USER MOD reduce.3.24.130724 H: found=0, std=0, add=1061, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1063 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 47 THR OG1 : rot 180:sc= 0.139 USER MOD Set 1.2: A 80 TYR OH : rot 150:sc= -0.0717 USER MOD Set 2.1: A 34 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 36 SER OG : rot -147:sc= 0.739 USER MOD Single : A 6 LYS NZ :NH3+ -169:sc= -0.0944 (180deg=-0.399) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ -168:sc= -0.0469 (180deg=-0.282) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot -20:sc= 0.0725 USER MOD Single : A 29 LYS NZ :NH3+ -118:sc= -0.31 (180deg=-1.55) USER MOD Single : A 38 SER OG : rot 80:sc= -2.14 USER MOD Single : A 49 GLN : amide:sc= -3.86 K(o=-3.9,f=-8.7!) USER MOD Single : A 54 TYR OH : rot 32:sc= 0.0138 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= -2.32 X(o=-2.3,f=-2.3) USER MOD Single : A 60 SER OG : rot 180:sc= 0.0805 USER MOD Single : A 61 LYS NZ :NH3+ -129:sc= -0.0589 (180deg=-2.52!) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 CYS SG : rot -90:sc= -1.08 USER MOD Single : A 69 THR OG1 : rot -130:sc= -1.31 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 MET CE :methyl -142:sc= -8.18! (180deg=-14.5!) USER MOD Single : A 93 GLN : amide:sc= -0.14 K(o=-0.14,f=-3.7!) USER MOD Single : A 94 SER OG : rot -169:sc= -1.33 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.0043) USER MOD Single : A 99 LYS NZ :NH3+ 151:sc= -0.124 (180deg=-0.537) USER MOD Single : A 101 SER OG : rot -36:sc= 1.05 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 HIS : no HD1:sc= -0.0904 X(o=-0.09,f=-0.29) USER MOD Single : A 105 ASN : amide:sc= 0.0199 X(o=0.02,f=0) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot -120:sc= -1.76 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0.964 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot 129:sc= -0.965! USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 143 LYS NZ :NH3+ -179:sc= -1.23 (180deg=-1.29) USER MOD ----------------------------------------------------------------- ATOM 21 N LEU A 4 -4.427 11.673 4.099 1.00 0.00 N ATOM 22 CA LEU A 4 -4.066 10.916 2.904 1.00 0.00 C ATOM 23 C LEU A 4 -4.613 11.589 1.649 1.00 0.00 C ATOM 24 O LEU A 4 -4.062 11.435 0.560 1.00 0.00 O ATOM 25 CB LEU A 4 -4.590 9.480 3.000 1.00 0.00 C ATOM 26 CG LEU A 4 -4.149 8.700 4.242 1.00 0.00 C ATOM 27 CD1 LEU A 4 -4.408 7.213 4.054 1.00 0.00 C ATOM 28 CD2 LEU A 4 -2.677 8.948 4.545 1.00 0.00 C ATOM 0 HA LEU A 4 -2.978 10.891 2.837 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -5.679 9.507 2.977 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -4.266 8.933 2.115 1.00 0.00 H new ATOM 0 HG LEU A 4 -4.735 9.052 5.091 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -4.089 6.673 4.945 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -5.473 7.047 3.890 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -3.848 6.852 3.191 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -2.388 8.383 5.431 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -2.072 8.627 3.697 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -2.516 10.011 4.724 1.00 0.00 H new ATOM 40 N ASP A 5 -5.699 12.342 1.812 1.00 0.00 N ATOM 41 CA ASP A 5 -6.316 13.044 0.694 1.00 0.00 C ATOM 42 C ASP A 5 -5.305 13.955 0.006 1.00 0.00 C ATOM 43 O ASP A 5 -5.305 14.086 -1.219 1.00 0.00 O ATOM 44 CB ASP A 5 -7.514 13.864 1.176 1.00 0.00 C ATOM 45 CG ASP A 5 -8.774 13.032 1.297 1.00 0.00 C ATOM 46 OD1 ASP A 5 -9.219 12.476 0.269 1.00 0.00 O ATOM 47 OD2 ASP A 5 -9.319 12.934 2.417 1.00 0.00 O ATOM 0 H ASP A 5 -6.168 12.480 2.707 1.00 0.00 H new ATOM 0 HA ASP A 5 -6.662 12.301 -0.025 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -7.281 14.308 2.144 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -7.690 14.686 0.483 1.00 0.00 H new ATOM 52 N LYS A 6 -4.443 14.581 0.802 1.00 0.00 N ATOM 53 CA LYS A 6 -3.417 15.486 0.251 1.00 0.00 C ATOM 54 C LYS A 6 -2.610 14.782 -0.840 1.00 0.00 C ATOM 55 O LYS A 6 -2.398 15.331 -1.921 1.00 0.00 O ATOM 56 CB LYS A 6 -2.452 16.013 1.336 1.00 0.00 C ATOM 57 CG LYS A 6 -1.254 16.752 0.765 1.00 0.00 C ATOM 58 CD LYS A 6 -0.396 17.359 1.864 1.00 0.00 C ATOM 59 CE LYS A 6 -1.177 18.373 2.684 1.00 0.00 C ATOM 60 NZ LYS A 6 -1.932 19.323 1.820 1.00 0.00 N ATOM 0 H LYS A 6 -4.426 14.486 1.817 1.00 0.00 H new ATOM 0 HA LYS A 6 -3.949 16.339 -0.171 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -2.997 16.680 2.005 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -2.100 15.175 1.938 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -0.652 16.065 0.170 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -1.597 17.539 0.094 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -0.026 16.568 2.517 1.00 0.00 H new ATOM 0 HD3 LYS A 6 0.476 17.841 1.422 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -1.871 17.850 3.342 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -0.491 18.930 3.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -2.297 20.105 2.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -1.300 19.702 1.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -2.727 18.826 1.369 1.00 0.00 H new ATOM 74 N TYR A 7 -2.165 13.567 -0.545 1.00 0.00 N ATOM 75 CA TYR A 7 -1.380 12.784 -1.495 1.00 0.00 C ATOM 76 C TYR A 7 -2.280 11.999 -2.450 1.00 0.00 C ATOM 77 O TYR A 7 -1.798 11.374 -3.394 1.00 0.00 O ATOM 78 CB TYR A 7 -0.456 11.821 -0.748 1.00 0.00 C ATOM 79 CG TYR A 7 0.814 12.469 -0.245 1.00 0.00 C ATOM 80 CD1 TYR A 7 1.797 12.898 -1.128 1.00 0.00 C ATOM 81 CD2 TYR A 7 1.031 12.651 1.115 1.00 0.00 C ATOM 82 CE1 TYR A 7 2.959 13.491 -0.671 1.00 0.00 C ATOM 83 CE2 TYR A 7 2.191 13.242 1.581 1.00 0.00 C ATOM 84 CZ TYR A 7 3.150 13.660 0.684 1.00 0.00 C ATOM 85 OH TYR A 7 4.306 14.250 1.143 1.00 0.00 O ATOM 0 H TYR A 7 -2.334 13.100 0.346 1.00 0.00 H new ATOM 0 HA TYR A 7 -0.782 13.479 -2.084 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -0.996 11.395 0.097 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -0.195 10.995 -1.409 1.00 0.00 H new ATOM 0 HD1 TYR A 7 1.651 12.766 -2.190 1.00 0.00 H new ATOM 0 HD2 TYR A 7 0.281 12.325 1.820 1.00 0.00 H new ATOM 0 HE1 TYR A 7 3.713 13.820 -1.371 1.00 0.00 H new ATOM 0 HE2 TYR A 7 2.345 13.375 2.642 1.00 0.00 H new ATOM 0 HH TYR A 7 4.284 14.295 2.122 1.00 0.00 H new ATOM 135 N ILE A 11 -10.331 11.178 -4.878 1.00 0.00 N ATOM 136 CA ILE A 11 -10.577 9.784 -4.530 1.00 0.00 C ATOM 137 C ILE A 11 -11.981 9.607 -3.961 1.00 0.00 C ATOM 138 O ILE A 11 -12.373 10.303 -3.023 1.00 0.00 O ATOM 139 CB ILE A 11 -9.551 9.266 -3.506 1.00 0.00 C ATOM 140 CG1 ILE A 11 -8.127 9.551 -3.987 1.00 0.00 C ATOM 141 CG2 ILE A 11 -9.745 7.774 -3.264 1.00 0.00 C ATOM 142 CD1 ILE A 11 -7.830 9.008 -5.368 1.00 0.00 C ATOM 0 HA ILE A 11 -10.479 9.205 -5.448 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.708 9.790 -2.563 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -7.962 10.628 -3.987 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.420 9.120 -3.277 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -9.011 7.425 -2.538 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.749 7.595 -2.880 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -9.613 7.233 -4.201 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -6.802 9.249 -5.640 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -7.962 7.926 -5.370 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -8.512 9.458 -6.090 1.00 0.00 H new ATOM 154 N GLU A 12 -12.734 8.674 -4.533 1.00 0.00 N ATOM 155 CA GLU A 12 -14.096 8.409 -4.083 1.00 0.00 C ATOM 156 C GLU A 12 -14.115 7.337 -2.996 1.00 0.00 C ATOM 157 O GLU A 12 -14.331 7.636 -1.823 1.00 0.00 O ATOM 158 CB GLU A 12 -14.971 7.978 -5.262 1.00 0.00 C ATOM 159 CG GLU A 12 -16.410 7.680 -4.877 1.00 0.00 C ATOM 160 CD GLU A 12 -17.156 6.919 -5.956 1.00 0.00 C ATOM 161 OE1 GLU A 12 -16.916 7.193 -7.150 1.00 0.00 O ATOM 162 OE2 GLU A 12 -17.981 6.049 -5.606 1.00 0.00 O ATOM 0 H GLU A 12 -12.425 8.089 -5.309 1.00 0.00 H new ATOM 0 HA GLU A 12 -14.497 9.330 -3.661 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -14.961 8.764 -6.017 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -14.536 7.090 -5.721 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -16.423 7.101 -3.954 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -16.929 8.616 -4.673 1.00 0.00 H new ATOM 169 N LYS A 13 -13.890 6.090 -3.398 1.00 0.00 N ATOM 170 CA LYS A 13 -13.885 4.968 -2.458 1.00 0.00 C ATOM 171 C LYS A 13 -12.781 3.976 -2.806 1.00 0.00 C ATOM 172 O LYS A 13 -12.192 4.040 -3.886 1.00 0.00 O ATOM 173 CB LYS A 13 -15.243 4.262 -2.457 1.00 0.00 C ATOM 174 CG LYS A 13 -16.331 5.021 -1.708 1.00 0.00 C ATOM 175 CD LYS A 13 -15.884 5.426 -0.317 1.00 0.00 C ATOM 176 CE LYS A 13 -17.041 5.993 0.490 1.00 0.00 C ATOM 177 NZ LYS A 13 -17.799 7.024 -0.272 1.00 0.00 N ATOM 0 H LYS A 13 -13.709 5.828 -4.367 1.00 0.00 H new ATOM 0 HA LYS A 13 -13.694 5.364 -1.461 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -15.563 4.110 -3.488 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.128 3.275 -2.010 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -16.608 5.911 -2.274 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -17.223 4.399 -1.636 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -15.466 4.562 0.199 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -15.090 6.169 -0.390 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -17.714 5.185 0.776 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -16.660 6.431 1.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -18.443 7.527 0.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -17.133 7.702 -0.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -18.351 6.564 -1.024 1.00 0.00 H new ATOM 191 N LEU A 14 -12.498 3.064 -1.881 1.00 0.00 N ATOM 192 CA LEU A 14 -11.456 2.064 -2.087 1.00 0.00 C ATOM 193 C LEU A 14 -12.055 0.721 -2.497 1.00 0.00 C ATOM 194 O LEU A 14 -13.257 0.496 -2.361 1.00 0.00 O ATOM 195 CB LEU A 14 -10.623 1.892 -0.813 1.00 0.00 C ATOM 196 CG LEU A 14 -10.131 3.193 -0.169 1.00 0.00 C ATOM 197 CD1 LEU A 14 -9.493 4.105 -1.207 1.00 0.00 C ATOM 198 CD2 LEU A 14 -11.275 3.902 0.537 1.00 0.00 C ATOM 0 H LEU A 14 -12.975 2.997 -0.982 1.00 0.00 H new ATOM 0 HA LEU A 14 -10.812 2.415 -2.893 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -11.218 1.346 -0.081 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -9.757 1.272 -1.046 1.00 0.00 H new ATOM 0 HG LEU A 14 -9.371 2.941 0.571 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -9.152 5.021 -0.726 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -8.644 3.598 -1.664 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -10.226 4.350 -1.976 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -10.908 4.824 0.989 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -12.057 4.138 -0.184 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -11.681 3.254 1.314 1.00 0.00 H new ATOM 210 N ARG A 15 -11.201 -0.167 -2.999 1.00 0.00 N ATOM 211 CA ARG A 15 -11.627 -1.487 -3.431 1.00 0.00 C ATOM 212 C ARG A 15 -11.053 -2.563 -2.528 1.00 0.00 C ATOM 213 O ARG A 15 -9.875 -2.910 -2.609 1.00 0.00 O ATOM 214 CB ARG A 15 -11.197 -1.760 -4.867 1.00 0.00 C ATOM 215 CG ARG A 15 -11.593 -0.668 -5.846 1.00 0.00 C ATOM 216 CD ARG A 15 -11.572 -1.173 -7.279 1.00 0.00 C ATOM 217 NE ARG A 15 -12.299 -2.433 -7.427 1.00 0.00 N ATOM 218 CZ ARG A 15 -13.623 -2.515 -7.553 1.00 0.00 C ATOM 219 NH1 ARG A 15 -14.367 -1.417 -7.546 1.00 0.00 N ATOM 220 NH2 ARG A 15 -14.202 -3.701 -7.685 1.00 0.00 N ATOM 0 H ARG A 15 -10.203 0.010 -3.116 1.00 0.00 H new ATOM 0 HA ARG A 15 -12.715 -1.510 -3.374 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -10.114 -1.884 -4.894 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -11.634 -2.703 -5.194 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -12.591 -0.303 -5.602 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -10.911 0.177 -5.746 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -12.012 -0.422 -7.935 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -10.539 -1.311 -7.600 1.00 0.00 H new ATOM 0 HE ARG A 15 -11.761 -3.300 -7.434 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -13.926 -0.503 -7.444 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -15.380 -1.487 -7.643 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -13.634 -4.548 -7.690 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -15.215 -3.766 -7.782 1.00 0.00 H new ATOM 234 N ARG A 16 -11.906 -3.084 -1.677 1.00 0.00 N ATOM 235 CA ARG A 16 -11.525 -4.137 -0.740 1.00 0.00 C ATOM 236 C ARG A 16 -11.513 -5.506 -1.419 1.00 0.00 C ATOM 237 O ARG A 16 -11.131 -6.505 -0.810 1.00 0.00 O ATOM 238 CB ARG A 16 -12.483 -4.160 0.453 1.00 