 0.648 3.633 1.00 0.00 O ATOM 735 CB LYS A 71 -11.097 2.201 1.583 1.00 0.00 C ATOM 736 CG LYS A 71 -11.776 3.482 2.071 1.00 0.00 C ATOM 737 CD LYS A 71 -12.773 3.181 3.192 1.00 0.00 C ATOM 738 CE LYS A 71 -12.052 2.967 4.524 1.00 0.00 C ATOM 739 NZ LYS A 71 -11.400 4.220 4.968 1.00 0.00 N ATOM 0 H LYS A 71 -8.963 0.395 1.088 1.00 0.00 H new ATOM 0 HA LYS A 71 -9.297 3.280 1.741 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -11.271 2.078 0.514 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -11.541 1.338 2.080 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -11.022 4.184 2.428 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -12.292 3.964 1.240 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -13.480 4.005 3.286 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -13.351 2.292 2.940 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -12.763 2.633 5.279 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -11.306 2.180 4.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -10.845 4.037 5.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -10.770 4.568 4.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -12.126 4.936 5.170 1.00 0.00 H new ATOM 753 N SER A 72 -8.832 2.819 4.072 1.00 0.00 N ATOM 754 CA SER A 72 -8.447 2.574 5.452 1.00 0.00 C ATOM 755 C SER A 72 -9.634 2.006 6.233 1.00 0.00 C ATOM 756 O SER A 72 -10.451 2.759 6.761 1.00 0.00 O ATOM 757 CB SER A 72 -7.937 3.854 6.117 1.00 0.00 C ATOM 758 OG SER A 72 -8.118 3.830 7.530 1.00 0.00 O ATOM 0 H SER A 72 -8.777 3.795 3.781 1.00 0.00 H new ATOM 0 HA SER A 72 -7.635 1.846 5.457 1.00 0.00 H new ATOM 0 HB2 SER A 72 -6.879 3.984 5.889 1.00 0.00 H new ATOM 0 HB3 SER A 72 -8.461 4.713 5.699 1.00 0.00 H new ATOM 0 HG SER A 72 -9.074 3.776 7.736 1.00 0.00 H new ATOM 764 N THR A 73 -9.691 0.684 6.281 1.00 0.00 N ATOM 765 CA THR A 73 -10.765 0.007 6.989 1.00 0.00 C ATOM 766 C THR A 73 -10.875 0.533 8.421 1.00 0.00 C ATOM 767 O THR A 73 -10.249 -0.004 9.334 1.00 0.00 O ATOM 768 CB THR A 73 -10.504 -1.499 6.914 1.00 0.00 C ATOM 769 OG1 THR A 73 -9.149 -1.596 6.484 1.00 0.00 O ATOM 770 CG2 THR A 73 -11.300 -2.176 5.796 1.00 0.00 C ATOM 0 H THR A 73 -9.012 0.063 5.842 1.00 0.00 H new ATOM 0 HA THR A 73 -11.732 0.208 6.527 1.00 0.00 H new ATOM 0 HB THR A 73 -10.757 -1.959 7.869 1.00 0.00 H new ATOM 0 HG1 THR A 73 -8.797 -2.482 6.710 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.078 -3.243 5.786 1.00 0.00 H new ATOM 0 HG22 THR A 73 -12.366 -2.028 5.968 1.00 0.00 H new ATOM 0 HG23 THR A 73 -11.023 -1.739 4.836 1.00 0.00 H new ATOM 778 N GLU A 74 -11.674 1.579 8.573 1.00 0.00 N ATOM 779 CA GLU A 74 -11.874 2.184 9.879 1.00 0.00 C ATOM 780 C GLU A 74 -12.420 3.606 9.727 1.00 0.00 C ATOM 781 O GLU A 74 -13.515 3.908 10.197 1.00 0.00 O ATOM 782 CB GLU A 74 -10.577 2.179 10.691 1.00 0.00 C ATOM 783 CG GLU A 74 -10.622 3.228 11.803 1.00 0.00 C ATOM 784 CD GLU A 74 -11.723 2.908 12.815 1.00 0.00 C ATOM 785 OE1 GLU A 74 -12.814 2.505 12.358 1.00 0.00 O ATOM 786 OE2 GLU A 74 -11.449 3.074 14.024 1.00 0.00 O ATOM 0 H GLU A 74 -12.190 2.023 7.814 1.00 0.00 H new ATOM 0 HA GLU A 74 -12.607 1.590 10.424 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -10.419 1.191 11.124 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -9.731 2.378 10.033 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.658 3.267 12.310 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -10.796 4.214 11.371 1.00 0.00 H new ATOM 793 N THR A 75 -11.630 4.441 9.068 1.00 0.00 N ATOM 794 CA THR A 75 -12.020 5.823 8.848 1.00 0.00 C ATOM 795 C THR A 75 -12.583 6.000 7.437 1.00 0.00 C ATOM 796 O THR A 75 -13.378 5.183 6.975 1.00 0.00 O ATOM 797 CB THR A 75 -10.805 6.708 9.133 1.00 0.00 C ATOM 798 OG1 THR A 75 -10.003 6.585 7.961 1.00 0.00 O ATOM 799 CG2 THR A 75 -9.922 6.149 10.249 1.00 0.00 C ATOM 0 H THR A 75 -10.722 4.187 8.679 1.00 0.00 H new ATOM 0 HA THR A 75 -12.822 6.120 9.524 1.00 0.00 H new ATOM 0 HB THR A 75 -11.141 7.709 9.404 1.00 0.00 H new ATOM 0 HG1 THR A 75 -9.194 7.129 8.060 1.00 0.00 H new ATOM 0 HG21 THR A 75 -9.075 6.815 10.411 1.00 0.00 H new ATOM 0 HG22 THR A 75 -10.503 6.071 11.168 1.00 0.00 H new ATOM 0 HG23 THR A 75 -9.558 5.162 9.965 1.00 0.00 H new ATOM 807 N GLY A 76 -12.150 7.073 6.791 1.00 0.00 N ATOM 808 CA GLY A 76 -12.601 7.368 5.442 1.00 0.00 C ATOM 809 C GLY A 76 -11.467 7.961 4.602 1.00 0.00 C ATOM 810 O GLY A 76 -11.561 9.097 4.140 1.00 0.00 O ATOM 0 H GLY A 76 -11.491 7.749 7.177 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.970 6.457 4.971 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -13.436 8.068 5.479 1.00 0.00 H new ATOM 814 N GLN A 77 -10.422 7.165 4.430 1.00 0.00 N ATOM 815 CA GLN A 77 -9.273 7.596 3.654 1.00 0.00 C ATOM 816 C GLN A 77 -8.900 6.532 2.619 1.00 0.00 C ATOM 817 O GLN A 77 -8.802 5.351 2.947 1.00 0.00 O ATOM 818 CB GLN A 77 -8.085 7.915 4.564 1.00 0.00 C ATOM 819 CG GLN A 77 -7.722 9.400 4.492 1.00 0.00 C ATOM 820 CD GLN A 77 -8.298 10.164 5.686 1.00 0.00 C ATOM 821 OE1 GLN A 77 -9.267 9.759 6.306 1.00 0.00 O ATOM 822 NE2 GLN A 77 -7.649 11.289 5.972 1.00 0.00 N ATOM 0 H GLN A 77 -10.347 6.223 4.815 1.00 0.00 H new ATOM 0 HA GLN A 77 -9.540 8.511 3.125 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -8.327 7.646 5.592 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -7.226 7.312 4.271 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -6.638 9.512 4.472 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -8.104 9.827 3.564 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -6.844 11.570 5.412 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -7.956 11.871 6.752 1.00 0.00 H new ATOM 831 N TYR A 78 -8.702 6.989 1.392 1.00 0.00 N ATOM 832 CA TYR A 78 -8.343 6.092 0.307 1.00 0.00 C ATOM 833 C TYR A 78 -6.872 6.259 -0.079 1.00 0.00 C ATOM 834 O TYR A 78 -6.479 7.301 -0.603 1.00 0.00 O ATOM 835 CB TYR A 78 -9.219 6.493 -0.881 1.00 0.00 C ATOM 836 CG TYR A 78 -10.675 6.039 -0.762 1.00 0.00 C ATOM 837 CD1 TYR A 78 -11.604 6.855 -0.149 1.00 0.00 C ATOM 838 CD2 TYR A 78 -11.059 4.814 -1.269 1.00 0.00 C ATOM 839 CE1 TYR A 78 -12.975 6.427 -0.037 1.00 0.00 C ATOM 840 CE2 TYR A 78 -12.430 4.387 -1.157 1.00 0.00 C ATOM 841 CZ TYR A 78 -13.320 5.215 -0.547 1.00 0.00 C ATOM 842 OH TYR A 78 -14.614 4.811 -0.441 1.00 0.00 O ATOM 0 H TYR A 78 -8.783 7.970 1.125 1.00 0.00 H new ATOM 0 HA TYR A 78 -8.492 5.054 0.603 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -9.195 7.578 -0.987 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -8.792 6.074 -1.792 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -11.303 7.814 0.247 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -10.332 4.176 -1.749 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -13.712 7.055 0.441 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -12.744 3.431 -1.549 1.00 0.00 H new ATOM 0 HH TYR A 78 -14.715 3.926 -0.850 1.00 0.00 H new ATOM 852 N LEU A 79 -6.099 5.219 0.195 1.00 0.00 N ATOM 853 CA LEU A 79 -4.680 5.238 -0.117 1.00 0.00 C ATOM 854 C LEU A 79 -4.475 5.859 -1.500 1.00 0.00 C ATOM 855 O LEU A 79 -5.404 5.913 -2.304 1.00 0.00 O ATOM 856 CB LEU A 79 -4.081 3.837 0.023 1.00 0.00 C ATOM 857 CG LEU A 79 -2.698 3.760 0.672 1.00 0.00 C ATOM 858 CD1 LEU A 79 -2.628 4.640 1.921 1.00 0.00 C ATOM 859 CD2 LEU A 79 -2.312 2.310 0.970 1.00 0.00 C ATOM 0 H LEU A 79 -6.428 4.357 0.630 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.142 5.862 0.596 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.769 3.226 0.607 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.020 3.389 -0.969 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.967 4.149 -0.037 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.634 4.567 2.363 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.828 5.676 1.648 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -3.372 4.305 2.644 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.325 2.284 1.431 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -3.042 1.872 1.651 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.294 1.740 0.041 1.00 0.00 H new ATOM 871 N ALA A 80 -3.252 6.312 -1.734 1.00 0.00 N ATOM 872 CA ALA A 80 -2.913 6.928 -3.006 1.00 0.00 C ATOM 873 C ALA A 80 -1.430 7.303 -3.007 1.00 0.00 C ATOM 874 O ALA A 80 -0.733 7.097 -2.015 1.00 0.00 O ATOM 875 CB ALA A 80 -3.821 8.135 -3.247 1.00 0.00 C ATOM 0 H ALA A 80 -2.484 6.265 -1.065 1.00 0.00 H new ATOM 0 HA ALA A 80 -3.076 6.229 -3.827 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.567 8.597 -4.201 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.861 7.810 -3.267 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.683 8.860 -2.445 1.00 0.00 H new ATOM 881 N MET A 81 -0.991 7.849 -4.132 1.00 0.00 N ATOM 882 CA MET A 81 0.397 8.255 -4.275 1.00 0.00 C ATOM 883 C MET A 81 0.505 9.580 -5.033 1.00 0.00 C ATOM 884 O MET A 81 0.356 9.615 -6.253 1.00 0.00 O ATOM 885 CB MET A 81 1.171 7.171 -5.027 1.00 0.00 C ATOM 886 CG MET A 81 2.569 6.983 -4.433 1.00 0.00 C ATOM 887 SD MET A 81 3.795 7.025 -5.729 1.00 0.00 S ATOM 888 CE MET A 81 5.044 5.974 -5.008 1.00 0.00 C ATOM 0 H MET A 81 -1.572 8.020 -4.953 1.00 0.00 H new ATOM 0 HA MET A 81 0.821 8.392 -3.280 1.00 0.00 H new ATOM 0 HB2 MET A 81 0.623 6.230 -4.981 1.00 0.00 H new ATOM 0 HB3 MET A 81 1.253 7.441 -6.080 1.00 0.00 H new ATOM 0 HG2 MET A 81 2.772 7.768 -3.704 1.00 0.00 H new ATOM 0 HG3 MET A 81 2.622 6.033 -3.902 1.00 0.00 H new ATOM 0 HE1 MET A 81 6.029 6.406 -5.184 1.00 0.00 H new ATOM 0 HE2 MET A 81 4.872 5.888 -3.935 1.00 0.00 H new ATOM 0 HE3 MET A 81 4.995 4.985 -5.464 1.00 0.00 H new ATOM 898 N ASP A 82 0.763 10.638 -4.278 1.00 0.00 N ATOM 899 CA ASP A 82 0.893 11.961 -4.863 1.00 0.00 C ATOM 900 C ASP A 82 2.057 11.963 -5.856 1.00 0.00 C ATOM 901 O ASP A 82 2.812 10.995 -5.935 1.00 0.00 O ATOM 902 CB ASP A 82 1.184 13.012 -3.790 1.00 0.00 C ATOM 903 CG ASP A 82 0.161 13.077 -2.654 1.00 0.00 C ATOM 