USER MOD reduce.3.24.130724 H: found=0, std=0, add=919, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 919 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 45 THR OG1 : rot 75:sc= 0.446 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0512) USER MOD Single : A 10 GLN : amide:sc= -0.0634 X(o=-0.063,f=-0.15) USER MOD Single : A 13 SER OG : rot 67:sc= 0.00627 USER MOD Single : A 18 HIS : no HD1:sc= -0.0105 X(o=-0.01,f=-0.019) USER MOD Single : A 20 THR OG1 : rot 180:sc= -0.425 USER MOD Single : A 26 THR OG1 : rot 110:sc= -0.967 USER MOD Single : A 27 SER OG : rot -130:sc= 0.444 USER MOD Single : A 35 CYS SG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 ASN : amide:sc= -0.896 K(o=-0.9,f=-0.047) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0.0391 USER MOD Single : A 49 SER OG : rot 55:sc= 0.462 USER MOD Single : A 50 THR OG1 : rot -46:sc= 0.411 USER MOD Single : A 57 MET CE :methyl -163:sc= 0 (180deg=-0.321) USER MOD Single : A 59 GLN : amide:sc= -0.797 X(o=-0.8,f=-0.61) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -0.0649 X(o=-0.065,f=-0.19) USER MOD Single : A 88 LYS NZ :NH3+ -166:sc= -0.0278 (180deg=-0.234) USER MOD Single : A 91 THR OG1 : rot 125:sc= 0.179 USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot -166:sc= -0.868 USER MOD Single : A 105 SER OG : rot -24:sc= 0.817 USER MOD Single : A 109 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0248) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= -0.0485 X(o=-0.049,f=-0.066) USER MOD Single : A 115 MET CE :methyl -116:sc= -0.146 (180deg=-2.87!) USER MOD Single : A 120 LYS NZ :NH3+ 156:sc= -0.0176 (180deg=-0.851) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 130 ASN : amide:sc= -0.995 K(o=-1,f=-2.6) USER MOD Single : A 131 TYR OH : rot 95:sc= 0.493 USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 136 GLN : amide:sc= -0.117 X(o=-0.12,f=-0.12) USER MOD Single : A 137 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 40 N ASP A 5 -21.760 13.415 -9.215 1.00 0.00 N ATOM 41 CA ASP A 5 -21.012 12.260 -8.725 1.00 0.00 C ATOM 42 C ASP A 5 -20.116 12.657 -7.558 1.00 0.00 C ATOM 43 O ASP A 5 -19.152 13.399 -7.729 1.00 0.00 O ATOM 44 CB ASP A 5 -20.174 11.644 -9.849 1.00 0.00 C ATOM 45 CG ASP A 5 -20.955 10.629 -10.660 1.00 0.00 C ATOM 46 OD1 ASP A 5 -21.178 9.509 -10.153 1.00 0.00 O ATOM 47 OD2 ASP A 5 -21.346 10.955 -11.801 1.00 0.00 O ATOM 0 HA ASP A 5 -21.727 11.515 -8.376 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -19.817 12.435 -10.508 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -19.294 11.164 -9.421 1.00 0.00 H new ATOM 52 N SER A 6 -20.445 12.155 -6.369 1.00 0.00 N ATOM 53 CA SER A 6 -19.670 12.454 -5.166 1.00 0.00 C ATOM 54 C SER A 6 -18.209 12.007 -5.307 1.00 0.00 C ATOM 55 O SER A 6 -17.298 12.774 -4.996 1.00 0.00 O ATOM 56 CB SER A 6 -20.310 11.791 -3.941 1.00 0.00 C ATOM 57 OG SER A 6 -19.955 12.471 -2.749 1.00 0.00 O ATOM 0 H SER A 6 -21.243 11.539 -6.213 1.00 0.00 H new ATOM 0 HA SER A 6 -19.675 13.536 -5.031 1.00 0.00 H new ATOM 0 HB2 SER A 6 -21.394 11.786 -4.051 1.00 0.00 H new ATOM 0 HB3 SER A 6 -19.991 10.751 -3.879 1.00 0.00 H new ATOM 0 HG SER A 6 -20.377 12.030 -1.983 1.00 0.00 H new ATOM 63 N PRO A 7 -17.960 10.758 -5.768 1.00 0.00 N ATOM 64 CA PRO A 7 -16.598 10.233 -5.929 1.00 0.00 C ATOM 65 C PRO A 7 -15.907 10.669 -7.229 1.00 0.00 C ATOM 66 O PRO A 7 -14.692 10.505 -7.362 1.00 0.00 O ATOM 67 CB PRO A 7 -16.820 8.722 -5.924 1.00 0.00 C ATOM 68 CG PRO A 7 -18.171 8.538 -6.525 1.00 0.00 C ATOM 69 CD PRO A 7 -18.978 9.755 -6.151 1.00 0.00 C ATOM 0 HA PRO A 7 -15.935 10.604 -5.147 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -16.055 8.207 -6.505 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -16.778 8.319 -4.912 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -18.103 8.436 -7.608 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -18.642 7.630 -6.149 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -19.586 10.103 -6.986 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -19.660 9.544 -5.327 1.00 0.00 H new ATOM 77 N TYR A 8 -16.670 11.205 -8.193 1.00 0.00 N ATOM 78 CA TYR A 8 -16.092 11.630 -9.472 1.00 0.00 C ATOM 79 C TYR A 8 -16.098 13.155 -9.626 1.00 0.00 C ATOM 80 O TYR A 8 -15.041 13.771 -9.752 1.00 0.00 O ATOM 81 CB TYR A 8 -16.842 10.984 -10.646 1.00 0.00 C ATOM 82 CG TYR A 8 -17.082 9.493 -10.496 1.00 0.00 C ATOM 83 CD1 TYR A 8 -16.228 8.693 -9.742 1.00 0.00 C ATOM 84 CD2 TYR A 8 -18.168 8.887 -11.113 1.00 0.00 C ATOM 85 CE1 TYR A 8 -16.453 7.336 -9.609 1.00 0.00 C ATOM 86 CE2 TYR A 8 -18.400 7.532 -10.985 1.00 0.00 C ATOM 87 CZ TYR A 8 -17.540 6.761 -10.232 1.00 0.00 C ATOM 88 OH TYR A 8 -17.769 5.409 -10.100 1.00 0.00 O ATOM 0 H TYR A 8 -17.676 11.352 -8.112 1.00 0.00 H new ATOM 0 HA TYR A 8 -15.054 11.297 -9.480 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -17.803 11.484 -10.765 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -16.277 11.158 -11.562 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -15.375 9.140 -9.253 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -18.844 9.487 -11.704 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -15.781 6.729 -9.020 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -19.251 7.078 -11.472 1.00 0.00 H new ATOM 0 HH TYR A 8 -18.576 5.164 -10.600 1.00 0.00 H new ATOM 98 N LYS A 9 -17.292 13.753 -9.628 1.00 0.00 N ATOM 99 CA LYS A 9 -17.439 15.203 -9.780 1.00 0.00 C ATOM 100 C LYS A 9 -17.004 15.947 -8.517 1.00 0.00 C ATOM 101 O LYS A 9 -16.052 16.730 -8.550 1.00 0.00 O ATOM 102 CB LYS A 9 -18.890 15.561 -10.125 1.00 0.00 C ATOM 103 CG LYS A 9 -19.018 16.519 -11.299 1.00 0.00 C ATOM 104 CD LYS A 9 -19.272 15.775 -12.601 1.00 0.00 C ATOM 105 CE LYS A 9 -18.286 16.186 -13.684 1.00 0.00 C ATOM 106 NZ LYS A 9 -18.762 15.812 -15.045 1.00 0.00 N ATOM 0 H LYS A 9 -18.175 13.253 -9.526 1.00 0.00 H new ATOM 0 HA LYS A 9 -16.789 15.515 -10.597 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -19.437 14.646 -10.352 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -19.363 16.006 -9.250 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -19.834 17.217 -11.113 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -18.107 17.110 -11.388 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -19.196 14.702 -12.428 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -20.289 15.972 -12.941 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -18.127 17.263 -13.639 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -17.322 15.713 -13.495 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -18.031 16.049 -15.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -18.954 14.790 -15.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -19.634 16.335 -15.264 1.00 0.00 H new ATOM 120 N GLN A 10 -17.706 15.697 -7.408 1.00 0.00 N ATOM 121 CA GLN A 10 -17.392 16.342 -6.133 1.00 0.00 C ATOM 122 C GLN A 10 -15.946 16.061 -5.728 1.00 0.00 C ATOM 123 O GLN A 10 -15.207 16.979 -5.364 1.00 0.00 O ATOM 124 CB GLN A 10 -18.353 15.861 -5.038 1.00 0.00 C ATOM 125 CG GLN A 10 -18.990 16.993 -4.243 1.00 0.00 C ATOM 126 CD GLN A 10 -17.984 17.768 -3.410 1.00 0.00 C ATOM 127 OE1 GLN A 10 -17.320 18.679 -3.908 1.00 0.00 O ATOM 128 NE2 GLN A 10 -17.863 17.413 -2.135 1.00 0.00 N ATOM 0 H GLN A 10 -18.495 15.052 -7.369 1.00 0.00 H new ATOM 0 HA GLN A 10 -17.513 17.418 -6.256 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -19.140 15.262 -5.495 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -17.812 15.207 -4.354 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -19.489 17.677 -4.930 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -19.758 16.583 -3.587 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -18.431 16.653 -1.761 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -17.202 17.900 -1.530 1.00 0.00 H new ATOM 137 N ALA A 11 -15.545 14.789 -5.811 1.00 0.00 N ATOM 138 CA ALA A 11 -14.184 14.383 -5.469 1.00 0.00 C ATOM 139 C ALA A 11 -13.161 15.128 -6.325 1.00 0.00 C ATOM 140 O ALA A 11 -12.133 15.578 -5.818 1.00 0.00 O ATOM 141 CB ALA A 11 -14.019 12.880 -5.630 1.00 0.00 C ATOM 0 H ALA A 11 -16.147 14.023 -6.113 1.00 0.00 H new ATOM 0 HA ALA A 11 -14.006 14.641 -4.425 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -12.999 12.596 -5.371 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -14.718 12.365 -4.971 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -14.222 12.600 -6.664 1.00 0.00 H new ATOM 147 N PHE A 12 -13.457 15.270 -7.625 1.00 0.00 N ATOM 148 CA PHE A 12 -12.566 15.981 -8.544 1.00 0.00 C ATOM 149 C PHE A 12 -12.308 17.406 -8.049 1.00 0.00 C ATOM 150 O PHE A 12 -11.172 17.886 -8.081 1.00 0.00 O ATOM 151 CB PHE A 12 -13.162 16.004 -9.954 1.00 0.00 C ATOM 152 CG PHE A 12 -12.402 16.860 -10.932 1.00 0.00 C ATOM 153 CD1 PHE A 12 -12.593 18.232 -10.970 1.00 0.00 C ATOM 154 CD2 PHE A 12 -11.500 16.289 -11.815 1.00 0.00 C ATOM 155 CE1 PHE A 12 -11.898 19.017 -11.866 1.00 0.00 C ATOM 156 CE2 PHE A 12 -10.803 17.070 -12.714 1.00 0.00 C ATOM 157 CZ PHE A 12 -11.002 18.435 -12.739 1.00 0.00 C ATOM 0 H PHE A 12 -14.304 14.902 -8.059 1.00 0.00 H new ATOM 0 HA PHE A 12 -11.614 15.452 -8.579 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -13.202 14.984 -10.336 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -14.189 16.363 -9.896 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -13.295 18.692 -10.290 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -11.341 15.221 -11.800 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -12.055 20.085 -11.884 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -10.102 16.613 -13.397 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.457 19.048 -13.442 1.00 0.00 H new ATOM 167 N SER A 13 -13.372 18.071 -7.583 1.00 0.00 N ATOM 168 CA SER A 13 -13.270 19.438 -7.067 1.00 0.00 C ATOM 169 C SER A 13 -12.339 19.502 -5.854 1.00 0.00 C ATOM 170 O SER A 13 -11.603 20.475 -5.683 1.00 0.00 O ATOM 171 CB SER A 13 -14.656 19.975 -6.691 1.00 0.00 C ATOM 172 OG SER A 13 -15.538 19.943 -7.801 1.00 0.00 O ATOM 0 H SER A 13 -14.314 17.682 -7.553 1.00 0.00 H new ATOM 0 HA SER A 13 -12.849 20.061 -7.856 1.00 0.00 H new ATOM 0 HB2 SER A 13 -15.070 19.380 -5.877 1.00 0.00 H new ATOM 0 HB3 SER A 13 -14.565 20.998 -6.325 1.00 0.00 H new ATOM 0 HG SER A 13 -15.725 19.012 -8.043 1.00 0.00 H new ATOM 178 N LEU A 14 -12.373 18.458 -5.016 1.00 0.00 N ATOM 179 CA LEU A 14 -11.526 18.394 -3.821 1.00 0.00 C ATOM 180 C LEU A 14 -10.040 18.368 -4.191 1.00 0.00 C ATOM 181 O LEU A 14 -9.206 18.911 -3.464 1.00 0.00 O ATOM 182 CB LEU A 14 -11.855 17.155 -2.973 1.00 0.00 C ATOM 183 CG LEU A 14 -13.322 16.725 -2.935 1.00 0.00 C ATOM 184 CD1 LEU A 14 -13.508 15.551 -1.987 1.00 0.00 C ATOM 185 CD2 LEU A 14 -14.215 17.887 -2.529 1.00 0.00 C ATOM 0 H LEU A 14 -12.978 17.647 -5.145 1.00 0.00 H new ATOM 0 HA LEU A 14 -11.732 19.292 -3.239 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -11.264 16.319 -3.347 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -11.528 17.345 -1.951 1.00 0.00 H new ATOM 0 HG LEU A 14 -13.611 16.409 -3.937 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -14.558 15.258 -1.972 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -12.902 14.711 -2.325 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -13.198 15.841 -0.983 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -15.254 17.558 -2.509 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -13.926 18.239 -1.538 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -14.106 18.699 -3.248 1.00 0.00 H new ATOM 197 N PHE A 15 -9.716 17.728 -5.319 1.00 0.00 N ATOM 198 CA PHE A 15 -8.329 17.622 -5.777 1.00 0.00 C ATOM 199 C PHE A 15 -7.957 18.737 -6.765 1.00 0.00 C ATOM 200 O PHE A 15 -7.099 18.542 -7.627 1.00 0.00 O ATOM 201 CB PHE A 15 -8.098 16.253 -6.429 1.00 0.00 C ATOM 202 CG PHE A 15 -8.046 15.118 -5.445 1.00 0.00 C ATOM 203 CD1 PHE A 15 -6.867 14.814 -4.787 1.00 0.00 C ATOM 204 CD2 PHE A 15 -9.173 14.358 -5.179 1.00 0.00 C ATOM 205 CE1 PHE A 15 -6.811 13.772 -3.881 1.00 0.00 C ATOM 206 CE2 PHE A 15 -9.124 13.315 -4.275 1.00 0.00 C ATOM 207 CZ PHE A 15 -7.941 13.021 -3.625 1.00 0.00 C ATOM 0 H PHE A 15 -10.396 17.276 -5.931 1.00 0.00 H new ATOM 0 HA PHE A 15 -7.688 17.731 -4.902 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -8.895 16.063 -7.148 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -7.163 16.280 -6.989 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -5.980 15.398 -4.984 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -10.101 14.584 -5.684 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -5.885 13.545 -3.374 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -10.010 12.730 -4.076 1.00 0.00 H new ATOM 0 HZ PHE A 15 -7.900 12.205 -2.918 1.00 0.00 H new ATOM 217 N ASP A 16 -8.589 19.908 -6.634 1.00 0.00 N ATOM 218 CA ASP A 16 -8.297 21.035 -7.520 1.00 0.00 C ATOM 219 C ASP A 16 -7.024 21.756 -7.080 1.00 0.00 C ATOM 220 O ASP A 16 -6.905 22.178 -5.927 1.00 0.00 O ATOM 221 CB ASP A 16 -9.472 22.015 -7.560 1.00 0.00 C ATOM 222 CG ASP A 16 -10.250 21.923 -8.860 1.00 0.00 C ATOM 223 OD1 ASP A 16 -10.973 20.921 -9.051 1.00 0.00 O ATOM 224 OD2 ASP A 16 -10.131 22.849 -9.690 1.00 0.00 O ATOM 0 H ASP A 16 -9.300 20.098 -5.928 1.00 0.00 H new ATOM 0 HA ASP A 16 -8.142 20.639 -8.524 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -10.141 21.813 -6.723 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -9.100 23.032 -7.432 1.00 0.00 H new ATOM 229 N ARG A 17 -6.073 21.886 -8.007 1.00 0.00 N ATOM 230 CA ARG A 17 -4.800 22.547 -7.723 1.00 0.00 C ATOM 231 C ARG A 17 -4.982 24.055 -7.544 1.00 0.00 C ATOM 232 O ARG A 17 -4.641 24.605 -6.497 1.00 0.00 O ATOM 233 CB ARG A 17 -3.797 22.267 -8.848 1.00 0.00 C ATOM 234 CG ARG A 17 -2.379 22.715 -8.535 1.00 0.00 C ATOM 235 CD ARG A 17 -1.636 21.684 -7.698 1.00 0.00 C ATOM 236 NE ARG A 17 -0.274 21.456 -8.186 1.00 0.00 N ATOM 237 CZ ARG A 17 0.684 20.851 -7.477 1.00 0.00 C ATOM 238 NH1 ARG A 17 0.437 20.404 -6.249 1.00 0.00 N ATOM 239 NH2 ARG A 17 1.894 20.690 -8.004 1.00 0.00 