0.00 C ATOM 239 CG ARG A 16 -11.829 -4.603 1.750 1.00 0.00 C ATOM 240 CD ARG A 16 -12.325 -3.785 2.933 1.00 0.00 C ATOM 241 NE ARG A 16 -11.857 -4.326 4.207 1.00 0.00 N ATOM 242 CZ ARG A 16 -12.354 -5.423 4.774 1.00 0.00 C ATOM 243 NH1 ARG A 16 -13.331 -6.099 4.182 1.00 0.00 N ATOM 244 NH2 ARG A 16 -11.871 -5.846 5.934 1.00 0.00 N ATOM 0 H ARG A 16 -12.882 -2.797 -1.608 1.00 0.00 H new ATOM 0 HA ARG A 16 -10.516 -3.919 -0.388 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -12.903 -3.164 0.590 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -13.314 -4.829 0.228 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -12.039 -5.659 1.923 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -10.747 -4.503 1.666 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -11.985 -2.755 2.830 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -13.415 -3.763 2.927 1.00 0.00 H new ATOM 0 HE ARG A 16 -11.105 -3.834 4.690 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -13.704 -5.778 3.289 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -13.708 -6.939 4.621 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -11.119 -5.331 6.392 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -12.252 -6.687 6.369 1.00 0.00 H new ATOM 258 N GLY A 17 -11.937 -5.548 -2.679 1.00 0.00 N ATOM 259 CA GLY A 17 -11.968 -6.800 -3.411 1.00 0.00 C ATOM 260 C GLY A 17 -13.313 -7.054 -4.061 1.00 0.00 C ATOM 261 O GLY A 17 -13.841 -6.192 -4.764 1.00 0.00 O ATOM 0 H GLY A 17 -12.260 -4.736 -3.206 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -11.193 -6.789 -4.177 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -11.734 -7.621 -2.733 1.00 0.00 H new ATOM 265 N ASP A 18 -13.869 -8.241 -3.829 1.00 0.00 N ATOM 266 CA ASP A 18 -15.158 -8.615 -4.395 1.00 0.00 C ATOM 267 C ASP A 18 -16.175 -7.485 -4.254 1.00 0.00 C ATOM 268 O ASP A 18 -17.061 -7.324 -5.094 1.00 0.00 O ATOM 269 CB ASP A 18 -15.687 -9.879 -3.714 1.00 0.00 C ATOM 270 CG ASP A 18 -15.236 -11.145 -4.415 1.00 0.00 C ATOM 271 OD1 ASP A 18 -14.882 -11.067 -5.611 1.00 0.00 O ATOM 272 OD2 ASP A 18 -15.235 -12.214 -3.769 1.00 0.00 O ATOM 0 H ASP A 18 -13.442 -8.963 -3.249 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.012 -8.811 -5.457 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -15.347 -9.900 -2.678 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -16.776 -9.848 -3.692 1.00 0.00 H new ATOM 277 N GLY A 19 -16.037 -6.704 -3.188 1.00 0.00 N ATOM 278 CA GLY A 19 -16.946 -5.598 -2.954 1.00 0.00 C ATOM 279 C GLY A 19 -16.218 -4.324 -2.571 1.00 0.00 C ATOM 280 O GLY A 19 -15.027 -4.352 -2.262 1.00 0.00 O ATOM 0 H GLY A 19 -15.311 -6.818 -2.481 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -17.536 -5.420 -3.853 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.645 -5.867 -2.162 1.00 0.00 H new ATOM 284 N GLU A 20 -16.933 -3.205 -2.592 1.00 0.00 N ATOM 285 CA GLU A 20 -16.345 -1.916 -2.245 1.00 0.00 C ATOM 286 C GLU A 20 -16.698 -1.524 -0.813 1.00 0.00 C ATOM 287 O GLU A 20 -17.691 -1.992 -0.258 1.00 0.00 O ATOM 288 CB GLU A 20 -16.824 -0.835 -3.215 1.00 0.00 C ATOM 289 CG GLU A 20 -15.985 -0.736 -4.478 1.00 0.00 C ATOM 290 CD GLU A 20 -16.000 -2.017 -5.289 1.00 0.00 C ATOM 291 OE1 GLU A 20 -15.209 -2.930 -4.971 1.00 0.00 O ATOM 292 OE2 GLU A 20 -16.803 -2.107 -6.242 1.00 0.00 O ATOM 0 H GLU A 20 -17.920 -3.164 -2.845 1.00 0.00 H new ATOM 0 HA GLU A 20 -15.261 -2.007 -2.321 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -17.859 -1.039 -3.491 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -16.814 0.129 -2.706 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -16.356 0.084 -5.093 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -14.957 -0.492 -4.209 1.00 0.00 H new ATOM 299 N VAL A 21 -15.877 -0.662 -0.223 1.00 0.00 N ATOM 300 CA VAL A 21 -16.103 -0.205 1.142 1.00 0.00 C ATOM 301 C VAL A 21 -15.954 1.308 1.246 1.00 0.00 C ATOM 302 O VAL A 21 -15.389 1.949 0.358 1.00 0.00 O ATOM 303 CB VAL A 21 -15.130 -0.875 2.130 1.00 0.00 C ATOM 304 CG1 VAL A 21 -15.375 -2.375 2.187 1.00 0.00 C ATOM 305 CG2 VAL A 21 -13.690 -0.576 1.746 1.00 0.00 C ATOM 0 H VAL A 21 -15.049 -0.266 -0.669 1.00 0.00 H new ATOM 0 HA VAL A 21 -17.123 -0.487 1.404 1.00 0.00 H new ATOM 0 HB VAL A 21 -15.309 -0.464 3.123 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -14.678 -2.831 2.890 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -16.397 -2.565 2.515 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -15.226 -2.806 1.197 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -13.017 -1.057 2.455 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -13.494 -0.957 0.744 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -13.525 0.501 1.763 1.00 0.00 H new ATOM 315 N GLU A 22 -16.466 1.874 2.333 1.00 0.00 N ATOM 316 CA GLU A 22 -16.393 3.314 2.550 1.00 0.00 C ATOM 317 C GLU A 22 -15.003 3.731 3.020 1.00 0.00 C ATOM 318 O GLU A 22 -14.376 3.044 3.827 1.00 0.00 O ATOM 319 CB GLU A 22 -17.440 3.746 3.577 1.00 0.00 C ATOM 320 CG GLU A 22 -18.845 3.260 3.257 1.00 0.00 C ATOM 321 CD GLU A 22 -19.309 2.160 4.190 1.00 0.00 C ATOM 322 OE1 GLU A 22 -18.445 1.509 4.816 1.00 0.00 O ATOM 323 OE2 GLU A 22 -20.535 1.948 4.296 1.00 0.00 O ATOM 0 H GLU A 22 -16.936 1.358 3.077 1.00 0.00 H new ATOM 0 HA GLU A 22 -16.595 3.808 1.599 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -17.150 3.371 4.559 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -17.447 4.834 3.641 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -19.538 4.099 3.318 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -18.874 2.896 2.230 1.00 0.00 H new ATOM 330 N VAL A 23 -14.530 4.865 2.512 1.00 0.00 N ATOM 331 CA VAL A 23 -13.215 5.384 2.879 1.00 0.00 C ATOM 332 C VAL A 23 -13.090 5.550 4.394 1.00 0.00 C ATOM 333 O VAL A 23 -11.993 5.480 4.948 1.00 0.00 O ATOM 334 CB VAL A 23 -12.940 6.741 2.197 1.00 0.00 C ATOM 335 CG1 VAL A 23 -11.636 7.345 2.696 1.00 0.00 C ATOM 336 CG2 VAL A 23 -12.916 6.581 0.685 1.00 0.00 C ATOM 0 H VAL A 23 -15.038 5.444 1.843 1.00 0.00 H new ATOM 0 HA VAL A 23 -12.479 4.657 2.537 1.00 0.00 H new ATOM 0 HB VAL A 23 -13.748 7.424 2.458 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -11.465 8.301 2.201 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -11.696 7.500 3.773 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -10.812 6.667 2.472 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -12.721 7.547 0.220 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -12.130 5.879 0.406 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -13.879 6.202 0.344 1.00 0.00 H new ATOM 346 N LYS A 24 -14.220 5.775 5.054 1.00 0.00 N ATOM 347 CA LYS A 24 -14.245 5.958 6.504 1.00 0.00 C ATOM 348 C LYS A 24 -13.514 4.822 7.218 1.00 0.00 C ATOM 349 O LYS A 24 -12.990 5.005 8.317 1.00 0.00 O ATOM 350 CB LYS A 24 -15.688 6.042 7.003 1.00 0.00 C ATOM 351 CG LYS A 24 -16.493 4.777 6.756 1.00 0.00 C ATOM 352 CD LYS A 24 -17.488 4.523 7.877 1.00 0.00 C ATOM 353 CE LYS A 24 -18.490 5.658 8.000 1.00 0.00 C ATOM 354 NZ LYS A 24 -19.691 5.257 8.783 1.00 0.00 N ATOM 0 H LYS A 24 -15.135 5.836 4.608 1.00 0.00 H new ATOM 0 HA LYS A 24 -13.731 6.892 6.732 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -15.682 6.256 8.072 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -16.185 6.880 6.513 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -17.025 4.862 5.808 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -15.818 3.926 6.668 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -18.017 3.588 7.691 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -16.953 4.405 8.819 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -18.013 6.513 8.480 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -18.797 5.981 7.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -20.350 6.059 8.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -20.161 4.458 8.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -19.402 4.973 9.741 1.00 0.00 H new ATOM 368 N SER A 25 -13.483 3.651 6.590 1.00 0.00 N ATOM 369 CA SER A 25 -12.816 2.490 7.172 1.00 0.00 C ATOM 370 C SER A 25 -11.326 2.754 7.391 1.00 0.00 C ATOM 371 O SER A 25 -10.667 2.036 8.141 1.00 0.00 O ATOM 372 CB SER A 25 -12.999 1.269 6.268 1.00 0.00 C ATOM 373 OG SER A 25 -12.393 0.119 6.834 1.00 0.00 O ATOM 0 H SER A 25 -13.911 3.480 5.680 1.00 0.00 H new ATOM 0 HA SER A 25 -13.273 2.295 8.142 1.00 0.00 H new ATOM 0 HB2 SER A 25 -14.062 1.084 6.112 1.00 0.00 H new ATOM 0 HB3 SER A 25 -12.563 1.469 5.289 1.00 0.00 H new ATOM 0 HG SER A 25 -11.722 0.394 7.493 1.00 0.00 H new ATOM 379 N LEU A 26 -10.800 3.789 6.739 1.00 0.00 N ATOM 380 CA LEU A 26 -9.391 4.143 6.874 1.00 0.00 C ATOM 381 C LEU A 26 -9.249 5.500 7.559 1.00 0.00 C ATOM 382 O LEU A 26 -8.532 6.381 7.083 1.00 0.00 O ATOM 383 CB LEU A 26 -8.703 4.174 5.502 1.00 0.00 C ATOM 384 CG LEU A 26 -9.209 3.155 4.474 1.00 0.00 C ATOM 385 CD1 LEU A 26 -8.212 3.014 3.333 1.00 0.00 C ATOM 386 CD2 LEU A 26 -9.464 1.801 5.126 1.00 0.00 C ATOM 0 H LEU A 26 -11.329 4.396 6.113 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.907 3.383 7.487 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -8.819 5.173 5.082 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -7.635 4.012 5.649 1.00 0.00 H new ATOM 0 HG LEU A 26 -10.154 3.520 4.072 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -8.585 2.287 2.611 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -8.082 3.979 2.842 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -7.254 2.675 3.727 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -9.822 1.097 4.375 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -8.538 1.427 5.562 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -10.215 1.910 5.909 1.00 0.00 H new ATOM 398 N ALA A 27 -9.949 5.660 8.677 1.00 0.00 N ATOM 399 CA ALA A 27 -9.928 6.886 9.433 1.00 0.00 C ATOM 400 C ALA A 27 -9.228 6.692 10.762 1.00 0.00 C ATOM 401 O ALA A 27 -9.836 6.333 11.771 1.00 0.00 O ATOM 402 CB ALA A 27 -11.332 7.361 9.656 1.00 0.00 C ATOM 0 H ALA A 27 -10.545 4.936 9.077 1.00 0.00 H new ATOM 0 HA ALA A 27 -9.375 7.635 8.866 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -11.316 8.289 10.228 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -11.814 7.536 8.694 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -11.889 6.604 10.208 1.00 0.00 H new ATOM 408 N GLY A 28 -7.949 6.940 10.732 1.00 0.00 N ATOM 409 CA GLY A 28 -7.116 6.811 11.915 1.00 0.00 C ATOM 410 C GLY A 28 -6.376 5.489 11.974 1.00 0.00 C ATOM 411 O GLY A 28 -6.429 4.781 12.980 1.00 0.00 O ATOM 0 H GLY A 28 -7.447 7.237 9.895 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -6.394 7.627 11.935 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.738 6.913 12.804 1.00 0.00 H new ATOM 415 N LYS A 29 -5.677 5.163 10.893 1.00 0.00 N ATOM 416 CA LYS A 29 -4.913 3.928 10.813 1.00 0.00 C ATOM 417 C LYS A 29 -3.732 4.091 9.859 1.00 0.00 C ATOM 418 O LYS A 29 -3.782 4.902 8.934 1.00 0.00 O ATOM 419 CB LYS A 29 -5.818 2.784 10.355 1.00 0.00 C ATOM 420 CG LYS A 29 -6.139 2.802 8.867 1.00 0.00 C ATOM 421 CD LYS A 29 -6.845 1.527 8.435 1.00 0.00 C ATOM 422 CE LYS A 29 -8.164 1.344 9.169 1.00 0.00 C ATOM 423 NZ LYS A 29 -7.993 0.590 10.441 1.00 0.00 N ATOM 0 H LYS A 29 -5.625 5.743 10.055 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.522 3.692 11.803 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -5.340 1.836 10.601 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -6.751 2.826 10.917 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.768 3.663 8.640 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.218 2.921 8.296 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -7.026 1.557 7.361 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -6.199 0.670 8.626 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -8.599 2.320 9.382 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -8.867 0.815 8.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -8.537 -0.295 10.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -6.986 0.371 10.