904 OD1 ASP A 82 -0.991 13.460 -2.950 1.00 0.00 O ATOM 905 OD2 ASP A 82 0.555 12.743 -1.516 1.00 0.00 O ATOM 0 H ASP A 82 0.885 10.605 -3.266 1.00 0.00 H new ATOM 0 HA ASP A 82 -0.047 12.204 -5.359 1.00 0.00 H new ATOM 0 HB2 ASP A 82 2.166 12.811 -3.363 1.00 0.00 H new ATOM 0 HB3 ASP A 82 1.238 13.991 -4.267 1.00 0.00 H new ATOM 910 N THR A 83 2.167 13.062 -6.588 1.00 0.00 N ATOM 911 CA THR A 83 3.226 13.203 -7.572 1.00 0.00 C ATOM 912 C THR A 83 4.593 13.221 -6.885 1.00 0.00 C ATOM 913 O THR A 83 5.623 13.067 -7.540 1.00 0.00 O ATOM 914 CB THR A 83 2.943 14.461 -8.396 1.00 0.00 C ATOM 915 OG1 THR A 83 1.869 14.081 -9.252 1.00 0.00 O ATOM 916 CG2 THR A 83 4.083 14.800 -9.358 1.00 0.00 C ATOM 0 H THR A 83 1.540 13.863 -6.519 1.00 0.00 H new ATOM 0 HA THR A 83 3.250 12.351 -8.252 1.00 0.00 H new ATOM 0 HB THR A 83 2.772 15.303 -7.725 1.00 0.00 H new ATOM 0 HG1 THR A 83 1.051 14.545 -8.977 1.00 0.00 H new ATOM 0 HG21 THR A 83 3.831 15.701 -9.918 1.00 0.00 H new ATOM 0 HG22 THR A 83 4.999 14.969 -8.792 1.00 0.00 H new ATOM 0 HG23 THR A 83 4.233 13.972 -10.051 1.00 0.00 H new ATOM 924 N ASP A 84 4.558 13.412 -5.575 1.00 0.00 N ATOM 925 CA ASP A 84 5.782 13.453 -4.792 1.00 0.00 C ATOM 926 C ASP A 84 6.341 12.036 -4.652 1.00 0.00 C ATOM 927 O ASP A 84 7.432 11.845 -4.119 1.00 0.00 O ATOM 928 CB ASP A 84 5.518 13.998 -3.386 1.00 0.00 C ATOM 929 CG ASP A 84 6.594 14.943 -2.847 1.00 0.00 C ATOM 930 OD1 ASP A 84 6.647 16.087 -3.347 1.00 0.00 O ATOM 931 OD2 ASP A 84 7.338 14.500 -1.946 1.00 0.00 O ATOM 0 H ASP A 84 3.702 13.540 -5.036 1.00 0.00 H new ATOM 0 HA ASP A 84 6.489 14.105 -5.305 1.00 0.00 H new ATOM 0 HB2 ASP A 84 4.563 14.523 -3.389 1.00 0.00 H new ATOM 0 HB3 ASP A 84 5.417 13.157 -2.700 1.00 0.00 H new ATOM 936 N GLY A 85 5.566 11.078 -5.141 1.00 0.00 N ATOM 937 CA GLY A 85 5.971 9.684 -5.077 1.00 0.00 C ATOM 938 C GLY A 85 5.859 9.145 -3.650 1.00 0.00 C ATOM 939 O GLY A 85 6.444 8.113 -3.324 1.00 0.00 O ATOM 0 H GLY A 85 4.661 11.240 -5.583 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.347 9.089 -5.744 1.00 0.00 H new ATOM 0 HA3 GLY A 85 6.998 9.584 -5.428 1.00 0.00 H new ATOM 943 N LEU A 86 5.104 9.868 -2.836 1.00 0.00 N ATOM 944 CA LEU A 86 4.908 9.476 -1.451 1.00 0.00 C ATOM 945 C LEU A 86 3.459 9.026 -1.252 1.00 0.00 C ATOM 946 O LEU A 86 2.527 9.749 -1.603 1.00 0.00 O ATOM 947 CB LEU A 86 5.337 10.603 -0.509 1.00 0.00 C ATOM 948 CG LEU A 86 5.748 10.177 0.902 1.00 0.00 C ATOM 949 CD1 LEU A 86 6.115 11.393 1.756 1.00 0.00 C ATOM 950 CD2 LEU A 86 4.660 9.324 1.557 1.00 0.00 C ATOM 0 H LEU A 86 4.621 10.723 -3.109 1.00 0.00 H new ATOM 0 HA LEU A 86 5.543 8.625 -1.203 1.00 0.00 H new ATOM 0 HB2 LEU A 86 6.173 11.133 -0.965 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.515 11.314 -0.428 1.00 0.00 H new ATOM 0 HG LEU A 86 6.640 9.556 0.825 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.403 11.063 2.754 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.948 11.924 1.295 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.256 12.059 1.828 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.978 9.035 2.559 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.736 9.899 1.621 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.489 8.429 0.958 1.00 0.00 H new ATOM 962 N LEU A 87 3.314 7.835 -0.690 1.00 0.00 N ATOM 963 CA LEU A 87 1.994 7.281 -0.441 1.00 0.00 C ATOM 964 C LEU A 87 1.181 8.268 0.399 1.00 0.00 C ATOM 965 O LEU A 87 1.697 8.846 1.355 1.00 0.00 O ATOM 966 CB LEU A 87 2.106 5.889 0.183 1.00 0.00 C ATOM 967 CG LEU A 87 2.430 4.746 -0.780 1.00 0.00 C ATOM 968 CD1 LEU A 87 3.658 5.077 -1.631 1.00 0.00 C ATOM 969 CD2 LEU A 87 2.594 3.424 -0.028 1.00 0.00 C ATOM 0 H LEU A 87 4.089 7.238 -0.400 1.00 0.00 H new ATOM 0 HA LEU A 87 1.456 7.142 -1.379 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.877 5.919 0.953 1.00 0.00 H new ATOM 0 HB3 LEU A 87 1.165 5.660 0.683 1.00 0.00 H new ATOM 0 HG LEU A 87 1.588 4.626 -1.462 1.00 0.00 H new ATOM 0 HD11 LEU A 87 3.867 4.248 -2.307 1.00 0.00 H new ATOM 0 HD12 LEU A 87 3.466 5.979 -2.212 1.00 0.00 H new ATOM 0 HD13 LEU A 87 4.518 5.240 -0.981 1.00 0.00 H new ATOM 0 HD21 LEU A 87 2.824 2.628 -0.737 1.00 0.00 H new ATOM 0 HD22 LEU A 87 3.407 3.514 0.693 1.00 0.00 H new ATOM 0 HD23 LEU A 87 1.668 3.186 0.496 1.00 0.00 H new ATOM 981 N TYR A 88 -0.075 8.431 0.013 1.00 0.00 N ATOM 982 CA TYR A 88 -0.964 9.338 0.719 1.00 0.00 C ATOM 983 C TYR A 88 -2.429 9.007 0.428 1.00 0.00 C ATOM 984 O TYR A 88 -2.754 8.498 -0.643 1.00 0.00 O ATOM 985 CB TYR A 88 -0.653 10.736 0.181 1.00 0.00 C ATOM 986 CG TYR A 88 -1.607 11.206 -0.920 1.00 0.00 C ATOM 987 CD1 TYR A 88 -1.498 10.690 -2.195 1.00 0.00 C ATOM 988 CD2 TYR A 88 -2.578 12.145 -0.637 1.00 0.00 C ATOM 989 CE1 TYR A 88 -2.395 11.132 -3.230 1.00 0.00 C ATOM 990 CE2 TYR A 88 -3.476 12.587 -1.672 1.00 0.00 C ATOM 991 CZ TYR A 88 -3.340 12.059 -2.918 1.00 0.00 C ATOM 992 OH TYR A 88 -4.188 12.476 -3.896 1.00 0.00 O ATOM 0 H TYR A 88 -0.499 7.950 -0.780 1.00 0.00 H new ATOM 0 HA TYR A 88 -0.815 9.261 1.796 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -0.688 11.448 1.006 1.00 0.00 H new ATOM 0 HB3 TYR A 88 0.366 10.747 -0.206 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -0.739 9.954 -2.416 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -2.664 12.548 0.361 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -2.319 10.736 -4.232 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -4.240 13.321 -1.464 1.00 0.00 H new ATOM 0 HH TYR A 88 -4.810 13.138 -3.529 1.00 0.00 H new ATOM 1002 N GLY A 89 -3.275 9.309 1.402 1.00 0.00 N ATOM 1003 CA GLY A 89 -4.698 9.050 1.265 1.00 0.00 C ATOM 1004 C GLY A 89 -5.460 10.334 0.929 1.00 0.00 C ATOM 1005 O GLY A 89 -5.010 11.431 1.258 1.00 0.00 O ATOM 0 H GLY A 89 -3.002 9.731 2.290 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -4.863 8.310 0.482 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.085 8.625 2.191 1.00 0.00 H new ATOM 1009 N SER A 90 -6.600 10.155 0.278 1.00 0.00 N ATOM 1010 CA SER A 90 -7.428 11.286 -0.106 1.00 0.00 C ATOM 1011 C SER A 90 -8.907 10.900 -0.031 1.00 0.00 C ATOM 1012 O SER A 90 -9.254 9.728 -0.164 1.00 0.00 O ATOM 1013 CB SER A 90 -7.076 11.773 -1.513 1.00 0.00 C ATOM 1014 OG SER A 90 -6.795 13.170 -1.539 1.00 0.00 O ATOM 0 H SER A 90 -6.970 9.244 0.007 1.00 0.00 H new ATOM 0 HA SER A 90 -7.237 12.103 0.590 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.211 11.222 -1.882 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.903 11.557 -2.189 1.00 0.00 H new ATOM 0 HG SER A 90 -6.573 13.442 -2.454 1.00 0.00 H new ATOM 1020 N GLN A 91 -9.738 11.910 0.180 1.00 0.00 N ATOM 1021 CA GLN A 91 -11.172 11.691 0.274 1.00 0.00 C ATOM 1022 C GLN A 91 -11.776 11.529 -1.123 1.00 0.00 C ATOM 1023 O GLN A 91 -12.989 11.382 -1.265 1.00 0.00 O ATOM 1024 CB GLN A 91 -11.852 12.830 1.036 1.00 0.00 C ATOM 1025 CG GLN A 91 -13.204 12.384 1.596 1.00 0.00 C ATOM 1026 CD GLN A 91 -14.162 13.571 1.723 1.00 0.00 C ATOM 1027 OE1 GLN A 91 -15.088 13.741 0.946 1.00 0.00 O ATOM 1028 NE2 GLN A 91 -13.890 14.379 2.744 1.00 0.00 N ATOM 0 H GLN A 91 -9.446 12.881 0.288 1.00 0.00 H new ATOM 0 HA GLN A 91 -11.344 10.771 0.833 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -11.209 13.162 1.851 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -11.993 13.683 0.372 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -13.640 11.628 0.944 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -13.062 11.920 2.572 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -13.099 14.179 3.356 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -14.472 15.199 2.915 1.00 0.00 H new ATOM 1037 N THR A 92 -10.902 11.561 -2.118 1.00 0.00 N ATOM 1038 CA THR A 92 -11.335 11.419 -3.498 1.00 0.00 C ATOM 1039 C THR A 92 -10.759 10.140 -4.109 1.00 0.00 C ATOM 1040 O THR A 92 -9.637 10.138 -4.611 1.00 0.00 O ATOM 1041 CB THR A 92 -10.931 12.687 -4.253 1.00 0.00 C ATOM 1042 OG1 THR A 92 -9.533 12.526 -4.480 1.00 0.00 O ATOM 1043 CG2 THR A 92 -11.023 13.942 -3.381 1.00 0.00 C ATOM 0 H THR A 92 -9.897 11.683 -1.996 1.00 0.00 H new ATOM 0 HA THR A 92 -12.418 11.315 -3.564 1.00 0.00 H new ATOM 0 HB THR A 92 -11.568 12.805 -5.130 1.00 0.00 H new ATOM 0 HG1 THR A 92 -9.388 11.811 -5.135 1.00 0.00 H new ATOM 0 HG21 THR A 92 -10.726 14.813 -3.965 1.00 0.00 H new ATOM 0 HG22 THR A 92 -12.049 14.070 -3.035 1.00 0.00 H new ATOM 0 HG23 THR A 92 -10.360 13.838 -2.522 1.00 0.00 H new ATOM 1051 N PRO A 93 -11.575 9.054 -4.043 1.00 0.00 N ATOM 1052 CA PRO A 93 -11.159 7.771 -4.583 1.00 0.00 C ATOM 1053 C PRO A 93 -11.226 7.772 -6.111 1.00 0.00 C ATOM 1054 O PRO A 93 -12.246 7.402 -6.692 1.00 0.00 O ATOM 1055 CB PRO A 93 -12.095 6.755 -3.948 1.00 0.00 C ATOM 1056 CG PRO A 93 -13.289 7.547 -3.442 1.00 0.00 C ATOM 1057 CD PRO A 93 -12.911 9.019 -3.455 1.00 0.00 C ATOM 0 HA PRO A 93 -10.120 7.534 -4.353 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -12.405 6.003 -4.673 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -11.602 6.227 -3.132 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -14.159 7.371 -4.074 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -13.558 7.231 -2.434 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -13.618 9.604 -4.043 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -12.912 9.437 -2.448 1.00 0.00 H new ATOM 1065 N ASN A 94 -10.127 8.191 -6.720 1.00 0.00 N ATOM 1066 CA ASN A 94 -10.048 8.245 -8.170 1.00 0.00 C ATOM 1067 C ASN A 94 -8.798 7.496 -8.636 1.00 0.00 C ATOM 1068 O ASN A 94 -8.094 6.893 -7.828 1.00 0.00 O ATOM 1069 CB ASN A 94 -9.945 9.690 -8.662 1.00 0.00 C ATOM 1070 CG ASN A 94 -11.253 10.446 -8.422 1.00 0.00 C ATOM 1071 OD1 ASN A 94 -11.611 10.514 -7.143 1.00 0.00 O flip ATOM 1072 ND2 ASN A 94 -11.895 10.934 -9.337 1.00 0.00 N flip ATOM 0 H ASN A 94 -9.283 8.497 -6.236 1.00 0.00 H new ATOM 0 HA ASN A 94 -10.952 7.790 -8.575 