N ATOM 0 H ARG A 17 -6.162 21.541 -8.963 1.00 0.00 H new ATOM 0 HA ARG A 17 -4.413 22.142 -6.788 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -3.791 21.198 -9.059 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -4.134 22.769 -9.755 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -1.838 22.887 -9.465 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -2.407 23.665 -8.002 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -1.598 22.019 -6.661 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -2.187 20.743 -7.709 1.00 0.00 H new ATOM 0 HE ARG A 17 -0.042 21.779 -9.125 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -0.490 20.522 -5.840 1.00 0.00 H new ATOM 0 HH12 ARG A 17 1.175 19.944 -5.716 1.00 0.00 H new ATOM 0 HH21 ARG A 17 2.089 21.028 -8.947 1.00 0.00 H new ATOM 0 HH22 ARG A 17 2.627 20.229 -7.466 1.00 0.00 H new ATOM 253 N HIS A 18 -5.518 24.718 -8.572 1.00 0.00 N ATOM 254 CA HIS A 18 -5.737 26.163 -8.524 1.00 0.00 C ATOM 255 C HIS A 18 -7.227 26.520 -8.406 1.00 0.00 C ATOM 256 O HIS A 18 -7.587 27.698 -8.462 1.00 0.00 O ATOM 257 CB HIS A 18 -5.138 26.823 -9.767 1.00 0.00 C ATOM 258 CG HIS A 18 -3.676 27.124 -9.640 1.00 0.00 C ATOM 259 ND1 HIS A 18 -2.759 26.601 -10.518 1.00 0.00 N ATOM 260 CD2 HIS A 18 -3.028 27.892 -8.729 1.00 0.00 C ATOM 261 CE1 HIS A 18 -1.583 27.056 -10.128 1.00 0.00 C ATOM 262 NE2 HIS A 18 -1.695 27.843 -9.046 1.00 0.00 N ATOM 0 H HIS A 18 -5.807 24.277 -9.445 1.00 0.00 H new ATOM 0 HA HIS A 18 -5.239 26.540 -7.631 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -5.293 26.169 -10.626 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -5.675 27.749 -9.971 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -3.476 28.437 -7.911 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -0.649 26.824 -10.617 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -0.935 28.314 -8.555 1.00 0.00 H new ATOM 270 N GLY A 19 -8.088 25.507 -8.239 1.00 0.00 N ATOM 271 CA GLY A 19 -9.517 25.753 -8.117 1.00 0.00 C ATOM 272 C GLY A 19 -10.107 26.418 -9.349 1.00 0.00 C ATOM 273 O GLY A 19 -10.910 27.346 -9.232 1.00 0.00 O ATOM 0 H GLY A 19 -7.818 24.525 -8.187 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -10.030 24.808 -7.939 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -9.700 26.383 -7.247 1.00 0.00 H new ATOM 277 N THR A 20 -9.705 25.944 -10.531 1.00 0.00 N ATOM 278 CA THR A 20 -10.196 26.497 -11.795 1.00 0.00 C ATOM 279 C THR A 20 -10.952 25.448 -12.624 1.00 0.00 C ATOM 280 O THR A 20 -11.259 25.684 -13.794 1.00 0.00 O ATOM 281 CB THR A 20 -9.026 27.067 -12.609 1.00 0.00 C ATOM 282 OG1 THR A 20 -8.020 26.086 -12.803 1.00 0.00 O ATOM 283 CG2 THR A 20 -8.373 28.272 -11.964 1.00 0.00 C ATOM 0 H THR A 20 -9.040 25.178 -10.639 1.00 0.00 H new ATOM 0 HA THR A 20 -10.898 27.296 -11.555 1.00 0.00 H new ATOM 0 HB THR A 20 -9.464 27.377 -13.558 1.00 0.00 H new ATOM 0 HG1 THR A 20 -7.285 26.470 -13.325 1.00 0.00 H new ATOM 0 HG21 THR A 20 -7.555 28.623 -12.593 1.00 0.00 H new ATOM 0 HG22 THR A 20 -9.109 29.067 -11.850 1.00 0.00 H new ATOM 0 HG23 THR A 20 -7.984 27.994 -10.984 1.00 0.00 H new ATOM 291 N GLY A 21 -11.253 24.291 -12.018 1.00 0.00 N ATOM 292 CA GLY A 21 -11.967 23.237 -12.724 1.00 0.00 C ATOM 293 C GLY A 21 -11.044 22.224 -13.393 1.00 0.00 C ATOM 294 O GLY A 21 -11.521 21.292 -14.043 1.00 0.00 O ATOM 0 H GLY A 21 -11.013 24.070 -11.052 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -12.618 22.716 -12.022 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -12.609 23.687 -13.481 1.00 0.00 H new ATOM 298 N ARG A 22 -9.726 22.402 -13.237 1.00 0.00 N ATOM 299 CA ARG A 22 -8.745 21.493 -13.832 1.00 0.00 C ATOM 300 C ARG A 22 -7.797 20.942 -12.768 1.00 0.00 C ATOM 301 O ARG A 22 -7.761 21.439 -11.639 1.00 0.00 O ATOM 302 CB ARG A 22 -7.943 22.209 -14.921 1.00 0.00 C ATOM 303 CG ARG A 22 -8.793 23.027 -15.881 1.00 0.00 C ATOM 304 CD ARG A 22 -8.768 24.505 -15.527 1.00 0.00 C ATOM 305 NE ARG A 22 -8.311 25.335 -16.641 1.00 0.00 N ATOM 306 CZ ARG A 22 -9.082 25.704 -17.671 1.00 0.00 C ATOM 307 NH1 ARG A 22 -10.355 25.312 -17.743 1.00 0.00 N ATOM 308 NH2 ARG A 22 -8.577 26.469 -18.634 1.00 0.00 N ATOM 0 H ARG A 22 -9.317 23.169 -12.703 1.00 0.00 H new ATOM 0 HA ARG A 22 -9.287 20.660 -14.279 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -7.214 22.866 -14.447 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -7.382 21.468 -15.490 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -8.428 22.889 -16.899 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -9.820 22.664 -15.859 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -9.767 24.821 -15.227 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -8.114 24.660 -14.669 1.00 0.00 H new ATOM 0 HE ARG A 22 -7.342 25.653 -16.632 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -10.750 24.725 -17.008 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -10.933 25.599 -18.533 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -7.605 26.773 -18.587 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -9.162 26.752 -19.420 1.00 0.00 H new ATOM 322 N ILE A 23 -7.033 19.911 -13.135 1.00 0.00 N ATOM 323 CA ILE A 23 -6.087 19.290 -12.209 1.00 0.00 C ATOM 324 C ILE A 23 -4.845 18.761 -12.936 1.00 0.00 C ATOM 325 O ILE A 23 -4.953 18.144 -13.998 1.00 0.00 O ATOM 326 CB ILE A 23 -6.744 18.131 -11.423 1.00 0.00 C ATOM 327 CG1 ILE A 23 -7.387 17.120 -12.379 1.00 0.00 C ATOM 328 CG2 ILE A 23 -7.781 18.669 -10.446 1.00 0.00 C ATOM 329 CD1 ILE A 23 -7.475 15.719 -11.815 1.00 0.00 C ATOM 0 H ILE A 23 -7.051 19.490 -14.064 1.00 0.00 H new ATOM 0 HA ILE A 23 -5.782 20.070 -11.511 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.965 17.620 -10.858 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.390 17.463 -12.635 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -6.813 17.094 -13.305 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -8.233 17.840 -9.902 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -7.299 19.346 -9.741 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -8.554 19.207 -10.995 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -7.941 15.060 -12.548 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.473 15.356 -11.585 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -8.074 15.730 -10.905 1.00 0.00 H new ATOM 341 N PRO A 24 -3.644 18.998 -12.367 1.00 0.00 N ATOM 342 CA PRO A 24 -2.377 18.547 -12.948 1.00 0.00 C ATOM 343 C PRO A 24 -2.004 17.127 -12.510 1.00 0.00 C ATOM 344 O PRO A 24 -2.656 16.554 -11.637 1.00 0.00 O ATOM 345 CB PRO A 24 -1.383 19.557 -12.384 1.00 0.00 C ATOM 346 CG PRO A 24 -1.926 19.912 -11.038 1.00 0.00 C ATOM 347 CD PRO A 24 -3.425 19.733 -11.106 1.00 0.00 C ATOM 0 HA PRO A 24 -2.408 18.502 -14.037 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -0.384 19.129 -12.308 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -1.305 20.436 -13.024 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -1.496 19.272 -10.267 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -1.672 20.940 -10.778 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -3.799 19.173 -10.249 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -3.941 20.693 -11.110 1.00 0.00 H new ATOM 355 N LYS A 25 -0.947 16.573 -13.123 1.00 0.00 N ATOM 356 CA LYS A 25 -0.465 15.216 -12.807 1.00 0.00 C ATOM 357 C LYS A 25 -0.411 14.956 -11.296 1.00 0.00 C ATOM 358 O LYS A 25 -0.741 13.860 -10.842 1.00 0.00 O ATOM 359 CB LYS A 25 0.927 14.983 -13.415 1.00 0.00 C ATOM 360 CG LYS A 25 1.921 16.106 -13.140 1.00 0.00 C ATOM 361 CD LYS A 25 3.182 15.950 -13.973 1.00 0.00 C ATOM 362 CE LYS A 25 3.945 17.262 -14.094 1.00 0.00 C ATOM 363 NZ LYS A 25 4.554 17.429 -15.444 1.00 0.00 N ATOM 0 H LYS A 25 -0.405 17.046 -13.846 1.00 0.00 H new ATOM 0 HA LYS A 25 -1.180 14.518 -13.243 1.00 0.00 H new ATOM 0 HB2 LYS A 25 1.332 14.050 -13.023 1.00 0.00 H new ATOM 0 HB3 LYS A 25 0.825 14.858 -14.493 1.00 0.00 H new ATOM 0 HG2 LYS A 25 1.456 17.067 -13.359 1.00 0.00 H new ATOM 0 HG3 LYS A 25 2.181 16.112 -12.082 1.00 0.00 H new ATOM 0 HD2 LYS A 25 3.826 15.196 -13.521 1.00 0.00 H new ATOM 0 HD3 LYS A 25 2.919 15.590 -14.967 1.00 0.00 H new ATOM 0 HE2 LYS A 25 3.270 18.094 -13.895 1.00 0.00 H new ATOM 0 HE3 LYS A 25 4.727 17.298 -13.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 5.064 18.334 -15.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 5.218 16.649 -15.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 3.805 17.420 -16.166 1.00 0.00 H new ATOM 377 N THR A 26 0.007 15.964 -10.525 1.00 0.00 N ATOM 378 CA THR A 26 0.104 15.832 -9.068 1.00 0.00 C ATOM 379 C THR A 26 -1.258 15.493 -8.451 1.00 0.00 C ATOM 380 O THR A 26 -1.350 14.629 -7.574 1.00 0.00 O ATOM 381 CB THR A 26 0.654 17.127 -8.448 1.00 0.00 C ATOM 382 OG1 THR A 26 -0.152 18.239 -8.798 1.00 0.00 O ATOM 383 CG2 THR A 26 2.076 17.444 -8.869 1.00 0.00 C ATOM 0 H THR A 26 0.283 16.878 -10.884 1.00 0.00 H new ATOM 0 HA THR A 26 0.791 15.014 -8.852 1.00 0.00 H new ATOM 0 HB THR A 26 0.641 16.952 -7.372 1.00 0.00 H new ATOM 0 HG1 THR A 26 -0.637 18.554 -8.007 1.00 0.00 H new ATOM 0 HG21 THR A 26 2.398 18.371 -8.394 1.00 0.00 H new ATOM 0 HG22 THR A 26 2.735 16.631 -8.564 1.00 0.00 H new ATOM 0 HG23 THR A 26 2.118 17.558 -9.952 1.00 0.00 H new ATOM 391 N SER A 27 -2.310 16.171 -8.920 1.00 0.00 N ATOM 392 CA SER A 27 -3.667 15.945 -8.423 1.00 0.00 C ATOM 393 C SER A 27 -4.219 14.594 -8.885 1.00 0.00 C ATOM 394 O SER A 27 -4.688 13.805 -8.066 1.00 0.00 O ATOM 395 CB SER A 27 -4.592 17.076 -8.880 1.00 0.00 C ATOM 396 OG SER A 27 -4.347 18.261 -8.143 1.00 0.00 O ATOM 0 H SER A 27 -2.245 16.884 -9.647 1.00 0.00 H new ATOM 0 HA SER A 27 -3.624 15.933 -7.334 1.00 0.00 H new ATOM 0 HB2 SER A 27 -4.442 17.267 -9.943 1.00 0.00 H new ATOM 0 HB3 SER A 27 -5.632 16.774 -8.754 1.00 0.00 H new ATOM 0 HG SER A 27 -5.194 18.611 -7.796 1.00 0.00 H new ATOM 402 N ILE A 28 -4.167 14.333 -10.201 1.00 0.00 N ATOM 403 CA ILE A 28 -4.676 13.064 -10.758 1.00 0.00 C ATOM 404 C ILE A 28 -4.090 11.849 -10.036 1.00 0.00 C ATOM 405 O ILE A 28 -4.780 10.845 -9.862 1.00 0.00 O ATOM 406 CB ILE A 28 -4.428 12.879 -12.288 1.00 0.00 C ATOM 407 CG1 ILE A 28 -3.719 14.082 -12.934 1.00 0.00 C ATOM 408 CG2 ILE A 28 -5.744 12.586 -12.998 1.00 0.00 C ATOM 409 CD1 ILE A 28 -4.637 15.245 -13.253 1.00 0.00 C ATOM 0 H ILE A 28 -3.783 14.974 -10.895 1.00 0.00 H new ATOM 0 HA ILE A 28 -5.752 13.128 -10.599 1.00 0.00 H new ATOM 0 HB ILE A 28 -3.754 12.030 -12.401 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -2.932 14.428 -12.264 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -3.234 13.753 -13.853 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -5.561 12.458 -14.065 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -6.181 11.673 -12.593 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -6.433 13.417 -12.845 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -4.059 16.051 -13.705 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -5.410 14.918 -13.948 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -5.103 15.603 -12.335 1.00 0.00 H new ATOM 421 N GLY A 29 -2.823 11.940 -9.617 1.00 0.00 N ATOM 422 CA GLY A 29 -2.187 10.831 -8.918 1.00 0.00 C ATOM 423 C GLY A 29 -2.975 10.379 -7.701 1.00 0.00 C ATOM 424 O GLY A 29 -3.580 9.306 -7.712 1.00 0.00 O ATOM 0 H GLY A 29 -2.230 12.759 -9.749 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.072 9.992 -9.604 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.185 11.128 -8.608 1.00 0.00 H new ATOM 428 N ASP A 30 -2.974 11.207 -6.655 1.00 0.00 N ATOM 429 CA ASP A 30 -3.704 10.894 -5.419 1.00 0.00 C ATOM 430 C ASP A 30 -5.217 10.827 -5.663 1.00 0.00 C ATOM 431 O ASP A 30 -5.931 10.123 -4.946 1.00 0.00 O ATOM 432 CB ASP A 30 -3.394 11.911 -4.306 1.00 0.00 C ATOM 433 CG ASP A 30 -3.057 13.302 -4.823 1.00 0.00 C ATOM 434 OD1 ASP A 30 -3.968 13.983 -5.336 1.00 0.00 O ATOM 435 OD2 ASP A 30 -1.882 13.707 -4.713 1.00 0.00 O ATOM 0 H ASP A 30 -2.478 12.098 -6.636 1.00 0.00 H new ATOM 0 HA ASP A 30 -3.363 9.912 -5.091 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -4.254 11.980 -3.639 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -2.558 11.542 -3.712 1.00 0.00 H new ATOM 440 N LEU A 31 -5.700 11.549 -6.684 1.00 0.00 N ATOM 441 CA LEU A 31 -7.126 11.550 -7.025 1.00 0.00 C ATOM 442 C LEU A 31 -7.561 10.159 -7.489 1.00 0.00 C ATOM 443 O LEU A 31 -8.551 9.612 -6.997 1.00 0.00 O ATOM 444 CB LEU A 31 -7.417 12.595 -8.114 1.00 0.00 C ATOM 445 CG LEU A 31 -8.687 12.358 -8.944 1.00 0.00 C ATOM 446 CD1 LEU A 31 -9.930 12.475 -8.074 1.00 0.00 C ATOM 447 CD2 LEU A 31 -8.756 13.340 -10.106 1.00 0.00 C ATOM 0 H LEU A 31 -5.124 12.138 -7.286 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.696 11.813 -6.134 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -7.492 13.574 -7.641 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -6.564 12.633 -8.792 1.00 0.00 H new ATOM 0 HG LEU A 31 -8.646 11.346 -9.347 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -10.818 12.303 -8.683 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -9.888 11.733 -7.277 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -9.976 13.473 -7.638 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -9.662 13.157 -10.683 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -8.770 14.359 -9.720 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.885 13.207 -10.747 1.00 0.00 H new ATOM 459 N LEU A 32 -6.802 9.592 -8.432 1.00 0.00 N ATOM 460 CA LEU A 32 -7.086 8.259 -8.965 1.00 0.00 C ATOM 461 C LEU A 32 -7.015 7.195 -7.868 1.00 0.00 C ATOM 462 O LEU A 32 -7.690 6.169 -7.953 1.00 0.00 O ATOM 463 CB LEU A 32 -6.109 7.915 -10.094 1.00 0.00 C ATOM 464 CG LEU A 32 -6.295 8.725 -11.381 1.00 0.00 C ATOM 465 CD1 LEU A 32 -5.031 8.686 -12.228 1.00 0.00 C ATOM 466 CD2 LEU A 32 -7.485 8.207 -12.175 1.00 0.00 C ATOM 0 H LEU A 32 -5.983 10.039 -8.843 1.00 0.00 H new ATOM 0 HA LEU A 32 -8.101 8.270 -9.363 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -5.092 8.065 -9.732 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -6.210 