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -8.336 1.167 11.235 1.00 0.00 H new ATOM 437 N LEU A 30 -2.675 3.317 10.080 1.00 0.00 N ATOM 438 CA LEU A 30 -1.498 3.390 9.224 1.00 0.00 C ATOM 439 C LEU A 30 -1.778 2.719 7.886 1.00 0.00 C ATOM 440 O LEU A 30 -1.725 1.494 7.769 1.00 0.00 O ATOM 441 CB LEU A 30 -0.293 2.732 9.902 1.00 0.00 C ATOM 442 CG LEU A 30 1.053 3.001 9.225 1.00 0.00 C ATOM 443 CD1 LEU A 30 1.519 4.421 9.507 1.00 0.00 C ATOM 444 CD2 LEU A 30 2.094 1.994 9.692 1.00 0.00 C ATOM 0 H LEU A 30 -2.609 2.638 10.838 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.264 4.441 9.051 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.240 3.080 10.934 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.457 1.655 9.937 1.00 0.00 H new ATOM 0 HG LEU A 30 0.925 2.890 8.148 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.478 4.593 9.017 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.783 5.128 9.124 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.631 4.561 10.582 1.00 0.00 H new ATOM 0 HD21 LEU A 30 3.045 2.200 9.201 1.00 0.00 H new ATOM 0 HD22 LEU A 30 2.219 2.074 10.772 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.765 0.986 9.438 1.00 0.00 H new ATOM 456 N VAL A 31 -2.088 3.529 6.880 1.00 0.00 N ATOM 457 CA VAL A 31 -2.391 3.012 5.553 1.00 0.00 C ATOM 458 C VAL A 31 -1.122 2.810 4.735 1.00 0.00 C ATOM 459 O VAL A 31 -0.407 3.763 4.429 1.00 0.00 O ATOM 460 CB VAL A 31 -3.343 3.949 4.784 1.00 0.00 C ATOM 461 CG1 VAL A 31 -3.869 3.265 3.533 1.00 0.00 C ATOM 462 CG2 VAL A 31 -4.490 4.397 5.677 1.00 0.00 C ATOM 0 H VAL A 31 -2.136 4.545 6.959 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.882 2.050 5.697 1.00 0.00 H new ATOM 0 HB VAL A 31 -2.784 4.834 4.479 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.539 3.942 3.003 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.034 3.000 2.885 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.412 2.362 3.813 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.151 5.058 5.116 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.050 3.525 6.015 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -4.092 4.930 6.541 1.00 0.00 H new ATOM 472 N PHE A 32 -0.855 1.558 4.381 1.00 0.00 N ATOM 473 CA PHE A 32 0.325 1.218 3.593 1.00 0.00 C ATOM 474 C PHE A 32 0.033 1.370 2.102 1.00 0.00 C ATOM 475 O PHE A 32 -1.127 1.396 1.690 1.00 0.00 O ATOM 476 CB PHE A 32 0.774 -0.212 3.904 1.00 0.00 C ATOM 477 CG PHE A 32 1.680 -0.317 5.097 1.00 0.00 C ATOM 478 CD1 PHE A 32 2.884 0.367 5.134 1.00 0.00 C ATOM 479 CD2 PHE A 32 1.327 -1.104 6.181 1.00 0.00 C ATOM 480 CE1 PHE A 32 3.720 0.269 6.230 1.00 0.00 C ATOM 481 CE2 PHE A 32 2.157 -1.205 7.280 1.00 0.00 C ATOM 482 CZ PHE A 32 3.355 -0.519 7.305 1.00 0.00 C ATOM 0 H PHE A 32 -1.441 0.760 4.627 1.00 0.00 H new ATOM 0 HA PHE A 32 1.130 1.903 3.859 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -0.107 -0.831 4.073 1.00 0.00 H new ATOM 0 HB3 PHE A 32 1.287 -0.619 3.033 1.00 0.00 H new ATOM 0 HD1 PHE A 32 3.173 0.984 4.296 1.00 0.00 H new ATOM 0 HD2 PHE A 32 0.392 -1.645 6.166 1.00 0.00 H new ATOM 0 HE1 PHE A 32 4.656 0.807 6.246 1.00 0.00 H new ATOM 0 HE2 PHE A 32 1.869 -1.820 8.120 1.00 0.00 H new ATOM 0 HZ PHE A 32 4.006 -0.598 8.163 1.00 0.00 H new ATOM 492 N PHE A 33 1.086 1.475 1.295 1.00 0.00 N ATOM 493 CA PHE A 33 0.926 1.631 -0.145 1.00 0.00 C ATOM 494 C PHE A 33 1.931 0.770 -0.906 1.00 0.00 C ATOM 495 O PHE A 33 3.123 1.078 -0.953 1.00 0.00 O ATOM 496 CB PHE A 33 1.088 3.101 -0.542 1.00 0.00 C ATOM 497 CG PHE A 33 -0.029 3.980 -0.052 1.00 0.00 C ATOM 498 CD1 PHE A 33 -0.179 4.242 1.301 1.00 0.00 C ATOM 499 CD2 PHE A 33 -0.928 4.542 -0.944 1.00 0.00 C ATOM 500 CE1 PHE A 33 -1.206 5.050 1.754 1.00 0.00 C ATOM 501 CE2 PHE A 33 -1.956 5.350 -0.496 1.00 0.00 C ATOM 502 CZ PHE A 33 -2.095 5.604 0.854 1.00 0.00 C ATOM 0 H PHE A 33 2.055 1.455 1.614 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.078 1.299 -0.410 1.00 0.00 H new ATOM 0 HB2 PHE A 33 2.033 3.474 -0.147 1.00 0.00 H new ATOM 0 HB3 PHE A 33 1.146 3.172 -1.628 1.00 0.00 H new ATOM 0 HD1 PHE A 33 0.513 3.811 2.009 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -0.824 4.347 -2.001 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -1.313 5.248 2.810 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -2.650 5.782 -1.201 1.00 0.00 H new ATOM 0 HZ PHE A 33 -2.898 6.235 1.206 1.00 0.00 H new ATOM 512 N TYR A 34 1.433 -0.306 -1.499 1.00 0.00 N ATOM 513 CA TYR A 34 2.267 -1.226 -2.267 1.00 0.00 C ATOM 514 C TYR A 34 2.235 -0.876 -3.755 1.00 0.00 C ATOM 515 O TYR A 34 1.220 -1.066 -4.424 1.00 0.00 O ATOM 516 CB TYR A 34 1.788 -2.667 -2.050 1.00 0.00 C ATOM 517 CG TYR A 34 2.467 -3.695 -2.933 1.00 0.00 C ATOM 518 CD1 TYR A 34 3.715 -3.454 -3.492 1.00 0.00 C ATOM 519 CD2 TYR A 34 1.853 -4.913 -3.204 1.00 0.00 C ATOM 520 CE1 TYR A 34 4.332 -4.393 -4.296 1.00 0.00 C ATOM 521 CE2 TYR A 34 2.464 -5.858 -4.006 1.00 0.00 C ATOM 522 CZ TYR A 34 3.703 -5.593 -4.550 1.00 0.00 C ATOM 523 OH TYR A 34 4.315 -6.531 -5.349 1.00 0.00 O ATOM 0 H TYR A 34 0.447 -0.566 -1.463 1.00 0.00 H new ATOM 0 HA TYR A 34 3.296 -1.135 -1.919 1.00 0.00 H new ATOM 0 HB2 TYR A 34 1.952 -2.938 -1.007 1.00 0.00 H new ATOM 0 HB3 TYR A 34 0.713 -2.709 -2.225 1.00 0.00 H new ATOM 0 HD1 TYR A 34 4.212 -2.516 -3.295 1.00 0.00 H new ATOM 0 HD2 TYR A 34 0.882 -5.124 -2.780 1.00 0.00 H new ATOM 0 HE1 TYR A 34 5.302 -4.188 -4.723 1.00 0.00 H new ATOM 0 HE2 TYR A 34 1.974 -6.799 -4.206 1.00 0.00 H new ATOM 0 HH TYR A 34 3.739 -7.320 -5.427 1.00 0.00 H new ATOM 533 N PHE A 35 3.353 -0.365 -4.265 1.00 0.00 N ATOM 534 CA PHE A 35 3.451 0.012 -5.674 1.00 0.00 C ATOM 535 C PHE A 35 4.055 -1.119 -6.504 1.00 0.00 C ATOM 536 O PHE A 35 5.148 -1.602 -6.206 1.00 0.00 O ATOM 537 CB PHE A 35 4.294 1.280 -5.827 1.00 0.00 C ATOM 538 CG PHE A 35 3.748 2.458 -5.072 1.00 0.00 C ATOM 539 CD1 PHE A 35 2.676 3.179 -5.572 1.00 0.00 C ATOM 540 CD2 PHE A 35 4.305 2.841 -3.863 1.00 0.00 C ATOM 541 CE1 PHE A 35 2.170 4.264 -4.880 1.00 0.00 C ATOM 542 CE2 PHE A 35 3.804 3.925 -3.167 1.00 0.00 C ATOM 543 CZ PHE A 35 2.734 4.637 -3.676 1.00 0.00 C ATOM 0 H PHE A 35 4.203 -0.202 -3.725 1.00 0.00 H new ATOM 0 HA PHE A 35 2.443 0.207 -6.041 1.00 0.00 H new ATOM 0 HB2 PHE A 35 5.308 1.076 -5.483 1.00 0.00 H new ATOM 0 HB3 PHE A 35 4.362 1.536 -6.884 1.00 0.00 H new ATOM 0 HD1 PHE A 35 2.231 2.891 -6.513 1.00 0.00 H new ATOM 0 HD2 PHE A 35 5.140 2.287 -3.460 1.00 0.00 H new ATOM 0 HE1 PHE A 35 1.335 4.819 -5.281 1.00 0.00 H new ATOM 0 HE2 PHE A 35 4.248 4.215 -2.226 1.00 0.00 H new ATOM 0 HZ PHE A 35 2.340 5.483 -3.133 1.00 0.00 H new ATOM 553 N SER A 36 3.339 -1.538 -7.548 1.00 0.00 N ATOM 554 CA SER A 36 3.815 -2.611 -8.414 1.00 0.00 C ATOM 555 C SER A 36 2.879 -2.801 -9.603 1.00 0.00 C ATOM 556 O SER A 36 1.809 -2.200 -9.662 1.00 0.00 O ATOM 557 CB SER A 36 3.932 -3.917 -7.625 1.00 0.00 C ATOM 558 OG SER A 36 2.655 -4.469 -7.359 1.00 0.00 O ATOM 0 H SER A 36 2.433 -1.152 -7.811 1.00 0.00 H new ATOM 0 HA SER A 36 4.800 -2.334 -8.790 1.00 0.00 H new ATOM 0 HB2 SER A 36 4.531 -4.633 -8.188 1.00 0.00 H new ATOM 0 HB3 SER A 36 4.454 -3.733 -6.686 1.00 0.00 H new ATOM 0 HG SER A 36 2.673 -4.933 -6.496 1.00 0.00 H new ATOM 564 N ALA A 37 3.287 -3.646 -10.544 1.00 0.00 N ATOM 565 CA ALA A 37 2.479 -3.917 -11.726 1.00 0.00 C ATOM 566 C ALA A 37 2.320 -5.417 -11.945 1.00 0.00 C ATOM 567 O ALA A 37 3.014 -6.219 -11.322 1.00 0.00 O ATOM 568 CB ALA A 37 3.100 -3.259 -12.951 1.00 0.00 C ATOM 0 H ALA A 37 4.171 -4.154 -10.511 1.00 0.00 H new ATOM 0 HA ALA A 37 1.487 -3.494 -11.568 1.00 0.00 H new ATOM 0 HB1 ALA A 37 2.487 -3.469 -13.827 1.00 0.00 H new ATOM 0 HB2 ALA A 37 3.155 -2.181 -12.797 1.00 0.00 H new ATOM 0 HB3 ALA A 37 4.104 -3.655 -13.107 1.00 0.00 H new ATOM 574 N SER A 38 1.400 -5.791 -12.829 1.00 0.00 N ATOM 575 CA SER A 38 1.149 -7.197 -13.125 1.00 0.00 C ATOM 576 C SER A 38 2.270 -7.791 -13.974 1.00 0.00 C ATOM 577 O SER A 38 2.538 -8.991 -13.911 1.00 0.00 O ATOM 578 CB SER A 38 -0.190 -7.355 -13.849 1.00 0.00 C ATOM 579 OG SER A 38 -0.382 -6.320 -14.798 1.00 0.00 O ATOM 0 H SER A 38 0.816 -5.139 -13.353 1.00 0.00 H new ATOM 0 HA SER A 38 1.113 -7.737 -12.179 1.00 0.00 H new ATOM 0 HB2 SER A 38 -0.224 -8.323 -14.350 1.00 0.00 H new ATOM 0 HB3 SER A 38 -1.003 -7.343 -13.123 1.00 0.00 H new ATOM 0 HG SER A 38 0.121 -6.526 -15.613 1.00 0.00 H new ATOM 585 N TRP A 39 2.921 -6.947 -14.768 1.00 0.00 N ATOM 586 CA TRP A 39 4.010 -7.395 -15.629 1.00 0.00 C ATOM 587 C TRP A 39 5.355 -7.346 -14.902 1.00 0.00 C ATOM 588 O TRP A 39 6.396 -7.637 -15.492 1.00 0.00 O ATOM 589 CB TRP A 39 4.072 -6.539 -16.896 1.00 0.00 C ATOM 590 CG TRP A 39 4.412 -5.103 -16.629 1.00 0.00 C ATOM 591 CD1 TRP A 39 3.570 -4.134 -16.165 1.00 0.00 C ATOM 592 CD2 TRP A 39 5.686 -4.475 -16.812 1.00 0.00 C ATOM 593 NE1 TRP A 39 4.242 -2.942 -16.047 1.00 0.00 N ATOM 594 CE2 TRP A 39 5.543 -3.125 -16.439 1.00 0.00 C ATOM 595 CE3 TRP A 39 6.934 -4.924 -17.254 1.00 0.00 C ATOM 596 CZ2 TRP A 39 6.601 -2.222 -16.495 1.00 0.00 C ATOM 597 CZ3 TRP A 39 7.982 -4.025 -17.309 1.00 0.00 C ATOM 598 CH2 TRP A 39 7.810 -2.688 -16.931 1.00 0.00 C ATOM 0 H TRP A 39 2.714 -5.950 -14.833 1.00 0.00 H new ATOM 0 HA TRP A 39 3.810 -8.431 -15.903 1.00 0.00 H new ATOM 0 HB2 TRP A 39 4.814 -6.960 -17.574 1.00 0.00 H new ATOM 0 HB3 TRP A 39 3.110 -6.588 -17.406 1.00 0.00 H new ATOM 0 HD1 TRP A 39 2.527 -4.283 -15.926 1.00 0.00 H new ATOM 0 HE1 TRP A 39 3.839 -2.064 -15.721 1.00 0.00 H new ATOM 0 HE3 TRP A 39 7.076 -5.954 -17.547 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 6.471 -1.190 -16.204 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 8.951 -4.360 -17.650 1.00 0.00 H new ATOM 0 HH2 TRP A 39 8.650 -2.011 -16.985 1.00 0.00 H new ATOM 609 N CYS A 40 5.332 -6.976 -13.623 1.00 0.00 N ATOM 610 CA CYS A 40 6.554 -6.891 -12.832 1.00 0.00 C ATOM 611 C CYS A 40 7.319 -8.218 -12.850 1.00 0.00 C ATOM 612 O CYS A 40 6.727 -9.282 -13.036 1.00 0.00 O ATOM 613 CB CYS A 40 6.229 -6.457 -11.397 1.00 0.00 C ATOM 614 SG CYS A 40 5.485 -7.744 -10.335 1.00 0.00 S ATOM 0 H CYS A 40 4.482 -6.731 -13.115 1.00 0.00 H new ATOM 0 HA CYS A 40 7.201 -6.137 -13.280 1.00 0.00 H new ATOM 0 HB2 CYS A 40 7.147 -6.107 -10.925 1.00 0.00 H new ATOM 0 HB3 CYS A 40 5.548 -5.607 -11.439 1.00 0.00 H new ATOM 619 N PRO A 41 8.657 -8.168 -12.683 1.00 0.00 N ATOM 620 CA PRO A 41 9.506 -9.366 -12.709 1.00 0.00 C ATOM 621 C PRO A 41 9.079 -10.436 -11.703 1.00 0.00 C ATOM 622 O PRO A 41 8.920 -11.600 -12.068 1.00 0.00 O ATOM 623 CB PRO A 41 10.905 -8.837 -12.378 1.00 0.00 C ATOM 624 CG PRO A 41 10.861 -7.386 -12.722 1.00 0.00 C ATOM 625 CD PRO A 41 9.444 -6.939 -12.481 1.00 0.00 C ATOM 0 HA PRO A 41 9.445 -9.866 -13.675 1.00 0.00 H new ATOM 0 HB2 PRO A 41 11.144 -8.986 -11.325 1.00 0.00 H new ATOM 0 HB3 PRO A 41 11.670 -9.356 -12.955 1.00 0.00 H new ATOM 0 HG2 PRO A 41 11.558 -6.819 -12.105 1.00 0.00 H new ATOM 0 HG3 PRO A 41 11.149 -7.223 -13.761 1.00 0.00 H new ATOM 0 HD2 PRO A 41 9.314 -6.540 -11.475 1.00 0.00 H new ATOM 0 HD3 PRO A 41 9.147 -6.153 -13.176 1.00 0.00 H new ATOM 633 N PRO A 42 8.875 -10.069 -10.424 1.00 0.00 N ATOM 634 CA PRO A 42 8.457 -11.023 -9.397 1.00 0.00 C ATOM 635 C PRO A 42 6.988 -11.390 -9.556 1.00 0.00 C ATOM 636 O PRO A 42 6.649 -12.505 -9.953 1.00 0.00 O ATOM 637 CB PRO A 42 8.688 -10.275 -8.072 1.00 0.00 C ATOM 638 CG PRO A 42 9.365 -8.990 -8.436 1.00 0.00 C ATOM 639 CD PRO A 42 9.017 -8.717 -9.871 1.00 0.00 C ATOM 0 HA PRO A 42 9.010 -11.961 -9.454 1.00 0.00 H new ATOM 0 HB2 PRO A 42 7.744 -10.087 -7.560 1.00 0.00 H new ATOM 0 HB3 PRO A 42 9.306 -10.864 -7.394 1.00 0.00 H new ATOM 0 HG2 PRO A 42 9.026 -8.177 -7.793 1.00 0.00 H new ATOM 0 HG3 PRO A 42 10.444 -9.070 -8.307 1.00 0.00 H new ATOM 0 HD2 PRO A 42 8.096 -8.142 -9.963 1.00 0.00 H new ATOM 0 HD3 PRO A 42 9.798 -8.151 -10.378 1.00 0.00 H new ATOM 647 N CYS A 43 6.124 -10.423 -9.270 1.00 0.00 N ATOM 648 CA CYS A 43 4.672 -10.608 -9.404 1.00 0.00 C ATOM 649 C CYS A 43 4.229 -11.956 -8.841 1.00 0.00 C ATOM 650 O CYS A 43 3.258 -12.548 -9.312 1.00 0.00 O ATOM 651 CB CYS A 43 4.296 -10.508 -10.881 1.00 0.00 C ATOM 652 SG CYS A 43 4.253 -8.807 -11.551 1.00 0.00 S ATOM 0 H CYS A 43 6.399 -9.497 -8.942 1.00 0.00 H new ATOM 0 HA CYS A 43 4.164 -9.830 -8.834 1.00 0.00 H new ATOM 0 HB2 CYS A 43 5.008 -11.094 -11.463 1.00 0.00 H new ATOM 0 HB3 CYS A 43 3.316 -10.964 -11.023 1.00 0.00 H new ATOM 657 N ARG A 44 4.948 -12.431 -7.832 1.00 0.00 N ATOM 658 CA ARG A 44 4.633 -13.708 -7.200 1.00 0.00 C ATOM 659 C ARG A 44 5.468 -13.911 -5.941 1.00 0.00 C ATOM 660 O ARG A 44 5.861 -15.032 -5.620 1.00 0.00 O ATOM 661 CB ARG A 44 4.876 -14.858 -8.179 1.00 0.00 C ATOM 662 CG ARG A 44 4.209 -16.160 -7.766 1.00 0.00 C ATOM 663 CD ARG A 44 2.711 -16.126 -8.023 1.00 0.00 C ATOM 664 NE ARG A 44 1.955 -15.813 -6.813 1.00 0.00 N ATOM 665 CZ ARG A 44 0.684 -15.416 -6.816 1.00 0.00 C ATOM 666 NH1 ARG A 44 0.026 -15.283 -7.961 1.00 0.00 N ATOM 667 NH2 ARG A 44 0.070 -15.153 -5.670 1.00 0.00 N ATOM 0 H ARG A 44 5.755 -11.951 -7.432 1.00 0.00 H new ATOM 0 HA ARG A 44 3.580 -13.697 -6.918 1.00 0.00 H new ATOM 0 HB2 ARG A 44 4.510 -14.569 -9.164 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.949 -15.023 -8.273 1.00 0.00 H new ATOM 0 HG2 ARG A 44 4.655 -16.989 -8.316 1.00 0.00 H new ATOM 0 HG3 ARG A 44 4.393 -16.344 -6.708 1.00 0.00 H new ATOM 0 HD2 ARG A 44 2.492 -15.383 -8.790 1.00 0.00 H new ATOM 0 HD3 ARG A 44 2.388 -17.091 -8.413 1.00 0.00 H new