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -9.129 10.196 -8.147 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -9.705 9.700 -9.725 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -11.563 10.845 -10.297 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -12.764 11.431 -9.142 1.00 0.00 H new ATOM 1079 N GLU A 95 -8.560 7.560 -9.938 1.00 0.00 N ATOM 1080 CA GLU A 95 -7.407 6.896 -10.522 1.00 0.00 C ATOM 1081 C GLU A 95 -6.197 7.018 -9.593 1.00 0.00 C ATOM 1082 O GLU A 95 -5.426 6.072 -9.446 1.00 0.00 O ATOM 1083 CB GLU A 95 -7.093 7.460 -11.909 1.00 0.00 C ATOM 1084 CG GLU A 95 -7.768 6.631 -13.004 1.00 0.00 C ATOM 1085 CD GLU A 95 -8.876 7.430 -13.693 1.00 0.00 C ATOM 1086 OE1 GLU A 95 -8.519 8.300 -14.517 1.00 0.00 O ATOM 1087 OE2 GLU A 95 -10.054 7.154 -13.379 1.00 0.00 O ATOM 0 H GLU A 95 -9.146 8.062 -10.605 1.00 0.00 H new ATOM 0 HA GLU A 95 -7.643 5.839 -10.642 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -7.432 8.494 -11.970 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -6.014 7.468 -12.067 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.026 6.322 -13.740 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -8.186 5.722 -12.571 1.00 0.00 H new ATOM 1094 N GLU A 96 -6.070 8.192 -8.992 1.00 0.00 N ATOM 1095 CA GLU A 96 -4.967 8.450 -8.082 1.00 0.00 C ATOM 1096 C GLU A 96 -5.029 7.495 -6.888 1.00 0.00 C ATOM 1097 O GLU A 96 -4.039 6.846 -6.555 1.00 0.00 O ATOM 1098 CB GLU A 96 -4.969 9.908 -7.618 1.00 0.00 C ATOM 1099 CG GLU A 96 -3.753 10.206 -6.739 1.00 0.00 C ATOM 1100 CD GLU A 96 -3.420 11.699 -6.750 1.00 0.00 C ATOM 1101 OE1 GLU A 96 -4.059 12.417 -7.550 1.00 0.00 O ATOM 1102 OE2 GLU A 96 -2.535 12.090 -5.959 1.00 0.00 O ATOM 0 H GLU A 96 -6.712 8.975 -9.117 1.00 0.00 H new ATOM 0 HA GLU A 96 -4.033 8.274 -8.615 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -4.966 10.569 -8.485 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -5.883 10.115 -7.062 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -3.950 9.881 -5.717 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -2.895 9.636 -7.094 1.00 0.00 H new ATOM 1109 N CYS A 97 -6.203 7.440 -6.276 1.00 0.00 N ATOM 1110 CA CYS A 97 -6.407 6.575 -5.126 1.00 0.00 C ATOM 1111 C CYS A 97 -6.261 5.123 -5.585 1.00 0.00 C ATOM 1112 O CYS A 97 -5.950 4.243 -4.784 1.00 0.00 O ATOM 1113 CB CYS A 97 -7.761 6.830 -4.460 1.00 0.00 C ATOM 1114 SG CYS A 97 -7.650 8.282 -3.352 1.00 0.00 S ATOM 0 H CYS A 97 -7.022 7.980 -6.555 1.00 0.00 H new ATOM 0 HA CYS A 97 -5.656 6.792 -4.367 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -8.523 7.000 -5.220 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -8.067 5.951 -3.892 1.00 0.00 H new ATOM 0 HG CYS A 97 -8.435 9.222 -3.789 1.00 0.00 H new ATOM 1120 N LEU A 98 -6.494 4.917 -6.873 1.00 0.00 N ATOM 1121 CA LEU A 98 -6.392 3.586 -7.449 1.00 0.00 C ATOM 1122 C LEU A 98 -4.932 3.132 -7.416 1.00 0.00 C ATOM 1123 O LEU A 98 -4.043 3.908 -7.068 1.00 0.00 O ATOM 1124 CB LEU A 98 -7.014 3.558 -8.846 1.00 0.00 C ATOM 1125 CG LEU A 98 -8.432 2.992 -8.938 1.00 0.00 C ATOM 1126 CD1 LEU A 98 -9.116 3.433 -10.234 1.00 0.00 C ATOM 1127 CD2 LEU A 98 -8.426 1.470 -8.782 1.00 0.00 C ATOM 0 H LEU A 98 -6.753 5.649 -7.534 1.00 0.00 H new ATOM 0 HA LEU A 98 -6.962 2.870 -6.858 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.024 4.575 -9.238 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.367 2.971 -9.498 1.00 0.00 H new ATOM 0 HG LEU A 98 -9.016 3.398 -8.112 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -10.123 3.017 -10.274 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -9.172 4.521 -10.264 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.541 3.076 -11.089 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.446 1.093 -8.851 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.821 1.026 -9.572 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.007 1.205 -7.811 1.00 0.00 H new ATOM 1139 N PHE A 99 -4.728 1.875 -7.782 1.00 0.00 N ATOM 1140 CA PHE A 99 -3.391 1.307 -7.799 1.00 0.00 C ATOM 1141 C PHE A 99 -3.273 0.213 -8.862 1.00 0.00 C ATOM 1142 O PHE A 99 -4.050 -0.740 -8.866 1.00 0.00 O ATOM 1143 CB PHE A 99 -3.149 0.690 -6.421 1.00 0.00 C ATOM 1144 CG PHE A 99 -2.057 1.389 -5.608 1.00 0.00 C ATOM 1145 CD1 PHE A 99 -0.849 1.649 -6.175 1.00 0.00 C ATOM 1146 CD2 PHE A 99 -2.296 1.752 -4.319 1.00 0.00 C ATOM 1147 CE1 PHE A 99 0.164 2.298 -5.421 1.00 0.00 C ATOM 1148 CE2 PHE A 99 -1.282 2.401 -3.565 1.00 0.00 C ATOM 1149 CZ PHE A 99 -0.074 2.660 -4.132 1.00 0.00 C ATOM 0 H PHE A 99 -5.467 1.234 -8.069 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.661 2.082 -8.031 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.080 0.714 -5.855 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -2.879 -0.359 -6.546 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -0.660 1.362 -7.199 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.256 1.547 -3.869 1.00 0.00 H new ATOM 0 HE1 PHE A 99 1.124 2.504 -5.871 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -1.471 2.689 -2.541 1.00 0.00 H new ATOM 0 HZ PHE A 99 0.697 3.153 -3.559 1.00 0.00 H new ATOM 1159 N LEU A 100 -2.294 0.387 -9.739 1.00 0.00 N ATOM 1160 CA LEU A 100 -2.065 -0.574 -10.804 1.00 0.00 C ATOM 1161 C LEU A 100 -1.596 -1.898 -10.199 1.00 0.00 C ATOM 1162 O LEU A 100 -0.447 -2.021 -9.778 1.00 0.00 O ATOM 1163 CB LEU A 100 -1.102 0.001 -11.845 1.00 0.00 C ATOM 1164 CG LEU A 100 -1.733 0.460 -13.161 1.00 0.00 C ATOM 1165 CD1 LEU A 100 -1.000 1.678 -13.726 1.00 0.00 C ATOM 1166 CD2 LEU A 100 -1.795 -0.689 -14.170 1.00 0.00 C ATOM 0 H LEU A 100 -1.651 1.179 -9.733 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.993 -0.779 -11.339 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.581 0.849 -11.400 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.349 -0.754 -12.070 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.759 0.767 -12.958 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -1.469 1.983 -14.661 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -1.051 2.498 -13.010 1.00 0.00 H new ATOM 0 HD13 LEU A 100 0.043 1.422 -13.910 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -2.248 -0.336 -15.096 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.787 -1.049 -14.373 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -2.395 -1.501 -13.760 1.00 0.00 H new ATOM 1178 N GLU A 101 -2.511 -2.857 -10.173 1.00 0.00 N ATOM 1179 CA GLU A 101 -2.206 -4.168 -9.626 1.00 0.00 C ATOM 1180 C GLU A 101 -2.166 -5.213 -10.743 1.00 0.00 C ATOM 1181 O GLU A 101 -2.906 -5.111 -11.720 1.00 0.00 O ATOM 1182 CB GLU A 101 -3.215 -4.559 -8.545 1.00 0.00 C ATOM 1183 CG GLU A 101 -2.648 -5.651 -7.635 1.00 0.00 C ATOM 1184 CD GLU A 101 -3.619 -6.829 -7.522 1.00 0.00 C ATOM 1185 OE1 GLU A 101 -4.732 -6.599 -7.002 1.00 0.00 O ATOM 1186 OE2 GLU A 101 -3.226 -7.932 -7.959 1.00 0.00 O ATOM 0 H GLU A 101 -3.464 -2.752 -10.522 1.00 0.00 H new ATOM 0 HA GLU A 101 -1.222 -4.126 -9.160 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -3.474 -3.683 -7.950 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -4.135 -4.911 -9.011 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -1.693 -5.999 -8.029 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -2.453 -5.239 -6.645 1.00 0.00 H new ATOM 1193 N ARG A 102 -1.294 -6.194 -10.561 1.00 0.00 N ATOM 1194 CA ARG A 102 -1.147 -7.256 -11.541 1.00 0.00 C ATOM 1195 C ARG A 102 -0.799 -8.575 -10.847 1.00 0.00 C ATOM 1196 O ARG A 102 -1.688 -9.299 -10.400 1.00 0.00 O ATOM 1197 CB ARG A 102 -0.056 -6.920 -12.559 1.00 0.00 C ATOM 1198 CG ARG A 102 0.918 -5.883 -11.997 1.00 0.00 C ATOM 1199 CD ARG A 102 1.567 -5.074 -13.122 1.00 0.00 C ATOM 1200 NE ARG A 102 2.661 -4.239 -12.578 1.00 0.00 N ATOM 1201 CZ ARG A 102 3.943 -4.625 -12.519 1.00 0.00 C ATOM 1202 NH1 ARG A 102 4.300 -5.835 -12.970 1.00 0.00 N ATOM 1203 NH2 ARG A 102 4.868 -3.801 -12.009 1.00 0.00 N ATOM 0 H ARG A 102 -0.682 -6.275 -9.749 1.00 0.00 H new ATOM 0 HA ARG A 102 -2.098 -7.357 -12.065 1.00 0.00 H new ATOM 0 HB2 ARG A 102 0.487 -7.826 -12.828 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -0.511 -6.539 -13.473 1.00 0.00 H new ATOM 0 HG2 ARG A 102 0.390 -5.212 -11.320 1.00 0.00 H new ATOM 0 HG3 ARG A 102 1.690 -6.383 -11.412 1.00 0.00 H new ATOM 0 HD2 ARG A 102 1.957 -5.746 -13.886 1.00 0.00 H new ATOM 0 HD3 ARG A 102 0.821 -4.442 -13.604 1.00 0.00 H new ATOM 0 HE ARG A 102 2.424 -3.311 -12.226 1.00 0.00 H new ATOM 0 HH11 ARG A 102 3.596 -6.463 -13.358 1.00 0.00 H new ATOM 0 HH12 ARG A 102 5.276 -6.129 -12.925 1.00 0.00 H new ATOM 0 HH21 ARG A 102 4.597 -2.880 -11.666 1.00 0.00 H new ATOM 0 HH22 ARG A 102 5.844 -4.095 -11.964 1.00 0.00 H new ATOM 1217 N LEU A 103 0.496 -8.846 -10.778 1.00 0.00 N ATOM 1218 CA LEU A 103 0.972 -10.065 -10.146 1.00 0.00 C ATOM 1219 C LEU A 103 2.497 -10.126 -10.251 1.00 0.00 C ATOM 1220 O LEU A 103 3.046 -10.180 -11.350 1.00 0.00 O ATOM 1221 CB LEU A 103 0.266 -11.286 -10.737 1.00 0.00 C ATOM 1222 CG LEU A 103 -0.190 -12.348 -9.733 1.00 0.00 C ATOM 1223 CD1 LEU A 103 -0.193 -13.739 -10.370 1.00 0.00 C ATOM 1224 CD2 LEU A 103 0.660 -12.301 -8.462 1.00 0.00 C ATOM 0 H LEU A 103 1.230 -8.243 -11.149 1.00 0.00 H new ATOM 0 HA LEU A 103 0.724 -10.066 -9.085 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.606 -10.943 -11.294 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.937 -11.757 -11.455 1.00 0.00 H new ATOM 0 HG LEU A 103 -1.217 -12.125 -9.442 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -0.521 -14.475 -9.636 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -0.874 -13.748 -11.221 1.00 0.00 H new ATOM 0 HD13 LEU A 103 0.813 -13.987 -10.708 1.00 0.00 H new ATOM 0 HD21 LEU A 103 0.315 -13.065 -7.765 1.00 0.00 H new ATOM 0 HD22 LEU A 103 1.704 -12.485 -8.715 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.567 -11.319 -7.998 1.00 0.00 H new ATOM 1236 N GLU A 104 3.139 -10.115 -9.092 1.00 0.00 N ATOM 1237 CA