6.856 -10.331 1.00 0.00 H new ATOM 0 HG LEU A 32 -6.492 9.761 -11.105 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -5.184 9.267 -13.137 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -4.201 9.109 -11.662 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -4.801 7.654 -12.492 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -7.599 8.796 -13.085 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -7.320 7.162 -12.437 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -8.389 8.291 -11.572 1.00 0.00 H new ATOM 478 N ARG A 33 -6.199 7.447 -6.834 1.00 0.00 N ATOM 479 CA ARG A 33 -6.049 6.517 -5.717 1.00 0.00 C ATOM 480 C ARG A 33 -7.413 6.190 -5.095 1.00 0.00 C ATOM 481 O ARG A 33 -7.666 5.049 -4.707 1.00 0.00 O ATOM 482 CB ARG A 33 -5.084 7.111 -4.671 1.00 0.00 C ATOM 483 CG ARG A 33 -5.667 7.283 -3.271 1.00 0.00 C ATOM 484 CD ARG A 33 -5.753 5.955 -2.531 1.00 0.00 C ATOM 485 NE ARG A 33 -4.777 5.855 -1.444 1.00 0.00 N ATOM 486 CZ ARG A 33 -4.788 4.895 -0.515 1.00 0.00 C ATOM 487 NH1 ARG A 33 -5.721 3.943 -0.537 1.00 0.00 N ATOM 488 NH2 ARG A 33 -3.863 4.885 0.440 1.00 0.00 N ATOM 0 H ARG A 33 -5.633 8.292 -6.753 1.00 0.00 H new ATOM 0 HA ARG A 33 -5.626 5.583 -6.086 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -4.206 6.469 -4.605 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -4.742 8.083 -5.027 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -5.049 7.978 -2.702 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -6.661 7.725 -3.342 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -6.757 5.833 -2.126 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -5.592 5.139 -3.236 1.00 0.00 H new ATOM 0 HE ARG A 33 -4.043 6.562 -1.393 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -6.434 3.944 -1.267 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -5.722 3.214 0.176 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -3.146 5.610 0.463 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -3.871 4.152 1.150 1.00 0.00 H new ATOM 502 N ALA A 34 -8.288 7.201 -5.019 1.00 0.00 N ATOM 503 CA ALA A 34 -9.629 7.027 -4.458 1.00 0.00 C ATOM 504 C ALA A 34 -10.470 6.061 -5.298 1.00 0.00 C ATOM 505 O ALA A 34 -11.324 5.350 -4.764 1.00 0.00 O ATOM 506 CB ALA A 34 -10.330 8.373 -4.342 1.00 0.00 C ATOM 0 H ALA A 34 -8.088 8.148 -5.340 1.00 0.00 H new ATOM 0 HA ALA A 34 -9.520 6.594 -3.464 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -11.326 8.230 -3.924 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -9.753 9.029 -3.690 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -10.413 8.826 -5.330 1.00 0.00 H new ATOM 512 N CYS A 35 -10.218 6.033 -6.611 1.00 0.00 N ATOM 513 CA CYS A 35 -10.944 5.148 -7.522 1.00 0.00 C ATOM 514 C CYS A 35 -10.318 3.756 -7.526 1.00 0.00 C ATOM 515 O CYS A 35 -11.026 2.747 -7.518 1.00 0.00 O ATOM 516 CB CYS A 35 -10.944 5.728 -8.940 1.00 0.00 C ATOM 517 SG CYS A 35 -11.676 7.377 -9.066 1.00 0.00 S ATOM 0 H CYS A 35 -9.515 6.615 -7.065 1.00 0.00 H new ATOM 0 HA CYS A 35 -11.974 5.067 -7.175 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -9.917 5.770 -9.303 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -11.488 5.050 -9.598 1.00 0.00 H new ATOM 0 HG CYS A 35 -11.627 7.780 -10.301 1.00 0.00 H new ATOM 523 N GLY A 36 -8.983 3.713 -7.534 1.00 0.00 N ATOM 524 CA GLY A 36 -8.273 2.449 -7.535 1.00 0.00 C ATOM 525 C GLY A 36 -6.923 2.539 -6.852 1.00 0.00 C ATOM 526 O GLY A 36 -6.798 2.218 -5.669 1.00 0.00 O ATOM 0 H GLY A 36 -8.383 4.538 -7.540 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.880 1.695 -7.034 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.134 2.115 -8.563 1.00 0.00 H new ATOM 530 N GLN A 37 -5.908 2.974 -7.601 1.00 0.00 N ATOM 531 CA GLN A 37 -4.552 3.102 -7.065 1.00 0.00 C ATOM 532 C GLN A 37 -3.918 4.444 -7.429 1.00 0.00 C ATOM 533 O GLN A 37 -4.460 5.203 -8.237 1.00 0.00 O ATOM 534 CB GLN A 37 -3.672 1.960 -7.578 1.00 0.00 C ATOM 535 CG GLN A 37 -3.110 1.082 -6.472 1.00 0.00 C ATOM 536 CD GLN A 37 -2.577 -0.242 -6.988 1.00 0.00 C ATOM 537 OE1 GLN A 37 -1.511 -0.296 -7.603 1.00 0.00 O ATOM 538 NE2 GLN A 37 -3.315 -1.321 -6.739 1.00 0.00 N ATOM 0 H GLN A 37 -6.000 3.244 -8.580 1.00 0.00 H new ATOM 0 HA GLN A 37 -4.625 3.051 -5.979 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -4.255 1.342 -8.261 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -2.846 2.379 -8.153 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -2.309 1.617 -5.961 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -3.889 0.892 -5.733 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -4.192 -1.232 -6.226 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -3.004 -2.237 -7.061 1.00 0.00 H new ATOM 547 N ASN A 38 -2.753 4.714 -6.837 1.00 0.00 N ATOM 548 CA ASN A 38 -2.017 5.947 -7.098 1.00 0.00 C ATOM 549 C ASN A 38 -0.604 5.628 -7.592 1.00 0.00 C ATOM 550 O ASN A 38 0.240 5.160 -6.825 1.00 0.00 O ATOM 551 CB ASN A 38 -1.967 6.819 -5.832 1.00 0.00 C ATOM 552 CG ASN A 38 -0.821 7.824 -5.828 1.00 0.00 C ATOM 553 OD1 ASN A 38 -0.081 7.929 -4.850 1.00 0.00 O ATOM 554 ND2 ASN A 38 -0.668 8.569 -6.921 1.00 0.00 N ATOM 0 H ASN A 38 -2.299 4.090 -6.170 1.00 0.00 H new ATOM 0 HA ASN A 38 -2.535 6.505 -7.878 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -2.910 7.356 -5.733 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -1.875 6.173 -4.959 1.00 0.00 H new ATOM 0 HD21 ASN A 38 0.084 9.257 -6.968 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -1.302 8.452 -7.711 1.00 0.00 H new ATOM 561 N PRO A 39 -0.331 5.873 -8.890 1.00 0.00 N ATOM 562 CA PRO A 39 0.978 5.608 -9.490 1.00 0.00 C ATOM 563 C PRO A 39 1.975 6.749 -9.254 1.00 0.00 C ATOM 564 O PRO A 39 1.771 7.593 -8.379 1.00 0.00 O ATOM 565 CB PRO A 39 0.634 5.482 -10.973 1.00 0.00 C ATOM 566 CG PRO A 39 -0.491 6.438 -11.166 1.00 0.00 C ATOM 567 CD PRO A 39 -1.284 6.419 -9.882 1.00 0.00 C ATOM 0 HA PRO A 39 1.466 4.731 -9.066 1.00 0.00 H new ATOM 0 HB2 PRO A 39 1.486 5.736 -11.603 1.00 0.00 H new ATOM 0 HB3 PRO A 39 0.341 4.464 -11.229 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -0.118 7.440 -11.379 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -1.112 6.143 -12.012 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -1.622 7.418 -9.605 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -2.173 5.794 -9.969 1.00 0.00 H new ATOM 575 N THR A 40 3.049 6.768 -10.044 1.00 0.00 N ATOM 576 CA THR A 40 4.078 7.804 -9.932 1.00 0.00 C ATOM 577 C THR A 40 3.760 8.990 -10.840 1.00 0.00 C ATOM 578 O THR A 40 2.908 8.892 -11.726 1.00 0.00 O ATOM 579 CB THR A 40 5.461 7.242 -10.289 1.00 0.00 C ATOM 580 OG1 THR A 40 5.377 6.316 -11.359 1.00 0.00 O ATOM 581 CG2 THR A 40 6.144 6.546 -9.131 1.00 0.00 C ATOM 0 H THR A 40 3.230 6.076 -10.771 1.00 0.00 H new ATOM 0 HA THR A 40 4.089 8.144 -8.897 1.00 0.00 H new ATOM 0 HB THR A 40 6.054 8.112 -10.572 1.00 0.00 H new ATOM 0 HG1 THR A 40 6.272 5.975 -11.567 1.00 0.00 H new ATOM 0 HG21 THR A 40 7.116 6.173 -9.453 1.00 0.00 H new ATOM 0 HG22 THR A 40 6.279 7.251 -8.311 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.529 5.712 -8.794 1.00 0.00 H new ATOM 589 N LEU A 41 4.462 10.106 -10.621 1.00 0.00 N ATOM 590 CA LEU A 41 4.270 11.313 -11.425 1.00 0.00 C ATOM 591 C LEU A 41 4.461 11.011 -12.911 1.00 0.00 C ATOM 592 O LEU A 41 3.776 11.586 -13.757 1.00 0.00 O ATOM 593 CB LEU A 41 5.243 12.409 -10.982 1.00 0.00 C ATOM 594 CG LEU A 41 4.811 13.219 -9.752 1.00 0.00 C ATOM 595 CD1 LEU A 41 3.842 14.321 -10.148 1.00 0.00 C ATOM 596 CD2 LEU A 41 4.190 12.320 -8.687 1.00 0.00 C ATOM 0 H LEU A 41 5.169 10.197 -9.892 1.00 0.00 H new ATOM 0 HA LEU A 41 3.249 11.664 -11.272 1.00 0.00 H new ATOM 0 HB2 LEU A 41 6.209 11.950 -10.772 1.00 0.00 H new ATOM 0 HB3 LEU A 41 5.391 13.097 -11.814 1.00 0.00 H new ATOM 0 HG LEU A 41 5.704 13.677 -9.326 1.00 0.00 H new ATOM 0 HD11 LEU A 41 3.548 14.883 -9.262 1.00 0.00 H new ATOM 0 HD12 LEU A 41 4.324 14.991 -10.859 1.00 0.00 H new ATOM 0 HD13 LEU A 41 2.957 13.880 -10.608 1.00 0.00 H new ATOM 0 HD21 LEU A 41 3.894 12.923 -7.829 1.00 0.00 H new ATOM 0 HD22 LEU A 41 3.313 11.821 -9.099 1.00 0.00 H new ATOM 0 HD23 LEU A 41 4.918 11.573 -8.372 1.00 0.00 H new ATOM 608 N ALA A 42 5.381 10.092 -13.222 1.00 0.00 N ATOM 609 CA ALA A 42 5.639 9.700 -14.605 1.00 0.00 C ATOM 610 C ALA A 42 4.372 9.135 -15.251 1.00 0.00 C ATOM 611 O ALA A 42 4.109 9.375 -16.430 1.00 0.00 O ATOM 612 CB ALA A 42 6.767 8.680 -14.671 1.00 0.00 C ATOM 0 H ALA A 42 5.957 9.608 -12.533 1.00 0.00 H new ATOM 0 HA ALA A 42 5.943 10.588 -15.160 1.00 0.00 H new ATOM 0 HB1 ALA A 42 6.944 8.400 -15.709 1.00 0.00 H new ATOM 0 HB2 ALA A 42 7.675 9.114 -14.252 1.00 0.00 H new ATOM 0 HB3 ALA A 42 6.491 7.794 -14.099 1.00 0.00 H new ATOM 618 N GLU A 43 3.585 8.390 -14.461 1.00 0.00 N ATOM 619 CA GLU A 43 2.338 7.796 -14.946 1.00 0.00 C ATOM 620 C GLU A 43 1.319 8.884 -15.300 1.00 0.00 C ATOM 621 O GLU A 43 0.805 8.915 -16.420 1.00 0.00 O ATOM 622 CB GLU A 43 1.750 6.847 -13.891 1.00 0.00 C ATOM 623 CG GLU A 43 1.050 5.630 -14.478 1.00 0.00 C ATOM 624 CD GLU A 43 -0.144 5.996 -15.340 1.00 0.00 C ATOM 625 OE1 GLU A 43 -1.241 6.201 -14.779 1.00 0.00 O ATOM 626 OE2 GLU A 43 0.019 6.083 -16.575 1.00 0.00 O ATOM 0 H GLU A 43 3.793 8.186 -13.483 1.00 0.00 H new ATOM 0 HA GLU A 43 2.563 7.226 -15.847 1.00 0.00 H new ATOM 0 HB2 GLU A 43 2.551 6.511 -13.232 1.00 0.00 H new ATOM 0 HB3 GLU A 43 1.041 7.399 -13.274 1.00 0.00 H new ATOM 0 HG2 GLU A 43 1.762 5.060 -15.075 1.00 0.00 H new ATOM 0 HG3 GLU A 43 0.721 4.980 -13.667 1.00 0.00 H new ATOM 633 N ILE A 44 1.038 9.780 -14.344 1.00 0.00 N ATOM 634 CA ILE A 44 0.083 10.875 -14.575 1.00 0.00 C ATOM 635 C ILE A 44 0.521 11.734 -15.759 1.00 0.00 C ATOM 636 O ILE A 44 -0.296 12.080 -16.615 1.00 0.00 O ATOM 637 CB ILE A 44 -0.138 11.795 -13.341 1.00 0.00 C ATOM 638 CG1 ILE A 44 0.959 11.631 -12.274 1.00 0.00 C ATOM 639 CG2 ILE A 44 -1.513 11.533 -12.749 1.00 0.00 C ATOM 640 CD1 ILE A 44 0.639 10.603 -11.208 1.00 0.00 C ATOM 0 H ILE A 44 1.453 9.770 -13.412 1.00 0.00 H new ATOM 0 HA ILE A 44 -0.867 10.384 -14.785 1.00 0.00 H new ATOM 0 HB ILE A 44 -0.079 12.828 -13.684 1.00 0.00 H new ATOM 0 HG12 ILE A 44 1.890 11.350 -12.766 1.00 0.00 H new ATOM 0 HG13 ILE A 44 1.130 12.595 -11.794 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -1.666 12.179 -11.884 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -2.277 11.742 -13.498 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -1.583 10.490 -12.440 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.462 10.549 -10.496 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -0.274 10.892 -10.687 1.00 0.00 H new ATOM 0 HD13 ILE A 44 0.498 9.628 -11.674 1.00 0.00 H new ATOM 652 N THR A 45 1.818 12.060 -15.811 1.00 0.00 N ATOM 653 CA THR A 45 2.368 12.860 -16.909 1.00 0.00 C ATOM 654 C THR A 45 2.110 12.171 -18.250 1.00 0.00 C ATOM 655 O THR A 45 1.712 12.819 -19.219 1.00 0.00 O ATOM 656 CB THR A 45 3.875 13.083 -16.724 1.00 0.00 C ATOM 657 OG1 THR A 45 4.154 13.653 -15.458 1.00 0.00 O ATOM 658 CG2 THR A 45 4.480 13.994 -17.775 1.00 0.00 C ATOM 0 H THR A 45 2.503 11.783 -15.108 1.00 0.00 H new ATOM 0 HA THR A 45 1.869 13.829 -16.901 1.00 0.00 H new ATOM 0 HB THR A 45 4.321 12.093 -16.817 1.00 0.00 H new ATOM 0 HG1 THR A 45 4.057 12.969 -14.763 1.00 0.00 H new ATOM 0 HG21 THR A 45 5.547 14.109 -17.586 1.00 0.00 H new ATOM 0 HG22 THR A 45 4.332 13.558 -18.763 1.00 0.00 H new ATOM 0 HG23 THR A 45 3.996 14.970 -17.733 1.00 0.00 H new ATOM 666 N GLU A 46 2.328 10.849 -18.291 1.00 0.00 N ATOM 667 CA GLU A 46 2.107 10.062 -19.508 1.00 0.00 C ATOM 668 C GLU A 46 0.672 10.230 -20.005 1.00 0.00 C ATOM 669 O GLU A 46 0.436 10.358 -21.208 1.00 0.00 O ATOM 670 CB GLU A 46 2.407 8.580 -19.258 1.00 0.00 C ATOM 671 CG GLU A 46 3.870 8.210 -19.454 1.00 0.00 C ATOM 672 CD GLU A 46 4.339 8.403 -20.885 1.00 0.00 C ATOM 673 OE1 GLU A 46 4.801 9.517 -21.215 1.00 0.00 O ATOM 674 OE2 GLU A 46 4.244 7.441 -21.676 1.00 0.00 O ATOM 0 H GLU A 46 2.657 10.304 -17.494 1.00 0.00 H new ATOM 0 HA GLU A 46 2.788 10.430 -20.275 1.00 0.00 H new ATOM 0 HB2 GLU A 46 2.110 8.325 -18.241 1.00 0.00 H new ATOM 0 HB3 GLU A 46 1.796 7.977 -19.929 1.00 0.00 H new ATOM 0 HG2 GLU A 46 4.486 8.817 -18.790 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.019 7.170 -19.165 1.00 0.00 H new ATOM 681 N ILE A 47 -0.282 10.256 -19.068 1.00 0.00 N ATOM 682 CA ILE A 47 -1.691 10.442 -19.407 1.00 0.00 C ATOM 683 C ILE A 47 -1.896 11.833 -20.005 1.00 0.00 C ATOM 684 O ILE A 47 -2.493 11.976 -21.070 1.00 0.00 O ATOM 685 CB ILE A 47 -2.603 10.267 -18.167 1.00 0.00 C ATOM 686 CG1 ILE A 47 -2.432 8.865 -17.572 1.00 0.00 C ATOM 687 CG2 ILE A 47 -4.060 10.519 -18.536 1.00 0.00 C ATOM 688 CD1 ILE A 47 -2.726 8.797 -16.088 1.00 0.00 C ATOM 0 H ILE A 47 -0.101 10.150 -18.070 1.00 0.00 H new ATOM 0 HA ILE A 47 -1.966 9.680 -20.136 1.00 0.00 H new ATOM 0 HB ILE A 47 -2.309 10.999 -17.415 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.091 8.174 -18.097 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -1.411 8.527 -17.748 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -4.686 10.392 -17.653 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -4.169 11.535 -18.915 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -4.368 9.810 -19.305 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -2.585 7.775 -15.736 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -2.049 9.463 -15.552 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.756 9.104 -15.907 1.00 0.00 H new ATOM 700 N GLU A 48 -1.367 12.852 -19.318 1.00 0.00 N ATOM 701 CA GLU A 48 -1.458 14.238 -19.782 1.00 0.00 C ATOM 702 C GLU A 48 -0.862 14.408 -21.189 1.00 0.00 C ATOM 703 O GLU A 48 -1.213 15.346 -21.905 1.00 0.00 O ATOM 704 CB GLU A 48 -0.757 15.170 -18.797 1.00 0.00 C ATOM 705 CG GLU A 48 -1.603 15.454 -17.570 1.00 0.00 C ATOM 706 CD GLU A 48 -0.981 16.474 -16.630 1.00 0.00 C ATOM 707 OE1 GLU A 48 0.210 16.321 -16.282 1.00 0.00 O ATOM 708 OE2 GLU A 48 -1.691 17.423 -16.232 1.00 0.00 O ATOM 0 H GLU A 48 -0.869 12.740 -18.435 