ATOM 0 HE ARG A 44 2.428 -15.904 -5.914 1.00 0.00 H new ATOM 0 HH11 ARG A 44 0.494 -15.485 -8.845 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -0.948 -14.979 -7.957 1.00 0.00 H new ATOM 0 HH21 ARG A 44 0.571 -15.255 -4.788 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -0.904 -14.849 -5.671 1.00 0.00 H new ATOM 681 N GLY A 45 5.734 -12.820 -5.231 1.00 0.00 N ATOM 682 CA GLY A 45 6.521 -12.900 -4.014 1.00 0.00 C ATOM 683 C GLY A 45 6.066 -11.907 -2.963 1.00 0.00 C ATOM 684 O GLY A 45 5.594 -12.296 -1.895 1.00 0.00 O ATOM 0 H GLY A 45 5.419 -11.882 -5.476 1.00 0.00 H new ATOM 0 HA2 GLY A 45 6.455 -13.910 -3.608 1.00 0.00 H new ATOM 0 HA3 GLY A 45 7.570 -12.719 -4.251 1.00 0.00 H new ATOM 688 N PHE A 46 6.208 -10.621 -3.267 1.00 0.00 N ATOM 689 CA PHE A 46 5.807 -9.569 -2.340 1.00 0.00 C ATOM 690 C PHE A 46 4.287 -9.482 -2.235 1.00 0.00 C ATOM 691 O PHE A 46 3.747 -9.108 -1.195 1.00 0.00 O ATOM 692 CB PHE A 46 6.376 -8.221 -2.789 1.00 0.00 C ATOM 693 CG PHE A 46 6.837 -7.357 -1.652 1.00 0.00 C ATOM 694 CD1 PHE A 46 5.947 -6.942 -0.674 1.00 0.00 C ATOM 695 CD2 PHE A 46 8.162 -6.960 -1.559 1.00 0.00 C ATOM 696 CE1 PHE A 46 6.369 -6.148 0.375 1.00 0.00 C ATOM 697 CE2 PHE A 46 8.589 -6.166 -0.512 1.00 0.00 C ATOM 698 CZ PHE A 46 7.692 -5.759 0.456 1.00 0.00 C ATOM 0 H PHE A 46 6.597 -10.283 -4.147 1.00 0.00 H new ATOM 0 HA PHE A 46 6.206 -9.816 -1.356 1.00 0.00 H new ATOM 0 HB2 PHE A 46 7.213 -8.396 -3.465 1.00 0.00 H new ATOM 0 HB3 PHE A 46 5.615 -7.685 -3.357 1.00 0.00 H new ATOM 0 HD1 PHE A 46 4.911 -7.243 -0.733 1.00 0.00 H new ATOM 0 HD2 PHE A 46 8.868 -7.275 -2.313 1.00 0.00 H new ATOM 0 HE1 PHE A 46 5.665 -5.832 1.131 1.00 0.00 H new ATOM 0 HE2 PHE A 46 9.624 -5.864 -0.451 1.00 0.00 H new ATOM 0 HZ PHE A 46 8.024 -5.138 1.275 1.00 0.00 H new ATOM 708 N THR A 47 3.603 -9.831 -3.320 1.00 0.00 N ATOM 709 CA THR A 47 2.145 -9.793 -3.354 1.00 0.00 C ATOM 710 C THR A 47 1.547 -10.626 -2.220 1.00 0.00 C ATOM 711 O THR A 47 0.829 -10.103 -1.368 1.00 0.00 O ATOM 712 CB THR A 47 1.628 -10.300 -4.704 1.00 0.00 C ATOM 713 OG1 THR A 47 2.705 -10.638 -5.561 1.00 0.00 O ATOM 714 CG2 THR A 47 0.765 -9.292 -5.430 1.00 0.00 C ATOM 0 H THR A 47 4.036 -10.144 -4.189 1.00 0.00 H new ATOM 0 HA THR A 47 1.834 -8.757 -3.220 1.00 0.00 H new ATOM 0 HB THR A 47 1.021 -11.174 -4.470 1.00 0.00 H new ATOM 0 HG1 THR A 47 2.353 -10.961 -6.417 1.00 0.00 H new ATOM 0 HG21 THR A 47 0.432 -9.714 -6.378 1.00 0.00 H new ATOM 0 HG22 THR A 47 -0.103 -9.047 -4.817 1.00 0.00 H new ATOM 0 HG23 THR A 47 1.343 -8.387 -5.619 1.00 0.00 H new ATOM 722 N PRO A 48 1.835 -11.940 -2.195 1.00 0.00 N ATOM 723 CA PRO A 48 1.318 -12.841 -1.159 1.00 0.00 C ATOM 724 C PRO A 48 1.912 -12.562 0.220 1.00 0.00 C ATOM 725 O PRO A 48 1.452 -13.111 1.222 1.00 0.00 O ATOM 726 CB PRO A 48 1.739 -14.229 -1.650 1.00 0.00 C ATOM 727 CG PRO A 48 2.920 -13.983 -2.522 1.00 0.00 C ATOM 728 CD PRO A 48 2.681 -12.649 -3.173 1.00 0.00 C ATOM 0 HA PRO A 48 0.242 -12.725 -1.028 1.00 0.00 H new ATOM 0 HB2 PRO A 48 1.993 -14.883 -0.816 1.00 0.00 H new ATOM 0 HB3 PRO A 48 0.934 -14.714 -2.202 1.00 0.00 H new ATOM 0 HG2 PRO A 48 3.841 -13.974 -1.939 1.00 0.00 H new ATOM 0 HG3 PRO A 48 3.024 -14.769 -3.270 1.00 0.00 H new ATOM 0 HD2 PRO A 48 3.615 -12.118 -3.356 1.00 0.00 H new ATOM 0 HD3 PRO A 48 2.180 -12.755 -4.135 1.00 0.00 H new ATOM 736 N GLN A 49 2.929 -11.706 0.272 1.00 0.00 N ATOM 737 CA GLN A 49 3.566 -11.362 1.537 1.00 0.00 C ATOM 738 C GLN A 49 2.703 -10.374 2.311 1.00 0.00 C ATOM 739 O GLN A 49 2.546 -10.487 3.526 1.00 0.00 O ATOM 740 CB GLN A 49 4.967 -10.787 1.300 1.00 0.00 C ATOM 741 CG GLN A 49 6.081 -11.800 1.513 1.00 0.00 C ATOM 742 CD GLN A 49 5.873 -13.075 0.719 1.00 0.00 C ATOM 743 OE1 GLN A 49 4.799 -13.676 0.757 1.00 0.00 O ATOM 744 NE2 GLN A 49 6.903 -13.495 -0.007 1.00 0.00 N ATOM 0 H GLN A 49 3.327 -11.241 -0.544 1.00 0.00 H new ATOM 0 HA GLN A 49 3.669 -12.271 2.130 1.00 0.00 H new ATOM 0 HB2 GLN A 49 5.026 -10.402 0.282 1.00 0.00 H new ATOM 0 HB3 GLN A 49 5.122 -9.941 1.970 1.00 0.00 H new ATOM 0 HG2 GLN A 49 7.033 -11.352 1.229 1.00 0.00 H new ATOM 0 HG3 GLN A 49 6.147 -12.044 2.573 1.00 0.00 H new ATOM 0 HE21 GLN A 49 7.775 -12.966 -0.009 1.00 0.00 H new ATOM 0 HE22 GLN A 49 6.822 -14.347 -0.562 1.00 0.00 H new ATOM 753 N LEU A 50 2.133 -9.409 1.593 1.00 0.00 N ATOM 754 CA LEU A 50 1.271 -8.407 2.196 1.00 0.00 C ATOM 755 C LEU A 50 0.121 -9.063 2.946 1.00 0.00 C ATOM 756 O LEU A 50 -0.169 -8.728 4.095 1.00 0.00 O ATOM 757 CB LEU A 50 0.702 -7.509 1.100 1.00 0.00 C ATOM 758 CG LEU A 50 0.642 -6.020 1.422 1.00 0.00 C ATOM 759 CD1 LEU A 50 0.171 -5.775 2.852 1.00 0.00 C ATOM 760 CD2 LEU A 50 1.998 -5.380 1.182 1.00 0.00 C ATOM 0 H LEU A 50 2.257 -9.304 0.586 1.00 0.00 H new ATOM 0 HA LEU A 50 1.860 -7.820 2.901 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.302 -7.642 0.200 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -0.306 -7.851 0.864 1.00 0.00 H new ATOM 0 HG LEU A 50 -0.088 -5.558 0.757 1.00 0.00 H new ATOM 0 HD11 LEU A 50 0.140 -4.703 3.046 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.826 -6.196 2.984 1.00 0.00 H new ATOM 0 HD13 LEU A 50 0.861 -6.250 3.549 1.00 0.00 H new ATOM 0 HD21 LEU A 50 1.945 -4.316 1.415 1.00 0.00 H new ATOM 0 HD22 LEU A 50 2.743 -5.855 1.821 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.281 -5.509 0.137 1.00 0.00 H new ATOM 772 N ILE A 51 -0.532 -9.997 2.270 1.00 0.00 N ATOM 773 CA ILE A 51 -1.667 -10.714 2.839 1.00 0.00 C ATOM 774 C ILE A 51 -1.304 -11.388 4.163 1.00 0.00 C ATOM 775 O ILE A 51 -2.065 -11.325 5.127 1.00 0.00 O ATOM 776 CB ILE A 51 -2.204 -11.779 1.860 1.00 0.00 C ATOM 777 CG1 ILE A 51 -2.719 -11.115 0.579 1.00 0.00 C ATOM 778 CG2 ILE A 51 -3.303 -12.602 2.516 1.00 0.00 C ATOM 779 CD1 ILE A 51 -2.116 -11.691 -0.683 1.00 0.00 C ATOM 0 H ILE A 51 -0.294 -10.279 1.319 1.00 0.00 H new ATOM 0 HA ILE A 51 -2.443 -9.971 3.024 1.00 0.00 H new ATOM 0 HB ILE A 51 -1.386 -12.450 1.596 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.803 -11.220 0.535 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -2.504 -10.047 0.621 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -3.669 -13.348 1.811 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -2.905 -13.102 3.399 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -4.123 -11.946 2.809 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.526 -11.174 -1.551 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -1.034 -11.562 -0.661 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.353 -12.753 -0.748 1.00 0.00 H new ATOM 791 N GLU A 52 -0.149 -12.044 4.200 1.00 0.00 N ATOM 792 CA GLU A 52 0.291 -12.737 5.406 1.00 0.00 C ATOM 793 C GLU A 52 0.601 -11.755 6.530 1.00 0.00 C ATOM 794 O GLU A 52 0.104 -11.903 7.646 1.00 0.00 O ATOM 795 CB GLU A 52 1.521 -13.596 5.107 1.00 0.00 C ATOM 796 CG GLU A 52 2.003 -14.403 6.301 1.00 0.00 C ATOM 797 CD GLU A 52 1.358 -15.773 6.376 1.00 0.00 C ATOM 798 OE1 GLU A 52 1.031 -16.336 5.310 1.00 0.00 O ATOM 799 OE2 GLU A 52 1.180 -16.285 7.502 1.00 0.00 O ATOM 0 H GLU A 52 0.497 -12.111 3.413 1.00 0.00 H new ATOM 0 HA GLU A 52 -0.524 -13.381 5.735 1.00 0.00 H new ATOM 0 HB2 GLU A 52 1.288 -14.277 4.289 1.00 0.00 H new ATOM 0 HB3 GLU A 52 2.330 -12.951 4.764 1.00 0.00 H new ATOM 0 HG2 GLU A 52 3.085 -14.518 6.245 1.00 0.00 H new ATOM 0 HG3 GLU A 52 1.788 -13.853 7.217 1.00 0.00 H new ATOM 806 N PHE A 53 1.422 -10.754 6.237 1.00 0.00 N ATOM 807 CA PHE A 53 1.785 -9.757 7.237 1.00 0.00 C ATOM 808 C PHE A 53 0.558 -8.970 7.681 1.00 0.00 C ATOM 809 O PHE A 53 0.480 -8.510 8.820 1.00 0.00 O ATOM 810 CB PHE A 53 2.847 -8.803 6.687 1.00 0.00 C ATOM 811 CG PHE A 53 3.261 -7.742 7.667 1.00 0.00 C ATOM 812 CD1 PHE A 53 3.984 -8.072 8.802 1.00 0.00 C ATOM 813 CD2 PHE A 53 2.922 -6.416 7.456 1.00 0.00 C ATOM 814 CE1 PHE A 53 4.362 -7.098 9.708 1.00 0.00 C ATOM 815 CE2 PHE A 53 3.297 -5.437 8.357 1.00 0.00 C ATOM 816 CZ PHE A 53 4.018 -5.780 9.485 1.00 0.00 C ATOM 0 H PHE A 53 1.847 -10.611 5.321 1.00 0.00 H new ATOM 0 HA PHE A 53 2.197 -10.279 8.100 1.00 0.00 H new ATOM 0 HB2 PHE A 53 3.725 -9.379 6.394 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.463 -8.325 5.786 1.00 0.00 H new ATOM 0 HD1 PHE A 53 4.255 -9.102 8.981 1.00 0.00 H new ATOM 0 HD2 PHE A 53 2.358 -6.143 6.577 1.00 0.00 H new ATOM 0 HE1 PHE A 53 4.926 -7.368 10.589 1.00 0.00 H new ATOM 0 HE2 PHE A 53 3.027 -4.406 8.180 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.312 -5.018 10.191 1.00 0.00 H new ATOM 826 N TYR A 54 -0.397 -8.815 6.770 1.00 0.00 N ATOM 827 CA TYR A 54 -1.620 -8.080 7.061 1.00 0.00 C ATOM 828 C TYR A 54 -2.643 -8.962 7.778 1.00 0.00 C ATOM 829 O TYR A 54 -3.073 -8.652 8.884 1.00 0.00 O ATOM 830 CB TYR A 54 -2.220 -7.526 5.765 1.00 0.00 C ATOM 831 CG TYR A 54 -3.576 -6.878 5.942 1.00 0.00 C ATOM 832 CD1 TYR A 54 -3.863 -6.113 7.065 1.00 0.00 C ATOM 833 CD2 TYR A 54 -4.570 -7.036 4.984 1.00 0.00 C ATOM 834 CE1 TYR A 54 -5.102 -5.524 7.230 1.00 0.00 C ATOM 835 CE2 TYR A 54 -5.812 -6.447 5.141 1.00 0.00 C ATOM 836 CZ TYR A 54 -6.072 -5.693 6.265 1.00 0.00 C ATOM 837 OH TYR A 54 -7.306 -5.107 6.425 1.00 0.00 O ATOM 0 H TYR A 54 -0.346 -9.190 5.823 1.00 0.00 H new ATOM 0 HA TYR A 54 -1.366 -7.253 7.724 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -1.532 -6.794 5.342 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -2.308 -8.337 5.042 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -3.105 -5.976 7.822 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -4.370 -7.628 4.103 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -5.310 -4.934 8.111 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -6.574 -6.577 4.387 1.00 0.00 H new ATOM 0 HH TYR A 54 -7.207 -4.265 6.917 1.00 0.00 H new ATOM 847 N ASP A 55 -3.035 -10.053 7.133 1.00 0.00 N ATOM 848 CA ASP A 55 -4.022 -10.969 7.701 1.00 0.00 C ATOM 849 C ASP A 55 -3.579 -11.524 9.055 1.00 0.00 C ATOM 850 O ASP A 55 -4.412 -11.921 9.871 1.00 0.00 O ATOM 851 CB ASP A 55 -4.287 -12.122 6.733 1.00 0.00 C ATOM 852 CG ASP A 55 -4.974 -11.662 5.462 1.00 0.00 C ATOM 853 OD1 ASP A 55 -4.881 -10.459 5.139 1.00 0.00 O ATOM 854 OD2 ASP A 55 -5.605 -12.505 4.791 1.00 0.00 O ATOM 0 H ASP A 55 -2.686 -10.328 6.215 1.00 0.00 H new ATOM 0 HA ASP A 55 -4.939 -10.401 7.859 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.343 -12.604 6.479 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -4.905 -12.872 7.226 1.00 0.00 H new ATOM 859 N LYS A 56 -2.273 -11.586 9.279 1.00 0.00 N ATOM 860 CA LYS A 56 -1.740 -12.132 10.518 1.00 0.00 C ATOM 861 C LYS A 56 -1.518 -11.069 11.597 1.00 0.00 C ATOM 862 O LYS A 56 -1.250 -11.410 12.750 1.00 0.00 O ATOM 863 CB LYS A 56 -0.422 -12.855 10.246 1.00 0.00 C ATOM 864 CG LYS A 56 -0.551 -14.005 9.259 1.00 0.00 C ATOM 865 CD LYS A 56 -0.578 -15.349 9.967 1.00 0.00 C ATOM 866 CE LYS A 56 -1.982 -15.711 10.423 1.00 0.00 C ATOM 867 NZ LYS A 56 -1.977 -16.405 11.740 1.00 0.00 N ATOM 0 H LYS A 56 -1.565 -11.265 8.619 1.00 0.00 H new ATOM 0 HA LYS A 56 -2.489 -12.828 10.897 1.00 0.00 H new ATOM 0 HB2 LYS A 56 0.304 -12.138 9.863 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -0.026 -13.237 11.187 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -1.463 -13.883 8.674 1.00 0.00 H new ATOM 0 HG3 LYS A 56 0.283 -13.979 8.558 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -0.201 -16.122 9.297 1.00 0.00 H new ATOM 0 HD3 LYS A 56 0.089 -15.321 10.828 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -2.586 -14.806 10.492 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -2.452 -16.352 9.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -2.953 -16.635 12.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -1.422 -17.282 11.