GLU A 104 4.590 -10.168 -9.039 1.00 0.00 C ATOM 1238 C GLU A 104 5.060 -11.606 -8.809 1.00 0.00 C ATOM 1239 O GLU A 104 6.092 -12.018 -9.338 1.00 0.00 O ATOM 1240 CB GLU A 104 5.135 -9.234 -7.957 1.00 0.00 C ATOM 1241 CG GLU A 104 6.590 -9.568 -7.625 1.00 0.00 C ATOM 1242 CD GLU A 104 6.676 -10.776 -6.690 1.00 0.00 C ATOM 1243 OE1 GLU A 104 5.601 -11.208 -6.221 1.00 0.00 O ATOM 1244 OE2 GLU A 104 7.815 -11.239 -6.465 1.00 0.00 O ATOM 0 H GLU A 104 2.681 -10.070 -8.182 1.00 0.00 H new ATOM 0 HA GLU A 104 4.981 -9.826 -9.997 1.00 0.00 H new ATOM 0 HB2 GLU A 104 5.064 -8.200 -8.295 1.00 0.00 H new ATOM 0 HB3 GLU A 104 4.525 -9.318 -7.058 1.00 0.00 H new ATOM 0 HG2 GLU A 104 7.138 -9.775 -8.544 1.00 0.00 H new ATOM 0 HG3 GLU A 104 7.067 -8.707 -7.157 1.00 0.00 H new ATOM 1251 N GLU A 105 4.281 -12.330 -8.019 1.00 0.00 N ATOM 1252 CA GLU A 105 4.605 -13.713 -7.713 1.00 0.00 C ATOM 1253 C GLU A 105 3.385 -14.607 -7.942 1.00 0.00 C ATOM 1254 O GLU A 105 3.080 -14.968 -9.078 1.00 0.00 O ATOM 1255 CB GLU A 105 5.124 -13.850 -6.280 1.00 0.00 C ATOM 1256 CG GLU A 105 6.634 -13.616 -6.218 1.00 0.00 C ATOM 1257 CD GLU A 105 7.385 -14.932 -6.006 1.00 0.00 C ATOM 1258 OE1 GLU A 105 7.339 -15.768 -6.935 1.00 0.00 O ATOM 1259 OE2 GLU A 105 7.987 -15.074 -4.920 1.00 0.00 O ATOM 0 H GLU A 105 3.427 -11.985 -7.582 1.00 0.00 H new ATOM 0 HA GLU A 105 5.400 -14.037 -8.385 1.00 0.00 H new ATOM 0 HB2 GLU A 105 4.615 -13.134 -5.635 1.00 0.00 H new ATOM 0 HB3 GLU A 105 4.891 -14.844 -5.899 1.00 0.00 H new ATOM 0 HG2 GLU A 105 6.971 -13.146 -7.142 1.00 0.00 H new ATOM 0 HG3 GLU A 105 6.866 -12.926 -5.406 1.00 0.00 H new ATOM 1266 N ASN A 106 2.720 -14.940 -6.846 1.00 0.00 N ATOM 1267 CA ASN A 106 1.540 -15.785 -6.913 1.00 0.00 C ATOM 1268 C ASN A 106 0.850 -15.800 -5.548 1.00 0.00 C ATOM 1269 O ASN A 106 0.379 -16.844 -5.098 1.00 0.00 O ATOM 1270 CB ASN A 106 1.914 -17.225 -7.270 1.00 0.00 C ATOM 1271 CG ASN A 106 1.978 -17.416 -8.787 1.00 0.00 C ATOM 1272 OD1 ASN A 106 3.028 -17.341 -9.404 1.00 0.00 O ATOM 1273 ND2 ASN A 106 0.800 -17.665 -9.351 1.00 0.00 N ATOM 0 H ASN A 106 2.976 -14.640 -5.905 1.00 0.00 H new ATOM 0 HA ASN A 106 0.880 -15.382 -7.682 1.00 0.00 H new ATOM 0 HB2 ASN A 106 2.879 -17.474 -6.828 1.00 0.00 H new ATOM 0 HB3 ASN A 106 1.181 -17.911 -6.844 1.00 0.00 H new ATOM 0 HD21 ASN A 106 0.737 -17.807 -10.359 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -0.041 -17.714 -8.776 1.00 0.00 H new ATOM 1280 N HIS A 107 0.812 -14.631 -4.927 1.00 0.00 N ATOM 1281 CA HIS A 107 0.187 -14.496 -3.622 1.00 0.00 C ATOM 1282 C HIS A 107 -0.013 -13.014 -3.299 1.00 0.00 C ATOM 1283 O HIS A 107 -1.143 -12.561 -3.123 1.00 0.00 O ATOM 1284 CB HIS A 107 0.998 -15.231 -2.553 1.00 0.00 C ATOM 1285 CG HIS A 107 0.805 -16.729 -2.558 1.00 0.00 C ATOM 1286 ND1 HIS A 107 -0.317 -17.483 -2.742 1.00 0.00 N flip ATOM 1287 CD2 HIS A 107 1.845 -17.620 -2.354 1.00 0.00 C flip ATOM 1288 CE1 HIS A 107 0.020 -18.764 -2.657 1.00 0.00 C flip ATOM 1289 NE2 HIS A 107 1.359 -18.851 -2.416 1.00 0.00 N flip ATOM 0 H HIS A 107 1.204 -13.768 -5.303 1.00 0.00 H new ATOM 0 HA HIS A 107 -0.797 -14.965 -3.636 1.00 0.00 H new ATOM 0 HB2 HIS A 107 2.056 -15.011 -2.698 1.00 0.00 H new ATOM 0 HB3 HIS A 107 0.723 -14.843 -1.572 1.00 0.00 H new ATOM 0 HD2 HIS A 107 2.877 -17.356 -2.175 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -0.656 -19.600 -2.762 1.00 0.00 H new ATOM 0 HE2 HIS A 107 1.893 -19.713 -2.303 1.00 0.00 H new ATOM 1297 N TYR A 108 1.101 -12.300 -3.231 1.00 0.00 N ATOM 1298 CA TYR A 108 1.062 -10.879 -2.933 1.00 0.00 C ATOM 1299 C TYR A 108 0.355 -10.104 -4.046 1.00 0.00 C ATOM 1300 O TYR A 108 -0.336 -10.694 -4.876 1.00 0.00 O ATOM 1301 CB TYR A 108 2.521 -10.424 -2.858 1.00 0.00 C ATOM 1302 CG TYR A 108 3.437 -11.390 -2.104 1.00 0.00 C ATOM 1303 CD1 TYR A 108 3.495 -11.351 -0.725 1.00 0.00 C ATOM 1304 CD2 TYR A 108 4.204 -12.300 -2.802 1.00 0.00 C ATOM 1305 CE1 TYR A 108 4.357 -12.261 -0.016 1.00 0.00 C ATOM 1306 CE2 TYR A 108 5.066 -13.210 -2.092 1.00 0.00 C ATOM 1307 CZ TYR A 108 5.100 -13.145 -0.734 1.00 0.00 C ATOM 1308 OH TYR A 108 5.914 -14.004 -0.064 1.00 0.00 O ATOM 0 H TYR A 108 2.036 -12.680 -3.377 1.00 0.00 H new ATOM 0 HA TYR A 108 0.519 -10.696 -2.006 1.00 0.00 H new ATOM 0 HB2 TYR A 108 2.903 -10.294 -3.871 1.00 0.00 H new ATOM 0 HB3 TYR A 108 2.562 -9.448 -2.374 1.00 0.00 H new ATOM 0 HD1 TYR A 108 2.895 -10.639 -0.179 1.00 0.00 H new ATOM 0 HD2 TYR A 108 4.158 -12.330 -3.881 1.00 0.00 H new ATOM 0 HE1 TYR A 108 4.412 -12.242 1.062 1.00 0.00 H new ATOM 0 HE2 TYR A 108 5.671 -13.927 -2.626 1.00 0.00 H new ATOM 0 HH TYR A 108 6.383 -14.578 -0.705 1.00 0.00 H new ATOM 1318 N ASN A 109 0.552 -8.794 -4.029 1.00 0.00 N ATOM 1319 CA ASN A 109 -0.059 -7.932 -5.027 1.00 0.00 C ATOM 1320 C ASN A 109 0.731 -6.624 -5.116 1.00 0.00 C ATOM 1321 O ASN A 109 0.347 -5.621 -4.517 1.00 0.00 O ATOM 1322 CB ASN A 109 -1.501 -7.589 -4.650 1.00 0.00 C ATOM 1323 CG ASN A 109 -2.311 -8.856 -4.368 1.00 0.00 C ATOM 1324 OD1 ASN A 109 -2.242 -9.442 -3.300 1.00 0.00 O ATOM 1325 ND2 ASN A 109 -3.079 -9.244 -5.381 1.00 0.00 N ATOM 0 H ASN A 109 1.126 -8.308 -3.340 1.00 0.00 H new ATOM 0 HA ASN A 109 -0.052 -8.461 -5.980 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -1.507 -6.946 -3.770 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -1.968 -7.027 -5.459 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -3.658 -10.079 -5.291 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -3.089 -8.707 -6.248 1.00 0.00 H new ATOM 1332 N THR A 110 1.819 -6.678 -5.870 1.00 0.00 N ATOM 1333 CA THR A 110 2.666 -5.510 -6.046 1.00 0.00 C ATOM 1334 C THR A 110 1.973 -4.479 -6.939 1.00 0.00 C ATOM 1335 O THR A 110 1.990 -4.600 -8.162 1.00 0.00 O ATOM 1336 CB THR A 110 4.013 -5.982 -6.596 1.00 0.00 C ATOM 1337 OG1 THR A 110 3.696 -6.525 -7.875 1.00 0.00 O ATOM 1338 CG2 THR A 110 4.580 -7.170 -5.817 1.00 0.00 C ATOM 0 H THR A 110 2.134 -7.512 -6.366 1.00 0.00 H new ATOM 0 HA THR A 110 2.845 -5.004 -5.097 1.00 0.00 H new ATOM 0 HB THR A 110 4.725 -5.157 -6.568 1.00 0.00 H new ATOM 0 HG1 THR A 110 3.238 -5.847 -8.414 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.536 -7.465 -6.249 1.00 0.00 H new ATOM 0 HG22 THR A 110 4.724 -6.886 -4.775 1.00 0.00 H new ATOM 0 HG23 THR A 110 3.884 -8.007 -5.872 1.00 0.00 H new ATOM 1346 N TYR A 111 1.379 -3.487 -6.291 1.00 0.00 N ATOM 1347 CA TYR A 111 0.682 -2.435 -7.011 1.00 0.00 C ATOM 1348 C TYR A 111 1.663 -1.383 -7.532 1.00 0.00 C ATOM 1349 O TYR A 111 2.875 -1.537 -7.392 1.00 0.00 O ATOM 1350 CB TYR A 111 -0.257 -1.780 -5.995 1.00 0.00 C ATOM 1351 CG TYR A 111 -0.982 -2.775 -5.087 1.00 0.00 C ATOM 1352 CD1 TYR A 111 -0.388 -3.202 -3.917 1.00 0.00 C ATOM 1353 CD2 TYR A 111 -2.232 -3.246 -5.437 1.00 0.00 C ATOM 1354 CE1 TYR A 111 -1.070 -4.138 -3.062 1.00 0.00 C ATOM 1355 CE2 TYR A 111 -2.914 -4.182 -4.582 1.00 0.00 C ATOM 1356 CZ TYR A 111 -2.300 -4.582 -3.437 1.00 0.00 C ATOM 1357 OH TYR A 111 -2.944 -5.466 -2.629 1.00 0.00 O ATOM 0 H TYR A 111 1.366 -3.390 -5.276 1.00 0.00 H new ATOM 0 HA TYR A 111 0.150 -2.845 -7.869 1.00 0.00 H new ATOM 0 HB2 TYR A 111 0.318 -1.091 -5.376 1.00 0.00 H new ATOM 0 HB3 TYR A 111 -0.998 -1.186 -6.530 1.00 0.00 H new ATOM 0 HD1 TYR A 111 0.589 -2.834 -3.642 1.00 0.00 H new ATOM 0 HD2 TYR A 111 -2.698 -2.912 -6.352 1.00 0.00 H new ATOM 0 HE1 TYR A 111 -0.616 -4.480 -2.144 1.00 0.00 H new ATOM 0 HE2 TYR A 111 -3.892 -4.558 -4.844 1.00 0.00 H new ATOM 0 HH TYR A 111 -3.497 -6.065 -3.174 1.00 0.00 H new ATOM 1367 N ILE A 112 1.102 -0.338 -8.122 1.00 0.00 N ATOM 1368 CA ILE A 112 1.913 0.739 -8.665 1.00 0.00 C ATOM 1369 C ILE A 112 1.075 2.018 -8.733 1.00 0.00 C ATOM 1370 O ILE A 112 -0.053 1.999 -9.223 1.00 0.00 O ATOM 1371 CB ILE A 112 2.519 0.329 -10.008 1.00 0.00 C ATOM 1372 CG1 ILE A 112 3.623 -0.714 -9.816 1.00 0.00 C ATOM 1373 CG2 ILE A 112 3.015 1.552 -10.783 1.00 0.00 C ATOM 1374 CD1 ILE A 112 4.636 -0.657 -10.961 1.00 0.00 C ATOM 0 H ILE A 112 0.096 -0.214 -8.236 1.00 0.00 H new ATOM 0 HA ILE A 112 2.759 0.946 -8.010 1.00 0.00 H new ATOM 0 HB ILE A 112 1.736 -0.136 -10.607 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.131 -0.541 -8.867 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.183 -1.710 -9.765 1.00 0.00 H new ATOM 0 HG21 ILE A 112 3.441 1.232 -11.734 1.00 0.00 H new ATOM 0 HG22 ILE A 112 2.180 2.228 -10.969 1.00 0.00 H new ATOM 0 HG23 ILE A 112 3.777 2.068 -10.199 1.00 0.00 H new ATOM 0 HD11 ILE A 112 5.410 -1.408 -10.800 1.00 0.00 H new ATOM 0 HD12 ILE A 112 4.129 -0.855 -11.905 1.00 0.00 H new ATOM 0 HD13 ILE A 112 5.092 0.332 -10.994 1.00 0.00 H new ATOM 1386 N SER A 113 1.660 3.097 -8.235 1.00 0.00 N ATOM 1387 CA SER A 113 0.981 4.382 -8.234 1.00 0.00 C ATOM 1388 C SER A 113 0.425 4.682 -9.627 1.00 0.00 C ATOM 1389 O SER A 113 1.119 5.255 -10.466 1.00 0.00 O ATOM 1390 CB SER A 113 1.923 5.502 -7.786 1.00 0.00 C ATOM 1391 OG SER A 113 3.265 5.271 -8.206 1.00 0.00 O ATOM 0 H SER A 113 2.596 3.108 -7.830 1.00 0.00 H new ATOM 0 HA SER A 113 0.156 4.332 -7.524 1.00 0.00 H new ATOM 0 HB2 SER A 113 1.575 6.452 -8.191 1.00 0.00 H new ATOM 0 HB3 SER A 113 1.893 5.588 -6.700 1.00 0.00 H new ATOM 0 HG SER A 113 3.670 4.580 -7.642 1.00 0.00 H new ATOM 1397 N LYS A 114 -0.821 4.281 -9.831 1.00 0.00 N ATOM 1398 CA LYS A 114 -1.478 4.499 -11.108 1.00 0.00 C ATOM 1399 C LYS A 114 -1.322 5.967 -11.513 1.00 0.00 C ATOM 1400 O LYS A 114 -1.059 6.269 -12.675 1.00 0.00 O ATOM 1401 CB LYS A 114 -2.932 4.028 -11.050 1.00 0.00 C ATOM 1402 CG LYS A 114 -3.620 4.202 -12.406 1.00 0.00 C ATOM 1403 CD LYS A 114 -4.931 3.416 -12.461 1.00 0.00 C ATOM 1404 CE LYS A 114 -4.999 2.550 -13.721 1.00 0.00 C ATOM 1405 NZ LYS A 114 -4.399 3.262 -14.871 1.00 0.00 N ATOM 0 H LYS A 114 -1.393 3.806 -9.133 1.00 0.00 H new ATOM 0 HA LYS A 114 -1.005 3.901 -11.887 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -2.967 2.980 -10.753 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -3.471 4.593 -10.290 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.818 5.259 -12.584 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -2.955 3.864 -13.201 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -5.018 2.785 -11.577 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -5.774 4.107 -12.444 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -4.473 1.610 -13.553 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -6.037 2.299 -13.