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.515 14.500 -19.837 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.188 14.724 -18.488 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -0.518 16.109 -19.296 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -2.582 15.814 -17.888 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -1.766 14.523 -17.027 1.00 0.00 H new ATOM 715 N SER A 49 0.042 13.494 -21.578 1.00 0.00 N ATOM 716 CA SER A 49 0.688 13.537 -22.897 1.00 0.00 C ATOM 717 C SER A 49 -0.308 13.333 -24.055 1.00 0.00 C ATOM 718 O SER A 49 0.073 13.464 -25.220 1.00 0.00 O ATOM 719 CB SER A 49 1.798 12.482 -22.985 1.00 0.00 C ATOM 720 OG SER A 49 2.670 12.556 -21.869 1.00 0.00 O ATOM 0 H SER A 49 0.342 12.714 -20.994 1.00 0.00 H new ATOM 0 HA SER A 49 1.114 14.535 -23.001 1.00 0.00 H new ATOM 0 HB2 SER A 49 1.354 11.488 -23.037 1.00 0.00 H new ATOM 0 HB3 SER A 49 2.367 12.626 -23.904 1.00 0.00 H new ATOM 0 HG SER A 49 2.149 12.485 -21.042 1.00 0.00 H new ATOM 726 N THR A 50 -1.573 13.015 -23.743 1.00 0.00 N ATOM 727 CA THR A 50 -2.587 12.802 -24.779 1.00 0.00 C ATOM 728 C THR A 50 -3.719 13.824 -24.657 1.00 0.00 C ATOM 729 O THR A 50 -4.130 14.414 -25.658 1.00 0.00 O ATOM 730 CB THR A 50 -3.154 11.377 -24.708 1.00 0.00 C ATOM 731 OG1 THR A 50 -3.445 11.006 -23.371 1.00 0.00 O ATOM 732 CG2 THR A 50 -2.223 10.331 -25.283 1.00 0.00 C ATOM 0 H THR A 50 -1.914 12.901 -22.788 1.00 0.00 H new ATOM 0 HA THR A 50 -2.103 12.935 -25.746 1.00 0.00 H new ATOM 0 HB THR A 50 -4.062 11.406 -25.310 1.00 0.00 H new ATOM 0 HG1 THR A 50 -2.694 11.254 -22.792 1.00 0.00 H new ATOM 0 HG21 THR A 50 -2.686 9.347 -25.201 1.00 0.00 H new ATOM 0 HG22 THR A 50 -2.029 10.554 -26.332 1.00 0.00 H new ATOM 0 HG23 THR A 50 -1.283 10.337 -24.731 1.00 0.00 H new ATOM 740 N LEU A 51 -4.208 14.047 -23.433 1.00 0.00 N ATOM 741 CA LEU A 51 -5.277 15.022 -23.205 1.00 0.00 C ATOM 742 C LEU A 51 -4.672 16.400 -22.935 1.00 0.00 C ATOM 743 O LEU A 51 -3.522 16.501 -22.507 1.00 0.00 O ATOM 744 CB LEU A 51 -6.184 14.618 -22.024 1.00 0.00 C ATOM 745 CG LEU A 51 -6.461 13.116 -21.845 1.00 0.00 C ATOM 746 CD1 LEU A 51 -6.561 12.405 -23.188 1.00 0.00 C ATOM 747 CD2 LEU A 51 -5.393 12.473 -20.971 1.00 0.00 C ATOM 0 H LEU A 51 -3.883 13.570 -22.592 1.00 0.00 H new ATOM 0 HA LEU A 51 -5.892 15.052 -24.104 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -5.732 14.992 -21.105 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -7.140 15.128 -22.140 1.00 0.00 H new ATOM 0 HG LEU A 51 -7.424 13.013 -21.344 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -6.757 11.345 -23.025 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -7.374 12.839 -23.770 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -5.623 12.521 -23.732 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -5.608 11.410 -20.857 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -4.416 12.598 -21.439 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -5.389 12.950 -19.991 1.00 0.00 H new ATOM 759 N PRO A 52 -5.439 17.482 -23.185 1.00 0.00 N ATOM 760 CA PRO A 52 -4.976 18.861 -22.968 1.00 0.00 C ATOM 761 C PRO A 52 -4.183 19.032 -21.667 1.00 0.00 C ATOM 762 O PRO A 52 -4.423 18.320 -20.689 1.00 0.00 O ATOM 763 CB PRO A 52 -6.281 19.650 -22.908 1.00 0.00 C ATOM 764 CG PRO A 52 -7.218 18.897 -23.788 1.00 0.00 C ATOM 765 CD PRO A 52 -6.819 17.446 -23.707 1.00 0.00 C ATOM 0 HA PRO A 52 -4.288 19.187 -23.748 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -6.660 19.712 -21.888 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -6.142 20.672 -23.260 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -8.249 19.033 -23.462 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -7.158 19.258 -24.815 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -7.481 16.887 -23.046 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -6.863 16.965 -24.684 1.00 0.00 H new ATOM 773 N ALA A 53 -3.232 19.979 -21.682 1.00 0.00 N ATOM 774 CA ALA A 53 -2.370 20.267 -20.524 1.00 0.00 C ATOM 775 C ALA A 53 -3.084 20.047 -19.189 1.00 0.00 C ATOM 776 O ALA A 53 -2.702 19.170 -18.413 1.00 0.00 O ATOM 777 CB ALA A 53 -1.837 21.693 -20.609 1.00 0.00 C ATOM 0 H ALA A 53 -3.039 20.565 -22.494 1.00 0.00 H new ATOM 0 HA ALA A 53 -1.539 19.562 -20.560 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -1.201 21.896 -19.748 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -1.257 21.811 -21.524 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -2.672 22.394 -20.616 1.00 0.00 H new ATOM 783 N GLU A 54 -4.125 20.842 -18.929 1.00 0.00 N ATOM 784 CA GLU A 54 -4.888 20.722 -17.690 1.00 0.00 C ATOM 785 C GLU A 54 -5.989 19.674 -17.836 1.00 0.00 C ATOM 786 O GLU A 54 -6.828 19.763 -18.736 1.00 0.00 O ATOM 787 CB GLU A 54 -5.490 22.072 -17.292 1.00 0.00 C ATOM 788 CG GLU A 54 -4.998 22.577 -15.943 1.00 0.00 C ATOM 789 CD GLU A 54 -5.206 24.071 -15.748 1.00 0.00 C ATOM 790 OE1 GLU A 54 -5.012 24.837 -16.718 1.00 0.00 O ATOM 791 OE2 GLU A 54 -5.557 24.478 -14.620 1.00 0.00 O ATOM 0 H GLU A 54 -4.456 21.573 -19.559 1.00 0.00 H new ATOM 0 HA GLU A 54 -4.206 20.402 -16.902 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -5.249 22.809 -18.058 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -6.576 21.984 -17.265 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -5.517 22.038 -15.150 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -3.937 22.349 -15.842 1.00 0.00 H new ATOM 798 N VAL A 55 -5.974 18.678 -16.949 1.00 0.00 N ATOM 799 CA VAL A 55 -6.963 17.605 -16.979 1.00 0.00 C ATOM 800 C VAL A 55 -8.212 17.991 -16.189 1.00 0.00 C ATOM 801 O VAL A 55 -8.324 17.694 -14.998 1.00 0.00 O ATOM 802 CB VAL A 55 -6.385 16.283 -16.417 1.00 0.00 C ATOM 803 CG1 VAL A 55 -7.422 15.168 -16.469 1.00 0.00 C ATOM 804 CG2 VAL A 55 -5.129 15.884 -17.178 1.00 0.00 C ATOM 0 H VAL A 55 -5.286 18.594 -16.201 1.00 0.00 H new ATOM 0 HA VAL A 55 -7.233 17.450 -18.023 1.00 0.00 H new ATOM 0 HB VAL A 55 -6.119 16.446 -15.373 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -6.990 14.251 -16.069 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -8.290 15.451 -15.874 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -7.728 15.004 -17.502 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -4.736 14.953 -16.770 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -5.371 15.745 -18.232 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -4.379 16.668 -17.079 1.00 0.00 H new ATOM 814 N ASP A 56 -9.152 18.648 -16.863 1.00 0.00 N ATOM 815 CA ASP A 56 -10.401 19.063 -16.224 1.00 0.00 C ATOM 816 C ASP A 56 -11.415 17.920 -16.226 1.00 0.00 C ATOM 817 O ASP A 56 -11.126 16.828 -16.721 1.00 0.00 O ATOM 818 CB ASP A 56 -10.993 20.304 -16.916 1.00 0.00 C ATOM 819 CG ASP A 56 -11.066 20.181 -18.431 1.00 0.00 C ATOM 820 OD1 ASP A 56 -11.593 19.162 -18.926 1.00 0.00 O ATOM 821 OD2 ASP A 56 -10.602 21.112 -19.121 1.00 0.00 O ATOM 0 H ASP A 56 -9.075 18.904 -17.847 1.00 0.00 H new ATOM 0 HA ASP A 56 -10.175 19.326 -15.191 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -11.995 20.484 -16.526 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -10.390 21.175 -16.659 1.00 0.00 H new ATOM 826 N MET A 57 -12.600 18.181 -15.668 1.00 0.00 N ATOM 827 CA MET A 57 -13.675 17.184 -15.600 1.00 0.00 C ATOM 828 C MET A 57 -13.797 16.382 -16.901 1.00 0.00 C ATOM 829 O MET A 57 -13.938 15.160 -16.870 1.00 0.00 O ATOM 830 CB MET A 57 -15.011 17.865 -15.283 1.00 0.00 C ATOM 831 CG MET A 57 -15.173 18.238 -13.817 1.00 0.00 C ATOM 832 SD MET A 57 -16.459 19.475 -13.550 1.00 0.00 S ATOM 833 CE MET A 57 -16.414 19.631 -11.766 1.00 0.00 C ATOM 0 H MET A 57 -12.842 19.081 -15.253 1.00 0.00 H new ATOM 0 HA MET A 57 -13.421 16.487 -14.801 1.00 0.00 H new ATOM 0 HB2 MET A 57 -15.103 18.765 -15.890 1.00 0.00 H new ATOM 0 HB3 MET A 57 -15.825 17.201 -15.572 1.00 0.00 H new ATOM 0 HG2 MET A 57 -15.411 17.343 -13.243 1.00 0.00 H new ATOM 0 HG3 MET A 57 -14.225 18.618 -13.436 1.00 0.00 H new ATOM 0 HE1 MET A 57 -17.328 20.114 -11.420 1.00 0.00 H new ATOM 0 HE2 MET A 57 -16.334 18.641 -11.316 1.00 0.00 H new ATOM 0 HE3 MET A 57 -15.553 20.233 -11.475 1.00 0.00 H new ATOM 843 N GLU A 58 -13.743 17.080 -18.039 1.00 0.00 N ATOM 844 CA GLU A 58 -13.852 16.441 -19.353 1.00 0.00 C ATOM 845 C GLU A 58 -12.624 15.584 -19.674 1.00 0.00 C ATOM 846 O GLU A 58 -12.757 14.415 -20.034 1.00 0.00 O ATOM 847 CB GLU A 58 -14.041 17.497 -20.443 1.00 0.00 C ATOM 848 CG GLU A 58 -14.599 16.941 -21.743 1.00 0.00 C ATOM 849 CD GLU A 58 -14.595 17.963 -22.864 1.00 0.00 C ATOM 850 OE1 GLU A 58 -13.557 18.088 -23.550 1.00 0.00 O ATOM 851 OE2 GLU A 58 -15.628 18.637 -23.057 1.00 0.00 O ATOM 0 H GLU A 58 -13.624 18.092 -18.076 1.00 0.00 H new ATOM 0 HA GLU A 58 -14.722 15.785 -19.324 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -14.711 18.273 -20.073 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -13.082 17.974 -20.644 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -14.012 16.074 -22.045 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -15.619 16.593 -21.577 1.00 0.00 H new ATOM 858 N GLN A 59 -11.434 16.179 -19.552 1.00 0.00 N ATOM 859 CA GLN A 59 -10.180 15.475 -19.838 1.00 0.00 C ATOM 860 C GLN A 59 -10.034 14.215 -18.984 1.00 0.00 C ATOM 861 O GLN A 59 -9.774 13.132 -19.508 1.00 0.00 O ATOM 862 CB GLN A 59 -8.983 16.404 -19.610 1.00 0.00 C ATOM 863 CG GLN A 59 -8.537 17.136 -20.865 1.00 0.00 C ATOM 864 CD GLN A 59 -9.392 18.353 -21.173 1.00 0.00 C ATOM 865 OE1 GLN A 59 -10.500 18.230 -21.694 1.00 0.00 O ATOM 866 NE2 GLN A 59 -8.882 19.537 -20.849 1.00 0.00 N ATOM 0 H GLN A 59 -11.312 17.148 -19.257 1.00 0.00 H new ATOM 0 HA GLN A 59 -10.205 15.171 -20.884 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -9.241 17.136 -18.845 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -8.148 15.820 -19.223 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -7.499 17.447 -20.749 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -8.571 16.450 -21.711 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -7.959 19.594 -20.418 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -9.414 20.388 -21.031 1.00 0.00 H new ATOM 875 N PHE A 60 -10.201 14.368 -17.668 1.00 0.00 N ATOM 876 CA PHE A 60 -10.085 13.245 -16.740 1.00 0.00 C ATOM 877 C PHE A 60 -11.123 12.164 -17.057 1.00 0.00 C ATOM 878 O PHE A 60 -10.782 10.986 -17.153 1.00 0.00 O ATOM 879 CB PHE A 60 -10.203 13.751 -15.289 1.00 0.00 C ATOM 880 CG PHE A 60 -11.330 13.158 -14.487 1.00 0.00 C ATOM 881 CD1 PHE A 60 -11.279 11.840 -14.068 1.00 0.00 C ATOM 882 CD2 PHE A 60 -12.434 13.923 -14.147 1.00 0.00 C ATOM 883 CE1 PHE A 60 -12.307 11.293 -13.325 1.00 0.00 C ATOM 884 CE2 PHE A 60 -13.466 13.383 -13.405 1.00 0.00 C ATOM 885 CZ PHE A 60 -13.403 12.065 -12.993 1.00 0.00 C ATOM 0 H PHE A 60 -10.417 15.260 -17.223 1.00 0.00 H new ATOM 0 HA PHE A 60 -9.104 12.785 -16.857 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -9.265 13.545 -14.773 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -10.325 14.834 -15.309 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -10.425 11.231 -14.325 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -12.488 14.953 -14.466 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -12.254 10.263 -13.004 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -14.321 13.990 -13.147 1.00 0.00 H new ATOM 0 HZ PHE A 60 -14.209 11.640 -12.413 1.00 0.00 H new ATOM 895 N LEU A 61 -12.383 12.572 -17.229 1.00 0.00 N ATOM 896 CA LEU A 61 -13.461 11.633 -17.548 1.00 0.00 C ATOM 897 C LEU A 61 -13.204 10.913 -18.875 1.00 0.00 C ATOM 898 O LEU A 61 -13.556 9.743 -19.026 1.00 0.00 O ATOM 899 CB LEU A 61 -14.809 12.359 -17.595 1.00 0.00 C ATOM 900 CG LEU A 61 -15.411 12.698 -16.226 1.00 0.00 C ATOM 901 CD1 LEU A 61 -16.734 13.434 -16.388 1.00 0.00 C ATOM 902 CD2 LEU A 61 -15.597 11.435 -15.397 1.00 0.00 C ATOM 0 H LEU A 61 -12.681 13.544 -17.153 1.00 0.00 H new ATOM 0 HA LEU A 61 -13.489 10.883 -16.758 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -14.687 13.283 -18.160 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -15.519 11.740 -18.144 1.00 0.00 H new ATOM 0 HG LEU A 61 -14.718 13.355 -15.700 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -17.144 13.665 -15.405 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -16.570 14.360 -16.940 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -17.436 12.805 -16.935 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -16.025 11.695 -14.429 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -16.268 10.753 -15.919 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -14.631 10.952 -15.249 1.00 0.00 H new ATOM 914 N GLN A 62 -12.589 11.616 -19.832 1.00 0.00 N ATOM 915 CA GLN A 62 -12.284 11.037 -21.143 1.00 0.00 C ATOM 916 C GLN A 62 -11.362 9.825 -21.006 1.00 0.00 C ATOM 917 O GLN A 62 -11.642 8.758 -21.558 1.00 0.00 O ATOM 918 CB GLN A 62 -11.637 12.084 -22.054 1.00 0.00 C ATOM 919 CG GLN A 62 -12.624 12.807 -22.956 1.00 0.00 C ATOM 920 CD GLN A 62 -11.943 13.561 -24.083 1.00 0.00 C ATOM 921 OE1 GLN A 62 -11.489 12.961 -25.059 1.00 0.00 O ATOM 922 NE2 GLN A 62 -11.867 14.883 -23.958 1.00 0.00 N ATOM 0 H GLN A 62 -12.293 12.586 -19.723 1.00 0.00 H new ATOM 0 HA GLN A 62 -13.222 10.708 -21.590 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -11.118 12.818 -21.437 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -10.883 11.597 -22.673 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -13.322 12.084 -23.378 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -13.211 13.505 -22.360 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -12.256 15.340 -23.133 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -11.420 15.439 -24.687 1.00 0.00 H new ATOM 931 N VAL A 63 -10.269 9.994 -20.258 1.00 0.00 N ATOM 932 CA VAL A 63 -9.310 8.903 -20.041 1.00 0.00 C ATOM 933 C VAL A 63 -9.858 7.883 -19.040 1.00 0.00 C ATOM 934 O VAL A 63 -9.635 6.680 -19.190 1.00 0.00 O ATOM 935 CB VAL A 63 -7.917 9.388 -19.550 1.00 0.00 C ATOM 936 CG1 VAL A 63 -6.876 9.210 -20.646 1.00 0.00 C ATOM 937 CG2 VAL A 63 -7.945 10.835 -19.079 1.00 0.00 C ATOM 0 H VAL A 63 -10.025 10.869 -19.794 1.00 0.00 H new ATOM 0 HA VAL A 63 -9.173 8.441 -21.019 1.00 0.00 H new ATOM 0 HB VAL A 63 -7.645 8.772 -18.693 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -5.906 9.554 -20.286 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -6.809 8.156 -20.917 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -7.166 9.792 -21.521 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -6.950 11.128 -18.746 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -8.257 11.479 -19.901 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -8.649 10.935 -18.252 1.00 0.00 H new ATOM 947 N LEU A 64 -10.581 8.372 -18.027 1.00 0.00 N ATOM 948 CA LEU A 64 -11.170 7.514 -17.006 1.00 0.00 C ATOM 949 C LEU A 64 -12.181 6.545 -17.620 1.00 0.00 C ATOM 950 O LEU A 64 -12.105 5.338 -17.396 1.00 0.00 O ATOM 951 CB LEU A 64 -11.851 8.365 -15.931 1.00 0.00 C ATOM 952 CG LEU A 64 -12.258 7.603 -14.673 1.00 0.00 C ATOM 953 CD1 LEU A 64 -11.265 7.850 -13.545 1.00 0.00 C ATOM 954 CD2 LEU A 64 -13.669 7.986 -14.246 1.00 0.00 C ATOM 0 H LEU A 64 -10.771 9.366 -17.896 1.00 0.00 H new ATOM 0 HA LEU A 64 -10.369 6.932 -16.550 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -11.177 9.173 -15.647 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -12.739 8.827 -16.362 1.00 0.00 H new ATOM 0 HG LEU A 64 -12.249 6.537 -14.903 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -11.576 7.297 -12.659 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -10.274 7.515 -13.853 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -11.233 8.915 -13.315 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -13.940 7.432 -13.347 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -13.709 9.055 -14.039 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -14.369 7.745 -15.046 1.00 0.00 H new ATOM 1165 N PHE A 79 -7.291 -5.254 -12.884 1.00 0.00 N ATOM 1166 CA PHE A 79 -6.019 -5.687 -12.300 1.00 0.00 C ATOM 1167 C PHE A 79 -5.918 -7.216 -12.304 1.00 0.00 C ATOM 1168 O PHE A 79 -4.876 -7.775 -12.658 1.00 0.00 O ATOM 1169 CB PHE A 79 -5.856 -5.117 -10.874 1.00 0.00 C ATOM 1170 CG PHE A 79 -5.704 -6.147 -9.781 1.00 0.00 C ATOM 1171 CD1 PHE A 79 -4.556 -6.922 -9.689 1.00 0.00 C ATOM 1172 CD2 PHE A 79 -6.707 -6.334 -8.844 1.00 0.00 C ATOM 1173 CE1 PHE A 79 -4.415 -7.862 -8.686 1.00 0.00 C ATOM 1174 CE2 PHE A 79 -6.572 -7.271 -7.839 1.00 0.00 C ATOM 1175 CZ PHE A 79 -5.425 -8.037 -7.760 1.00 0.00 C ATOM 0 HA PHE A 79 -5.204 -5.297 -12.911 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.983 -4.464 -10.859 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -6.723 -4.496 -10.647 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -3.763 -6.789 -10.410 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -7.607 -5.739 -8.900 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -3.517 -8.459 -8.626 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -7.362 -7.405 -7.115 1.00 0.00 H new ATOM 0 HZ PHE A 79 -5.318 -8.772 -6.975 1.00 0.00 H new ATOM 1185 N VAL A 80 -7.009 -7.884 -11.919 1.00 0.00 N ATOM 1186 CA VAL A 80 -7.049 -9.344 -11.886 1.00 0.00 C ATOM 1187 C VAL A 80 -6.963 -9.926 -13.301 1.00 0.00 C ATOM 1188 O VAL A 80 -6.298 -10.939 -13.519 1.00 0.00 O ATOM 1189 CB VAL A 80 -8.331 -9.864 -11.194 1.00 0.00 C ATOM 1190 CG1 VAL A 80 -8.395 -11.384 -11.243 1.00 0.00 C ATOM 1191 CG2 VAL A 80 -8.403 -9.372 -9.752 1.00 0.00 C ATOM 0 H VAL A 80 -7.876 -7.434 -11.626 1.00 0.00 H new ATOM 0 HA VAL A 80 -6.185 -9.673 -11.308 1.00 0.00 H new ATOM 0 HB VAL A 80 -9.191 -9.469 -11.735 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -9.305 -11.726 -10.750 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -8.399 -11.715 -12.282 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -7.527 -11.801 -10.732 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -9.312 -9.749 -9.284 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -7.535 -9.733 -9.201 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -8.414 -8.282 -9.740 1.00 0.00 H new ATOM 1201 N LYS A 81 -7.634 -9.274 -14.257 1.00 0.00 N ATOM 1202 CA LYS A 81 -7.632 -9.719 -15.653 1.00 0.00 C ATOM 1203 C LYS A 81 -6.219 -9.698 -16.242 1.00 0.00 C ATOM 1204 O LYS A 81 -5.865 -10.562 -17.048 1.00 0.00 O ATOM 1205 CB LYS A 81 -8.558 -8.838 -16.494 1.00 0.00 C ATOM 1206 CG LYS A 81 -9.575 -9.622 -17.311 1.00 0.00 C ATOM 1207 CD LYS A 81 -10.548 -10.386 -16.427 1.00 0.00 C ATOM 1208 CE LYS A 81 -11.439 -9.440 -15.641 1.00 0.00 C ATOM 1209 NZ LYS A 81 -12.773 -10.034 -15.352 1.00 0.00 N ATOM 0 H LYS A 81 -8.187 -8.434 -14.087 1.00 0.00 H new ATOM 0 HA LYS A 81 -7.996 -10.746 -15.674 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -9.088 -8.150 -15.835 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -7.954 -8.231 -17.168 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -10.129 -8.938 -17.953 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -9.054 -10.321 -17.965 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -11.164 -11.042 -17.042 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -9.993 -11.023 -15.738 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -10.949 -9.177 -14.703 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -11.569 -8.515 -16.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -13.347 -9.353 -14.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -13.253 -10.261 -16.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -12.652 -10.903 -14.793 1.00 0.00 H new ATOM 1223 N GLY A 82 -5.415 -8.714 -15.829 1.00 0.00 N ATOM 1224 CA GLY A 82 -4.051 -8.605 -16.318 1.00 0.00 C ATOM 1225 C GLY A 82 -3.163 -9.691 -15.750 1.00 0.00 C ATOM 1226 O GLY A 82 -2.529 -10.435 -16.498 1.00 0.00 O ATOM 0 H GLY A 82 -5.688 -7.991 -15.163 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -4.049 -8.666 -17.406 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -3.646 -7.628 -16.052 1.00 0.00 H new ATOM 1230 N PHE A 83 -3.130 -9.790 -14.419 1.00 0.00 N ATOM 1231 CA PHE A 83 -2.323 -10.803 -13.742 1.00 0.00 C ATOM 1232 C PHE A 83 -2.723 -12.205 -14.199 1.00 0.00 C ATOM 1233 O PHE A 83 -1.865 -13.031 -14.502 1.00 0.00 O ATOM 1234 CB PHE A 83 -2.473 -10.685 -12.222 1.00 0.00 C ATOM 1235 CG PHE A 83 -1.470 -9.763 -11.586 1.00 0.00 C ATOM 1236 CD1 PHE A 83 -1.262 -8.486 -12.087 1.00 0.00 C ATOM 1237 CD2 PHE A 83 -0.733 -10.175 -10.488 1.00 0.00 C ATOM 1238 CE1 PHE A 83 -0.339 -7.640 -11.505 1.00 0.00 C ATOM 1239 CE2 PHE A 83 0.191 -9.332 -9.901 1.00 0.00 C ATOM 1240 CZ PHE A 83 0.388 -8.063 -10.409 1.00 0.00 C ATOM 0 H PHE A 83 -3.653 -9.180 -13.791 1.00 0.00 H new ATOM 0 HA PHE A 83 -1.279 -10.634 -14.005 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -3.477 -10.330 -11.991 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -2.375 -11.676 -11.778 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -1.829 -8.150 -12.943 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -0.882 -11.166 -10.086 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -0.186 -6.649 -11.906 1.00 0.00 H new ATOM 0 HE2 PHE A 83 0.759 -9.665 -9.045 1.00 0.00 H new ATOM 0 HZ PHE A 83 1.109 -7.403 -9.950 1.00 0.00 H new ATOM 1250 N GLN A 84 -4.034 -12.460 -14.256 1.00 0.00 N ATOM 1251 CA GLN A 84 -4.549 -13.759 -14.690 1.00 0.00 C ATOM 1252 C GLN A 84 -4.539 -13.867 -16.221 1.00 0.00 C ATOM 1253 O GLN A 84 -5.593 -13.955 -16.857 1.00 0.00 O ATOM 1254 CB GLN A 84 -5.966 -13.982 -14.141 1.00 0.00 C ATOM 1255 CG GLN A 84 -6.237 -15.419 -13.727 1.00 0.00 C ATOM 1256 CD GLN A 84 -5.502 -15.807 -12.456 1.00 0.00 C ATOM 1257 OE1 GLN A 84 -4.404 -16.361 -12.506 1.00 0.00 O ATOM 1258 NE2 GLN A 84 -6.103 -15.513 -11.307 1.00 0.00 N ATOM 0 H GLN A 84 -4.756 -11.784 -14.007 1.00 0.00 H new ATOM 0 HA GLN A 84 -3.897 -14.537 -14.293 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -6.121 -13.329 -13.282 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -6.691 -13.688 -14.900 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -7.308 -15.555 -13.579 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -5.939 -16.088 -14.534 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -7.013 -15.053 -11.311 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -5.654 -15.747 -10.422 1.00 0.00 H new ATOM 1267 N VAL A 85 -3.339 -13.854 -16.805 1.00 0.00 N ATOM 1268 CA VAL A 85 -3.186 -13.943 -18.258 1.00 0.00 C ATOM 1269 C VAL A 85 -2.476 -15.239 -18.669 1.00 0.00 C ATOM 1270 O VAL A 85 -2.869 -15.882 -19.644 1.00 0.00 O ATOM 1271 CB VAL A 85 -2.421 -12.720 -18.822 1.00 0.00 C ATOM 1272 CG1 VAL A 85 -0.970 -12.708 -18.358 1.00 0.00 C ATOM 1273 CG2 VAL A 85 -2.501 -12.684 -20.342 1.00 0.00 C ATOM 0 H VAL A 85 -2.459 -13.783 -16.294 1.00 0.00 H new ATOM 0 HA VAL A 85 -4.190 -13.949 -18.683 1.00 0.00 H new ATOM 0 HB VAL A 85 -2.902 -11.823 -18.432 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -0.463 -11.837 -18.772 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -0.936 -12.664 -17.269 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -0.471 -13.615 -18.700 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -1.956 -11.816 -20.715 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.060 -13.593 -20.751 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -3.544 -12.617 -20.650 1.00 0.00 H new ATOM 1283 N PHE A 86 -1.437 -15.616 -17.920 1.00 0.00 N ATOM 1284 CA PHE A 86 -0.680 -16.833 -18.202 1.00 0.00 C ATOM 1285 C PHE A 86 -0.695 -17.783 -16.997 1.00 0.00 C ATOM 1286 O PHE A 86 0.266 -18.519 -16.761 1.00 0.00 O ATOM 1287 CB PHE A 86 0.762 -16.477 -18.583 1.00 0.00 C ATOM 1288 CG PHE A 86 1.091 -16.756 -20.022 1.00 0.00 C ATOM 1289 CD1 PHE A 86 1.429 -18.035 -20.435 1.00 0.00 C ATOM 1290 CD2 PHE A 86 1.061 -15.738 -20.960 1.00 0.00 C ATOM 1291 CE1 PHE A 86 1.732 -18.293 -21.758 1.00 0.00 C ATOM 1292 CE2 PHE A 86 1.364 -15.989 -22.285 1.00 0.00 C ATOM 1293 CZ PHE A 86 1.699 -17.269 -22.685 1.00 0.00 C ATOM 0 H PHE A 86 -1.102 -15.092 -17.111 1.00 0.00 H new ATOM 0 HA PHE A 86 -1.153 -17.345 -19.040 1.00 0.00 H new ATOM 0 HB2 PHE A 86 0.932 -15.420 -18.379 1.00 0.00 H new ATOM 0 HB3 PHE A 86 1.446 -17.039 -17.947 1.00 0.00 H new ATOM 0 HD1 PHE A 86 1.456 -18.839 -19.715 1.00 0.00 H new ATOM 0 HD2 PHE A 86 0.798 -14.737 -20.653 1.00 0.00 H new ATOM 0 HE1 PHE A 86 1.994 -19.294 -22.067 1.00 0.00 H new ATOM 0 HE2 PHE A 86 1.339 -15.186 -23.007 1.00 0.00 H new ATOM 0 HZ PHE A 86 1.934 -17.468 -23.720 1.00 0.00 H new ATOM 1303 N ASP A 87 -1.796 -17.764 -16.239 1.00 0.00 N ATOM 1304 CA ASP A 87 -1.938 -18.621 -15.064 1.00 0.00 C ATOM 1305 C ASP A 87 -3.368 -19.156 -14.959 1.00 0.00 C ATOM 1306 O ASP A 87 -4.157 -18.699 -14.126 1.00 0.00 O ATOM 1307 CB ASP A 87 -1.556 -17.851 -13.794 1.00 0.00 C ATOM 1308 CG ASP A 87 -0.154 -18.181 -13.314 1.00 0.00 C ATOM 1309 OD1 ASP A 87 -0.009 -19.126 -12.511 1.00 0.00 O ATOM 1310 OD2 ASP A 87 0.797 -17.494 -13.741 1.00 0.00 O ATOM 0 H ASP A 87 -2.600 -17.164 -16.420 1.00 0.00 H new ATOM 0 HA ASP A 87 -1.263 -19.470 -15.170 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -1.628 -16.781 -13.986 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -2.271 -18.082 -13.004 1.00 0.00 H new ATOM 1315 N LYS A 88 -3.694 -20.128 -15.813 1.00 0.00 N ATOM 1316 CA LYS A 88 -5.027 -20.734 -15.825 1.00 0.00 C ATOM 1317 C LYS A 88 -5.308 -21.467 -14.515 1.00 0.00 C ATOM 1318 O LYS A 88 -6.395 -21.342 -13.947 1.00 0.00 O ATOM 1319 CB LYS A 88 -5.165 -21.705 -17.004 1.00 0.00 C ATOM 1320 CG LYS A 88 -6.466 -21.543 -17.778 1.00 0.00 C ATOM 1321 CD LYS A 88 -6.244 -20.858 -19.121 1.00 0.00 C ATOM 1322 CE LYS A 88 -5.881 -19.389 -18.955 1.00 0.00 C ATOM 1323 NZ LYS A 88 -6.997 -18.598 -18.362 1.00 0.00 N ATOM 0 H LYS A 88 -3.052 -20.513 -16.506 1.00 0.00 H new ATOM 0 HA LYS A 88 -5.757 -19.932 -15.936 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -4.326 -21.558 -17.685 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -5.098 -22.727 -16.632 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -6.917 -22.522 -17.940 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -7.172 -20.961 -17.185 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -5.448 -21.370 -19.663 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -7.147 -20.943 -19.726 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -4.999 -19.304 -18.320 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -5.616 -18.970 -19.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -6.806 -17.583 -18.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -7.888 -18.842 -18.