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -1.552 -15.784 12.458 1.00 0.00 H new ATOM 881 N PHE A 57 -1.598 -9.792 11.236 1.00 0.00 N ATOM 882 CA PHE A 57 -1.366 -8.731 12.213 1.00 0.00 C ATOM 883 C PHE A 57 -2.364 -7.578 12.086 1.00 0.00 C ATOM 884 O PHE A 57 -2.248 -6.579 12.797 1.00 0.00 O ATOM 885 CB PHE A 57 0.063 -8.202 12.070 1.00 0.00 C ATOM 886 CG PHE A 57 0.973 -8.629 13.186 1.00 0.00 C ATOM 887 CD1 PHE A 57 0.705 -8.262 14.495 1.00 0.00 C ATOM 888 CD2 PHE A 57 2.097 -9.397 12.926 1.00 0.00 C ATOM 889 CE1 PHE A 57 1.539 -8.654 15.524 1.00 0.00 C ATOM 890 CE2 PHE A 57 2.936 -9.791 13.952 1.00 0.00 C ATOM 891 CZ PHE A 57 2.657 -9.419 15.253 1.00 0.00 C ATOM 0 H PHE A 57 -1.817 -9.470 10.293 1.00 0.00 H new ATOM 0 HA PHE A 57 -1.510 -9.167 13.202 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.477 -8.547 11.122 1.00 0.00 H new ATOM 0 HB3 PHE A 57 0.037 -7.113 12.029 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -0.166 -7.662 14.713 1.00 0.00 H new ATOM 0 HD2 PHE A 57 2.320 -9.691 11.911 1.00 0.00 H new ATOM 0 HE1 PHE A 57 1.317 -8.363 16.540 1.00 0.00 H new ATOM 0 HE2 PHE A 57 3.809 -10.389 13.737 1.00 0.00 H new ATOM 0 HZ PHE A 57 3.311 -9.725 16.056 1.00 0.00 H new ATOM 901 N HIS A 58 -3.330 -7.695 11.180 1.00 0.00 N ATOM 902 CA HIS A 58 -4.306 -6.633 10.986 1.00 0.00 C ATOM 903 C HIS A 58 -5.052 -6.315 12.281 1.00 0.00 C ATOM 904 O HIS A 58 -5.182 -5.154 12.662 1.00 0.00 O ATOM 905 CB HIS A 58 -5.305 -6.998 9.884 1.00 0.00 C ATOM 906 CG HIS A 58 -6.285 -8.060 10.279 1.00 0.00 C ATOM 907 ND1 HIS A 58 -7.489 -7.783 10.893 1.00 0.00 N ATOM 908 CD2 HIS A 58 -6.237 -9.406 10.143 1.00 0.00 C ATOM 909 CE1 HIS A 58 -8.137 -8.912 11.120 1.00 0.00 C ATOM 910 NE2 HIS A 58 -7.398 -9.912 10.672 1.00 0.00 N ATOM 0 H HIS A 58 -3.456 -8.507 10.575 1.00 0.00 H new ATOM 0 HA HIS A 58 -3.756 -5.743 10.680 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -5.853 -6.102 9.593 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -4.755 -7.334 9.005 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -5.434 -9.976 9.700 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -9.105 -9.002 11.591 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -7.650 -10.900 10.713 1.00 0.00 H new ATOM 919 N GLU A 59 -5.552 -7.353 12.943 1.00 0.00 N ATOM 920 CA GLU A 59 -6.302 -7.181 14.184 1.00 0.00 C ATOM 921 C GLU A 59 -5.463 -6.505 15.261 1.00 0.00 C ATOM 922 O GLU A 59 -5.893 -5.529 15.877 1.00 0.00 O ATOM 923 CB GLU A 59 -6.775 -8.540 14.697 1.00 0.00 C ATOM 924 CG GLU A 59 -5.686 -9.601 14.741 1.00 0.00 C ATOM 925 CD GLU A 59 -6.244 -11.002 14.885 1.00 0.00 C ATOM 926 OE1 GLU A 59 -6.692 -11.571 13.867 1.00 0.00 O ATOM 927 OE2 GLU A 59 -6.235 -11.532 16.016 1.00 0.00 O ATOM 0 H GLU A 59 -5.452 -8.322 12.642 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.158 -6.542 13.965 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -7.186 -8.415 15.699 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -7.587 -8.894 14.061 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -5.090 -9.543 13.830 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -5.015 -9.394 15.575 1.00 0.00 H new ATOM 934 N SER A 60 -4.273 -7.036 15.487 1.00 0.00 N ATOM 935 CA SER A 60 -3.371 -6.497 16.499 1.00 0.00 C ATOM 936 C SER A 60 -2.863 -5.111 16.111 1.00 0.00 C ATOM 937 O SER A 60 -3.222 -4.111 16.732 1.00 0.00 O ATOM 938 CB SER A 60 -2.190 -7.445 16.712 1.00 0.00 C ATOM 939 OG SER A 60 -2.476 -8.741 16.212 1.00 0.00 O ATOM 0 H SER A 60 -3.905 -7.843 14.983 1.00 0.00 H new ATOM 0 HA SER A 60 -3.931 -6.403 17.429 1.00 0.00 H new ATOM 0 HB2 SER A 60 -1.306 -7.047 16.213 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.956 -7.506 17.775 1.00 0.00 H new ATOM 0 HG SER A 60 -1.704 -9.326 16.359 1.00 0.00 H new ATOM 945 N LYS A 61 -2.016 -5.063 15.088 1.00 0.00 N ATOM 946 CA LYS A 61 -1.446 -3.803 14.623 1.00 0.00 C ATOM 947 C LYS A 61 -2.531 -2.812 14.202 1.00 0.00 C ATOM 948 O LYS A 61 -2.282 -1.609 14.128 1.00 0.00 O ATOM 949 CB LYS A 61 -0.491 -4.055 13.455 1.00 0.00 C ATOM 950 CG LYS A 61 0.610 -5.055 13.773 1.00 0.00 C ATOM 951 CD LYS A 61 1.885 -4.370 14.243 1.00 0.00 C ATOM 952 CE LYS A 61 1.609 -3.386 15.406 1.00 0.00 C ATOM 953 NZ LYS A 61 2.859 -2.730 15.881 1.00 0.00 N ATOM 0 H LYS A 61 -1.709 -5.883 14.565 1.00 0.00 H new ATOM 0 HA LYS A 61 -0.896 -3.364 15.455 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -1.063 -4.417 12.601 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -0.037 -3.110 13.158 1.00 0.00 H new ATOM 0 HG2 LYS A 61 0.263 -5.743 14.544 1.00 0.00 H new ATOM 0 HG3 LYS A 61 0.825 -5.652 12.886 1.00 0.00 H new ATOM 0 HD2 LYS A 61 2.605 -5.122 14.565 1.00 0.00 H new ATOM 0 HD3 LYS A 61 2.338 -3.832 13.410 1.00 0.00 H new ATOM 0 HE2 LYS A 61 0.901 -2.625 15.079 1.00 0.00 H new ATOM 0 HE3 LYS A 61 1.142 -3.921 16.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 2.931 -2.827 16.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 3.681 -3.183 15.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 2.839 -1.721 15.628 1.00 0.00 H new ATOM 967 N ASN A 62 -3.732 -3.315 13.926 1.00 0.00 N ATOM 968 CA ASN A 62 -4.841 -2.460 13.514 1.00 0.00 C ATOM 969 C ASN A 62 -4.413 -1.502 12.405 1.00 0.00 C ATOM 970 O ASN A 62 -4.314 -0.293 12.615 1.00 0.00 O ATOM 971 CB ASN A 62 -5.365 -1.677 14.716 1.00 0.00 C ATOM 972 CG ASN A 62 -6.821 -1.284 14.563 1.00 0.00 C ATOM 973 OD1 ASN A 62 -7.134 -0.178 14.124 1.00 0.00 O ATOM 974 ND2 ASN A 62 -7.720 -2.191 14.927 1.00 0.00 N ATOM 0 H ASN A 62 -3.961 -4.307 13.980 1.00 0.00 H new ATOM 0 HA ASN A 62 -5.637 -3.093 13.122 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -5.247 -2.279 15.617 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -4.762 -0.779 14.852 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -8.715 -1.983 14.848 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -7.415 -3.096 15.286 1.00 0.00 H new ATOM 981 N PHE A 63 -4.153 -2.055 11.223 1.00 0.00 N ATOM 982 CA PHE A 63 -3.729 -1.255 10.079 1.00 0.00 C ATOM 983 C PHE A 63 -4.352 -1.778 8.789 1.00 0.00 C ATOM 984 O PHE A 63 -4.964 -2.845 8.774 1.00 0.00 O ATOM 985 CB PHE A 63 -2.203 -1.251 9.965 1.00 0.00 C ATOM 986 CG PHE A 63 -1.619 -2.579 9.575 1.00 0.00 C ATOM 987 CD1 PHE A 63 -1.793 -3.692 10.380 1.00 0.00 C ATOM 988 CD2 PHE A 63 -0.893 -2.712 8.403 1.00 0.00 C ATOM 989 CE1 PHE A 63 -1.255 -4.914 10.023 1.00 0.00 C ATOM 990 CE2 PHE A 63 -0.352 -3.930 8.040 1.00 0.00 C ATOM 991 CZ PHE A 63 -0.534 -5.033 8.851 1.00 0.00 C ATOM 0 H PHE A 63 -4.229 -3.054 11.033 1.00 0.00 H new ATOM 0 HA PHE A 63 -4.072 -0.232 10.236 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -1.905 -0.504 9.229 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -1.778 -0.944 10.921 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.356 -3.604 11.298 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -0.748 -1.853 7.765 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -1.398 -5.775 10.660 1.00 0.00 H new ATOM 0 HE2 PHE A 63 0.212 -4.020 7.124 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.113 -5.987 8.569 1.00 0.00 H new ATOM 1001 N GLU A 64 -4.192 -1.020 7.708 1.00 0.00 N ATOM 1002 CA GLU A 64 -4.735 -1.405 6.424 1.00 0.00 C ATOM 1003 C GLU A 64 -3.727 -1.132 5.314 1.00 0.00 C ATOM 1004 O GLU A 64 -3.074 -0.090 5.289 1.00 0.00 O ATOM 1005 CB GLU A 64 -6.030 -0.651 6.138 1.00 0.00 C ATOM 1006 CG GLU A 64 -6.940 -1.358 5.147 1.00 0.00 C ATOM 1007 CD GLU A 64 -8.138 -2.007 5.812 1.00 0.00 C ATOM 1008 OE1 GLU A 64 -8.131 -2.134 7.055 1.00 0.00 O ATOM 1009 OE2 GLU A 64 -9.084 -2.386 5.091 1.00 0.00 O ATOM 0 H GLU A 64 -3.688 -0.133 7.704 1.00 0.00 H new ATOM 0 HA GLU A 64 -4.949 -2.473 6.456 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -6.570 -0.505 7.074 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -5.787 0.339 5.752 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -7.287 -0.641 4.403 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -6.369 -2.119 4.614 1.00 0.00 H new ATOM 1016 N VAL A 65 -3.622 -2.076 4.403 1.00 0.00 N ATOM 1017 CA VAL A 65 -2.709 -1.969 3.272 1.00 0.00 C ATOM 1018 C VAL A 65 -3.481 -1.695 1.985 1.00 0.00 C ATOM 1019 O VAL A 65 -4.389 -2.443 1.626 1.00 0.00 O ATOM 1020 CB VAL A 65 -1.876 -3.260 3.104 1.00 0.00 C ATOM 1021 CG1 VAL A 65 -0.973 -3.183 1.874 1.00 0.00 C ATOM 1022 CG2 VAL A 65 -1.060 -3.530 4.359 1.00 0.00 C ATOM 0 H VAL A 65 -4.164 -2.940 4.420 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.033 -1.138 3.473 1.00 0.00 H new ATOM 0 HB VAL A 65 -2.566 -4.090 2.953 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.401 -4.106 1.784 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -1.584 -3.047 0.982 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.289 -2.341 1.977 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.479 -4.442 4.226 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.386 -2.693 4.541 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -1.730 -3.648 5.210 1.00 0.00 H new ATOM 1032 N VAL A 66 -3.120 -0.621 1.293 1.00 0.00 N ATOM 1033 CA VAL A 66 -3.789 -0.264 0.049 1.00 0.00 C ATOM 1034 C VAL A 66 -2.910 -0.600 -1.154 1.00 0.00 C ATOM 1035 O VAL A 66 -1.710 -0.326 -1.148 1.00 0.00 O ATOM 1036 CB VAL A 66 -4.148 1.235 0.009 1.00 0.00 C ATOM 1037 CG1 VAL A 66 -4.949 1.562 -1.243 1.00 0.00 C ATOM 1038 CG2 VAL A 66 -4.914 1.633 1.260 1.00 0.00 C ATOM 0 H VAL A 66 -2.372 0.014 1.570 1.00 0.00 H new ATOM 0 HA VAL A 66 -4.709 -0.846 0.003 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.222 1.810 -0.022 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -5.192 2.624 -1.252 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -4.359 1.317 -2.126 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -5.870 0.979 -1.248 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.159 2.694 1.214 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.833 1.051 1.324 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -4.300 1.440 2.140 1.00 0.00 H new ATOM 1048 N PHE A 67 -3.505 -1.205 -2.182 1.00 0.00 N ATOM 1049 CA PHE A 67 -2.759 -1.580 -3.374 1.00 0.00 C ATOM 1050 C PHE A 67 -2.502 -0.384 -4.281 1.00 0.00 C ATOM 1051 O PHE A 67 -3.342 0.506 -4.416 1.00 0.00 O ATOM 1052 CB PHE A 67 -3.512 -2.654 -4.155 1.00 0.00 C ATOM 1053 CG PHE A 67 -2.609 -3.597 -4.898 1.00 0.00 C ATOM 1054 CD1 PHE A 67 -1.708 -4.397 -4.216 1.00 0.00 C ATOM 1055 CD2 PHE A 67 -2.663 -3.681 -6.281 1.00 0.00 C ATOM 1056 CE1 PHE A 67 -0.876 -5.265 -4.899 1.00 0.00 C ATOM 1057 CE2 PHE A 67 -1.834 -4.546 -6.968 1.00 0.00 C ATOM 1058 CZ PHE A 67 -0.939 -5.339 -6.276 1.00 0.00 C ATOM 0 H PHE A 67 -4.496 -1.443 -2.210 1.00 0.00 H new ATOM 0 HA PHE A 67 -1.797 -1.970 -3.043 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -4.133 -3.226 -3.465 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -4.184 -2.172 -4.865 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -1.654 -4.343 -3.139 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -3.361 -3.063 -6.827 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -0.178 -5.884 -4.356 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -1.885 -4.602 -8.045 1.00 0.00 H new ATOM 0 HZ PHE A 67 -0.290 -6.016 -6.812 1.00 0.00 H new ATOM 1068 N CYS A 68 -1.338 -0.391 -4.917 1.00 0.00 N ATOM 1069 CA CYS A 68 -0.951 0.666 -5.838 1.00 0.00 C ATOM 1070 C CYS A 68 -0.378 0.046 -7.104 1.00 0.00 C ATOM 1071 O CYS A 68 0.744 -0.456 -7.108 1.00 0.00 O ATOM 1072 CB CYS A 68 0.074 1.597 -5.192 1.00 0.00 C ATOM 1073 SG CYS A 68 -0.431 2.241 -3.580 1.00 0.00 S ATOM 0 H CYS A 68 -0.639 -1.126 -4.809 1.00 0.00 H new ATOM 0 HA CYS A 68 -1.831 1.257 -6.090 1.00 0.00 H new ATOM 0 HB2 CYS A 68 1.016 1.061 -5.079 1.00 0.00 H new ATOM 0 HB3 CYS A 68 0.263 2.435 -5.863 1.00 0.00 H new ATOM 0 HG CYS A 68 -1.078 3.357 -3.742 1.00 0.00 H new ATOM 1079 N THR A 69 -1.163 0.055 -8.172 1.00 0.00 N ATOM 1080 CA THR A 69 -0.729 -0.538 -9.429 1.00 0.00 C ATOM 1081 C THR A 69 0.213 0.386 -10.197 1.00 0.00 C ATOM 1082 O THR A 69 0.220 1.600 -10.000 1.00 0.00 O ATOM 1083 CB THR A 69 -1.937 -0.903 -10.299 1.00 0.00 C ATOM 1084 OG1 THR A 69 -1.567 -1.840 -11.295 1.00 0.00 O ATOM 1085 CG2 THR A 69 -2.561 0.283 -11.001 1.00 0.00 C ATOM 0 H THR A 69 -2.097 0.463 -8.194 1.00 0.00 H new ATOM 0 HA THR A 69 -0.178 -1.447 -9.186 1.00 0.00 H new ATOM 0 HB THR A 69 -2.671 -1.319 -9.608 1.00 0.00 H new ATOM 0 HG1 THR A 69 -1.884 -1.530 -12.169 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.409 -0.052 -11.598 1.00 0.00 H new ATOM 0 HG22 THR A 69 -2.902 1.006 -10.260 1.00 0.00 H new ATOM 0 HG23 THR A 69 -1.822 0.751 -11.652 1.00 0.00 H new ATOM 1093 N TRP A 70 0.999 -0.215 -11.078 1.00 0.00 N ATOM 1094 CA TRP A 70 1.953 0.518 -11.902 1.00 0.00 C ATOM 1095 C TRP A 70 2.037 -0.102 -13.296 1.00 0.00 C ATOM 1096 O TRP A 70 3.112 -0.187 -13.890 1.00 0.00 O ATOM 1097 CB TRP A 70 3.334 0.519 -11.241 1.00 0.00 C ATOM 1098 CG TRP A 70 3.698 1.835 -10.624 1.00 0.00 C ATOM 1099 CD1 TRP A 70 3.611 2.173 -9.304 1.00 0.00 C ATOM 1100 CD2 TRP A 70 4.207 2.988 -11.302 1.00 0.00 C ATOM 1101 NE1 TRP A 70 4.036 3.466 -9.120 1.00 0.00 N ATOM 1102 CE2 TRP A 70 4.407 3.988 -10.332 1.00 0.00 C ATOM 1103 CE3 TRP A 70 4.514 3.272 -12.637 1.00 0.00 C ATOM 1104 CZ2 TRP A 70 4.900 5.250 -10.655 1.00 0.00 C ATOM 1105 CZ3 TRP A 70 5.002 4.526 -12.954 1.00 0.00 C ATOM 1106 CH2 TRP A 70 5.191 5.501 -11.968 1.00 0.00 C ATOM 0 H TRP A 70 0.995 -1.222 -11.243 1.00 0.00 H new ATOM 0 HA TRP A 70 1.609 1.548 -11.998 1.00 0.00 H new ATOM 0 HB2 TRP A 70 3.361 -0.254 -10.473 1.00 0.00 H new ATOM 0 HB3 TRP A 70 4.085 0.255 -11.986 1.00 0.00 H new ATOM 0 HD1 TRP A 70 3.259 1.519 -8.519 1.00 0.00 H new ATOM 0 HE1 TRP A 70 4.070 3.958 -8.227 1.00 0.00 H new ATOM 0 HE3 TRP A 70 4.373 2.526 -13.405 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 5.047 