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -4.864 2.957 -15.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -4.527 4.287 -14.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -3.384 3.043 -14.923 1.00 0.00 H new ATOM 1419 N LYS A 115 -1.492 6.839 -10.530 1.00 0.00 N ATOM 1420 CA LYS A 115 -1.374 8.267 -10.768 1.00 0.00 C ATOM 1421 C LYS A 115 -0.125 8.538 -11.610 1.00 0.00 C ATOM 1422 O LYS A 115 -0.061 9.533 -12.330 1.00 0.00 O ATOM 1423 CB LYS A 115 -1.402 9.036 -9.446 1.00 0.00 C ATOM 1424 CG LYS A 115 -2.123 10.376 -9.605 1.00 0.00 C ATOM 1425 CD LYS A 115 -1.234 11.535 -9.151 1.00 0.00 C ATOM 1426 CE LYS A 115 -0.623 12.259 -10.352 1.00 0.00 C ATOM 1427 NZ LYS A 115 -1.669 12.982 -11.109 1.00 0.00 N ATOM 0 H LYS A 115 -1.711 6.584 -9.567 1.00 0.00 H new ATOM 0 HA LYS A 115 -2.229 8.629 -11.339 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -1.902 8.438 -8.684 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -0.383 9.206 -9.099 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -2.408 10.518 -10.648 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -3.044 10.369 -9.021 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -1.820 12.237 -8.558 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -0.440 11.158 -8.506 1.00 0.00 H new ATOM 0 HE2 LYS A 115 0.139 12.961 -10.012 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.126 11.540 -11.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -1.241 13.784 -11.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -2.109 12.337 -11.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -2.393 13.334 -10.451 1.00 0.00 H new ATOM 1441 N HIS A 116 0.837 7.634 -11.492 1.00 0.00 N ATOM 1442 CA HIS A 116 2.080 7.763 -12.233 1.00 0.00 C ATOM 1443 C HIS A 116 2.849 6.441 -12.179 1.00 0.00 C ATOM 1444 O HIS A 116 3.829 6.319 -11.447 1.00 0.00 O ATOM 1445 CB HIS A 116 2.900 8.947 -11.717 1.00 0.00 C ATOM 1446 CG HIS A 116 2.532 9.387 -10.320 1.00 0.00 C ATOM 1447 ND1 HIS A 116 2.630 8.551 -9.221 1.00 0.00 N ATOM 1448 CD2 HIS A 116 2.067 10.582 -9.855 1.00 0.00 C ATOM 1449 CE1 HIS A 116 2.238 9.223 -8.149 1.00 0.00 C ATOM 1450 NE2 HIS A 116 1.889 10.481 -8.544 1.00 0.00 N ATOM 0 H HIS A 116 0.780 6.809 -10.894 1.00 0.00 H new ATOM 0 HA HIS A 116 1.863 7.975 -13.280 1.00 0.00 H new ATOM 0 HB2 HIS A 116 3.957 8.680 -11.736 1.00 0.00 H new ATOM 0 HB3 HIS A 116 2.772 9.789 -12.398 1.00 0.00 H new ATOM 0 HD1 HIS A 116 2.950 7.582 -9.234 1.00 0.00 H new ATOM 0 HD2 HIS A 116 1.876 11.461 -10.452 1.00 0.00 H new ATOM 0 HE1 HIS A 116 2.201 8.842 -7.139 1.00 0.00 H new ATOM 1458 N ALA A 117 2.374 5.485 -12.964 1.00 0.00 N ATOM 1459 CA ALA A 117 3.005 4.177 -13.015 1.00 0.00 C ATOM 1460 C ALA A 117 4.056 4.166 -14.127 1.00 0.00 C ATOM 1461 O ALA A 117 4.719 3.154 -14.348 1.00 0.00 O ATOM 1462 CB ALA A 117 1.935 3.102 -13.215 1.00 0.00 C ATOM 0 H ALA A 117 1.560 5.590 -13.570 1.00 0.00 H new ATOM 0 HA ALA A 117 3.515 3.960 -12.076 1.00 0.00 H new ATOM 0 HB1 ALA A 117 2.408 2.121 -13.253 1.00 0.00 H new ATOM 0 HB2 ALA A 117 1.229 3.132 -12.385 1.00 0.00 H new ATOM 0 HB3 ALA A 117 1.405 3.286 -14.149 1.00 0.00 H new ATOM 1468 N GLU A 118 4.176 5.303 -14.796 1.00 0.00 N ATOM 1469 CA GLU A 118 5.136 5.437 -15.879 1.00 0.00 C ATOM 1470 C GLU A 118 6.563 5.309 -15.342 1.00 0.00 C ATOM 1471 O GLU A 118 7.490 5.019 -16.096 1.00 0.00 O ATOM 1472 CB GLU A 118 4.946 6.761 -16.620 1.00 0.00 C ATOM 1473 CG GLU A 118 6.182 7.106 -17.453 1.00 0.00 C ATOM 1474 CD GLU A 118 5.808 7.978 -18.653 1.00 0.00 C ATOM 1475 OE1 GLU A 118 5.810 9.216 -18.478 1.00 0.00 O ATOM 1476 OE2 GLU A 118 5.528 7.388 -19.719 1.00 0.00 O ATOM 0 H GLU A 118 3.624 6.140 -14.609 1.00 0.00 H new ATOM 0 HA GLU A 118 4.963 4.632 -16.593 1.00 0.00 H new ATOM 0 HB2 GLU A 118 4.072 6.697 -17.269 1.00 0.00 H new ATOM 0 HB3 GLU A 118 4.752 7.559 -15.903 1.00 0.00 H new ATOM 0 HG2 GLU A 118 6.909 7.629 -16.832 1.00 0.00 H new ATOM 0 HG3 GLU A 118 6.659 6.189 -17.800 1.00 0.00 H new ATOM 1483 N LYS A 119 6.694 5.532 -14.042 1.00 0.00 N ATOM 1484 CA LYS A 119 7.993 5.446 -13.395 1.00 0.00 C ATOM 1485 C LYS A 119 8.070 4.149 -12.587 1.00 0.00 C ATOM 1486 O LYS A 119 9.057 3.902 -11.896 1.00 0.00 O ATOM 1487 CB LYS A 119 8.264 6.703 -12.568 1.00 0.00 C ATOM 1488 CG LYS A 119 9.513 7.431 -13.068 1.00 0.00 C ATOM 1489 CD LYS A 119 9.461 8.918 -12.714 1.00 0.00 C ATOM 1490 CE LYS A 119 10.826 9.417 -12.239 1.00 0.00 C ATOM 1491 NZ LYS A 119 11.740 9.602 -13.389 1.00 0.00 N ATOM 0 H LYS A 119 5.922 5.772 -13.420 1.00 0.00 H new ATOM 0 HA LYS A 119 8.788 5.406 -14.140 1.00 0.00 H new ATOM 0 HB2 LYS A 119 7.404 7.370 -12.622 1.00 0.00 H new ATOM 0 HB3 LYS A 119 8.392 6.432 -11.520 1.00 0.00 H new ATOM 0 HG2 LYS A 119 10.402 6.980 -12.627 1.00 0.00 H new ATOM 0 HG3 LYS A 119 9.598 7.314 -14.148 1.00 0.00 H new ATOM 0 HD2 LYS A 119 9.143 9.492 -13.585 1.00 0.00 H new ATOM 0 HD3 LYS A 119 8.718 9.084 -11.934 1.00 0.00 H new ATOM 0 HE2 LYS A 119 10.709 10.360 -11.705 1.00 0.00 H new ATOM 0 HE3 LYS A 119 11.256 8.703 -11.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 12.662 9.941 -13.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 11.865 8.695 -13.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 11.335 10.300 -14.045 1.00 0.00 H new ATOM 1505 N ASN A 120 7.015 3.355 -12.700 1.00 0.00 N ATOM 1506 CA ASN A 120 6.951 2.090 -11.988 1.00 0.00 C ATOM 1507 C ASN A 120 6.924 2.358 -10.482 1.00 0.00 C ATOM 1508 O ASN A 120 7.219 1.469 -9.684 1.00 0.00 O ATOM 1509 CB ASN A 120 8.174 1.224 -12.293 1.00 0.00 C ATOM 1510 CG ASN A 120 7.794 0.024 -13.162 1.00 0.00 C ATOM 1511 OD1 ASN A 120 6.894 0.300 -14.102 1.00 0.00 O flip ATOM 1512 ND2 ASN A 120 8.285 -1.080 -12.991 1.00 0.00 N flip ATOM 0 H ASN A 120 6.198 3.563 -13.274 1.00 0.00 H new ATOM 0 HA ASN A 120 6.050 1.567 -12.310 1.00 0.00 H new ATOM 0 HB2 ASN A 120 8.929 1.822 -12.803 1.00 0.00 H new ATOM 0 HB3 ASN A 120 8.619 0.876 -11.361 1.00 0.00 H new ATOM 0 HD21 ASN A 120 8.971 -1.224 -12.250 1.00 0.00 H new ATOM 0 HD22 ASN A 120 8.009 -1.859 -13.589 1.00 0.00 H new ATOM 1519 N TRP A 121 6.569 3.587 -10.138 1.00 0.00 N ATOM 1520 CA TRP A 121 6.501 3.984 -8.742 1.00 0.00 C ATOM 1521 C TRP A 121 5.595 2.989 -8.012 1.00 0.00 C ATOM 1522 O TRP A 121 4.380 3.173 -7.961 1.00 0.00 O ATOM 1523 CB TRP A 121 6.029 5.433 -8.605 1.00 0.00 C ATOM 1524 CG TRP A 121 7.106 6.471 -8.930 1.00 0.00 C ATOM 1525 CD1 TRP A 121 8.404 6.260 -9.187 1.00 0.00 C ATOM 1526 CD2 TRP A 121 6.922 7.899 -9.024 1.00 0.00 C ATOM 1527 NE1 TRP A 121 9.068 7.443 -9.438 1.00 0.00 N ATOM 1528 CE2 TRP A 121 8.139 8.472 -9.335 1.00 0.00 C ATOM 1529 CE3 TRP A 121 5.767 8.681 -8.850 1.00 0.00 C ATOM 1530 CZ2 TRP A 121 8.317 9.851 -9.501 1.00 0.00 C ATOM 1531 CZ3 TRP A 121 5.962 10.058 -9.019 1.00 0.00 C ATOM 1532 CH2 TRP A 121 7.180 10.650 -9.333 1.00 0.00 C ATOM 0 H TRP A 121 6.325 4.322 -10.802 1.00 0.00 H new ATOM 0 HA TRP A 121 7.490 3.956 -8.285 1.00 0.00 H new ATOM 0 HB2 TRP A 121 5.176 5.591 -9.265 1.00 0.00 H new ATOM 0 HB3 TRP A 121 5.678 5.595 -7.586 1.00 0.00 H new ATOM 0 HD1 TRP A 121 8.872 5.286 -9.196 1.00 0.00 H new ATOM 0 HE1 TRP A 121 10.059 7.544 -9.659 1.00 0.00 H new ATOM 0 HE3 TRP A 121 4.806 8.254 -8.605 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 9.280 10.275 -9.745 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 5.106 10.705 -8.897 1.00 0.00 H new ATOM 0 HH2 TRP A 121 7.249 11.722 -9.447 1.00 0.00 H new ATOM 1543 N PHE A 122 6.222 1.958 -7.465 1.00 0.00 N ATOM 1544 CA PHE A 122 5.488 0.935 -6.741 1.00 0.00 C ATOM 1545 C PHE A 122 4.937 1.484 -5.423 1.00 0.00 C ATOM 1546 O PHE A 122 4.979 2.690 -5.184 1.00 0.00 O ATOM 1547 CB PHE A 122 6.476 -0.193 -6.435 1.00 0.00 C ATOM 1548 CG PHE A 122 6.527 -1.283 -7.508 1.00 0.00 C ATOM 1549 CD1 PHE A 122 7.395 -1.173 -8.549 1.00 0.00 C ATOM 1550 CD2 PHE A 122 5.705 -2.363 -7.419 1.00 0.00 C ATOM 1551 CE1 PHE A 122 7.442 -2.185 -9.544 1.00 0.00 C ATOM 1552 CE2 PHE A 122 5.752 -3.375 -8.414 1.00 0.00 C ATOM 1553 CZ PHE A 122 6.620 -3.264 -9.456 1.00 0.00 C ATOM 0 H PHE A 122 7.230 1.809 -7.509 1.00 0.00 H new ATOM 0 HA PHE A 122 4.646 0.588 -7.340 1.00 0.00 H new ATOM 0 HB2 PHE A 122 7.472 0.233 -6.316 1.00 0.00 H new ATOM 0 HB3 PHE A 122 6.208 -0.648 -5.481 1.00 0.00 H new ATOM 0 HD1 PHE A 122 8.049 -0.316 -8.619 1.00 0.00 H new ATOM 0 HD2 PHE A 122 5.017 -2.451 -6.592 1.00 0.00 H new ATOM 0 HE1 PHE A 122 8.131 -2.097 -10.371 1.00 0.00 H new ATOM 0 HE2 PHE A 122 5.099 -4.232 -8.344 1.00 0.00 H new ATOM 0 HZ PHE A 122 6.656 -4.033 -10.213 1.00 0.00 H new ATOM 1563 N VAL A 123 4.433 0.573 -4.604 1.00 0.00 N ATOM 1564 CA VAL A 123 3.874 0.952 -3.317 1.00 0.00 C ATOM 1565 C VAL A 123 4.579 0.167 -2.209 1.00 0.00 C ATOM 1566 O VAL A 123 3.930 -0.353 -1.302 1.00 0.00 O ATOM 1567 CB VAL A 123 2.358 0.745 -3.324 1.00 0.00 C ATOM 1568 CG1 VAL A 123 2.000 -0.677 -3.761 1.00 0.00 C ATOM 1569 CG2 VAL A 123 1.755 1.067 -1.955 1.00 0.00 C ATOM 0 H VAL A 123 4.400 -0.426 -4.806 1.00 0.00 H new ATOM 0 HA VAL A 123 4.043 2.011 -3.124 1.00 0.00 H new ATOM 0 HB VAL A 123 1.929 1.436 -4.050 1.00 0.00 H new ATOM 0 HG11 VAL A 123 0.917 -0.797 -3.757 1.00 0.00 H new ATOM 0 HG12 VAL A 123 2.381 -0.856 -4.766 1.00 0.00 H new ATOM 0 HG13 VAL A 123 2.447 -1.393 -3.071 1.00 0.00 H new ATOM 0 HG21 VAL A 123 0.677 0.912 -1.987 1.00 0.00 H new ATOM 0 HG22 VAL A 123 2.194 0.413 -1.201 1.00 0.00 H new ATOM 0 