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -7.077 -18.816 -17.348 1.00 0.00 H new ATOM 1337 N ASP A 89 -4.321 -22.228 -14.037 1.00 0.00 N ATOM 1338 CA ASP A 89 -4.462 -22.977 -12.792 1.00 0.00 C ATOM 1339 C ASP A 89 -4.112 -22.102 -11.588 1.00 0.00 C ATOM 1340 O ASP A 89 -4.947 -21.896 -10.704 1.00 0.00 O ATOM 1341 CB ASP A 89 -3.572 -24.221 -12.816 1.00 0.00 C ATOM 1342 CG ASP A 89 -4.308 -25.468 -12.365 1.00 0.00 C ATOM 1343 OD1 ASP A 89 -4.645 -25.559 -11.165 1.00 0.00 O ATOM 1344 OD2 ASP A 89 -4.549 -26.354 -13.211 1.00 0.00 O ATOM 0 H ASP A 89 -3.417 -22.340 -14.495 1.00 0.00 H new ATOM 0 HA ASP A 89 -5.502 -23.289 -12.699 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -3.191 -24.373 -13.826 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -2.708 -24.059 -12.171 1.00 0.00 H new ATOM 1349 N ALA A 90 -2.874 -21.591 -11.564 1.00 0.00 N ATOM 1350 CA ALA A 90 -2.399 -20.733 -10.475 1.00 0.00 C ATOM 1351 C ALA A 90 -2.551 -21.420 -9.116 1.00 0.00 C ATOM 1352 O ALA A 90 -3.390 -21.028 -8.299 1.00 0.00 O ATOM 1353 CB ALA A 90 -3.133 -19.397 -10.491 1.00 0.00 C ATOM 0 H ALA A 90 -2.180 -21.760 -12.293 1.00 0.00 H new ATOM 0 HA ALA A 90 -1.337 -20.548 -10.633 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -2.768 -18.772 -9.676 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -2.954 -18.895 -11.442 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -4.202 -19.568 -10.367 1.00 0.00 H new ATOM 1359 N THR A 91 -1.735 -22.449 -8.880 1.00 0.00 N ATOM 1360 CA THR A 91 -1.775 -23.192 -7.623 1.00 0.00 C ATOM 1361 C THR A 91 -0.377 -23.289 -7.005 1.00 0.00 C ATOM 1362 O THR A 91 0.217 -24.369 -6.944 1.00 0.00 O ATOM 1363 CB THR A 91 -2.364 -24.593 -7.852 1.00 0.00 C ATOM 1364 OG1 THR A 91 -3.501 -24.532 -8.696 1.00 0.00 O ATOM 1365 CG2 THR A 91 -2.784 -25.285 -6.571 1.00 0.00 C ATOM 0 H THR A 91 -1.038 -22.786 -9.545 1.00 0.00 H new ATOM 0 HA THR A 91 -2.417 -22.655 -6.925 1.00 0.00 H new ATOM 0 HB THR A 91 -1.560 -25.168 -8.312 1.00 0.00 H new ATOM 0 HG1 THR A 91 -3.375 -25.134 -9.459 1.00 0.00 H new ATOM 0 HG21 THR A 91 -3.191 -26.269 -6.805 1.00 0.00 H new ATOM 0 HG22 THR A 91 -1.919 -25.396 -5.917 1.00 0.00 H new ATOM 0 HG23 THR A 91 -3.545 -24.688 -6.068 1.00 0.00 H new ATOM 1373 N GLY A 92 0.142 -22.145 -6.553 1.00 0.00 N ATOM 1374 CA GLY A 92 1.465 -22.107 -5.947 1.00 0.00 C ATOM 1375 C GLY A 92 2.534 -21.594 -6.898 1.00 0.00 C ATOM 1376 O GLY A 92 3.658 -22.101 -6.902 1.00 0.00 O ATOM 0 H GLY A 92 -0.332 -21.243 -6.597 1.00 0.00 H new ATOM 0 HA2 GLY A 92 1.436 -21.471 -5.063 1.00 0.00 H new ATOM 0 HA3 GLY A 92 1.734 -23.108 -5.611 1.00 0.00 H new ATOM 1380 N MET A 93 2.186 -20.587 -7.705 1.00 0.00 N ATOM 1381 CA MET A 93 3.123 -20.006 -8.668 1.00 0.00 C ATOM 1382 C MET A 93 2.527 -18.767 -9.331 1.00 0.00 C ATOM 1383 O MET A 93 1.370 -18.779 -9.759 1.00 0.00 O ATOM 1384 CB MET A 93 3.496 -21.038 -9.741 1.00 0.00 C ATOM 1385 CG MET A 93 4.416 -20.496 -10.826 1.00 0.00 C ATOM 1386 SD MET A 93 3.533 -20.065 -12.340 1.00 0.00 S ATOM 1387 CE MET A 93 4.621 -20.769 -13.577 1.00 0.00 C ATOM 0 H MET A 93 1.261 -20.158 -7.709 1.00 0.00 H new ATOM 0 HA MET A 93 4.021 -19.712 -8.125 1.00 0.00 H new ATOM 0 HB2 MET A 93 3.979 -21.889 -9.260 1.00 0.00 H new ATOM 0 HB3 MET A 93 2.583 -21.411 -10.205 1.00 0.00 H new ATOM 0 HG2 MET A 93 4.934 -19.614 -10.449 1.00 0.00 H new ATOM 0 HG3 MET A 93 5.179 -21.240 -11.055 1.00 0.00 H new ATOM 0 HE1 MET A 93 4.211 -20.585 -14.570 1.00 0.00 H new ATOM 0 HE2 MET A 93 5.606 -20.308 -13.500 1.00 0.00 H new ATOM 0 HE3 MET A 93 4.710 -21.843 -13.415 1.00 0.00 H new ATOM 1397 N ILE A 94 3.326 -17.706 -9.423 1.00 0.00 N ATOM 1398 CA ILE A 94 2.882 -16.462 -10.046 1.00 0.00 C ATOM 1399 C ILE A 94 3.545 -16.262 -11.415 1.00 0.00 C ATOM 1400 O ILE A 94 2.885 -15.845 -12.370 1.00 0.00 O ATOM 1401 CB ILE A 94 3.151 -15.238 -9.129 1.00 0.00 C ATOM 1402 CG1 ILE A 94 2.126 -14.126 -9.404 1.00 0.00 C ATOM 1403 CG2 ILE A 94 4.575 -14.716 -9.290 1.00 0.00 C ATOM 1404 CD1 ILE A 94 2.337 -13.393 -10.714 1.00 0.00 C ATOM 0 H ILE A 94 4.284 -17.683 -9.074 1.00 0.00 H new ATOM 0 HA ILE A 94 1.805 -16.541 -10.194 1.00 0.00 H new ATOM 0 HB ILE A 94 3.040 -15.566 -8.095 1.00 0.00 H new ATOM 0 HG12 ILE A 94 1.126 -14.561 -9.401 1.00 0.00 H new ATOM 0 HG13 ILE A 94 2.162 -13.405 -8.588 1.00 0.00 H new ATOM 0 HG21 ILE A 94 4.725 -13.860 -8.632 1.00 0.00 H new ATOM 0 HG22 ILE A 94 5.283 -15.503 -9.029 1.00 0.00 H new ATOM 0 HG23 ILE A 94 4.736 -14.412 -10.324 1.00 0.00 H new ATOM 0 HD11 ILE A 94 1.571 -12.626 -10.829 1.00 0.00 H new ATOM 0 HD12 ILE A 94 3.322 -12.926 -10.715 1.00 0.00 H new ATOM 0 HD13 ILE A 94 2.270 -14.100 -11.541 1.00 0.00 H new ATOM 1416 N GLY A 95 4.846 -16.563 -11.506 1.00 0.00 N ATOM 1417 CA GLY A 95 5.563 -16.406 -12.761 1.00 0.00 C ATOM 1418 C GLY A 95 5.809 -14.949 -13.106 1.00 0.00 C ATOM 1419 O GLY A 95 5.065 -14.366 -13.895 1.00 0.00 O ATOM 0 H GLY A 95 5.411 -16.912 -10.732 1.00 0.00 H new ATOM 0 HA2 GLY A 95 6.518 -16.928 -12.699 1.00 0.00 H new ATOM 0 HA3 GLY A 95 4.994 -16.876 -13.563 1.00 0.00 H new ATOM 1423 N VAL A 96 6.847 -14.357 -12.501 1.00 0.00 N ATOM 1424 CA VAL A 96 7.196 -12.950 -12.738 1.00 0.00 C ATOM 1425 C VAL A 96 7.163 -12.598 -14.228 1.00 0.00 C ATOM 1426 O VAL A 96 6.712 -11.513 -14.596 1.00 0.00 O ATOM 1427 CB VAL A 96 8.580 -12.585 -12.150 1.00 0.00 C ATOM 1428 CG1 VAL A 96 8.966 -11.162 -12.532 1.00 0.00 C ATOM 1429 CG2 VAL A 96 8.583 -12.748 -10.635 1.00 0.00 C ATOM 0 H VAL A 96 7.462 -14.833 -11.841 1.00 0.00 H new ATOM 0 HA VAL A 96 6.437 -12.362 -12.222 1.00 0.00 H new ATOM 0 HB VAL A 96 9.318 -13.268 -12.570 1.00 0.00 H new ATOM 0 HG11 VAL A 96 9.942 -10.924 -12.109 1.00 0.00 H new ATOM 0 HG12 VAL A 96 9.010 -11.076 -13.618 1.00 0.00 H new ATOM 0 HG13 VAL A 96 8.223 -10.466 -12.143 1.00 0.00 H new ATOM 0 HG21 VAL A 96 9.566 -12.486 -10.243 1.00 0.00 H new ATOM 0 HG22 VAL A 96 7.831 -12.092 -10.197 1.00 0.00 H new ATOM 0 HG23 VAL A 96 8.355 -13.783 -10.380 1.00 0.00 H new ATOM 1439 N GLY A 97 7.633 -13.519 -15.081 1.00 0.00 N ATOM 1440 CA GLY A 97 7.629 -13.280 -16.520 1.00 0.00 C ATOM 1441 C GLY A 97 6.266 -12.833 -17.026 1.00 0.00 C ATOM 1442 O GLY A 97 6.173 -11.936 -17.867 1.00 0.00 O ATOM 0 H GLY A 97 8.014 -14.422 -14.799 1.00 0.00 H new ATOM 0 HA2 GLY A 97 8.371 -12.520 -16.762 1.00 0.00 H new ATOM 0 HA3 GLY A 97 7.926 -14.192 -17.039 1.00 0.00 H new ATOM 1446 N GLU A 98 5.209 -13.449 -16.489 1.00 0.00 N ATOM 1447 CA GLU A 98 3.838 -13.109 -16.860 1.00 0.00 C ATOM 1448 C GLU A 98 3.450 -11.744 -16.284 1.00 0.00 C ATOM 1449 O GLU A 98 2.913 -10.896 -16.997 1.00 0.00 O ATOM 1450 CB GLU A 98 2.872 -14.198 -16.366 1.00 0.00 C ATOM 1451 CG GLU A 98 1.417 -13.754 -16.271 1.00 0.00 C ATOM 1452 CD GLU A 98 0.698 -14.358 -15.079 1.00 0.00 C ATOM 1453 OE1 GLU A 98 1.042 -13.999 -13.933 1.00 0.00 O ATOM 1454 OE2 GLU A 98 -0.206 -15.190 -15.292 1.00 0.00 O ATOM 0 H GLU A 98 5.281 -14.190 -15.792 1.00 0.00 H new ATOM 0 HA GLU A 98 3.773 -13.052 -17.947 1.00 0.00 H new ATOM 0 HB2 GLU A 98 2.935 -15.054 -17.038 1.00 0.00 H new ATOM 0 HB3 GLU A 98 3.200 -14.539 -15.384 1.00 0.00 H new ATOM 0 HG2 GLU A 98 1.377 -12.667 -16.202 1.00 0.00 H new ATOM 0 HG3 GLU A 98 0.895 -14.035 -17.186 1.00 0.00 H new ATOM 1461 N LEU A 99 3.730 -11.540 -14.988 1.00 0.00 N ATOM 1462 CA LEU A 99 3.413 -10.275 -14.317 1.00 0.00 C ATOM 1463 C LEU A 99 4.102 -9.093 -15.008 1.00 0.00 C ATOM 1464 O LEU A 99 3.521 -8.013 -15.127 1.00 0.00 O ATOM 1465 CB LEU A 99 3.797 -10.342 -12.822 1.00 0.00 C ATOM 1466 CG LEU A 99 5.149 -9.725 -12.429 1.00 0.00 C ATOM 1467 CD1 LEU A 99 5.048 -8.208 -12.330 1.00 0.00 C ATOM 1468 CD2 LEU A 99 5.633 -10.311 -11.109 1.00 0.00 C ATOM 0 H LEU A 99 4.174 -12.234 -14.387 1.00 0.00 H new ATOM 0 HA LEU A 99 2.337 -10.116 -14.387 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.016 -9.844 -12.247 1.00 0.00 H new ATOM 0 HB3 LEU A 99 3.799 -11.389 -12.518 1.00 0.00 H new ATOM 0 HG LEU A 99 5.873 -9.966 -13.208 1.00 0.00 H new ATOM 0 HD11 LEU A 99 6.018 -7.796 -12.051 1.00 0.00 H new ATOM 0 HD12 LEU A 99 4.745 -7.800 -13.294 1.00 0.00 H new ATOM 0 HD13 LEU A 99 4.309 -7.941 -11.574 1.00 0.00 H new ATOM 0 HD21 LEU A 99 6.591 -9.865 -10.843 1.00 0.00 H new ATOM 0 HD22 LEU A 99 4.904 -10.098 -10.327 1.00 0.00 H new ATOM 0 HD23 LEU A 99 5.751 -11.390 -11.211 1.00 0.00 H new ATOM 1480 N ARG A 100 5.337 -9.311 -15.471 1.00 0.00 N ATOM 1481 CA ARG A 100 6.105 -8.275 -16.159 1.00 0.00 C ATOM 1482 C ARG A 100 5.478 -7.949 -17.515 1.00 0.00 C ATOM 1483 O ARG A 100 5.347 -6.781 -17.877 1.00 0.00 O ATOM 1484 CB ARG A 100 7.557 -8.729 -16.343 1.00 0.00 C ATOM 1485 CG ARG A 100 8.464 -7.671 -16.952 1.00 0.00 C ATOM 1486 CD ARG A 100 9.279 -8.232 -18.108 1.00 0.00 C ATOM 1487 NE ARG A 100 8.770 -7.796 -19.412 1.00 0.00 N ATOM 1488 CZ ARG A 100 9.183 -8.291 -20.584 1.00 0.00 C ATOM 1489 NH1 ARG A 100 10.117 -9.240 -20.629 1.00 0.00 N ATOM 1490 NH2 ARG A 100 8.661 -7.833 -21.719 1.00 0.00 N ATOM 0 H ARG A 100 5.826 -10.201 -15.380 1.00 0.00 H new ATOM 0 HA ARG A 100 6.091 -7.373 -15.548 1.00 0.00 H new ATOM 0 HB2 ARG A 100 7.960 -9.024 -15.374 1.00 0.00 H new ATOM 0 HB3 ARG A 100 7.572 -9.615 -16.978 1.00 0.00 H new ATOM 0 HG2 ARG A 100 7.862 -6.833 -17.303 1.00 0.00 H new ATOM 0 HG3 ARG A 100 9.136 -7.282 -16.187 1.00 0.00 H new ATOM 0 HD2 ARG A 100 10.318 -7.919 -18.003 1.00 0.00 H new ATOM 0 HD3 ARG A 100 9.268 -9.321 -18.062 1.00 0.00 H new ATOM 0 HE ARG A 100 8.055 -7.069 -19.426 1.00 0.00 H new ATOM 0 HH11 ARG A 100 10.524 -9.596 -19.764 1.00 0.00 H new ATOM 0 HH12 ARG A 100 10.425 -9.611 -21.528 1.00 0.00 H new ATOM 0 HH21 ARG A 100 7.947 -7.105 -21.695 1.00 0.00 H new ATOM 0 HH22 ARG A 100 8.975 -8.210 -22.613 1.00 0.00 H new ATOM 1504 N TYR A 101 5.087 -8.991 -18.254 1.00 0.00 N ATOM 1505 CA TYR A 101 4.464 -8.825 -19.568 1.00 0.00 C ATOM 1506 C TYR A 101 3.186 -7.980 -19.478 1.00 0.00 C ATOM 1507 O TYR A 101 2.894 -7.190 -20.377 1.00 0.00 O ATOM 1508 CB TYR A 101 4.146 -10.199 -20.174 1.00 0.00 C ATOM 1509 CG TYR A 101 3.314 -10.146 -21.437 1.00 0.00 C ATOM 1510 CD1 TYR A 101 3.880 -9.775 -22.650 1.00 0.00 C ATOM 1511 CD2 TYR A 101 1.961 -10.466 -21.414 1.00 0.00 C ATOM 1512 CE1 TYR A 101 3.123 -9.725 -23.804 1.00 0.00 C ATOM 1513 CE2 TYR A 101 1.198 -10.419 -22.565 1.00 0.00 C ATOM 1514 CZ TYR A 101 1.783 -10.048 -23.757 1.00 0.00 C ATOM 1515 OH TYR A 101 1.025 -9.998 -24.904 1.00 0.00 O ATOM 0 H TYR A 101 5.192 -9.963 -17.962 1.00 0.00 H new ATOM 0 HA TYR A 101 5.169 -8.300 -20.212 1.00 0.00 H new ATOM 0 HB2 TYR A 101 5.083 -10.713 -20.391 1.00 0.00 H new ATOM 0 HB3 TYR A 101 3.619 -10.798 -19.431 1.00 0.00 H new ATOM 0 HD1 TYR A 101 4.929 -9.522 -22.691 1.00 0.00 H new ATOM 0 HD2 TYR A 101 1.499 -10.756 -20.482 1.00 0.00 H new ATOM 0 HE1 TYR A 101 3.578 -9.434 -24.739 1.00 0.00 H new ATOM 0 HE2 TYR A 101 0.149 -10.672 -22.531 1.00 0.00 H new ATOM 0 HH TYR A 101 0.102 -10.256 -24.698 1.00 0.00 H new ATOM 1525 N VAL A 102 2.431 -8.157 -18.390 1.00 0.00 N ATOM 1526 CA VAL A 102 1.183 -7.419 -18.182 1.00 0.00 C ATOM 1527 C VAL A 102 1.447 -5.987 -17.712 1.00 0.00 C ATOM 1528 O VAL A 102 0.897 -5.033 -18.267 1.00 0.00 O ATOM 1529 CB VAL A 102 0.278 -8.125 -17.145 1.00 0.00 C ATOM 1530 CG1 VAL A 102 -1.107 -7.494 -17.121 1.00 0.00 C ATOM 1531 CG2 VAL A 102 0.177 -9.618 -17.439 1.00 0.00 C ATOM 0 H VAL A 102 2.663 -8.806 -17.639 1.00 0.00 H new ATOM 0 HA VAL A 102 0.676 -7.391 -19.146 1.00 0.00 H new ATOM 0 HB VAL A 102 0.732 -8.000 -16.162 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -1.727 -8.006 -16.385 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -1.022 -6.440 -16.855 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -1.565 -7.583 -18.106 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -0.464 -10.092 -16.696 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -0.247 -9.765 -18.432 1.00 0.00 H new ATOM 0 HG23 VAL A 102 1.170 -10.065 -17.399 1.00 0.00 H new ATOM 1541 N LEU A 103 2.280 -5.845 -16.679 1.00 0.00 N ATOM 1542 CA LEU A 103 2.610 -4.534 -16.118 1.00 0.00 C ATOM 1543 C LEU A 103 3.348 -3.647 -17.129 1.00 0.00 C ATOM 1544 O LEU A 103 3.053 -2.456 -17.244 1.00 0.00 O ATOM 1545 CB LEU A 103 3.445 -4.703 -14.848 1.00 0.00 C ATOM 1546 CG LEU A 103 2.645 -4.703 -13.544 1.00 0.00 C ATOM 1547 CD1 LEU A 103 3.424 -5.395 -12.438 1.00 0.00 C ATOM 1548 CD2 LEU A 103 2.291 -3.283 -13.137 1.00 0.00 C ATOM 0 H LEU A 103 2.740 -6.626 -16.212 1.00 0.00 H new ATOM 0 HA LEU A 103 1.674 -4.034 -15.871 1.00 0.00 H new ATOM 0 HB2 LEU A 103 3.999 -5.639 -14.917 1.00 0.00 H new ATOM 0 HB3 LEU A 103 4.181 -3.900 -14.805 1.00 0.00 H new ATOM 0 HG LEU A 103 1.720 -5.256 -13.709 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.838 -5.385 -11.519 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.628 -6.426 -12.727 1.00 0.00 H new ATOM 0 HD13 LEU A 103 4.366 -4.871 -12.274 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.722 -3.302 -12.207 1.00 0.00 H new ATOM 0 HD22 LEU A 103 3.205 -2.708 -12.991 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.691 -2.819 -13.920 1.00 0.00 H new ATOM 1560 N THR A 104 4.302 -4.231 -17.861 1.00 0.00 N ATOM 1561 CA THR A 104 5.071 -3.489 -18.864 1.00 0.00 C ATOM 1562 C THR A 104 4.168 -3.011 -20.005 1.00 0.00 C ATOM 1563 O THR A 104 4.296 -1.877 -20.471 1.00 0.00 O ATOM 1564 CB THR A 104 6.210 -4.356 -19.417 1.00 0.00 C ATOM 1565 OG1 THR A 104 7.118 -4.707 -18.387 1.00 0.00 O ATOM 1566 CG2 THR A 104 7.011 -3.686 -20.516 1.00 0.00 C ATOM 0 H THR A 104 4.560 -5.214 -17.778 1.00 0.00 H new ATOM 0 HA THR A 104 5.500 -2.613 -18.378 1.00 0.00 H new ATOM 0 HB THR A 104 5.717 -5.233 -19.836 1.00 0.00 H new ATOM 0 HG1 THR A 104 7.941 -5.063 -18.783 1.00 0.00 H new ATOM 0 HG21 THR A 104 7.797 -4.360 -20.856 1.00 0.00 H new ATOM 0 HG22 THR A 104 6.353 -3.446 -21.351 1.00 0.00 H new ATOM 0 HG23 THR A 104 7.459 -2.770 -20.132 1.00 0.00 H new ATOM 1574 N SER A 105 3.252 -3.880 -20.444 1.00 0.00 N ATOM 1575 CA SER A 105 2.321 -3.545 -21.523 1.00 0.00 C ATOM 1576 C SER A 105 1.277 -2.510 -21.077 1.00 0.00 C ATOM 1577 O SER A 105 0.603 -1.908 -21.916 1.00 0.00 O ATOM 1578 CB SER A 105 1.620 -4.810 -22.036 1.00 0.00 C ATOM 1579 OG SER A 105 0.764 -5.362 -21.048 1.00 0.00 O ATOM 0 H SER A 105 3.136 -4.821 -20.068 1.00 0.00 H new ATOM 0 HA SER A 105 2.904 -3.103 -22.331 1.00 0.00 H new ATOM 0 HB2 SER A 105 1.042 -4.571 -22.929 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.366 -5.549 -22.328 1.00 0.00 H new ATOM 0 HG SER A 105 1.069 -5.084 -20.159 1.00 0.00 H new ATOM 1585 N LEU A 106 1.148 -2.303 -19.760 1.00 0.00 N ATOM 1586 CA LEU A 106 0.191 -1.337 -19.221 1.00 0.00 C ATOM 1587 C LEU A 106 0.684 0.093 -19.435 1.00 0.00 C ATOM 1588 O LEU A 106 -0.002 0.910 -20.055 1.00 0.00 O ATOM 1589 CB LEU A 106 -0.044 -1.594 -17.727 1.00 0.00 C ATOM 1590 CG LEU A 106 -1.388 -2.241 -17.382 1.00 0.00 C ATOM 1591 CD1 LEU A 106 -1.407 -2.698 -15.930 1.00 0.00 C ATOM 1592 CD2 LEU A 106 -2.532 -1.275 -17.655 1.00 0.00 C ATOM 0 H LEU A 106 1.695 -2.792 -19.052 1.00 0.00 H new ATOM 0 HA LEU A 106 -0.752 -1.461 -19.754 1.00 0.00 H new ATOM 0 HB2 LEU A 106 0.756 -2.234 -17.354 1.00 0.00 H new ATOM 0 HB3 LEU A 106 0.032 -0.646 -17.195 1.00 0.00 H new ATOM 0 HG LEU A 106 -1.520 -3.117 -18.017 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.371 -3.155 -15.705 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -0.613 -3.427 -15.768 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -1.251 -1.840 -15.276 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -3.479 -1.752 -17.404 