6.004 -9.896 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 5.242 4.757 -13.981 1.00 0.00 H new ATOM 0 HH2 TRP A 70 5.574 6.471 -12.249 1.00 0.00 H new ATOM 1117 N ASP A 71 0.889 -0.538 -13.808 1.00 0.00 N ATOM 1118 CA ASP A 71 0.819 -1.158 -15.128 1.00 0.00 C ATOM 1119 C ASP A 71 0.123 -0.239 -16.126 1.00 0.00 C ATOM 1120 O ASP A 71 -0.554 0.714 -15.742 1.00 0.00 O ATOM 1121 CB ASP A 71 0.076 -2.497 -15.053 1.00 0.00 C ATOM 1122 CG ASP A 71 0.263 -3.332 -16.305 1.00 0.00 C ATOM 1123 OD1 ASP A 71 1.146 -2.992 -17.121 1.00 0.00 O ATOM 1124 OD2 ASP A 71 -0.474 -4.328 -16.470 1.00 0.00 O ATOM 0 H ASP A 71 -0.008 -0.473 -13.327 1.00 0.00 H new ATOM 0 HA ASP A 71 1.839 -1.334 -15.469 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.431 -3.058 -14.189 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.987 -2.312 -14.898 1.00 0.00 H new ATOM 1129 N GLU A 72 0.294 -0.537 -17.409 1.00 0.00 N ATOM 1130 CA GLU A 72 -0.319 0.255 -18.468 1.00 0.00 C ATOM 1131 C GLU A 72 -1.520 -0.473 -19.070 1.00 0.00 C ATOM 1132 O GLU A 72 -2.368 0.141 -19.718 1.00 0.00 O ATOM 1133 CB GLU A 72 0.705 0.563 -19.562 1.00 0.00 C ATOM 1134 CG GLU A 72 0.301 1.714 -20.468 1.00 0.00 C ATOM 1135 CD GLU A 72 1.459 2.638 -20.788 1.00 0.00 C ATOM 1136 OE1 GLU A 72 1.805 3.476 -19.930 1.00 0.00 O ATOM 1137 OE2 GLU A 72 2.020 2.524 -21.898 1.00 0.00 O ATOM 0 H GLU A 72 0.853 -1.323 -17.741 1.00 0.00 H new ATOM 0 HA GLU A 72 -0.667 1.191 -18.031 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.662 0.797 -19.096 1.00 0.00 H new ATOM 0 HB3 GLU A 72 0.856 -0.330 -20.169 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -0.108 1.315 -21.396 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -0.494 2.286 -19.990 1.00 0.00 H new ATOM 1144 N GLU A 73 -1.587 -1.785 -18.853 1.00 0.00 N ATOM 1145 CA GLU A 73 -2.683 -2.591 -19.375 1.00 0.00 C ATOM 1146 C GLU A 73 -3.648 -2.987 -18.262 1.00 0.00 C ATOM 1147 O GLU A 73 -3.276 -3.696 -17.327 1.00 0.00 O ATOM 1148 CB GLU A 73 -2.139 -3.843 -20.065 1.00 0.00 C ATOM 1149 CG GLU A 73 -3.142 -4.514 -20.991 1.00 0.00 C ATOM 1150 CD GLU A 73 -2.794 -5.961 -21.278 1.00 0.00 C ATOM 1151 OE1 GLU A 73 -1.612 -6.331 -21.116 1.00 0.00 O ATOM 1152 OE2 GLU A 73 -3.703 -6.725 -21.665 1.00 0.00 O ATOM 0 H GLU A 73 -0.894 -2.310 -18.319 1.00 0.00 H new ATOM 0 HA GLU A 73 -3.227 -1.990 -20.104 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -1.251 -3.575 -20.638 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -1.824 -4.558 -19.305 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -4.134 -4.465 -20.542 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -3.189 -3.963 -21.930 1.00 0.00 H new ATOM 1159 N GLU A 74 -4.889 -2.522 -18.369 1.00 0.00 N ATOM 1160 CA GLU A 74 -5.913 -2.823 -17.370 1.00 0.00 C ATOM 1161 C GLU A 74 -6.028 -4.325 -17.131 1.00 0.00 C ATOM 1162 O GLU A 74 -6.115 -4.779 -15.990 1.00 0.00 O ATOM 1163 CB GLU A 74 -7.276 -2.270 -17.804 1.00 0.00 C ATOM 1164 CG GLU A 74 -7.546 -2.364 -19.299 1.00 0.00 C ATOM 1165 CD GLU A 74 -8.997 -2.678 -19.607 1.00 0.00 C ATOM 1166 OE1 GLU A 74 -9.872 -2.285 -18.807 1.00 0.00 O ATOM 1167 OE2 GLU A 74 -9.258 -3.318 -20.648 1.00 0.00 O ATOM 0 H GLU A 74 -5.212 -1.934 -19.138 1.00 0.00 H new ATOM 0 HA GLU A 74 -5.610 -2.342 -16.440 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.059 -2.809 -17.271 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -7.344 -1.226 -17.500 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -7.272 -1.422 -19.775 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -6.910 -3.136 -19.732 1.00 0.00 H new ATOM 1174 N ASP A 75 -6.034 -5.089 -18.216 1.00 0.00 N ATOM 1175 CA ASP A 75 -6.145 -6.541 -18.135 1.00 0.00 C ATOM 1176 C ASP A 75 -5.053 -7.136 -17.248 1.00 0.00 C ATOM 1177 O ASP A 75 -5.214 -8.226 -16.700 1.00 0.00 O ATOM 1178 CB ASP A 75 -6.064 -7.153 -19.535 1.00 0.00 C ATOM 1179 CG ASP A 75 -7.403 -7.147 -20.247 1.00 0.00 C ATOM 1180 OD1 ASP A 75 -8.435 -7.342 -19.571 1.00 0.00 O ATOM 1181 OD2 ASP A 75 -7.419 -6.947 -21.479 1.00 0.00 O ATOM 0 H ASP A 75 -5.963 -4.726 -19.167 1.00 0.00 H new ATOM 0 HA ASP A 75 -7.111 -6.777 -17.689 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -5.337 -6.599 -20.129 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -5.700 -8.178 -19.460 1.00 0.00 H new ATOM 1186 N GLY A 76 -3.941 -6.419 -17.115 1.00 0.00 N ATOM 1187 CA GLY A 76 -2.842 -6.903 -16.299 1.00 0.00 C ATOM 1188 C GLY A 76 -3.094 -6.753 -14.809 1.00 0.00 C ATOM 1189 O GLY A 76 -3.026 -7.729 -14.063 1.00 0.00 O ATOM 0 H GLY A 76 -3.782 -5.514 -17.557 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -2.664 -7.954 -16.527 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -1.934 -6.361 -16.564 1.00 0.00 H new ATOM 1193 N PHE A 77 -3.369 -5.526 -14.373 1.00 0.00 N ATOM 1194 CA PHE A 77 -3.615 -5.251 -12.959 1.00 0.00 C ATOM 1195 C PHE A 77 -5.036 -5.646 -12.547 1.00 0.00 C ATOM 1196 O PHE A 77 -5.287 -5.955 -11.383 1.00 0.00 O ATOM 1197 CB PHE A 77 -3.358 -3.764 -12.670 1.00 0.00 C ATOM 1198 CG PHE A 77 -4.311 -3.145 -11.680 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -4.117 -3.305 -10.317 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -5.398 -2.406 -12.117 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -4.992 -2.737 -9.409 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -6.275 -1.836 -11.213 1.00 0.00 C ATOM 1203 CZ PHE A 77 -6.072 -2.002 -9.857 1.00 0.00 C ATOM 0 H PHE A 77 -3.427 -4.707 -14.978 1.00 0.00 H new ATOM 0 HA PHE A 77 -2.928 -5.856 -12.367 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -2.341 -3.650 -12.295 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -3.417 -3.210 -13.607 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -3.274 -3.879 -9.961 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -5.562 -2.274 -13.176 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -4.831 -2.868 -8.349 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -7.118 -1.261 -11.567 1.00 0.00 H new ATOM 0 HZ PHE A 77 -6.756 -1.558 -9.149 1.00 0.00 H new ATOM 1213 N ALA A 78 -5.959 -5.621 -13.499 1.00 0.00 N ATOM 1214 CA ALA A 78 -7.353 -5.962 -13.222 1.00 0.00 C ATOM 1215 C ALA A 78 -7.497 -7.393 -12.743 1.00 0.00 C ATOM 1216 O ALA A 78 -8.037 -7.651 -11.667 1.00 0.00 O ATOM 1217 CB ALA A 78 -8.156 -5.798 -14.477 1.00 0.00 C ATOM 0 H ALA A 78 -5.771 -5.369 -14.469 1.00 0.00 H new ATOM 0 HA ALA A 78 -7.710 -5.297 -12.436 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.197 -6.051 -14.278 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.092 -4.765 -14.817 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -7.763 -6.459 -15.249 1.00 0.00 H new ATOM 1223 N GLY A 79 -6.969 -8.321 -13.531 1.00 0.00 N ATOM 1224 CA GLY A 79 -7.008 -9.710 -13.147 1.00 0.00 C ATOM 1225 C GLY A 79 -6.114 -9.921 -11.957 1.00 0.00 C ATOM 1226 O GLY A 79 -6.169 -10.950 -11.284 1.00 0.00 O ATOM 0 H GLY A 79 -6.517 -8.133 -14.426 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.029 -10.004 -12.906 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -6.683 -10.338 -13.977 1.00 0.00 H new ATOM 1230 N TYR A 80 -5.276 -8.917 -11.713 1.00 0.00 N ATOM 1231 CA TYR A 80 -4.332 -8.957 -10.602 1.00 0.00 C ATOM 1232 C TYR A 80 -5.035 -8.750 -9.261 1.00 0.00 C ATOM 1233 O TYR A 80 -4.692 -9.392 -8.268 1.00 0.00 O ATOM 1234 CB TYR A 80 -3.245 -7.897 -10.788 1.00 0.00 C ATOM 1235 CG TYR A 80 -1.913 -8.280 -10.183 1.00 0.00 C ATOM 1236 CD1 TYR A 80 -0.991 -9.029 -10.905 1.00 0.00 C ATOM 1237 CD2 TYR A 80 -1.578 -7.894 -8.892 1.00 0.00 C ATOM 1238 CE1 TYR A 80 0.227 -9.380 -10.355 1.00 0.00 C ATOM 1239 CE2 TYR A 80 -0.362 -8.241 -8.335 1.00 0.00 C ATOM 1240 CZ TYR A 80 0.537 -8.984 -9.072 1.00 0.00 C ATOM 1241 OH TYR A 80 1.749 -9.333 -8.521 1.00 0.00 O ATOM 0 H TYR A 80 -5.232 -8.065 -12.271 1.00 0.00 H new ATOM 0 HA TYR A 80 -3.874 -9.946 -10.595 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -3.110 -7.711 -11.853 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -3.582 -6.962 -10.341 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -1.230 -9.341 -11.911 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -2.280 -7.312 -8.313 1.00 0.00 H new ATOM 0 HE1 TYR A 80 0.933 -9.962 -10.928 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -0.117 -7.933 -7.329 1.00 0.00 H new ATOM 0 HH TYR A 80 2.027 -8.646 -7.880 1.00 0.00 H new ATOM 1251 N PHE A 81 -6.009 -7.846 -9.233 1.00 0.00 N ATOM 1252 CA PHE A 81 -6.744 -7.553 -8.004 1.00 0.00 C ATOM 1253 C PHE A 81 -7.813 -8.609 -7.711 1.00 0.00 C ATOM 1254 O PHE A 81 -8.376 -8.645 -6.617 1.00 0.00 O ATOM 1255 CB PHE A 81 -7.383 -6.158 -8.079 1.00 0.00 C ATOM 1256 CG PHE A 81 -8.616 -6.083 -8.938 1.00 0.00 C ATOM 1257 CD1 PHE A 81 -9.814 -6.635 -8.510 1.00 0.00 C ATOM 1258 CD2 PHE A 81 -8.578 -5.451 -10.170 1.00 0.00 C ATOM 1259 CE1 PHE A 81 -10.948 -6.560 -9.297 1.00 0.00 C ATOM 1260 CE2 PHE A 81 -9.709 -5.374 -10.961 1.00 0.00 C ATOM 1261 CZ PHE A 81 -10.895 -5.929 -10.524 1.00 0.00 C ATOM 0 H PHE A 81 -6.308 -7.304 -10.044 1.00 0.00 H new ATOM 0 HA PHE A 81 -6.026 -7.574 -7.184 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -7.638 -5.834 -7.070 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -6.645 -5.454 -8.463 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.862 -7.129 -7.551 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -7.654 -5.013 -10.517 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -11.875 -6.995 -8.952 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -9.665 -4.880 -11.920 1.00 0.00 H new ATOM 0 HZ PHE A 81 -11.780 -5.870 -11.141 1.00 0.00 H new ATOM 1271 N ALA A 82 -8.103 -9.453 -8.694 1.00 0.00 N ATOM 1272 CA ALA A 82 -9.119 -10.491 -8.536 1.00 0.00 C ATOM 1273 C ALA A 82 -8.982 -11.243 -7.210 1.00 0.00 C ATOM 1274 O ALA A 82 -9.983 -11.576 -6.576 1.00 0.00 O ATOM 1275 CB ALA A 82 -9.052 -11.466 -9.702 1.00 0.00 C ATOM 0 H ALA A 82 -7.651 -9.441 -9.608 1.00 0.00 H new ATOM 0 HA ALA A 82 -10.090 -9.997 -8.526 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -9.813 -12.236 -9.576 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -9.229 -10.930 -10.635 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -8.066 -11.931 -9.732 1.00 0.00 H new ATOM 1281 N LYS A 83 -7.747 -11.533 -6.808 1.00 0.00 N ATOM 1282 CA LYS A 83 -7.501 -12.272 -5.577 1.00 0.00 C ATOM 1283 C LYS A 83 -6.752 -11.440 -4.529 1.00 0.00 C ATOM 1284 O LYS A 83 -5.782 -11.911 -3.934 1.00 0.00 O ATOM 1285 CB LYS A 83 -6.719 -13.543 -5.915 1.00 0.00 C ATOM 1286 CG LYS A 83 -5.223 -13.326 -6.101 1.00 0.00 C ATOM 1287 CD LYS A 83 -4.642 -14.290 -7.123 1.00 0.00 C ATOM 1288 CE LYS A 83 -3.922 -15.447 -6.450 1.00 0.00 C ATOM 1289 NZ LYS A 83 -4.875 -16.407 -5.827 1.00 0.00 N ATOM 0 H LYS A 83 -6.904 -11.267 -7.317 1.00 0.00 H new ATOM 0 HA LYS A 83 -8.464 -12.526 -5.134 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -6.873 -14.273 -5.120 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -7.128 -13.976 -6.828 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -5.040 -12.300 -6.422 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -4.714 -13.457 -5.146 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -5.441 -14.676 -7.756 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -3.949 -13.758 -7.774 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -3.309 -15.969 -7.184 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -3.246 -15.060 -5.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -4.345 -17.181 -5.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -5.443 -15.915 -5.