HG23 VAL A 123 1.965 2.106 -1.700 1.00 0.00 H new ATOM 1579 N GLY A 124 5.898 0.105 -2.319 1.00 0.00 N ATOM 1580 CA GLY A 124 6.698 -0.608 -1.337 1.00 0.00 C ATOM 1581 C GLY A 124 7.231 0.347 -0.267 1.00 0.00 C ATOM 1582 O GLY A 124 6.866 1.521 -0.240 1.00 0.00 O ATOM 0 H GLY A 124 6.433 0.537 -3.073 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.096 -1.386 -0.868 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.531 -1.105 -1.833 1.00 0.00 H new ATOM 1586 N LEU A 125 8.086 -0.193 0.589 1.00 0.00 N ATOM 1587 CA LEU A 125 8.672 0.595 1.659 1.00 0.00 C ATOM 1588 C LEU A 125 10.043 0.019 2.019 1.00 0.00 C ATOM 1589 O LEU A 125 10.152 -1.149 2.388 1.00 0.00 O ATOM 1590 CB LEU A 125 7.712 0.685 2.847 1.00 0.00 C ATOM 1591 CG LEU A 125 6.225 0.527 2.521 1.00 0.00 C ATOM 1592 CD1 LEU A 125 5.922 -0.884 2.014 1.00 0.00 C ATOM 1593 CD2 LEU A 125 5.357 0.903 3.724 1.00 0.00 C ATOM 0 H LEU A 125 8.387 -1.167 0.563 1.00 0.00 H new ATOM 0 HA LEU A 125 8.833 1.622 1.331 1.00 0.00 H new ATOM 0 HB2 LEU A 125 7.988 -0.082 3.571 1.00 0.00 H new ATOM 0 HB3 LEU A 125 7.857 1.650 3.333 1.00 0.00 H new ATOM 0 HG LEU A 125 5.976 1.219 1.716 1.00 0.00 H new ATOM 0 HD11 LEU A 125 4.859 -0.970 1.790 1.00 0.00 H new ATOM 0 HD12 LEU A 125 6.500 -1.078 1.111 1.00 0.00 H new ATOM 0 HD13 LEU A 125 6.191 -1.611 2.780 1.00 0.00 H new ATOM 0 HD21 LEU A 125 4.305 0.782 3.466 1.00 0.00 H new ATOM 0 HD22 LEU A 125 5.601 0.255 4.566 1.00 0.00 H new ATOM 0 HD23 LEU A 125 5.546 1.941 3.999 1.00 0.00 H new ATOM 1605 N LYS A 126 11.055 0.866 1.900 1.00 0.00 N ATOM 1606 CA LYS A 126 12.415 0.456 2.208 1.00 0.00 C ATOM 1607 C LYS A 126 12.397 -0.495 3.406 1.00 0.00 C ATOM 1608 O LYS A 126 11.865 -0.157 4.463 1.00 0.00 O ATOM 1609 CB LYS A 126 13.311 1.679 2.407 1.00 0.00 C ATOM 1610 CG LYS A 126 14.790 1.297 2.311 1.00 0.00 C ATOM 1611 CD LYS A 126 15.685 2.531 2.437 1.00 0.00 C ATOM 1612 CE LYS A 126 17.140 2.189 2.110 1.00 0.00 C ATOM 1613 NZ LYS A 126 18.061 2.978 2.958 1.00 0.00 N ATOM 0 H LYS A 126 10.960 1.835 1.594 1.00 0.00 H new ATOM 0 HA LYS A 126 12.846 -0.093 1.371 1.00 0.00 H new ATOM 0 HB2 LYS A 126 13.077 2.432 1.655 1.00 0.00 H new ATOM 0 HB3 LYS A 126 13.110 2.127 3.380 1.00 0.00 H new ATOM 0 HG2 LYS A 126 15.036 0.583 3.097 1.00 0.00 H new ATOM 0 HG3 LYS A 126 14.980 0.801 1.359 1.00 0.00 H new ATOM 0 HD2 LYS A 126 15.331 3.312 1.764 1.00 0.00 H new ATOM 0 HD3 LYS A 126 15.620 2.930 3.449 1.00 0.00 H new ATOM 0 HE2 LYS A 126 17.314 1.124 2.267 1.00 0.00 H new ATOM 0 HE3 LYS A 126 17.340 2.393 1.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 19.044 2.734 2.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 17.906 3.992 2.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 17.881 2.763 3.959 1.00 0.00 H new ATOM 1627 N LYS A 127 12.983 -1.665 3.201 1.00 0.00 N ATOM 1628 CA LYS A 127 13.041 -2.667 4.252 1.00 0.00 C ATOM 1629 C LYS A 127 13.921 -2.153 5.393 1.00 0.00 C ATOM 1630 O LYS A 127 14.930 -2.770 5.731 1.00 0.00 O ATOM 1631 CB LYS A 127 13.496 -4.014 3.684 1.00 0.00 C ATOM 1632 CG LYS A 127 14.858 -3.888 3.000 1.00 0.00 C ATOM 1633 CD LYS A 127 15.987 -4.304 3.946 1.00 0.00 C ATOM 1634 CE LYS A 127 16.898 -5.343 3.288 1.00 0.00 C ATOM 1635 NZ LYS A 127 17.828 -5.920 4.284 1.00 0.00 N ATOM 0 H LYS A 127 13.422 -1.942 2.323 1.00 0.00 H new ATOM 0 HA LYS A 127 12.048 -2.841 4.667 1.00 0.00 H new ATOM 0 HB2 LYS A 127 13.554 -4.750 4.486 1.00 0.00 H new ATOM 0 HB3 LYS A 127 12.758 -4.379 2.969 1.00 0.00 H new ATOM 0 HG2 LYS A 127 14.879 -4.512 2.106 1.00 0.00 H new ATOM 0 HG3 LYS A 127 15.012 -2.859 2.675 1.00 0.00 H new ATOM 0 HD2 LYS A 127 16.572 -3.428 4.227 1.00 0.00 H new ATOM 0 HD3 LYS A 127 15.565 -4.714 4.864 1.00 0.00 H new ATOM 0 HE2 LYS A 127 16.295 -6.135 2.843 1.00 0.00 H new ATOM 0 HE3 LYS A 127 17.463 -4.880 2.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 18.462 -6.598 3.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 18.392 -5.159 4.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 17.285 -6.409 5.024 1.00 0.00 H new ATOM 1649 N ASN A 128 13.506 -1.028 5.957 1.00 0.00 N ATOM 1650 CA ASN A 128 14.243 -0.424 7.053 1.00 0.00 C ATOM 1651 C ASN A 128 13.258 0.220 8.031 1.00 0.00 C ATOM 1652 O ASN A 128 13.409 0.089 9.245 1.00 0.00 O ATOM 1653 CB ASN A 128 15.188 0.668 6.546 1.00 0.00 C ATOM 1654 CG ASN A 128 16.446 0.059 5.925 1.00 0.00 C ATOM 1655 OD1 ASN A 128 16.542 -0.144 4.726 1.00 0.00 O ATOM 1656 ND2 ASN A 128 17.404 -0.219 6.805 1.00 0.00 N ATOM 0 H ASN A 128 12.668 -0.519 5.675 1.00 0.00 H new ATOM 0 HA ASN A 128 14.825 -1.207 7.540 1.00 0.00 H new ATOM 0 HB2 ASN A 128 14.675 1.284 5.807 1.00 0.00 H new ATOM 0 HB3 ASN A 128 15.466 1.325 7.370 1.00 0.00 H new ATOM 0 HD21 ASN A 128 18.284 -0.627 6.489 1.00 0.00 H new ATOM 0 HD22 ASN A 128 17.259 -0.024 7.796 1.00 0.00 H new ATOM 1663 N GLY A 129 12.273 0.901 7.466 1.00 0.00 N ATOM 1664 CA GLY A 129 11.263 1.565 8.273 1.00 0.00 C ATOM 1665 C GLY A 129 10.943 2.954 7.717 1.00 0.00 C ATOM 1666 O GLY A 129 11.151 3.961 8.392 1.00 0.00 O ATOM 0 H GLY A 129 12.152 1.008 6.459 1.00 0.00 H new ATOM 0 HA2 GLY A 129 10.356 0.961 8.296 1.00 0.00 H new ATOM 0 HA3 GLY A 129 11.614 1.653 9.301 1.00 0.00 H new ATOM 1670 N SER A 130 10.442 2.964 6.490 1.00 0.00 N ATOM 1671 CA SER A 130 10.090 4.212 5.835 1.00 0.00 C ATOM 1672 C SER A 130 9.526 3.931 4.441 1.00 0.00 C ATOM 1673 O SER A 130 10.015 3.049 3.736 1.00 0.00 O ATOM 1674 CB SER A 130 11.300 5.144 5.740 1.00 0.00 C ATOM 1675 OG SER A 130 11.510 5.872 6.947 1.00 0.00 O ATOM 0 H SER A 130 10.272 2.127 5.932 1.00 0.00 H new ATOM 0 HA SER A 130 9.328 4.710 6.434 1.00 0.00 H new ATOM 0 HB2 SER A 130 12.191 4.559 5.510 1.00 0.00 H new ATOM 0 HB3 SER A 130 11.156 5.843 4.916 1.00 0.00 H new ATOM 0 HG SER A 130 11.137 5.370 7.701 1.00 0.00 H new ATOM 1681 N CYS A 131 8.506 4.697 4.085 1.00 0.00 N ATOM 1682 CA CYS A 131 7.870 4.542 2.788 1.00 0.00 C ATOM 1683 C CYS A 131 8.928 4.758 1.705 1.00 0.00 C ATOM 1684 O CYS A 131 10.033 5.217 1.994 1.00 0.00 O ATOM 1685 CB CYS A 131 6.682 5.492 2.623 1.00 0.00 C ATOM 1686 SG CYS A 131 5.236 4.578 1.972 1.00 0.00 S ATOM 0 H CYS A 131 8.104 5.427 4.672 1.00 0.00 H new ATOM 0 HA CYS A 131 7.461 3.536 2.699 1.00 0.00 H new ATOM 0 HB2 CYS A 131 6.434 5.947 3.582 1.00 0.00 H new ATOM 0 HB3 CYS A 131 6.946 6.303 1.944 1.00 0.00 H new ATOM 0 HG CYS A 131 4.157 4.990 2.569 1.00 0.00 H new ATOM 1692 N LYS A 132 8.555 4.418 0.480 1.00 0.00 N ATOM 1693 CA LYS A 132 9.458 4.569 -0.647 1.00 0.00 C ATOM 1694 C LYS A 132 9.064 5.812 -1.448 1.00 0.00 C ATOM 1695 O LYS A 132 7.893 5.997 -1.776 1.00 0.00 O ATOM 1696 CB LYS A 132 9.495 3.286 -1.481 1.00 0.00 C ATOM 1697 CG LYS A 132 10.573 2.330 -0.968 1.00 0.00 C ATOM 1698 CD LYS A 132 11.088 1.430 -2.093 1.00 0.00 C ATOM 1699 CE LYS A 132 12.606 1.554 -2.243 1.00 0.00 C ATOM 1700 NZ LYS A 132 13.016 1.247 -3.631 1.00 0.00 N ATOM 0 H LYS A 132 7.638 4.038 0.244 1.00 0.00 H new ATOM 0 HA LYS A 132 10.479 4.724 -0.298 1.00 0.00 H new ATOM 0 HB2 LYS A 132 8.522 2.796 -1.444 1.00 0.00 H new ATOM 0 HB3 LYS A 132 9.689 3.532 -2.525 1.00 0.00 H new ATOM 0 HG2 LYS A 132 11.400 2.901 -0.547 1.00 0.00 H new ATOM 0 HG3 LYS A 132 10.167 1.717 -0.164 1.00 0.00 H new ATOM 0 HD2 LYS A 132 10.823 0.393 -1.884 1.00 0.00 H new ATOM 0 HD3 LYS A 132 10.603 1.701 -3.031 1.00 0.00 H new ATOM 0 HE2 LYS A 132 12.922 2.563 -1.979 1.00 0.00 H new ATOM 0 HE3 LYS A 132 13.103 0.873 -1.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 13.997 1.560 -3.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 12.951 0.222 -3.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 12.389 1.743 -4.296 1.00 0.00 H new ATOM 1714 N ARG A 133 10.064 6.630 -1.740 1.00 0.00 N ATOM 1715 CA ARG A 133 9.836 7.850 -2.496 1.00 0.00 C ATOM 1716 C ARG A 133 9.733 7.537 -3.990 1.00 0.00 C ATOM 1717 O ARG A 133 10.287 6.544 -4.460 1.00 0.00 O ATOM 1718 CB ARG A 133 10.965 8.857 -2.270 1.00 0.00 C ATOM 1719 CG ARG A 133 10.411 10.272 -2.095 1.00 0.00 C ATOM 1720 CD ARG A 133 11.350 11.310 -2.715 1.00 0.00 C ATOM 1721 NE ARG A 133 11.962 12.137 -1.651 1.00 0.00 N ATOM 1722 CZ ARG A 133 12.451 13.369 -1.846 1.00 0.00 C ATOM 1723 NH1 ARG A 133 12.403 13.924 -3.065 1.00 0.00 N ATOM 1724 NH2 ARG A 133 12.989 14.046 -0.822 1.00 0.00 N ATOM 0 H ARG A 133 11.034 6.472 -1.467 1.00 0.00 H new ATOM 0 HA ARG A 133 8.900 8.286 -2.147 1.00 0.00 H new ATOM 0 HB2 ARG A 133 11.537 8.575 -1.386 1.00 0.00 H new ATOM 0 HB3 ARG A 133 11.652 8.834 -3.116 1.00 0.00 H new ATOM 0 HG2 ARG A 133 9.428 10.342 -2.561 1.00 0.00 H new ATOM 0 HG3 ARG A 133 10.277 10.485 -1.034 1.00 0.00 H new ATOM 0 HD2 ARG A 133 12.128 10.810 -3.292 1.00 0.00 H new ATOM 0 HD3 ARG A 133 10.798 11.945 -3.408 1.00 0.00 H new ATOM 0 HE ARG A 133 12.015 11.745 -0.711 1.00 0.00 H new ATOM 0 HH11 ARG A 133 11.994 13.408 -3.844 1.00 0.00 H new ATOM 0 HH12 ARG A 133 12.775 14.862 -3.213 1.00 0.00 H new ATOM 0 HH21 ARG A 133 13.026 13.623 0.106 1.00 0.00 H new ATOM 0 HH22 ARG A 133 13.361 14.984 -0.970 1.00 0.00 H new ATOM 1738 N GLY A 134 9.021 8.402 -4.696 1.00 0.00 N ATOM 1739 CA GLY A 134 8.838 8.231 -6.127 1.00 0.00 C ATOM 1740 C GLY A 134 10.108 7.680 -6.780 1.00 0.00 C ATOM 1741 O GLY A 134 10.098 6.582 -7.335 1.00 0.00 O ATOM 0 H GLY A 134 8.563 9.225 -4.303 1.00 0.00 H new ATOM 0 HA2 GLY A 134 8.006 7.552 -6.312 1.00 0.00 H new ATOM 0 HA3 GLY A 134 8.577 9.187 -6.581 1.00 0.00 H new ATOM 1745 N PRO A 135 11.198 8.488 -6.689 1.00 0.00 N ATOM 1746 CA PRO A 135 12.472 8.093 -7.264 1.00 0.00 C ATOM 1747 C PRO A 135 13.152 7.022 -6.407 1.00 0.00 C ATOM 1748 O PRO A 135 14.303 7.183 -6.004 1.00 0.00 O ATOM 1749 CB PRO A 135 13.278 9.379 -7.356 1.00 0.00 C ATOM 1750 CG PRO A 135 12.607 10.359 -6.408 1.00 0.00 C ATOM 1751 CD PRO A 135 11.245 9.794 -6.039 1.00 0.00 C ATOM 0 HA PRO A 135 12.365 7.634 -8.247 1.00 0.00 H new ATOM 0 HB2 PRO A 135 14.317 9.210 -7.072 1.00 0.00 