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.405 -0.379 -17.047 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -2.533 -1.001 -18.710 1.00 0.00 H new ATOM 1604 N GLY A 107 1.881 0.383 -18.923 1.00 0.00 N ATOM 1605 CA GLY A 107 2.462 1.709 -19.065 1.00 0.00 C ATOM 1606 C GLY A 107 3.926 1.740 -18.661 1.00 0.00 C ATOM 1607 O GLY A 107 4.363 2.665 -17.971 1.00 0.00 O ATOM 0 H GLY A 107 2.460 -0.281 -18.410 1.00 0.00 H new ATOM 0 HA2 GLY A 107 2.365 2.037 -20.100 1.00 0.00 H new ATOM 0 HA3 GLY A 107 1.903 2.416 -18.453 1.00 0.00 H new ATOM 1611 N GLU A 108 4.681 0.719 -19.084 1.00 0.00 N ATOM 1612 CA GLU A 108 6.105 0.610 -18.763 1.00 0.00 C ATOM 1613 C GLU A 108 6.324 0.603 -17.250 1.00 0.00 C ATOM 1614 O GLU A 108 7.189 1.314 -16.730 1.00 0.00 O ATOM 1615 CB GLU A 108 6.894 1.747 -19.423 1.00 0.00 C ATOM 1616 CG GLU A 108 7.351 1.426 -20.837 1.00 0.00 C ATOM 1617 CD GLU A 108 6.294 1.743 -21.879 1.00 0.00 C ATOM 1618 OE1 GLU A 108 5.344 0.944 -22.025 1.00 0.00 O ATOM 1619 OE2 GLU A 108 6.419 2.789 -22.550 1.00 0.00 O ATOM 0 H GLU A 108 4.324 -0.048 -19.654 1.00 0.00 H new ATOM 0 HA GLU A 108 6.472 -0.337 -19.160 1.00 0.00 H new ATOM 0 HB2 GLU A 108 6.275 2.644 -19.444 1.00 0.00 H new ATOM 0 HB3 GLU A 108 7.766 1.977 -18.811 1.00 0.00 H new ATOM 0 HG2 GLU A 108 8.256 1.991 -21.059 1.00 0.00 H new ATOM 0 HG3 GLU A 108 7.612 0.370 -20.899 1.00 0.00 H new ATOM 1626 N LYS A 109 5.533 -0.217 -16.555 1.00 0.00 N ATOM 1627 CA LYS A 109 5.628 -0.349 -15.103 1.00 0.00 C ATOM 1628 C LYS A 109 6.951 -1.033 -14.719 1.00 0.00 C ATOM 1629 O LYS A 109 7.993 -0.736 -15.307 1.00 0.00 O ATOM 1630 CB LYS A 109 4.411 -1.118 -14.569 1.00 0.00 C ATOM 1631 CG LYS A 109 3.079 -0.466 -14.911 1.00 0.00 C ATOM 1632 CD LYS A 109 2.849 0.797 -14.097 1.00 0.00 C ATOM 1633 CE LYS A 109 1.481 1.403 -14.375 1.00 0.00 C ATOM 1634 NZ LYS A 109 1.369 1.926 -15.767 1.00 0.00 N ATOM 0 H LYS A 109 4.815 -0.803 -16.980 1.00 0.00 H new ATOM 0 HA LYS A 109 5.625 0.640 -14.645 1.00 0.00 H new ATOM 0 HB2 LYS A 109 4.425 -2.130 -14.974 1.00 0.00 H new ATOM 0 HB3 LYS A 109 4.495 -1.207 -13.486 1.00 0.00 H new ATOM 0 HG2 LYS A 109 3.054 -0.224 -15.974 1.00 0.00 H new ATOM 0 HG3 LYS A 109 2.269 -1.172 -14.725 1.00 0.00 H new ATOM 0 HD2 LYS A 109 2.936 0.567 -13.035 1.00 0.00 H new ATOM 0 HD3 LYS A 109 3.625 1.527 -14.330 1.00 0.00 H new ATOM 0 HE2 LYS A 109 0.711 0.649 -14.209 1.00 0.00 H new ATOM 0 HE3 LYS A 109 1.293 2.212 -13.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 0.453 2.404 -15.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 2.139 2.602 -15.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 1.437 1.137 -16.441 1.00 0.00 H new ATOM 1648 N LEU A 110 6.920 -1.950 -13.744 1.00 0.00 N ATOM 1649 CA LEU A 110 8.130 -2.657 -13.324 1.00 0.00 C ATOM 1650 C LEU A 110 8.578 -3.636 -14.412 1.00 0.00 C ATOM 1651 O LEU A 110 8.312 -4.838 -14.332 1.00 0.00 O ATOM 1652 CB LEU A 110 7.890 -3.400 -12.007 1.00 0.00 C ATOM 1653 CG LEU A 110 7.313 -2.548 -10.873 1.00 0.00 C ATOM 1654 CD1 LEU A 110 7.082 -3.398 -9.636 1.00 0.00 C ATOM 1655 CD2 LEU A 110 8.233 -1.375 -10.559 1.00 0.00 C ATOM 0 H LEU A 110 6.076 -2.216 -13.236 1.00 0.00 H new ATOM 0 HA LEU A 110 8.920 -1.923 -13.167 1.00 0.00 H new ATOM 0 HB2 LEU A 110 7.212 -4.232 -12.196 1.00 0.00 H new ATOM 0 HB3 LEU A 110 8.835 -3.829 -11.673 1.00 0.00 H new ATOM 0 HG LEU A 110 6.353 -2.147 -11.198 1.00 0.00 H new ATOM 0 HD11 LEU A 110 6.672 -2.777 -8.839 1.00 0.00 H new ATOM 0 HD12 LEU A 110 6.380 -4.198 -9.870 1.00 0.00 H new ATOM 0 HD13 LEU A 110 8.028 -3.829 -9.309 1.00 0.00 H new ATOM 0 HD21 LEU A 110 7.804 -0.783 -9.751 1.00 0.00 H new ATOM 0 HD22 LEU A 110 9.210 -1.750 -10.255 1.00 0.00 H new ATOM 0 HD23 LEU A 110 8.344 -0.752 -11.446 1.00 0.00 H new ATOM 1667 N SER A 111 9.246 -3.099 -15.436 1.00 0.00 N ATOM 1668 CA SER A 111 9.730 -3.899 -16.562 1.00 0.00 C ATOM 1669 C SER A 111 10.750 -4.952 -16.119 1.00 0.00 C ATOM 1670 O SER A 111 11.043 -5.091 -14.929 1.00 0.00 O ATOM 1671 CB SER A 111 10.345 -2.984 -17.629 1.00 0.00 C ATOM 1672 OG SER A 111 11.379 -2.178 -17.085 1.00 0.00 O ATOM 0 H SER A 111 9.465 -2.105 -15.507 1.00 0.00 H new ATOM 0 HA SER A 111 8.875 -4.428 -16.984 1.00 0.00 H new ATOM 0 HB2 SER A 111 10.743 -3.589 -18.444 1.00 0.00 H new ATOM 0 HB3 SER A 111 9.570 -2.346 -18.055 1.00 0.00 H new ATOM 0 HG SER A 111 11.753 -1.607 -17.788 1.00 0.00 H new ATOM 1678 N ASN A 112 11.279 -5.695 -17.095 1.00 0.00 N ATOM 1679 CA ASN A 112 12.263 -6.749 -16.839 1.00 0.00 C ATOM 1680 C ASN A 112 13.410 -6.274 -15.936 1.00 0.00 C ATOM 1681 O ASN A 112 13.985 -7.073 -15.207 1.00 0.00 O ATOM 1682 CB ASN A 112 12.825 -7.284 -18.163 1.00 0.00 C ATOM 1683 CG ASN A 112 13.776 -6.306 -18.835 1.00 0.00 C ATOM 1684 OD1 ASN A 112 14.991 -6.380 -18.649 1.00 0.00 O ATOM 1685 ND2 ASN A 112 13.228 -5.383 -19.621 1.00 0.00 N ATOM 0 H ASN A 112 11.038 -5.583 -18.080 1.00 0.00 H new ATOM 0 HA ASN A 112 11.744 -7.549 -16.311 1.00 0.00 H new ATOM 0 HB2 ASN A 112 13.347 -8.223 -17.978 1.00 0.00 H new ATOM 0 HB3 ASN A 112 12.000 -7.506 -18.840 1.00 0.00 H new ATOM 0 HD21 ASN A 112 13.820 -4.702 -20.097 1.00 0.00 H new ATOM 0 HD22 ASN A 112 12.216 -5.357 -19.748 1.00 0.00 H new ATOM 1692 N GLU A 113 13.742 -4.979 -15.995 1.00 0.00 N ATOM 1693 CA GLU A 113 14.826 -4.417 -15.181 1.00 0.00 C ATOM 1694 C GLU A 113 14.557 -4.596 -13.683 1.00 0.00 C ATOM 1695 O GLU A 113 15.317 -5.278 -12.988 1.00 0.00 O ATOM 1696 CB GLU A 113 15.013 -2.934 -15.498 1.00 0.00 C ATOM 1697 CG GLU A 113 16.269 -2.332 -14.888 1.00 0.00 C ATOM 1698 CD GLU A 113 16.160 -0.831 -14.697 1.00 0.00 C ATOM 1699 OE1 GLU A 113 15.624 -0.404 -13.652 1.00 0.00 O ATOM 1700 OE2 GLU A 113 16.610 -0.085 -15.593 1.00 0.00 O ATOM 0 H GLU A 113 13.276 -4.301 -16.598 1.00 0.00 H new ATOM 0 HA GLU A 113 15.738 -4.959 -15.429 1.00 0.00 H new ATOM 0 HB2 GLU A 113 15.047 -2.804 -16.580 1.00 0.00 H new ATOM 0 HB3 GLU A 113 14.145 -2.382 -15.138 1.00 0.00 H new ATOM 0 HG2 GLU A 113 16.464 -2.804 -13.925 1.00 0.00 H new ATOM 0 HG3 GLU A 113 17.122 -2.552 -15.530 1.00 0.00 H new ATOM 1707 N GLU A 114 13.477 -3.980 -13.191 1.00 0.00 N ATOM 1708 CA GLU A 114 13.116 -4.077 -11.774 1.00 0.00 C ATOM 1709 C GLU A 114 12.907 -5.536 -11.368 1.00 0.00 C ATOM 1710 O GLU A 114 13.356 -5.964 -10.302 1.00 0.00 O ATOM 1711 CB GLU A 114 11.855 -3.262 -11.477 1.00 0.00 C ATOM 1712 CG GLU A 114 11.837 -2.660 -10.077 1.00 0.00 C ATOM 1713 CD GLU A 114 10.935 -3.414 -9.111 1.00 0.00 C ATOM 1714 OE1 GLU A 114 11.064 -4.653 -9.013 1.00 0.00 O ATOM 1715 OE2 GLU A 114 10.105 -2.761 -8.445 1.00 0.00 O ATOM 0 H GLU A 114 12.841 -3.412 -13.750 1.00 0.00 H new ATOM 0 HA GLU A 114 13.939 -3.667 -11.189 1.00 0.00 H new ATOM 0 HB2 GLU A 114 11.769 -2.460 -12.210 1.00 0.00 H new ATOM 0 HB3 GLU A 114 10.981 -3.902 -11.600 1.00 0.00 H new ATOM 0 HG2 GLU A 114 12.852 -2.647 -9.681 1.00 0.00 H new ATOM 0 HG3 GLU A 114 11.506 -1.623 -10.139 1.00 0.00 H new ATOM 1722 N MET A 115 12.238 -6.295 -12.239 1.00 0.00 N ATOM 1723 CA MET A 115 11.975 -7.714 -11.991 1.00 0.00 C ATOM 1724 C MET A 115 13.278 -8.511 -11.980 1.00 0.00 C ATOM 1725 O MET A 115 13.408 -9.482 -11.232 1.00 0.00 O ATOM 1726 CB MET A 115 11.033 -8.283 -13.057 1.00 0.00 C ATOM 1727 CG MET A 115 9.830 -7.402 -13.352 1.00 0.00 C ATOM 1728 SD MET A 115 8.387 -7.833 -12.362 1.00 0.00 S ATOM 1729 CE MET A 115 8.558 -6.690 -10.993 1.00 0.00 C ATOM 0 H MET A 115 11.868 -5.949 -13.124 1.00 0.00 H new ATOM 0 HA MET A 115 11.499 -7.800 -11.014 1.00 0.00 H new ATOM 0 HB2 MET A 115 11.594 -8.435 -13.979 1.00 0.00 H new ATOM 0 HB3 MET A 115 10.682 -9.262 -12.732 1.00 0.00 H new ATOM 0 HG2 MET A 115 10.094 -6.361 -13.167 1.00 0.00 H new ATOM 0 HG3 MET A 115 9.577 -7.483 -14.409 1.00 0.00 H new ATOM 0 HE1 MET A 115 8.719 -7.248 -10.071 1.00 0.00 H new ATOM 0 HE2 MET A 115 9.409 -6.033 -11.172 1.00 0.00 H new ATOM 0 HE3 MET A 115 7.651 -6.093 -10.902 1.00 0.00 H new ATOM 1739 N ASP A 116 14.242 -8.093 -12.809 1.00 0.00 N ATOM 1740 CA ASP A 116 15.540 -8.767 -12.882 1.00 0.00 C ATOM 1741 C ASP A 116 16.204 -8.783 -11.509 1.00 0.00 C ATOM 1742 O ASP A 116 16.650 -9.832 -11.043 1.00 0.00 O ATOM 1743 CB ASP A 116 16.459 -8.082 -13.903 1.00 0.00 C ATOM 1744 CG ASP A 116 16.744 -8.958 -15.109 1.00 0.00 C ATOM 1745 OD1 ASP A 116 15.857 -9.079 -15.982 1.00 0.00 O ATOM 1746 OD2 ASP A 116 17.855 -9.523 -15.182 1.00 0.00 O ATOM 0 H ASP A 116 14.147 -7.294 -13.436 1.00 0.00 H new ATOM 0 HA ASP A 116 15.371 -9.793 -13.208 1.00 0.00 H new ATOM 0 HB2 ASP A 116 15.998 -7.152 -14.235 1.00 0.00 H new ATOM 0 HB3 ASP A 116 17.400 -7.817 -13.420 1.00 0.00 H new ATOM 1751 N GLU A 117 16.241 -7.614 -10.860 1.00 0.00 N ATOM 1752 CA GLU A 117 16.827 -7.490 -9.524 1.00 0.00 C ATOM 1753 C GLU A 117 16.068 -8.360 -8.521 1.00 0.00 C ATOM 1754 O GLU A 117 16.676 -9.013 -7.668 1.00 0.00 O ATOM 1755 CB GLU A 117 16.814 -6.028 -9.067 1.00 0.00 C ATOM 1756 CG GLU A 117 17.681 -5.116 -9.922 1.00 0.00 C ATOM 1757 CD GLU A 117 17.830 -3.727 -9.331 1.00 0.00 C ATOM 1758 OE1 GLU A 117 16.947 -2.876 -9.580 1.00 0.00 O ATOM 1759 OE2 GLU A 117 18.830 -3.488 -8.621 1.00 0.00 O ATOM 0 H GLU A 117 15.872 -6.742 -11.239 1.00 0.00 H new ATOM 0 HA GLU A 117 17.860 -7.834 -9.572 1.00 0.00 H new ATOM 0 HB2 GLU A 117 15.788 -5.660 -9.083 1.00 0.00 H new ATOM 0 HB3 GLU A 117 17.155 -5.976 -8.033 1.00 0.00 H new ATOM 0 HG2 GLU A 117 18.668 -5.564 -10.039 1.00 0.00 H new ATOM 0 HG3 GLU A 117 17.246 -5.038 -10.918 1.00 0.00 H new ATOM 1766 N LEU A 118 14.735 -8.377 -8.640 1.00 0.00 N ATOM 1767 CA LEU A 118 13.892 -9.182 -7.757 1.00 0.00 C ATOM 1768 C LEU A 118 14.246 -10.667 -7.888 1.00 0.00 C ATOM 1769 O LEU A 118 14.330 -11.384 -6.888 1.00 0.00 O ATOM 1770 CB LEU A 118 12.401 -8.935 -8.068 1.00 0.00 C ATOM 1771 CG LEU A 118 11.648 -10.077 -8.771 1.00 0.00 C ATOM 1772 CD1 LEU A 118 11.294 -11.183 -7.785 1.00 0.00 C ATOM 1773 CD2 LEU A 118 10.393 -9.546 -9.453 1.00 0.00 C ATOM 0 H LEU A 118 14.220 -7.842 -9.339 1.00 0.00 H new ATOM 0 HA LEU A 118 14.076 -8.882 -6.725 1.00 0.00 H new ATOM 0 HB2 LEU A 118 11.889 -8.715 -7.131 1.00 0.00 H new ATOM 0 HB3 LEU A 118 12.325 -8.043 -8.690 1.00 0.00 H new ATOM 0 HG LEU A 118 12.304 -10.500 -9.532 1.00 0.00 H new ATOM 0 HD11 LEU A 118 10.762 -11.979 -8.306 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.207 -11.584 -7.345 1.00 0.00 H new ATOM 0 HD13 LEU A 118 10.659 -10.778 -6.997 1.00 0.00 H new ATOM 0 HD21 LEU A 118 9.872 -10.367 -9.946 1.00 0.00 H new ATOM 0 HD22 LEU A 118 9.737 -9.095 -8.708 1.00 0.00 H new ATOM 0 HD23 LEU A 118 10.671 -8.796 -10.194 1.00 0.00 H new ATOM 1785 N LEU A 119 14.462 -11.113 -9.128 1.00 0.00 N ATOM 1786 CA LEU A 119 14.817 -12.503 -9.403 1.00 0.00 C ATOM 1787 C LEU A 119 16.221 -12.830 -8.892 1.00 0.00 C ATOM 1788 O LEU A 119 16.493 -13.963 -8.500 1.00 0.00 O ATOM 1789 CB LEU A 119 14.730 -12.788 -10.905 1.00 0.00 C ATOM 1790 CG LEU A 119 13.432 -13.454 -11.362 1.00 0.00 C ATOM 1791 CD1 LEU A 119 13.070 -13.012 -12.772 1.00 0.00 C ATOM 1792 CD2 LEU A 119 13.564 -14.968 -11.287 1.00 0.00 C ATOM 0 H LEU A 119 14.396 -10.526 -9.960 1.00 0.00 H new ATOM 0 HA LEU A 119 14.105 -13.138 -8.875 1.00 0.00 H new ATOM 0 HB2 LEU A 119 14.849 -11.849 -11.445 1.00 0.00 H new ATOM 0 HB3 LEU A 119 15.567 -13.426 -11.188 1.00 0.00 H new ATOM 0 HG LEU A 119 12.628 -13.144 -10.695 1.00 0.00 H new ATOM 0 HD11 LEU A 119 12.143 -13.497 -13.079 1.00 0.00 H new ATOM 0 HD12 LEU A 119 12.937 -11.930 -12.791 1.00 0.00 H new ATOM 0 HD13 LEU A 119 13.870 -13.292 -13.458 1.00 0.00 H new ATOM 0 HD21 LEU A 119 12.633 -15.431 -11.615 1.00 0.00 H new ATOM 0 HD22 LEU A 119 14.379 -15.295 -11.933 1.00 0.00 H new ATOM 0 HD23 LEU A 119 13.774 -15.264 -10.259 1.00 0.00 H new ATOM 1804 N LYS A 120 17.110 -11.833 -8.896 1.00 0.00 N ATOM 1805 CA LYS A 120 18.482 -12.023 -8.425 1.00 0.00 C ATOM 1806 C LYS A 120 18.501 -12.392 -6.940 1.00 0.00 C ATOM 1807 O LYS A 120 19.251 -13.277 -6.524 1.00 0.00 O ATOM 1808 CB LYS A 120 19.313 -10.758 -8.658 1.00 0.00 C ATOM 1809 CG LYS A 120 19.551 -10.446 -10.128 1.00 0.00 C ATOM 1810 CD LYS A 120 20.910 -9.802 -10.350 1.00 0.00 C ATOM 1811 CE LYS A 120 20.879 -8.816 -11.509 1.00 0.00 C ATOM 1812 NZ LYS A 120 20.095 -7.589 -11.185 1.00 0.00 N ATOM 0 H LYS A 120 16.903 -10.888 -9.220 1.00 0.00 H new ATOM 0 HA LYS A 120 18.921 -12.843 -8.994 1.00 0.00 H new ATOM 0 HB2 LYS A 120 18.808 -9.911 -8.193 1.00 0.00 H new ATOM 0 HB3 LYS A 120 20.275 -10.869 -8.159 1.00 0.00 H new ATOM 0 HG2 LYS A 120 19.483 -11.364 -10.711 1.00 0.00 H new ATOM 0 HG3 LYS A 120 18.768 -9.780 -10.491 1.00 0.00 H new ATOM 0 HD2 LYS A 120 21.222 -9.287 -9.441 1.00 0.00 H new ATOM 0 HD3 LYS A 120 21.652 -10.575 -10.549 1.00 0.00 H new ATOM 0 HE2 LYS A 120 21.899 -8.535 -11.772 1.00 0.00 H new ATOM 0 HE3 LYS A 120 20.447 -9.301 -12.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 20.416 -6.803 -11.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 19.085 -7.767 -11.