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -5.504 -16.796 -6.558 1.00 0.00 H new ATOM 1303 N MET A 84 -7.200 -10.209 -4.294 1.00 0.00 N ATOM 1304 CA MET A 84 -6.551 -9.349 -3.310 1.00 0.00 C ATOM 1305 C MET A 84 -7.496 -8.978 -2.162 1.00 0.00 C ATOM 1306 O MET A 84 -8.547 -8.375 -2.380 1.00 0.00 O ATOM 1307 CB MET A 84 -6.019 -8.082 -3.981 1.00 0.00 C ATOM 1308 CG MET A 84 -7.102 -7.167 -4.537 1.00 0.00 C ATOM 1309 SD MET A 84 -6.837 -5.434 -4.118 1.00 0.00 S ATOM 1310 CE MET A 84 -5.972 -4.865 -5.579 1.00 0.00 C ATOM 0 H MET A 84 -8.001 -9.789 -4.766 1.00 0.00 H new ATOM 0 HA MET A 84 -5.719 -9.910 -2.885 1.00 0.00 H new ATOM 0 HB2 MET A 84 -5.424 -7.524 -3.258 1.00 0.00 H new ATOM 0 HB3 MET A 84 -5.349 -8.368 -4.792 1.00 0.00 H new ATOM 0 HG2 MET A 84 -7.138 -7.272 -5.621 1.00 0.00 H new ATOM 0 HG3 MET A 84 -8.072 -7.485 -4.153 1.00 0.00 H new ATOM 0 HE1 MET A 84 -5.197 -4.156 -5.290 1.00 0.00 H new ATOM 0 HE2 MET A 84 -5.515 -5.715 -6.086 1.00 0.00 H new ATOM 0 HE3 MET A 84 -6.677 -4.377 -6.252 1.00 0.00 H new ATOM 1320 N PRO A 85 -7.131 -9.330 -0.913 1.00 0.00 N ATOM 1321 CA PRO A 85 -7.946 -9.019 0.262 1.00 0.00 C ATOM 1322 C PRO A 85 -7.753 -7.576 0.718 1.00 0.00 C ATOM 1323 O PRO A 85 -8.689 -6.926 1.183 1.00 0.00 O ATOM 1324 CB PRO A 85 -7.413 -9.988 1.312 1.00 0.00 C ATOM 1325 CG PRO A 85 -5.977 -10.166 0.955 1.00 0.00 C ATOM 1326 CD PRO A 85 -5.894 -10.049 -0.546 1.00 0.00 C ATOM 0 HA PRO A 85 -9.014 -9.120 0.071 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -7.525 -9.585 2.318 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -7.950 -10.936 1.287 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -5.360 -9.409 1.438 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -5.611 -11.137 1.290 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -5.005 -9.499 -0.856 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -5.845 -11.029 -1.021 1.00 0.00 H new ATOM 1334 N TRP A 86 -6.527 -7.082 0.566 1.00 0.00 N ATOM 1335 CA TRP A 86 -6.189 -5.713 0.941 1.00 0.00 C ATOM 1336 C TRP A 86 -7.005 -4.729 0.117 1.00 0.00 C ATOM 1337 O TRP A 86 -7.562 -5.107 -0.915 1.00 0.00 O ATOM 1338 CB TRP A 86 -4.699 -5.472 0.701 1.00 0.00 C ATOM 1339 CG TRP A 86 -4.278 -5.696 -0.714 1.00 0.00 C ATOM 1340 CD1 TRP A 86 -4.668 -4.972 -1.798 1.00 0.00 C ATOM 1341 CD2 TRP A 86 -3.384 -6.704 -1.199 1.00 0.00 C ATOM 1342 NE1 TRP A 86 -4.071 -5.461 -2.931 1.00 0.00 N ATOM 1343 CE2 TRP A 86 -3.279 -6.527 -2.591 1.00 0.00 C ATOM 1344 CE3 TRP A 86 -2.663 -7.736 -0.594 1.00 0.00 C ATOM 1345 CZ2 TRP A 86 -2.480 -7.345 -3.388 1.00 0.00 C ATOM 1346 CZ3 TRP A 86 -1.870 -8.548 -1.386 1.00 0.00 C ATOM 1347 CH2 TRP A 86 -1.785 -8.347 -2.769 1.00 0.00 C ATOM 0 H TRP A 86 -5.746 -7.615 0.183 1.00 0.00 H new ATOM 0 HA TRP A 86 -6.417 -5.566 1.997 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -4.454 -4.449 0.987 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -4.123 -6.131 1.351 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -5.349 -4.134 -1.770 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -4.196 -5.092 -3.874 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -2.723 -7.897 0.472 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -2.412 -7.193 -4.455 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -1.308 -9.349 -0.930 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -1.157 -8.997 -3.360 1.00 0.00 H new ATOM 1358 N LEU A 87 -7.092 -3.469 0.551 1.00 0.00 N ATOM 1359 CA LEU A 87 -7.856 -2.506 -0.200 1.00 0.00 C ATOM 1360 C LEU A 87 -7.021 -1.924 -1.335 1.00 0.00 C ATOM 1361 O LEU A 87 -5.802 -1.831 -1.234 1.00 0.00 O ATOM 1362 CB LEU A 87 -8.367 -1.386 0.709 1.00 0.00 C ATOM 1363 CG LEU A 87 -9.733 -1.637 1.350 1.00 0.00 C ATOM 1364 CD1 LEU A 87 -9.768 -1.078 2.767 1.00 0.00 C ATOM 1365 CD2 LEU A 87 -10.839 -1.021 0.503 1.00 0.00 C ATOM 0 H LEU A 87 -6.651 -3.111 1.398 1.00 0.00 H new ATOM 0 HA LEU A 87 -8.716 -3.020 -0.629 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -7.637 -1.222 1.501 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.420 -0.465 0.129 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.899 -2.713 1.402 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -10.747 -1.265 3.208 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -9.000 -1.564 3.369 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -9.582 -0.004 2.739 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -11.804 -1.209 0.973 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.678 0.054 0.421 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.827 -1.467 -0.492 1.00 0.00 H new ATOM 1377 N ALA A 88 -7.681 -1.568 -2.431 1.00 0.00 N ATOM 1378 CA ALA A 88 -6.989 -1.030 -3.590 1.00 0.00 C ATOM 1379 C ALA A 88 -7.766 0.111 -4.233 1.00 0.00 C ATOM 1380 O ALA A 88 -8.994 0.129 -4.209 1.00 0.00 O ATOM 1381 CB ALA A 88 -6.782 -2.141 -4.594 1.00 0.00 C ATOM 0 H ALA A 88 -8.693 -1.643 -2.539 1.00 0.00 H new ATOM 0 HA ALA A 88 -6.030 -0.628 -3.264 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -6.263 -1.749 -5.469 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -6.184 -2.933 -4.142 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.749 -2.543 -4.896 1.00 0.00 H new ATOM 1387 N VAL A 89 -7.040 1.051 -4.828 1.00 0.00 N ATOM 1388 CA VAL A 89 -7.668 2.182 -5.499 1.00 0.00 C ATOM 1389 C VAL A 89 -8.263 1.742 -6.835 1.00 0.00 C ATOM 1390 O VAL A 89 -7.578 1.124 -7.650 1.00 0.00 O ATOM 1391 CB VAL A 89 -6.666 3.327 -5.749 1.00 0.00 C ATOM 1392 CG1 VAL A 89 -7.355 4.508 -6.426 1.00 0.00 C ATOM 1393 CG2 VAL A 89 -6.012 3.758 -4.446 1.00 0.00 C ATOM 0 H VAL A 89 -6.020 1.052 -4.859 1.00 0.00 H new ATOM 0 HA VAL A 89 -8.456 2.549 -4.842 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.886 2.961 -6.417 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.630 5.305 -6.593 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.770 4.188 -7.382 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -8.158 4.876 -5.787 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -5.308 4.567 -4.642 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -6.778 4.104 -3.752 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -5.481 2.913 -4.009 1.00 0.00 H new ATOM 1403 N PRO A 90 -9.546 2.054 -7.086 1.00 0.00 N ATOM 1404 CA PRO A 90 -10.211 1.682 -8.337 1.00 0.00 C ATOM 1405 C PRO A 90 -9.483 2.239 -9.553 1.00 0.00 C ATOM 1406 O PRO A 90 -8.893 3.318 -9.494 1.00 0.00 O ATOM 1407 CB PRO A 90 -11.609 2.304 -8.213 1.00 0.00 C ATOM 1408 CG PRO A 90 -11.496 3.313 -7.120 1.00 0.00 C ATOM 1409 CD PRO A 90 -10.445 2.792 -6.185 1.00 0.00 C ATOM 0 HA PRO A 90 -10.234 0.602 -8.481 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -11.916 2.771 -9.149 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -12.356 1.547 -7.974 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -11.216 4.289 -7.517 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -12.448 3.439 -6.605 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -9.927 3.600 -5.668 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -10.870 2.145 -5.418 1.00 0.00 H new ATOM 1417 N PHE A 91 -9.526 1.499 -10.658 1.00 0.00 N ATOM 1418 CA PHE A 91 -8.867 1.925 -11.888 1.00 0.00 C ATOM 1419 C PHE A 91 -9.205 3.378 -12.207 1.00 0.00 C ATOM 1420 O PHE A 91 -8.399 4.104 -12.791 1.00 0.00 O ATOM 1421 CB PHE A 91 -9.284 1.025 -13.054 1.00 0.00 C ATOM 1422 CG PHE A 91 -8.245 0.924 -14.134 1.00 0.00 C ATOM 1423 CD1 PHE A 91 -6.959 0.500 -13.840 1.00 0.00 C ATOM 1424 CD2 PHE A 91 -8.556 1.251 -15.445 1.00 0.00 C ATOM 1425 CE1 PHE A 91 -6.002 0.405 -14.832 1.00 0.00 C ATOM 1426 CE2 PHE A 91 -7.603 1.158 -16.441 1.00 0.00 C ATOM 1427 CZ PHE A 91 -6.325 0.735 -16.135 1.00 0.00 C ATOM 0 H PHE A 91 -10.009 0.603 -10.726 1.00 0.00 H new ATOM 0 HA PHE A 91 -7.790 1.842 -11.743 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -9.499 0.027 -12.673 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -10.209 1.408 -13.485 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -6.702 0.241 -12.824 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -9.554 1.582 -15.690 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -5.003 0.073 -14.590 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -7.858 1.416 -17.458 1.00 0.00 H new ATOM 0 HZ PHE A 91 -5.579 0.662 -16.912 1.00 0.00 H new ATOM 1437 N ALA A 92 -10.406 3.792 -11.817 1.00 0.00 N ATOM 1438 CA ALA A 92 -10.865 5.154 -12.056 1.00 0.00 C ATOM 1439 C ALA A 92 -9.889 6.196 -11.504 1.00 0.00 C ATOM 1440 O ALA A 92 -9.700 7.251 -12.109 1.00 0.00 O ATOM 1441 CB ALA A 92 -12.246 5.355 -11.449 1.00 0.00 C ATOM 0 H ALA A 92 -11.081 3.201 -11.332 1.00 0.00 H new ATOM 0 HA ALA A 92 -10.918 5.297 -13.135 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -12.579 6.376 -11.633 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -12.948 4.656 -11.903 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -12.201 5.177 -10.375 1.00 0.00 H new ATOM 1447 N GLN A 93 -9.280 5.911 -10.351 1.00 0.00 N ATOM 1448 CA GLN A 93 -8.343 6.849 -9.742 1.00 0.00 C ATOM 1449 C GLN A 93 -6.921 6.300 -9.732 1.00 0.00 C ATOM 1450 O GLN A 93 -6.099 6.709 -8.911 1.00 0.00 O ATOM 1451 CB GLN A 93 -8.776 7.178 -8.312 1.00 0.00 C ATOM 1452 CG GLN A 93 -10.277 7.347 -8.147 1.00 0.00 C ATOM 1453 CD GLN A 93 -10.782 8.658 -8.719 1.00 0.00 C ATOM 1454 OE1 GLN A 93 -10.130 9.274 -9.561 1.00 0.00 O ATOM 1455 NE2 GLN A 93 -11.952 9.090 -8.262 1.00 0.00 N ATOM 0 H GLN A 93 -9.419 5.047 -9.827 1.00 0.00 H new ATOM 0 HA GLN A 93 -8.352 7.757 -10.345 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -8.434 6.384 -7.648 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -8.280 8.095 -7.994 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -10.788 6.519 -8.638 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.531 7.295 -7.088 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -12.459 8.547 -7.563 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -12.344 9.965 -8.610 1.00 0.00 H new ATOM 1464 N SER A 94 -6.624 5.380 -10.645 1.00 0.00 N ATOM 1465 CA SER A 94 -5.288 4.802 -10.721 1.00 0.00 C ATOM 1466 C SER A 94 -4.256 5.880 -11.030 1.00 0.00 C ATOM 1467 O SER A 94 -3.093 5.767 -10.643 1.00 0.00 O ATOM 1468 CB SER A 94 -5.229 3.704 -11.780 1.00 0.00 C ATOM 1469 OG SER A 94 -5.765 2.489 -11.287 1.00 0.00 O ATOM 0 H SER A 94 -7.284 5.022 -11.336 1.00 0.00 H new ATOM 0 HA SER A 94 -5.058 4.360 -9.752 1.00 0.00 H new ATOM 0 HB2 SER A 94 -5.784 4.017 -12.664 1.00 0.00 H new ATOM 0 HB3 SER A 94 -4.196 3.549 -12.091 1.00 0.00 H new ATOM 0 HG SER A 94 -5.560 1.763 -11.913 1.00 0.00 H new ATOM 1475 N GLU A 95 -4.691 6.932 -11.721 1.00 0.00 N ATOM 1476 CA GLU A 95 -3.805 8.036 -12.069 1.00 0.00 C ATOM 1477 C GLU A 95 -3.122 8.581 -10.821 1.00 0.00 C ATOM 1478 O GLU A 95 -1.985 9.050 -10.872 1.00 0.00 O ATOM 1479 CB GLU A 95 -4.588 9.150 -12.768 1.00 0.00 C ATOM 1480 CG GLU A 95 -3.709 10.271 -13.297 1.00 0.00 C ATOM 1481 CD GLU A 95 -4.355 11.635 -13.155 1.00 0.00 C ATOM 1482 OE1 GLU A 95 -5.478 11.818 -13.671 1.00 0.00 O ATOM 1483 OE2 GLU A 95 -3.739 12.521 -12.527 1.00 0.00 O ATOM 0 H GLU A 95 -5.650 7.041 -12.050 1.00 0.00 H new ATOM 0 HA GLU A 95 -3.042 7.663 -12.752 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -5.153 8.721 -13.596 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.313 9.567 -12.069 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -2.759 10.266 -12.763 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -3.485 10.087 -14.348 1.00 0.00 H new ATOM 1490 N ALA A 96 -3.825 8.500 -9.694 1.00 0.00 N ATOM 1491 CA ALA A 96 -3.292 8.965 -8.421 1.00 0.00 C ATOM 1492 C ALA A 96 -1.999 8.244 -8.087 1.00 0.00 C ATOM 1493 O ALA A 96 -1.063 8.832 -7.559 1.00 0.00 O ATOM 1494 CB ALA A 96 -4.299 8.726 -7.311 1.00 0.00 C ATOM 0 H ALA A 96 -4.768 8.115 -9.639 1.00 0.00 H new ATOM 0 HA ALA A 96 -3.093 10.033 -8.508 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.888 9.078 -6.365 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -5.219 9.268 -7.531 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.515 7.660 -7.239 1.00 0.00 H new ATOM 1500 N VAL A 97 -1.976 6.957 -8.394 1.00 0.00 N ATOM 1501 CA VAL A 97 -0.820 6.116 -8.127 1.00 0.00 C ATOM 1502 C VAL A 97 0.432 6.653 -8.808 1.00 0.00 C ATOM 1503 O VAL A 97 1.541 6.529 -8.288 1.00 0.00 O ATOM 1504 CB VAL A 97 -1.091 4.681 -8.595 1.00 0.00 C ATOM 1505 CG1 VAL A 97 0.129 3.807 -8.371 1.00 0.00 C ATOM 1506 CG2 VAL A 97 -2.312 4.127 -7.876 1.00 0.00 C ATOM 0 H VAL A 97 -2.755 6.467 -8.834 1.00 0.00 H new ATOM 0 HA VAL A 97 -0.648 6.122 -7.051 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.297 4.686 -9.665 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.083 2.793 -8.709 1.00 0.00 H new ATOM 0 HG12 VAL A 97 0.972 4.208 -8.933 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.375 3.791 -7.309 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -2.500 3.107 -8.212 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -2.133 4.128 -6.801 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -3.179 4.749 -8.099 1.00 0.00 H new ATOM 1516 N GLN A 98 0.240 7.251 -9.968 1.00 0.00 N ATOM 1517 CA GLN A 98 1.343 7.817 -10.736 1.00 0.00 C ATOM 1518 C GLN A 98 1.890 9.069 -10.057 1.00 0.00 C ATOM 1519 O GLN A 98 3.104 9.239 -9.930 1.00 0.00 O ATOM 1520 CB GLN A 98 0.886 8.150 -12.157 1.00 0.00 C ATOM 1521 CG GLN A 98 0.209 6.990 -12.866 1.00 0.00 C ATOM 1522 CD GLN A 98 0.418 7.022 -14.368 1.00 0.00 C ATOM 1523 OE1 GLN A 98 0.260 8.063 -15.006 1.00 0.00 O ATOM 1524 NE2 GLN A 98 0.775 5.878 -14.940 1.00 0.00 N ATOM 0 H GLN A 98 -0.675 7.360 -10.406 1.00 0.00 H new ATOM 0 HA GLN A 98 2.139 7.074 -10.785 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.197 8.994 -12.120 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.749 8.469 -12.742 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.595 6.051 -12.469 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -0.859 7.011 -12.651 1.00 0.00 H new ATOM 0 HE21 GLN A 98 0.895 5.039 -14.372 1.00 0.00 H new ATOM 0 HE22 GLN A 98 0.930 5.838 -15.947 1.00 0.00 H new ATOM 1533 N LYS A 99 0.989 9.945 -9.624 1.00 0.00 N ATOM 1534 CA LYS A 99 1.381 11.181 -8.957 1.00 0.00 C ATOM 1535 C LYS A 99 1.745 10.921 -7.499 1.00 0.00 C ATOM 1536 O LYS A 99 2.677 11.522 -6.963 1.00 0.00 O ATOM 1537 CB LYS A 99 0.252 12.211 -9.038 1.00 0.00 C ATOM 1538 CG LYS A 99 0.044 12.778 -10.432 1.00 0.00 C ATOM 1539 CD LYS A 99 1.328 13.378 -10.987 1.00 0.00 C ATOM 1540 CE LYS A 99 2.008 12.431 -11.963 1.00 0.00 C ATOM 1541 NZ LYS A 99 1.173 12.185 -13.172 1.00 0.00 N ATOM 0 H LYS A 99 -0.019 9.821 -9.723 1.00 0.00 H new ATOM 0 HA LYS A 99 2.260 11.576 -9.467 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -0.676 11.748 -8.701 1.00 0.00 H new ATOM 0 HB3 LYS A 99 0.468 13.029 -8.351 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -0.308 11.990 -11.098 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -0.733 13.542 -10.403 1.00 0.00 H new ATOM 0 HD2 LYS A 99 1.104 14.320 -11.488 1.00 0.00 H new ATOM 0 HD3 LYS A 99 2.008 13.607 -10.167 1.00 0.00 H new ATOM 0 HE2 LYS A 99 2.969 12.849 -12.264 1.00 0.00 H new ATOM 0 HE3 LYS A 99 2.214 11.483 -11.