H new ATOM 0 HB3 PRO A 135 13.284 9.764 -8.376 1.00 0.00 H new ATOM 0 HG2 PRO A 135 13.215 10.503 -5.515 1.00 0.00 H new ATOM 0 HG3 PRO A 135 12.500 11.335 -6.881 1.00 0.00 H new ATOM 0 HD2 PRO A 135 11.133 9.703 -4.959 1.00 0.00 H new ATOM 0 HD3 PRO A 135 10.440 10.440 -6.389 1.00 0.00 H new ATOM 1759 N ARG A 136 12.410 5.954 -6.155 1.00 0.00 N ATOM 1760 CA ARG A 136 12.926 4.857 -5.354 1.00 0.00 C ATOM 1761 C ARG A 136 11.801 3.883 -5.000 1.00 0.00 C ATOM 1762 O ARG A 136 11.740 3.381 -3.878 1.00 0.00 O ATOM 1763 CB ARG A 136 13.570 5.372 -4.065 1.00 0.00 C ATOM 1764 CG ARG A 136 15.089 5.478 -4.215 1.00 0.00 C ATOM 1765 CD ARG A 136 15.806 4.720 -3.096 1.00 0.00 C ATOM 1766 NE ARG A 136 17.249 5.046 -3.107 1.00 0.00 N ATOM 1767 CZ ARG A 136 18.202 4.257 -2.591 1.00 0.00 C ATOM 1768 NH1 ARG A 136 17.869 3.092 -2.020 1.00 0.00 N ATOM 1769 NH2 ARG A 136 19.486 4.634 -2.646 1.00 0.00 N ATOM 0 H ARG A 136 11.456 5.825 -6.491 1.00 0.00 H new ATOM 0 HA ARG A 136 13.684 4.343 -5.945 1.00 0.00 H new ATOM 0 HB2 ARG A 136 13.157 6.349 -3.813 1.00 0.00 H new ATOM 0 HB3 ARG A 136 13.328 4.701 -3.240 1.00 0.00 H new ATOM 0 HG2 ARG A 136 15.391 5.077 -5.182 1.00 0.00 H new ATOM 0 HG3 ARG A 136 15.387 6.526 -4.198 1.00 0.00 H new ATOM 0 HD2 ARG A 136 15.373 4.984 -2.131 1.00 0.00 H new ATOM 0 HD3 ARG A 136 15.666 3.647 -3.225 1.00 0.00 H new ATOM 0 HE ARG A 136 17.537 5.926 -3.534 1.00 0.00 H new ATOM 0 HH11 ARG A 136 16.891 2.806 -1.978 1.00 0.00 H new ATOM 0 HH12 ARG A 136 18.594 2.491 -1.627 1.00 0.00 H new ATOM 0 HH21 ARG A 136 19.739 5.522 -3.081 1.00 0.00 H new ATOM 0 HH22 ARG A 136 20.211 4.034 -2.253 1.00 0.00 H new ATOM 1783 N THR A 137 10.939 3.644 -5.977 1.00 0.00 N ATOM 1784 CA THR A 137 9.819 2.739 -5.782 1.00 0.00 C ATOM 1785 C THR A 137 9.773 1.698 -6.903 1.00 0.00 C ATOM 1786 O THR A 137 8.760 1.561 -7.587 1.00 0.00 O ATOM 1787 CB THR A 137 8.544 3.579 -5.681 1.00 0.00 C ATOM 1788 OG1 THR A 137 9.006 4.924 -5.772 1.00 0.00 O ATOM 1789 CG2 THR A 137 7.899 3.499 -4.296 1.00 0.00 C ATOM 0 H THR A 137 10.993 4.061 -6.906 1.00 0.00 H new ATOM 0 HA THR A 137 9.926 2.171 -4.858 1.00 0.00 H new ATOM 0 HB THR A 137 7.829 3.246 -6.434 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.422 5.185 -4.924 1.00 0.00 H new ATOM 0 HG21 THR A 137 6.998 4.113 -4.278 1.00 0.00 H new ATOM 0 HG22 THR A 137 7.637 2.464 -4.076 1.00 0.00 H new ATOM 0 HG23 THR A 137 8.601 3.863 -3.546 1.00 0.00 H new ATOM 1797 N HIS A 138 10.883 0.992 -7.057 1.00 0.00 N ATOM 1798 CA HIS A 138 10.983 -0.032 -8.083 1.00 0.00 C ATOM 1799 C HIS A 138 11.335 -1.373 -7.437 1.00 0.00 C ATOM 1800 O HIS A 138 12.125 -1.425 -6.495 1.00 0.00 O ATOM 1801 CB HIS A 138 11.978 0.382 -9.169 1.00 0.00 C ATOM 1802 CG HIS A 138 11.977 1.862 -9.470 1.00 0.00 C ATOM 1803 ND1 HIS A 138 12.417 2.812 -8.565 1.00 0.00 N ATOM 1804 CD2 HIS A 138 11.587 2.544 -10.585 1.00 0.00 C ATOM 1805 CE1 HIS A 138 12.292 4.008 -9.120 1.00 0.00 C ATOM 1806 NE2 HIS A 138 11.776 3.840 -10.372 1.00 0.00 N ATOM 0 H HIS A 138 11.722 1.109 -6.488 1.00 0.00 H new ATOM 0 HA HIS A 138 10.020 -0.149 -8.580 1.00 0.00 H new ATOM 0 HB2 HIS A 138 12.981 0.085 -8.861 1.00 0.00 H new ATOM 0 HB3 HIS A 138 11.750 -0.165 -10.084 1.00 0.00 H new ATOM 0 HD2 HIS A 138 11.191 2.104 -11.488 1.00 0.00 H new ATOM 0 HE1 HIS A 138 12.553 4.951 -8.662 1.00 0.00 H new ATOM 0 HE2 HIS A 138 11.570 4.587 -11.035 1.00 0.00 H new ATOM 1814 N TYR A 139 10.732 -2.426 -7.968 1.00 0.00 N ATOM 1815 CA TYR A 139 10.972 -3.765 -7.455 1.00 0.00 C ATOM 1816 C TYR A 139 12.396 -4.225 -7.770 1.00 0.00 C ATOM 1817 O TYR A 139 13.242 -3.419 -8.155 1.00 0.00 O ATOM 1818 CB TYR A 139 9.981 -4.678 -8.180 1.00 0.00 C ATOM 1819 CG TYR A 139 10.464 -5.154 -9.552 1.00 0.00 C ATOM 1820 CD1 TYR A 139 10.343 -4.327 -10.651 1.00 0.00 C ATOM 1821 CD2 TYR A 139 11.019 -6.409 -9.691 1.00 0.00 C ATOM 1822 CE1 TYR A 139 10.797 -4.775 -11.942 1.00 0.00 C ATOM 1823 CE2 TYR A 139 11.473 -6.857 -10.982 1.00 0.00 C ATOM 1824 CZ TYR A 139 11.340 -6.018 -12.044 1.00 0.00 C ATOM 1825 OH TYR A 139 11.769 -6.441 -13.263 1.00 0.00 O ATOM 0 H TYR A 139 10.077 -2.380 -8.749 1.00 0.00 H new ATOM 0 HA TYR A 139 10.848 -3.790 -6.372 1.00 0.00 H new ATOM 0 HB2 TYR A 139 9.780 -5.548 -7.555 1.00 0.00 H new ATOM 0 HB3 TYR A 139 9.036 -4.148 -8.302 1.00 0.00 H new ATOM 0 HD1 TYR A 139 9.908 -3.344 -10.542 1.00 0.00 H new ATOM 0 HD2 TYR A 139 11.113 -7.056 -8.831 1.00 0.00 H new ATOM 0 HE1 TYR A 139 10.708 -4.138 -12.810 1.00 0.00 H new ATOM 0 HE2 TYR A 139 11.909 -7.837 -11.104 1.00 0.00 H new ATOM 0 HH TYR A 139 12.135 -7.347 -13.185 1.00 0.00 H new ATOM 1835 N GLY A 140 12.618 -5.519 -7.593 1.00 0.00 N ATOM 1836 CA GLY A 140 13.926 -6.097 -7.853 1.00 0.00 C ATOM 1837 C GLY A 140 14.128 -7.382 -7.048 1.00 0.00 C ATOM 1838 O GLY A 140 14.582 -8.391 -7.586 1.00 0.00 O ATOM 0 H GLY A 140 11.914 -6.184 -7.273 1.00 0.00 H new ATOM 0 HA2 GLY A 140 14.028 -6.311 -8.917 1.00 0.00 H new ATOM 0 HA3 GLY A 140 14.703 -5.377 -7.596 1.00 0.00 H new ATOM 1842 N GLN A 141 13.782 -7.303 -5.772 1.00 0.00 N ATOM 1843 CA GLN A 141 13.919 -8.447 -4.887 1.00 0.00 C ATOM 1844 C GLN A 141 12.541 -8.964 -4.469 1.00 0.00 C ATOM 1845 O GLN A 141 12.088 -9.999 -4.955 1.00 0.00 O ATOM 1846 CB GLN A 141 14.767 -8.095 -3.663 1.00 0.00 C ATOM 1847 CG GLN A 141 16.185 -8.654 -3.799 1.00 0.00 C ATOM 1848 CD GLN A 141 17.084 -7.687 -4.572 1.00 0.00 C ATOM 1849 OE1 GLN A 141 17.457 -6.628 -4.094 1.00 0.00 O ATOM 1850 NE2 GLN A 141 17.411 -8.109 -5.791 1.00 0.00 N ATOM 0 H GLN A 141 13.407 -6.464 -5.329 1.00 0.00 H new ATOM 0 HA GLN A 141 14.434 -9.241 -5.429 1.00 0.00 H new ATOM 0 HB2 GLN A 141 14.809 -7.012 -3.544 1.00 0.00 H new ATOM 0 HB3 GLN A 141 14.299 -8.496 -2.764 1.00 0.00 H new ATOM 0 HG2 GLN A 141 16.605 -8.834 -2.809 1.00 0.00 H new ATOM 0 HG3 GLN A 141 16.153 -9.615 -4.312 1.00 0.00 H new ATOM 0 HE21 GLN A 141 17.064 -9.006 -6.130 1.00 0.00 H new ATOM 0 HE22 GLN A 141 18.008 -7.535 -6.386 1.00 0.00 H new ATOM 1859 N LYS A 142 11.913 -8.219 -3.571 1.00 0.00 N ATOM 1860 CA LYS A 142 10.595 -8.588 -3.082 1.00 0.00 C ATOM 1861 C LYS A 142 10.236 -7.709 -1.882 1.00 0.00 C ATOM 1862 O LYS A 142 9.974 -8.216 -0.793 1.00 0.00 O ATOM 1863 CB LYS A 142 10.535 -10.088 -2.785 1.00 0.00 C ATOM 1864 CG LYS A 142 11.775 -10.544 -2.012 1.00 0.00 C ATOM 1865 CD LYS A 142 12.594 -11.545 -2.829 1.00 0.00 C ATOM 1866 CE LYS A 142 12.911 -12.795 -2.007 1.00 0.00 C ATOM 1867 NZ LYS A 142 12.062 -13.929 -2.439 1.00 0.00 N ATOM 0 H LYS A 142 12.292 -7.362 -3.169 1.00 0.00 H new ATOM 0 HA LYS A 142 9.840 -8.407 -3.847 1.00 0.00 H new ATOM 0 HB2 LYS A 142 9.639 -10.312 -2.207 1.00 0.00 H new ATOM 0 HB3 LYS A 142 10.459 -10.645 -3.719 1.00 0.00 H new ATOM 0 HG2 LYS A 142 12.392 -9.680 -1.765 1.00 0.00 H new ATOM 0 HG3 LYS A 142 11.473 -11.000 -1.069 1.00 0.00 H new ATOM 0 HD2 LYS A 142 12.042 -11.826 -3.726 1.00 0.00 H new ATOM 0 HD3 LYS A 142 13.522 -11.078 -3.159 1.00 0.00 H new ATOM 0 HE2 LYS A 142 13.963 -13.056 -2.122 1.00 0.00 H new ATOM 0 HE3 LYS A 142 12.747 -12.593 -0.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 12.290 -14.770 -1.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 11.060 -13.683 -2.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 12.239 -14.132 -3.444 1.00 0.00 H new ATOM 1881 N ALA A 143 10.236 -6.406 -2.123 1.00 0.00 N ATOM 1882 CA ALA A 143 9.913 -5.452 -1.076 1.00 0.00 C ATOM 1883 C ALA A 143 8.613 -4.729 -1.434 1.00 0.00 C ATOM 1884 O ALA A 143 8.328 -3.657 -0.901 1.00 0.00 O ATOM 1885 CB ALA A 143 11.085 -4.486 -0.887 1.00 0.00 C ATOM 0 H ALA A 143 10.455 -5.989 -3.028 1.00 0.00 H new ATOM 0 HA ALA A 143 9.755 -5.963 -0.126 1.00 0.00 H new ATOM 0 HB1 ALA A 143 10.843 -3.770 -0.102 1.00 0.00 H new ATOM 0 HB2 ALA A 143 11.977 -5.046 -0.605 1.00 0.00 H new ATOM 0 HB3 ALA A 143 11.271 -3.953 -1.819 1.00 0.00 H new ATOM 1891 N ILE A 144 7.860 -5.344 -2.334 1.00 0.00 N ATOM 1892 CA ILE A 144 6.597 -4.772 -2.769 1.00 0.00 C ATOM 1893 C ILE A 144 5.491 -5.819 -2.624 1.00 0.00 C ATOM 1894 O ILE A 144 4.319 -5.474 -2.480 1.00 0.00 O ATOM 1895 CB ILE A 144 6.725 -4.205 -4.184 1.00 0.00 C ATOM 1896 CG1 ILE A 144 7.287 -5.253 -5.146 1.00 0.00 C ATOM 1897 CG2 ILE A 144 7.556 -2.920 -4.187 1.00 0.00 C ATOM 1898 CD1 ILE A 144 7.944 -4.589 -6.358 1.00 0.00 C ATOM 0 H ILE A 144 8.100 -6.232 -2.774 1.00 0.00 H new ATOM 0 HA ILE A 144 6.323 -3.928 -2.136 1.00 0.00 H new ATOM 0 HB ILE A 144 5.728 -3.944 -4.539 1.00 0.00 H new ATOM 0 HG12 ILE A 144 8.017 -5.874 -4.627 1.00 0.00 H new ATOM 0 HG13 ILE A 144 6.486 -5.913 -5.478 1.00 0.00 H new ATOM 0 HG21 ILE A 144 7.631 -2.538 -5.205 1.00 0.00 H new ATOM 0 HG22 ILE A 144 7.075 -2.174 -3.554 1.00 0.00 H new ATOM 0 HG23 ILE A 144 8.554 -3.131 -3.804 1.00 0.00 H new ATOM 0 HD11 ILE A 144 8.335 -5.357 -7.026 1.00 0.00 H new ATOM 0 HD12 ILE A 144 7.205 -3.988 -6.889 1.00 0.00 H new ATOM 0 HD13 ILE A 144 8.760 -3.948 -6.024 1.00 0.00 H new ATOM 1910 N LEU A 145 5.903 -7.078 -2.666 1.00 0.00 N ATOM 1911 CA LEU A 145 4.961 -8.178 -2.541 1.00 0.00 C ATOM 1912 C LEU A 145 4.204 -8.047 -1.218 1.00 0.00 C ATOM 1913 O LEU A 145 4.721 -8.412 -0.164 1.00 0.00 O ATOM 1914 CB LEU A 145 5.679 -9.518 -2.709 1.00 0.00 C ATOM 1915 CG LEU A 145 7.051 -9.465 -3.384 1.00 0.00 C ATOM 1916 CD1 LEU A 145 7.658 -10.865 -3.504 1.00 0.00 C ATOM 1917 CD2 LEU A 145 6.969 -8.758 -4.738 1.00 0.00 C ATOM 0 H LEU A 145 6.876 -7.361 -2.785 1.00 0.00 H new ATOM 0 HA LEU A 145 4.219 -8.138 -3.338 1.00 0.00 H new ATOM 0 HB2 LEU A 145 5.798 -9.970 -1.724 1.00 0.00 H new ATOM 0 HB3 LEU A 145 5.037 -10.181 -3.288 1.00 0.00 H new ATOM 0 HG LEU A 145 7.719 -8.878 -2.754 1.00 0.00 H new ATOM 0 HD11 LEU A 145 8.633 -10.799 -3.987 1.00 0.00 H new ATOM 0 HD12 LEU A 145 7.774 -11.298 -2.510 1.00 0.00 H new ATOM 0 HD13 LEU A 145 7.000 -11.497 -4.100 1.00 0.00 H new ATOM 0 HD21 LEU A 145 7.958 -8.734 -5.196 1.00 0.00 H new ATOM 0 HD22 LEU