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 20.237 -7.340 -10.185 1.00 0.00 H new ATOM 1826 N GLY A 121 17.664 -11.712 -6.150 1.00 0.00 N ATOM 1827 CA GLY A 121 17.592 -11.983 -4.722 1.00 0.00 C ATOM 1828 C GLY A 121 16.979 -13.339 -4.407 1.00 0.00 C ATOM 1829 O GLY A 121 17.492 -14.072 -3.559 1.00 0.00 O ATOM 0 H GLY A 121 17.035 -10.978 -6.477 1.00 0.00 H new ATOM 0 HA2 GLY A 121 18.595 -11.936 -4.297 1.00 0.00 H new ATOM 0 HA3 GLY A 121 17.004 -11.203 -4.238 1.00 0.00 H new ATOM 1833 N VAL A 122 15.879 -13.672 -5.087 1.00 0.00 N ATOM 1834 CA VAL A 122 15.195 -14.947 -4.875 1.00 0.00 C ATOM 1835 C VAL A 122 15.845 -16.066 -5.693 1.00 0.00 C ATOM 1836 O VAL A 122 16.001 -15.940 -6.907 1.00 0.00 O ATOM 1837 CB VAL A 122 13.698 -14.851 -5.257 1.00 0.00 C ATOM 1838 CG1 VAL A 122 12.975 -16.156 -4.956 1.00 0.00 C ATOM 1839 CG2 VAL A 122 13.028 -13.688 -4.536 1.00 0.00 C ATOM 0 H VAL A 122 15.444 -13.074 -5.790 1.00 0.00 H new ATOM 0 HA VAL A 122 15.281 -15.180 -3.814 1.00 0.00 H new ATOM 0 HB VAL A 122 13.637 -14.668 -6.330 1.00 0.00 H new ATOM 0 HG11 VAL A 122 11.925 -16.063 -5.233 1.00 0.00 H new ATOM 0 HG12 VAL A 122 13.431 -16.965 -5.528 1.00 0.00 H new ATOM 0 HG13 VAL A 122 13.051 -16.377 -3.891 1.00 0.00 H new ATOM 0 HG21 VAL A 122 11.977 -13.641 -4.820 1.00 0.00 H new ATOM 0 HG22 VAL A 122 13.106 -13.834 -3.459 1.00 0.00 H new ATOM 0 HG23 VAL A 122 13.521 -12.756 -4.813 1.00 0.00 H new ATOM 1849 N PRO A 123 16.231 -17.183 -5.038 1.00 0.00 N ATOM 1850 CA PRO A 123 16.859 -18.324 -5.720 1.00 0.00 C ATOM 1851 C PRO A 123 15.846 -19.155 -6.520 1.00 0.00 C ATOM 1852 O PRO A 123 15.642 -20.342 -6.250 1.00 0.00 O ATOM 1853 CB PRO A 123 17.448 -19.131 -4.566 1.00 0.00 C ATOM 1854 CG PRO A 123 16.560 -18.838 -3.407 1.00 0.00 C ATOM 1855 CD PRO A 123 16.082 -17.422 -3.588 1.00 0.00 C ATOM 0 HA PRO A 123 17.599 -18.014 -6.458 1.00 0.00 H new ATOM 0 HB2 PRO A 123 17.462 -20.197 -4.795 1.00 0.00 H new ATOM 0 HB3 PRO A 123 18.477 -18.836 -4.361 1.00 0.00 H new ATOM 0 HG2 PRO A 123 15.719 -19.531 -3.376 1.00 0.00 H new ATOM 0 HG3 PRO A 123 17.099 -18.949 -2.466 1.00 0.00 H new ATOM 0 HD2 PRO A 123 15.047 -17.305 -3.268 1.00 0.00 H new ATOM 0 HD3 PRO A 123 16.678 -16.721 -3.004 1.00 0.00 H new ATOM 1863 N VAL A 124 15.210 -18.512 -7.501 1.00 0.00 N ATOM 1864 CA VAL A 124 14.212 -19.165 -8.346 1.00 0.00 C ATOM 1865 C VAL A 124 14.471 -18.885 -9.832 1.00 0.00 C ATOM 1866 O VAL A 124 15.318 -18.057 -10.179 1.00 0.00 O ATOM 1867 CB VAL A 124 12.784 -18.701 -7.961 1.00 0.00 C ATOM 1868 CG1 VAL A 124 12.442 -17.371 -8.619 1.00 0.00 C ATOM 1869 CG2 VAL A 124 11.753 -19.765 -8.314 1.00 0.00 C ATOM 0 H VAL A 124 15.371 -17.531 -7.730 1.00 0.00 H new ATOM 0 HA VAL A 124 14.293 -20.240 -8.182 1.00 0.00 H new ATOM 0 HB VAL A 124 12.761 -18.554 -6.881 1.00 0.00 H new ATOM 0 HG11 VAL A 124 11.435 -17.071 -8.331 1.00 0.00 H new ATOM 0 HG12 VAL A 124 13.154 -16.611 -8.295 1.00 0.00 H new ATOM 0 HG13 VAL A 124 12.493 -17.477 -9.703 1.00 0.00 H new ATOM 0 HG21 VAL A 124 10.759 -19.416 -8.034 1.00 0.00 H new ATOM 0 HG22 VAL A 124 11.781 -19.957 -9.387 1.00 0.00 H new ATOM 0 HG23 VAL A 124 11.980 -20.684 -7.774 1.00 0.00 H new ATOM 1879 N LYS A 125 13.729 -19.573 -10.700 1.00 0.00 N ATOM 1880 CA LYS A 125 13.861 -19.399 -12.144 1.00 0.00 C ATOM 1881 C LYS A 125 12.546 -18.894 -12.726 1.00 0.00 C ATOM 1882 O LYS A 125 11.479 -19.420 -12.399 1.00 0.00 O ATOM 1883 CB LYS A 125 14.261 -20.717 -12.810 1.00 0.00 C ATOM 1884 CG LYS A 125 15.765 -20.901 -12.944 1.00 0.00 C ATOM 1885 CD LYS A 125 16.394 -21.332 -11.627 1.00 0.00 C ATOM 1886 CE LYS A 125 17.910 -21.414 -11.730 1.00 0.00 C ATOM 1887 NZ LYS A 125 18.390 -22.821 -11.836 1.00 0.00 N ATOM 0 H LYS A 125 13.027 -20.260 -10.425 1.00 0.00 H new ATOM 0 HA LYS A 125 14.643 -18.665 -12.338 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.852 -21.545 -12.231 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.808 -20.766 -13.800 1.00 0.00 H new ATOM 0 HG2 LYS A 125 15.974 -21.648 -13.710 1.00 0.00 H new ATOM 0 HG3 LYS A 125 16.219 -19.967 -13.277 1.00 0.00 H new ATOM 0 HD2 LYS A 125 16.120 -20.625 -10.844 1.00 0.00 H new ATOM 0 HD3 LYS A 125 15.996 -22.303 -11.334 1.00 0.00 H new ATOM 0 HE2 LYS A 125 18.245 -20.851 -12.601 1.00 0.00 H new ATOM 0 HE3 LYS A 125 18.358 -20.944 -10.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 19.428 -22.830 -11.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 18.094 -23.353 -10.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 17.984 -23.263 -12.685 1.00 0.00 H new ATOM 1901 N ASP A 126 12.631 -17.852 -13.563 1.00 0.00 N ATOM 1902 CA ASP A 126 11.454 -17.229 -14.187 1.00 0.00 C ATOM 1903 C ASP A 126 10.780 -16.250 -13.222 1.00 0.00 C ATOM 1904 O ASP A 126 10.468 -15.119 -13.598 1.00 0.00 O ATOM 1905 CB ASP A 126 10.438 -18.278 -14.669 1.00 0.00 C ATOM 1906 CG ASP A 126 11.058 -19.319 -15.583 1.00 0.00 C ATOM 1907 OD1 ASP A 126 11.431 -18.965 -16.721 1.00 0.00 O ATOM 1908 OD2 ASP A 126 11.171 -20.489 -15.159 1.00 0.00 O ATOM 0 H ASP A 126 13.515 -17.417 -13.827 1.00 0.00 H new ATOM 0 HA ASP A 126 11.808 -16.680 -15.060 1.00 0.00 H new ATOM 0 HB2 ASP A 126 9.998 -18.775 -13.805 1.00 0.00 H new ATOM 0 HB3 ASP A 126 9.626 -17.776 -15.195 1.00 0.00 H new ATOM 1913 N GLY A 127 10.565 -16.690 -11.976 1.00 0.00 N ATOM 1914 CA GLY A 127 9.940 -15.843 -10.976 1.00 0.00 C ATOM 1915 C GLY A 127 8.733 -16.494 -10.329 1.00 0.00 C ATOM 1916 O GLY A 127 7.652 -15.907 -10.298 1.00 0.00 O ATOM 0 H GLY A 127 10.816 -17.622 -11.646 1.00 0.00 H new ATOM 0 HA2 GLY A 127 10.671 -15.597 -10.206 1.00 0.00 H new ATOM 0 HA3 GLY A 127 9.637 -14.904 -11.439 1.00 0.00 H new ATOM 1920 N MET A 128 8.914 -17.708 -9.808 1.00 0.00 N ATOM 1921 CA MET A 128 7.821 -18.427 -9.160 1.00 0.00 C ATOM 1922 C MET A 128 8.010 -18.456 -7.649 1.00 0.00 C ATOM 1923 O MET A 128 8.873 -19.161 -7.120 1.00 0.00 O ATOM 1924 CB MET A 128 7.680 -19.845 -9.742 1.00 0.00 C ATOM 1925 CG MET A 128 7.452 -20.945 -8.711 1.00 0.00 C ATOM 1926 SD MET A 128 6.994 -22.519 -9.465 1.00 0.00 S ATOM 1927 CE MET A 128 8.526 -23.433 -9.297 1.00 0.00 C ATOM 0 H MET A 128 9.802 -18.210 -9.822 1.00 0.00 H new ATOM 0 HA MET A 128 6.892 -17.894 -9.362 1.00 0.00 H new ATOM 0 HB2 MET A 128 6.849 -19.851 -10.447 1.00 0.00 H new ATOM 0 HB3 MET A 128 8.581 -20.080 -10.309 1.00 0.00 H new ATOM 0 HG2 MET A 128 8.359 -21.079 -8.122 1.00 0.00 H new ATOM 0 HG3 MET A 128 6.667 -20.635 -8.022 1.00 0.00 H new ATOM 0 HE1 MET A 128 8.403 -24.431 -9.719 1.00 0.00 H new ATOM 0 HE2 MET A 128 9.322 -22.910 -9.828 1.00 0.00 H new ATOM 0 HE3 MET A 128 8.787 -23.515 -8.242 1.00 0.00 H new ATOM 1937 N VAL A 129 7.183 -17.673 -6.969 1.00 0.00 N ATOM 1938 CA VAL A 129 7.218 -17.579 -5.518 1.00 0.00 C ATOM 1939 C VAL A 129 5.793 -17.455 -4.948 1.00 0.00 C ATOM 1940 O VAL A 129 5.601 -17.015 -3.811 1.00 0.00 O ATOM 1941 CB VAL A 129 8.070 -16.371 -5.070 1.00 0.00 C ATOM 1942 CG1 VAL A 129 8.172 -16.308 -3.555 1.00 0.00 C ATOM 1943 CG2 VAL A 129 9.458 -16.426 -5.696 1.00 0.00 C ATOM 0 H VAL A 129 6.472 -17.088 -7.407 1.00 0.00 H new ATOM 0 HA VAL A 129 7.673 -18.491 -5.132 1.00 0.00 H new ATOM 0 HB VAL A 129 7.572 -15.465 -5.415 1.00 0.00 H new ATOM 0 HG11 VAL A 129 8.777 -15.448 -3.266 1.00 0.00 H new ATOM 0 HG12 VAL A 129 7.174 -16.210 -3.127 1.00 0.00 H new ATOM 0 HG13 VAL A 129 8.638 -17.221 -3.183 1.00 0.00 H new ATOM 0 HG21 VAL A 129 10.040 -15.565 -5.366 1.00 0.00 H new ATOM 0 HG22 VAL A 129 9.960 -17.343 -5.388 1.00 0.00 H new ATOM 0 HG23 VAL A 129 9.368 -16.409 -6.782 1.00 0.00 H new ATOM 1953 N ASN A 130 4.792 -17.852 -5.749 1.00 0.00 N ATOM 1954 CA ASN A 130 3.386 -17.788 -5.334 1.00 0.00 C ATOM 1955 C ASN A 130 2.967 -16.361 -4.953 1.00 0.00 C ATOM 1956 O ASN A 130 2.002 -16.178 -4.207 1.00 0.00 O ATOM 1957 CB ASN A 130 3.161 -18.719 -4.136 1.00 0.00 C ATOM 1958 CG ASN A 130 1.699 -19.088 -3.939 1.00 0.00 C ATOM 1959 OD1 ASN A 130 0.927 -19.156 -4.896 1.00 0.00 O ATOM 1960 ND2 ASN A 130 1.312 -19.329 -2.691 1.00 0.00 N ATOM 0 H ASN A 130 4.933 -18.221 -6.689 1.00 0.00 H new ATOM 0 HA ASN A 130 2.776 -18.104 -6.180 1.00 0.00 H new ATOM 0 HB2 ASN A 130 3.745 -19.629 -4.275 1.00 0.00 H new ATOM 0 HB3 ASN A 130 3.534 -18.236 -3.232 1.00 0.00 H new ATOM 0 HD21 ASN A 130 0.343 -19.581 -2.497 1.00 0.00 H new ATOM 0 HD22 ASN A 130 1.984 -19.262 -1.927 1.00 0.00 H new ATOM 1967 N TYR A 131 3.702 -15.354 -5.445 1.00 0.00 N ATOM 1968 CA TYR A 131 3.407 -13.958 -5.120 1.00 0.00 C ATOM 1969 C TYR A 131 3.378 -13.769 -3.597 1.00 0.00 C ATOM 1970 O TYR A 131 3.861 -14.633 -2.859 1.00 0.00 O ATOM 1971 CB TYR A 131 2.077 -13.521 -5.748 1.00 0.00 C ATOM 1972 CG TYR A 131 2.101 -12.092 -6.241 1.00 0.00 C ATOM 1973 CD1 TYR A 131 3.113 -11.651 -7.082 1.00 0.00 C ATOM 1974 CD2 TYR A 131 1.124 -11.181 -5.857 1.00 0.00 C ATOM 1975 CE1 TYR A 131 3.153 -10.348 -7.529 1.00 0.00 C ATOM 1976 CE2 TYR A 131 1.157 -9.873 -6.298 1.00 0.00 C ATOM 1977 CZ TYR A 131 2.175 -9.460 -7.134 1.00 0.00 C ATOM 1978 OH TYR A 131 2.213 -8.158 -7.576 1.00 0.00 O ATOM 0 H TYR A 131 4.501 -15.482 -6.066 1.00 0.00 H new ATOM 0 HA TYR A 131 4.195 -13.329 -5.535 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.839 -14.183 -6.580 1.00 0.00 H new ATOM 0 HB3 TYR A 131 1.280 -13.633 -5.013 1.00 0.00 H new ATOM 0 HD1 TYR A 131 3.883 -12.342 -7.392 1.00 0.00 H new ATOM 0 HD2 TYR A 131 0.326 -11.501 -5.203 1.00 0.00 H new ATOM 0 HE1 TYR A 131 3.947 -10.024 -8.186 1.00 0.00 H new ATOM 0 HE2 TYR A 131 0.391 -9.177 -5.991 1.00 0.00 H new ATOM 0 HH TYR A 131 1.642 -8.064 -8.367 1.00 0.00 H new ATOM 1988 N HIS A 132 2.820 -12.645 -3.128 1.00 0.00 N ATOM 1989 CA HIS A 132 2.734 -12.354 -1.693 1.00 0.00 C ATOM 1990 C HIS A 132 4.105 -12.000 -1.113 1.00 0.00 C ATOM 1991 O HIS A 132 4.274 -10.925 -0.542 1.00 0.00 O ATOM 1992 CB HIS A 132 2.121 -13.534 -0.929 1.00 0.00 C ATOM 1993 CG HIS A 132 0.773 -13.237 -0.351 1.00 0.00 C ATOM 1994 ND1 HIS A 132 0.634 -12.579 0.845 1.00 0.00 N ATOM 1995 CD2 HIS A 132 -0.456 -13.528 -0.843 1.00 0.00 C ATOM 1996 CE1 HIS A 132 -0.667 -12.483 1.056 1.00 0.00 C ATOM 1997 NE2 HIS A 132 -1.368 -13.044 0.060 1.00 0.00 N ATOM 0 H HIS A 132 2.420 -11.921 -3.725 1.00 0.00 H new ATOM 0 HA HIS A 132 2.082 -11.489 -1.574 1.00 0.00 H new ATOM 0 HB2 HIS A 132 2.039 -14.388 -1.601 1.00 0.00 H new ATOM 0 HB3 HIS A 132 2.796 -13.825 -0.124 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -0.675 -14.042 -1.767 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -1.110 -12.012 1.921 1.00 0.00 H new ATOM 0 HE2 HIS A 132 -2.384 -13.100 -0.012 1.00 0.00 H new ATOM 2005 N ASP A 133 5.078 -12.907 -1.262 1.00 0.00 N ATOM 2006 CA ASP A 133 6.433 -12.683 -0.752 1.00 0.00 C ATOM 2007 C ASP A 133 7.006 -11.347 -1.240 1.00 0.00 C ATOM 2008 O ASP A 133 7.678 -10.643 -0.482 1.00 0.00 O ATOM 2009 CB ASP A 133 7.357 -13.828 -1.178 1.00 0.00 C ATOM 2010 CG ASP A 133 8.407 -14.144 -0.131 1.00 0.00 C ATOM 2011 OD1 ASP A 133 9.419 -13.414 -0.064 1.00 0.00 O ATOM 2012 OD2 ASP A 133 8.216 -15.120 0.624 1.00 0.00 O ATOM 0 H ASP A 133 4.950 -13.803 -1.732 1.00 0.00 H new ATOM 0 HA ASP A 133 6.373 -12.649 0.336 1.00 0.00 H new ATOM 0 HB2 ASP A 133 6.761 -14.720 -1.371 1.00 0.00 H new ATOM 0 HB3 ASP A 133 7.849 -13.565 -2.114 1.00 0.00 H new ATOM 2017 N PHE A 134 6.731 -11.003 -2.502 1.00 0.00 N ATOM 2018 CA PHE A 134 7.215 -9.747 -3.083 1.00 0.00 C ATOM 2019 C PHE A 134 6.519 -8.553 -2.438 1.00 0.00 C ATOM 2020 O PHE A 134 7.174 -7.647 -1.924 1.00 0.00 O ATOM 2021 CB PHE A 134 6.996 -9.705 -4.603 1.00 0.00 C ATOM 2022 CG PHE A 134 7.246 -11.008 -5.315 1.00 0.00 C ATOM 2023 CD1 PHE A 134 8.358 -11.783 -5.020 1.00 0.00 C ATOM 2024 CD2 PHE A 134 6.367 -11.451 -6.289 1.00 0.00 C ATOM 2025 CE1 PHE A 134 8.585 -12.973 -5.684 1.00 0.00 C ATOM 2026 CE2 PHE A 134 6.589 -12.640 -6.955 1.00 0.00 C ATOM 2027 CZ PHE A 134 7.698 -13.402 -6.652 1.00 0.00 C ATOM 0 H PHE A 134 6.177 -11.575 -3.139 1.00 0.00 H new ATOM 0 HA PHE A 134 8.286 -9.693 -2.887 1.00 0.00 H new ATOM 0 HB2 PHE A 134 5.971 -9.391 -4.799 1.00 0.00 H new ATOM 0 HB3 PHE A 134 7.650 -8.944 -5.029 1.00 0.00 H new ATOM 0 HD1 PHE A 134 9.054 -11.453 -4.263 1.00 0.00 H new ATOM 0 HD2 PHE A 134 5.497 -10.859 -6.531 1.00 0.00 H new ATOM 0 HE1 PHE A 134 9.455 -13.567 -5.446 1.00 0.00 H new ATOM 0 HE2 PHE A 134 5.895 -12.973 -7.712 1.00 0.00 H new ATOM 0 HZ PHE A 134 7.873 -14.333 -7.171 1.00 0.00 H new ATOM 2037 N VAL A 135 5.182 -8.567 -2.468 1.00 0.00 N ATOM 2038 CA VAL A 135 4.379 -7.490 -1.885 1.00 0.00 C ATOM 2039 C VAL A 135 4.652 -7.342 -0.386 1.00 0.00 C ATOM 2040 O VAL A 135 4.576 -6.240 0.159 1.00 0.00 O ATOM 2041 CB VAL A 135 2.864 -7.728 -2.104 1.00 0.00 C ATOM 2042 CG1 VAL A 135 2.056 -6.516 -1.661 1.00 0.00 C ATOM 2043 CG2 VAL A 135 2.573 -8.062 -3.562 1.00 0.00 C ATOM 0 H VAL A 135 4.633 -9.315 -2.891 1.00 0.00 H new ATOM 0 HA VAL A 135 4.670 -6.572 -2.395 1.00 0.00 H new ATOM 0 HB VAL A 135 2.565 -8.580 -1.493 1.00 0.00 H new ATOM 0 HG11 VAL A 135 0.995 -6.706 -1.824 1.00 0.00 H new ATOM 0 HG12 VAL A 135 2.232 -6.329 -0.602 1.00 0.00 H new ATOM 0 HG13 VAL A 135 2.361 -5.644 -2.239 1.00 0.00 H new ATOM 0 HG21 VAL A 135 1.503 -8.225 -3.691 1.00 0.00 H new ATOM 0 HG22 VAL A 135 2.893 -7.235 -4.196 1.00 0.00 H new ATOM 0 HG23 VAL A 135 3.114 -8.965 -3.843 1.00 0.00 H new ATOM 2053 N GLN A 136 4.976 -8.458 0.274 1.00 0.00 N ATOM 2054 CA GLN A 136 5.265 -8.453 1.705 1.00 0.00 C ATOM 2055 C GLN A 136 6.587 -7.739 1.991 1.00 0.00 C ATOM 2056 O GLN A 136 6.632 -6.805 2.791 1.00 0.00 O ATOM 2057 CB GLN A 136 5.310 -9.891 2.244 1.00 0.00 C ATOM 2058 CG GLN A 136 5.554 -9.984 3.744 1.00 0.00 C ATOM 2059 CD GLN A 136 4.533 -9.205 4.554 1.00 0.00 C ATOM 2060 OE1 GLN A 136 3.341 -9.514 4.536 1.00 0.00 O ATOM 2061 NE2 GLN A 136 4.996 -8.185 5.272 1.00 0.00 N ATOM 0 H GLN A 136 5.044 -9.377 -0.164 1.00 0.00 H new ATOM 0 HA GLN A 136 4.467 -7.911 2.212 1.00 0.00 H new ATOM 0 HB2 GLN A 136 4.368 -10.386 2.008 1.00 0.00 H new ATOM 0 HB3 GLN A 136 6.096 -10.438 1.724 1.00 0.00 H new ATOM 0 HG2 GLN A 136 5.530 -11.031 4.047 1.00 0.00 H new ATOM 0 HG3 GLN A 136 6.553 -9.609 3.969 1.00 0.00 H new ATOM 0 HE21 GLN A 136 5.991 -7.962 5.259 1.00 0.00 H new ATOM 0 HE22 GLN A 136 4.356 -7.626 5.835 1.00 0.00 H new ATOM 2070 N MET A 137 7.657 -8.181 1.326 1.00 0.00 N ATOM 2071 CA MET A 137 8.981 -7.584 1.502 1.00 0.00 C ATOM 2072 C MET A 137 9.008 -6.128 1.026 1.00 0.00 C ATOM 2073 O MET A 137 9.706 -5.293 1.606 1.00 0.00 O ATOM 2074 CB MET A 137 10.034 -8.400 0.746 1.00 0.00 C ATOM 2075 CG MET A 137 11.465 -8.065 1.140 1.00 0.00 C ATOM 2076 SD MET A 137 12.443 -9.532 1.515 1.00 0.00 S ATOM 2077 CE MET A 137 12.658 -9.356 3.285 1.00 0.00 C ATOM 0 H MET A 137 7.631 -8.952 0.659 1.00 0.00 H new ATOM 0 HA MET A 137 9.211 -7.595 2.567 1.00 0.00 H new ATOM 0 HB2 MET A 137 9.856 -9.461 0.924 1.00 0.00 H new ATOM 0 HB3 MET A 137 9.912 -8.232 -0.324 1.00 0.00 H new ATOM 0 HG2 MET A 137 11.941 -7.513 0.330 1.00 0.00 H new ATOM 0 HG3 MET A 137 11.454 -7.408 2.010 1.00 0.00 H new ATOM 0 HE1 MET A 137 13.246 -10.192 3.665 1.00 0.00 H new ATOM 0 HE2 MET A 137 13.177 -8.421 3.497 1.00 0.00 H new ATOM 0 HE3 MET A 137 11.682 -9.348 3.771 1.00 0.00 H new