A 145 6.280 -9.297 -5.389 1.00 0.00 H new ATOM 0 HD23 LEU A 145 6.611 -7.739 -4.595 1.00 0.00 H new ATOM 1929 N PHE A 146 2.990 -7.525 -1.317 1.00 0.00 N ATOM 1930 CA PHE A 146 2.156 -7.341 -0.142 1.00 0.00 C ATOM 1931 C PHE A 146 1.312 -8.588 0.131 1.00 0.00 C ATOM 1932 O PHE A 146 0.527 -9.009 -0.717 1.00 0.00 O ATOM 1933 CB PHE A 146 1.225 -6.163 -0.434 1.00 0.00 C ATOM 1934 CG PHE A 146 1.817 -4.798 -0.078 1.00 0.00 C ATOM 1935 CD1 PHE A 146 2.412 -4.609 1.131 1.00 0.00 C ATOM 1936 CD2 PHE A 146 1.750 -3.774 -0.970 1.00 0.00 C ATOM 1937 CE1 PHE A 146 2.962 -3.343 1.461 1.00 0.00 C ATOM 1938 CE2 PHE A 146 2.301 -2.507 -0.640 1.00 0.00 C ATOM 1939 CZ PHE A 146 2.895 -2.318 0.569 1.00 0.00 C ATOM 0 H PHE A 146 2.564 -7.224 -2.193 1.00 0.00 H new ATOM 0 HA PHE A 146 2.780 -7.158 0.733 1.00 0.00 H new ATOM 0 HB2 PHE A 146 0.968 -6.171 -1.493 1.00 0.00 H new ATOM 0 HB3 PHE A 146 0.297 -6.301 0.121 1.00 0.00 H new ATOM 0 HD1 PHE A 146 2.466 -5.422 1.839 1.00 0.00 H new ATOM 0 HD2 PHE A 146 1.278 -3.924 -1.930 1.00 0.00 H new ATOM 0 HE1 PHE A 146 3.434 -3.193 2.421 1.00 0.00 H new ATOM 0 HE2 PHE A 146 2.248 -1.694 -1.349 1.00 0.00 H new ATOM 0 HZ PHE A 146 3.313 -1.355 0.821 1.00 0.00 H new ATOM 1949 N LEU A 147 1.502 -9.143 1.319 1.00 0.00 N ATOM 1950 CA LEU A 147 0.767 -10.333 1.715 1.00 0.00 C ATOM 1951 C LEU A 147 -0.363 -9.936 2.667 1.00 0.00 C ATOM 1952 O LEU A 147 -0.117 -9.626 3.832 1.00 0.00 O ATOM 1953 CB LEU A 147 1.719 -11.382 2.293 1.00 0.00 C ATOM 1954 CG LEU A 147 1.342 -12.843 2.038 1.00 0.00 C ATOM 1955 CD1 LEU A 147 0.343 -13.342 3.084 1.00 0.00 C ATOM 1956 CD2 LEU A 147 0.822 -13.034 0.612 1.00 0.00 C ATOM 0 H LEU A 147 2.154 -8.791 2.020 1.00 0.00 H new ATOM 0 HA LEU A 147 0.303 -10.801 0.847 1.00 0.00 H new ATOM 0 HB2 LEU A 147 2.713 -11.207 1.882 1.00 0.00 H new ATOM 0 HB3 LEU A 147 1.787 -11.228 3.370 1.00 0.00 H new ATOM 0 HG LEU A 147 2.242 -13.450 2.137 1.00 0.00 H new ATOM 0 HD11 LEU A 147 0.092 -14.383 2.880 1.00 0.00 H new ATOM 0 HD12 LEU A 147 0.786 -13.264 4.077 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -0.562 -12.735 3.042 1.00 0.00 H new ATOM 0 HD21 LEU A 147 0.561 -14.081 0.457 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -0.061 -12.414 0.461 1.00 0.00 H new ATOM 0 HD23 LEU A 147 1.595 -12.744 -0.099 1.00 0.00 H new ATOM 1968 N PRO A 148 -1.608 -9.960 2.123 1.00 0.00 N ATOM 1969 CA PRO A 148 -2.777 -9.607 2.911 1.00 0.00 C ATOM 1970 C PRO A 148 -3.143 -10.731 3.883 1.00 0.00 C ATOM 1971 O PRO A 148 -3.241 -11.891 3.487 1.00 0.00 O ATOM 1972 CB PRO A 148 -3.868 -9.325 1.891 1.00 0.00 C ATOM 1973 CG PRO A 148 -3.409 -9.977 0.597 1.00 0.00 C ATOM 1974 CD PRO A 148 -1.936 -10.323 0.747 1.00 0.00 C ATOM 0 HA PRO A 148 -2.609 -8.737 3.546 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -4.823 -9.736 2.218 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -4.011 -8.253 1.759 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -3.993 -10.874 0.393 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -3.559 -9.301 -0.245 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -1.758 -11.383 0.564 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -1.325 -9.769 0.035 1.00 0.00 H new ATOM 1982 N LEU A 149 -3.334 -10.347 5.136 1.00 0.00 N ATOM 1983 CA LEU A 149 -3.687 -11.307 6.167 1.00 0.00 C ATOM 1984 C LEU A 149 -4.835 -10.746 7.010 1.00 0.00 C ATOM 1985 O LEU A 149 -4.676 -10.518 8.208 1.00 0.00 O ATOM 1986 CB LEU A 149 -2.454 -11.691 6.987 1.00 0.00 C ATOM 1987 CG LEU A 149 -1.757 -10.547 7.726 1.00 0.00 C ATOM 1988 CD1 LEU A 149 -1.518 -10.907 9.194 1.00 0.00 C ATOM 1989 CD2 LEU A 149 -0.462 -10.145 7.017 1.00 0.00 C ATOM 0 H LEU A 149 -3.251 -9.384 5.461 1.00 0.00 H new ATOM 0 HA LEU A 149 -4.044 -12.234 5.717 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -2.749 -12.443 7.719 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -1.731 -12.161 6.320 1.00 0.00 H new ATOM 0 HG LEU A 149 -2.416 -9.679 7.710 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -1.021 -10.077 9.696 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -2.473 -11.106 9.680 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -0.889 -11.795 9.253 1.00 0.00 H new ATOM 0 HD21 LEU A 149 0.014 -9.330 7.563 1.00 0.00 H new ATOM 0 HD22 LEU A 149 0.213 -11.000 6.980 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -0.689 -9.818 6.002 1.00 0.00 H new ATOM 2001 N PRO A 150 -5.995 -10.535 6.333 1.00 0.00 N ATOM 2002 CA PRO A 150 -7.169 -10.005 7.006 1.00 0.00 C ATOM 2003 C PRO A 150 -7.831 -11.075 7.876 1.00 0.00 C ATOM 2004 O PRO A 150 -7.543 -12.262 7.734 1.00 0.00 O ATOM 2005 CB PRO A 150 -8.071 -9.506 5.889 1.00 0.00 C ATOM 2006 CG PRO A 150 -7.584 -10.191 4.622 1.00 0.00 C ATOM 2007 CD PRO A 150 -6.220 -10.794 4.914 1.00 0.00 C ATOM 0 HA PRO A 150 -6.929 -9.197 7.697 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -9.114 -9.752 6.090 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -8.012 -8.422 5.794 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -8.286 -10.966 4.313 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -7.518 -9.475 3.802 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -6.206 -11.863 4.700 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -5.445 -10.335 4.300 1.00 0.00 H new ATOM 2015 N VAL A 151 -8.707 -10.615 8.758 1.00 0.00 N ATOM 2016 CA VAL A 151 -9.412 -11.518 9.652 1.00 0.00 C ATOM 2017 C VAL A 151 -10.676 -10.830 10.172 1.00 0.00 C ATOM 2018 O VAL A 151 -10.850 -10.674 11.380 1.00 0.00 O ATOM 2019 CB VAL A 151 -8.479 -11.981 10.773 1.00 0.00 C ATOM 2020 CG1 VAL A 151 -7.412 -12.938 10.238 1.00 0.00 C ATOM 2021 CG2 VAL A 151 -7.839 -10.785 11.481 1.00 0.00 C ATOM 0 H VAL A 151 -8.944 -9.630 8.872 1.00 0.00 H new ATOM 0 HA VAL A 151 -9.726 -12.415 9.118 1.00 0.00 H new ATOM 0 HB VAL A 151 -9.077 -12.523 11.505 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -6.762 -13.252 11.055 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -7.894 -13.813 9.801 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -6.819 -12.432 9.476 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -7.181 -11.141 12.273 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -7.261 -10.204 10.763 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -8.619 -10.157 11.912 1.00 0.00 H new ATOM 2031 N SER A 152 -11.525 -10.435 9.234 1.00 0.00 N ATOM 2032 CA SER A 152 -12.767 -9.767 9.583 1.00 0.00 C ATOM 2033 C SER A 152 -13.646 -10.699 10.420 1.00 0.00 C ATOM 2034 O SER A 152 -14.573 -11.317 9.900 1.00 0.00 O ATOM 2035 CB SER A 152 -13.519 -9.313 8.330 1.00 0.00 C ATOM 2036 OG SER A 152 -14.656 -8.516 8.649 1.00 0.00 O ATOM 0 H SER A 152 -11.377 -10.565 8.233 1.00 0.00 H new ATOM 0 HA SER A 152 -12.525 -8.881 10.170 1.00 0.00 H new ATOM 0 HB2 SER A 152 -12.845 -8.744 7.689 1.00 0.00 H new ATOM 0 HB3 SER A 152 -13.837 -10.187 7.761 1.00 0.00 H new ATOM 0 HG SER A 152 -15.108 -8.245 7.823 1.00 0.00 H new ATOM 2042 N SER A 153 -13.323 -10.770 11.703 1.00 0.00 N ATOM 2043 CA SER A 153 -14.071 -11.616 12.617 1.00 0.00 C ATOM 2044 C SER A 153 -14.501 -10.809 13.844 1.00 0.00 C ATOM 2045 O SER A 153 -14.159 -11.159 14.973 1.00 0.00 O ATOM 2046 CB SER A 153 -13.245 -12.831 13.044 1.00 0.00 C ATOM 2047 OG SER A 153 -13.919 -13.618 14.022 1.00 0.00 O ATOM 0 H SER A 153 -12.553 -10.255 12.131 1.00 0.00 H new ATOM 0 HA SER A 153 -14.959 -11.978 12.099 1.00 0.00 H new ATOM 0 HB2 SER A 153 -13.027 -13.446 12.171 1.00 0.00 H new ATOM 0 HB3 SER A 153 -12.288 -12.496 13.445 1.00 0.00 H new ATOM 0 HG SER A 153 -14.047 -13.088 14.836 1.00 0.00 H new ATOM 2053 N ASP A 154 -15.243 -9.743 13.581 1.00 0.00 N ATOM 2054 CA ASP A 154 -15.723 -8.883 14.650 1.00 0.00 C ATOM 2055 C ASP A 154 -17.013 -8.193 14.203 1.00 0.00 C ATOM 2056 O ASP A 154 -17.407 -8.297 13.042 1.00 0.00 O ATOM 2057 CB ASP A 154 -14.698 -7.799 14.986 1.00 0.00 C ATOM 2058 CG ASP A 154 -14.917 -7.096 16.327 1.00 0.00 C ATOM 2059 OD1 ASP A 154 -15.789 -6.201 16.363 1.00 0.00 O ATOM 2060 OD2 ASP A 154 -14.208 -7.469 17.286 1.00 0.00 O ATOM 0 H ASP A 154 -15.524 -9.455 12.643 1.00 0.00 H new ATOM 0 HA ASP A 154 -15.894 -9.502 15.530 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -13.704 -8.247 14.986 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -14.710 -7.050 14.194 1.00 0.00 H new TER 2065 ASP A 154 HETATM 2066 C1 NTS A 178 16.100 -6.405 -0.338 1.00 0.00 C HETATM 2067 C2 NTS A 178 15.530 -7.557 0.204 1.00 0.00 C HETATM 2068 C3 NTS A 178 14.232 -7.928 -0.140 1.00 0.00 C HETATM 2069 C4 NTS A 178 13.501 -7.144 -1.030 1.00 0.00 C HETATM 2070 C5 NTS A 178 13.322 -5.214 -2.465 1.00 0.00 C HETATM 2071 C6 NTS A 178 13.873 -4.060 -3.017 1.00 0.00 C HETATM 2072 C7 NTS A 178 15.171 -3.682 -2.678 1.00 0.00 C HETATM 2073 C8 NTS A 178 15.914 -4.458 -1.789 1.00 0.00 C HETATM 2074 C9 NTS A 178 15.368 -5.617 -1.231 1.00 0.00 C HETATM 2075 C10 NTS A 178 14.066 -5.991 -1.575 1.00 0.00 C HETATM 2076 O11 NTS A 178 18.228 -6.856 1.657 1.00 0.00 O HETATM 2077 O12 NTS A 178 17.930 -4.199 0.439 1.00 0.00 O HETATM 2078 O13 NTS A 178 18.933 -6.447 -1.166 1.00 0.00 O HETATM 2079 O31 NTS A 178 13.976 -9.564 2.300 1.00 0.00 O HETATM 2080 O32 NTS A 178 14.089 -10.872 -0.329 1.00 0.00 O HETATM 2081 O33 NTS A 178 11.702 -9.333 0.452 1.00 0.00 O HETATM 2082 O61 NTS A 178 11.220 -3.687 -4.247 1.00 0.00 O HETATM 2083 O62 NTS A 178 13.645 -3.129 -5.811 1.00 0.00 O HETATM 2084 O63 NTS A 178 12.871 -1.342 -3.602 1.00 0.00 O HETATM 2085 S1 NTS A 178 17.800 -5.971 0.150 1.00 0.00 S HETATM 2086 S3 NTS A 178 13.495 -9.431 0.571 1.00 0.00 S HETATM 2087 S6 NTS A 178 12.902 -3.048 -4.175 1.00 0.00 S HETATM 0 H8 NTS A 178 16.929 -4.158 -1.527 1.00 0.00 H new HETATM 0 H7 NTS A 178 15.605 -2.780 -3.108 1.00 0.00 H new HETATM 0 H5 NTS A 178 12.307 -5.511 -2.729 1.00 0.00 H new HETATM 0 H4 NTS A 178 12.485 -7.432 -1.301 1.00 0.00 H new HETATM 0 H2 NTS A 178 16.103 -8.170 0.900 1.00 0.00 H new