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 1.790 11.979 -13.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 0.544 11.375 -13.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 0.601 13.029 -13.377 1.00 0.00 H new ATOM 1555 N LEU A 100 1.006 10.019 -6.863 1.00 0.00 N ATOM 1556 CA LEU A 100 1.257 9.675 -5.464 1.00 0.00 C ATOM 1557 C LEU A 100 2.573 8.913 -5.332 1.00 0.00 C ATOM 1558 O LEU A 100 3.261 9.016 -4.316 1.00 0.00 O ATOM 1559 CB LEU A 100 0.093 8.852 -4.864 1.00 0.00 C ATOM 1560 CG LEU A 100 0.492 7.884 -3.757 1.00 0.00 C ATOM 1561 CD1 LEU A 100 1.134 8.651 -2.620 1.00 0.00 C ATOM 1562 CD2 LEU A 100 -0.718 7.095 -3.277 1.00 0.00 C ATOM 0 H LEU A 100 0.230 9.513 -7.290 1.00 0.00 H new ATOM 0 HA LEU A 100 1.330 10.605 -4.900 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.655 9.541 -4.471 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.384 8.287 -5.665 1.00 0.00 H new ATOM 0 HG LEU A 100 1.217 7.169 -4.146 1.00 0.00 H new ATOM 0 HD11 LEU A 100 1.419 7.958 -1.829 1.00 0.00 H new ATOM 0 HD12 LEU A 100 2.021 9.169 -2.985 1.00 0.00 H new ATOM 0 HD13 LEU A 100 0.425 9.379 -2.226 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.415 6.409 -2.486 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.471 7.782 -2.892 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -1.136 6.528 -4.109 1.00 0.00 H new ATOM 1574 N SER A 101 2.919 8.152 -6.365 1.00 0.00 N ATOM 1575 CA SER A 101 4.155 7.378 -6.362 1.00 0.00 C ATOM 1576 C SER A 101 5.370 8.298 -6.447 1.00 0.00 C ATOM 1577 O SER A 101 6.306 8.181 -5.657 1.00 0.00 O ATOM 1578 CB SER A 101 4.168 6.389 -7.529 1.00 0.00 C ATOM 1579 OG SER A 101 3.394 5.240 -7.231 1.00 0.00 O ATOM 0 H SER A 101 2.362 8.055 -7.214 1.00 0.00 H new ATOM 0 HA SER A 101 4.204 6.822 -5.426 1.00 0.00 H new ATOM 0 HB2 SER A 101 3.777 6.873 -8.424 1.00 0.00 H new ATOM 0 HB3 SER A 101 5.194 6.094 -7.748 1.00 0.00 H new ATOM 0 HG SER A 101 3.485 5.022 -6.280 1.00 0.00 H new ATOM 1585 N LYS A 102 5.346 9.212 -7.411 1.00 0.00 N ATOM 1586 CA LYS A 102 6.445 10.153 -7.597 1.00 0.00 C ATOM 1587 C LYS A 102 6.594 11.063 -6.382 1.00 0.00 C ATOM 1588 O LYS A 102 7.693 11.515 -6.064 1.00 0.00 O ATOM 1589 CB LYS A 102 6.217 10.994 -8.855 1.00 0.00 C ATOM 1590 CG LYS A 102 7.343 11.974 -9.143 1.00 0.00 C ATOM 1591 CD LYS A 102 6.877 13.107 -10.044 1.00 0.00 C ATOM 1592 CE LYS A 102 8.040 13.726 -10.804 1.00 0.00 C ATOM 1593 NZ LYS A 102 8.677 14.833 -10.039 1.00 0.00 N ATOM 0 H LYS A 102 4.579 9.321 -8.075 1.00 0.00 H new ATOM 0 HA LYS A 102 7.365 9.580 -7.714 1.00 0.00 H new ATOM 0 HB2 LYS A 102 6.098 10.329 -9.710 1.00 0.00 H new ATOM 0 HB3 LYS A 102 5.284 11.547 -8.748 1.00 0.00 H new ATOM 0 HG2 LYS A 102 7.719 12.384 -8.206 1.00 0.00 H new ATOM 0 HG3 LYS A 102 8.172 11.448 -9.616 1.00 0.00 H new ATOM 0 HD2 LYS A 102 6.137 12.731 -10.751 1.00 0.00 H new ATOM 0 HD3 LYS A 102 6.384 13.872 -9.444 1.00 0.00 H new ATOM 0 HE2 LYS A 102 8.783 12.958 -11.018 1.00 0.00 H new ATOM 0 HE3 LYS A 102 7.687 14.104 -11.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 9.465 15.228 -10.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 7.975 15.578 -9.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 9.037 14.467 -9.134 1.00 0.00 H new ATOM 1607 N HIS A 103 5.479 11.328 -5.707 1.00 0.00 N ATOM 1608 CA HIS A 103 5.485 12.184 -4.527 1.00 0.00 C ATOM 1609 C HIS A 103 6.220 11.514 -3.369 1.00 0.00 C ATOM 1610 O HIS A 103 6.792 12.188 -2.513 1.00 0.00 O ATOM 1611 CB HIS A 103 4.051 12.523 -4.112 1.00 0.00 C ATOM 1612 CG HIS A 103 3.722 13.978 -4.231 1.00 0.00 C ATOM 1613 ND1 HIS A 103 4.585 14.980 -3.840 1.00 0.00 N ATOM 1614 CD2 HIS A 103 2.616 14.601 -4.705 1.00 0.00 C ATOM 1615 CE1 HIS A 103 4.024 16.154 -4.065 1.00 0.00 C ATOM 1616 NE2 HIS A 103 2.830 15.952 -4.589 1.00 0.00 N ATOM 0 H HIS A 103 4.561 10.962 -5.958 1.00 0.00 H new ATOM 0 HA HIS A 103 6.011 13.105 -4.779 1.00 0.00 H new ATOM 0 HB2 HIS A 103 3.358 11.951 -4.729 1.00 0.00 H new ATOM 0 HB3 HIS A 103 3.896 12.207 -3.080 1.00 0.00 H new ATOM 0 HD2 HIS A 103 1.731 14.124 -5.100 1.00 0.00 H new ATOM 0 HE1 HIS A 103 4.467 17.116 -3.856 1.00 0.00 H new ATOM 0 HE2 HIS A 103 2.172 16.682 -4.864 1.00 0.00 H new ATOM 1625 N PHE A 104 6.200 10.185 -3.348 1.00 0.00 N ATOM 1626 CA PHE A 104 6.863 9.427 -2.292 1.00 0.00 C ATOM 1627 C PHE A 104 8.297 9.066 -2.683 1.00 0.00 C ATOM 1628 O PHE A 104 8.922 8.212 -2.055 1.00 0.00 O ATOM 1629 CB PHE A 104 6.072 8.158 -1.976 1.00 0.00 C ATOM 1630 CG PHE A 104 4.899 8.394 -1.068 1.00 0.00 C ATOM 1631 CD1 PHE A 104 4.027 9.445 -1.302 1.00 0.00 C ATOM 1632 CD2 PHE A 104 4.669 7.566 0.019 1.00 0.00 C ATOM 1633 CE1 PHE A 104 2.947 9.666 -0.469 1.00 0.00 C ATOM 1634 CE2 PHE A 104 3.590 7.782 0.855 1.00 0.00 C ATOM 1635 CZ PHE A 104 2.727 8.834 0.611 1.00 0.00 C ATOM 0 H PHE A 104 5.732 9.611 -4.049 1.00 0.00 H new ATOM 0 HA PHE A 104 6.903 10.056 -1.403 1.00 0.00 H new ATOM 0 HB2 PHE A 104 5.717 7.719 -2.908 1.00 0.00 H new ATOM 0 HB3 PHE A 104 6.738 7.430 -1.514 1.00 0.00 H new ATOM 0 HD1 PHE A 104 4.193 10.099 -2.145 1.00 0.00 H new ATOM 0 HD2 PHE A 104 5.340 6.743 0.215 1.00 0.00 H new ATOM 0 HE1 PHE A 104 2.275 10.489 -0.662 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.421 7.129 1.699 1.00 0.00 H new ATOM 0 HZ PHE A 104 1.883 9.005 1.263 1.00 0.00 H new ATOM 1645 N ASN A 105 8.815 9.724 -3.719 1.00 0.00 N ATOM 1646 CA ASN A 105 10.174 9.473 -4.184 1.00 0.00 C ATOM 1647 C ASN A 105 10.410 7.989 -4.452 1.00 0.00 C ATOM 1648 O ASN A 105 11.516 7.483 -4.256 1.00 0.00 O ATOM 1649 CB ASN A 105 11.185 9.984 -3.156 1.00 0.00 C ATOM 1650 CG ASN A 105 12.475 10.454 -3.798 1.00 0.00 C ATOM 1651 OD1 ASN A 105 12.587 11.603 -4.226 1.00 0.00 O ATOM 1652 ND2 ASN A 105 13.460 9.566 -3.865 1.00 0.00 N ATOM 0 H ASN A 105 8.312 10.435 -4.251 1.00 0.00 H new ATOM 0 HA ASN A 105 10.308 10.010 -5.123 1.00 0.00 H new ATOM 0 HB2 ASN A 105 10.742 10.806 -2.593 1.00 0.00 H new ATOM 0 HB3 ASN A 105 11.406 9.190 -2.442 1.00 0.00 H new ATOM 0 HD21 ASN A 105 14.353 9.826 -4.284 1.00 0.00 H new ATOM 0 HD22 ASN A 105 13.324 8.624 -3.498 1.00 0.00 H new ATOM 1659 N VAL A 106 9.370 7.295 -4.902 1.00 0.00 N ATOM 1660 CA VAL A 106 9.474 5.867 -5.197 1.00 0.00 C ATOM 1661 C VAL A 106 10.629 5.591 -6.156 1.00 0.00 C ATOM 1662 O VAL A 106 10.526 5.842 -7.356 1.00 0.00 O ATOM 1663 CB VAL A 106 8.172 5.311 -5.810 1.00 0.00 C ATOM 1664 CG1 VAL A 106 8.282 3.809 -6.030 1.00 0.00 C ATOM 1665 CG2 VAL A 106 6.979 5.637 -4.922 1.00 0.00 C ATOM 0 H VAL A 106 8.447 7.695 -5.071 1.00 0.00 H new ATOM 0 HA VAL A 106 9.657 5.365 -4.247 1.00 0.00 H new ATOM 0 HB VAL A 106 8.018 5.788 -6.778 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.354 3.436 -6.463 1.00 0.00 H new ATOM 0 HG12 VAL A 106 9.109 3.600 -6.709 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.462 3.314 -5.076 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.070 5.236 -5.372 1.00 0.00 H new ATOM 0 HG22 VAL A 106 7.125 5.190 -3.939 1.00 0.00 H new ATOM 0 HG23 VAL A 106 6.887 6.718 -4.819 1.00 0.00 H new ATOM 1675 N GLU A 107 11.729 5.071 -5.618 1.00 0.00 N ATOM 1676 CA GLU A 107 12.902 4.759 -6.427 1.00 0.00 C ATOM 1677 C GLU A 107 12.533 3.842 -7.588 1.00 0.00 C ATOM 1678 O GLU A 107 12.911 4.090 -8.733 1.00 0.00 O ATOM 1679 CB GLU A 107 13.980 4.100 -5.564 1.00 0.00 C ATOM 1680 CG GLU A 107 14.942 5.090 -4.928 1.00 0.00 C ATOM 1681 CD GLU A 107 15.233 4.769 -3.474 1.00 0.00 C ATOM 1682 OE1 GLU A 107 14.323 4.936 -2.636 1.00 0.00 O ATOM 1683 OE2 GLU A 107 16.372 4.353 -3.176 1.00 0.00 O ATOM 0 H GLU A 107 11.832 4.857 -4.626 1.00 0.00 H new ATOM 0 HA GLU A 107 13.292 5.692 -6.834 1.00 0.00 H new ATOM 0 HB2 GLU A 107 13.499 3.518 -4.778 1.00 0.00 H new ATOM 0 HB3 GLU A 107 14.546 3.399 -6.178 1.00 0.00 H new ATOM 0 HG2 GLU A 107 15.876 5.095 -5.489 1.00 0.00 H new ATOM 0 HG3 GLU A 107 14.523 6.094 -4.998 1.00 0.00 H new ATOM 1690 N SER A 108 11.788 2.785 -7.283 1.00 0.00 N ATOM 1691 CA SER A 108 11.360 1.830 -8.300 1.00 0.00 C ATOM 1692 C SER A 108 10.534 0.709 -7.681 1.00 0.00 C ATOM 1693 O SER A 108 10.720 0.354 -6.517 1.00 0.00 O ATOM 1694 CB SER A 108 12.571 1.242 -9.027 1.00 0.00 C ATOM 1695 OG SER A 108 13.513 0.719 -8.107 1.00 0.00 O ATOM 0 H SER A 108 11.468 2.567 -6.339 1.00 0.00 H new ATOM 0 HA SER A 108 10.738 2.363 -9.019 1.00 0.00 H new ATOM 0 HB2 SER A 108 12.244 0.454 -9.706 1.00 0.00 H new ATOM 0 HB3 SER A 108 13.043 2.013 -9.637 1.00 0.00 H new ATOM 0 HG SER A 108 14.277 0.348 -8.596 1.00 0.00 H new ATOM 1701 N ILE A 109 9.620 0.155 -8.469 1.00 0.00 N ATOM 1702 CA ILE A 109 8.763 -0.929 -8.003 1.00 0.00 C ATOM 1703 C ILE A 109 9.460 -2.280 -8.150 1.00 0.00 C ATOM 1704 O ILE A 109 10.345 -2.440 -8.990 1.00 0.00 O ATOM 1705 CB ILE A 109 7.427 -0.959 -8.775 1.00 0.00 C ATOM 1706 CG1 ILE A 109 7.680 -1.213 -10.271 1.00 0.00 C ATOM 1707 CG2 ILE A 109 6.665 0.341 -8.546 1.00 0.00 C ATOM 1708 CD1 ILE A 109 6.888 -0.316 -11.204 1.00 0.00 C ATOM 0 H ILE A 109 9.453 0.439 -9.434 1.00 0.00 H new ATOM 0 HA ILE A 109 8.558 -0.744 -6.949 1.00 0.00 H new ATOM 0 HB ILE A 109 6.813 -1.778 -8.402 1.00 0.00 H new ATOM 0 HG12 ILE A 109 8.743 -1.080 -10.475 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.440 -2.252 -10.496 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.723 0.312 -9.094 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.462 0.461 -7.482 1.00 0.00 H new ATOM 0 HG23 ILE A 109 7.264 1.181 -8.898 1.00 0.00 H new ATOM 0 HD11 ILE A 109 7.128 -0.564 -12.238 1.00 0.00 H new ATOM 0 HD12 ILE A 109 5.822 -0.465 -11.033 1.00 0.00 H new ATOM 0 HD13 ILE A 109 7.144 0.726 -11.012 1.00 0.00 H new ATOM 1720 N PRO A 110 9.074 -3.277 -7.332 1.00 0.00 N ATOM 1721 CA PRO A 110 8.026 -3.131 -6.319 1.00 0.00 C ATOM 1722 C PRO A 110 8.549 -2.542 -5.011 1.00 0.00 C ATOM 1723 O PRO A 110 9.609 -2.935 -4.523 1.00 0.00 O ATOM 1724 CB PRO A 110 7.569 -4.570 -6.108 1.00 0.00 C ATOM 1725 CG PRO A 110 8.797 -5.386 -6.329 1.00 0.00 C ATOM 1726 CD PRO A 110 9.636 -4.641 -7.340 1.00 0.00 C ATOM 0 HA PRO A 110 7.238 -2.447 -6.634 1.00 0.00 H new ATOM 0 HB2 PRO A 110 7.170 -4.717 -5.104 1.00 0.00 H new ATOM 0 HB3 PRO A 110 6.779 -4.843 -6.808 1.00 0.00 H new ATOM 0 HG2 PRO A 110 9.345 -5.522 -5.396 1.00 0.00 H new ATOM 0 HG3 PRO A 110 8.541 -6.380 -6.696 1.00 0.00 H new ATOM 0 HD2 PRO A 110 10.690 -4.640 -7.062 1.00 0.00 H new ATOM 0 HD3 PRO A 110 9.568 -5.095 -8.328 1.00 0.00 H new ATOM 1734 N THR A 111 7.795 -1.604 -4.444 1.00 0.00 N ATOM 1735 CA THR A 111 8.179 -0.970 -3.187 1.00 0.00 C ATOM 1736 C THR A 111 7.019 -1.000 -2.196 1.00 0.00 C ATOM 1737 O THR A 111 5.909 -1.400 -2.543 1.00 0.00 O ATOM 1738 CB THR A 111 8.637 0.473 -3.435 1.00 0.00 C ATOM 1739 OG1 THR A 111 9.469 0.921 -2.381 1.00 0.00 O ATOM 1740 CG2 THR A 111 7.495 1.461 -3.566 1.00 0.00 C ATOM 0 H THR A 111 6.915 -1.267 -4.835 1.00 0.00 H new ATOM 0 HA THR A 111 9.011 -1.528 -2.758 1.00 0.00 H new ATOM 0 HB THR A 111 9.174 0.441 -4.383 1.00 0.00 H new ATOM 0 HG1 THR A 111 9.065 1.706 -1.956 1.00 0.00 H new ATOM 0 HG21 THR A 111 7.896 2.460 -3.740 1.00 0.00 H new ATOM 0 HG22 THR A 111 6.860 1.174 -4.404 1.00 0.00 H new ATOM 0 HG23 THR A 111 6.907 1.461 -2.648 1.00 0.00 H new ATOM 1748 N LEU A 112 7.274 -0.557 -0.971 1.00 0.00 N ATOM 1749 CA LEU A 112 6.224 -0.524 0.055 1.00 0.00 C ATOM 1750 C LEU A 112 6.438 0.658 1.001 1.00 0.00 C ATOM 1751 O LEU A 112 7.531 0.843 1.536 1.00 0.00 O ATOM 1752 CB LEU A 112 6.146 -1.868 0.831 1.00 0.00 C ATOM 1753 CG LEU A 112 5.134 -1.951 1.989 1.00 0.00 C ATOM 1754 CD1 LEU A 112 3.880 -1.145 1.725 1.00 0.00 C ATOM 1755 CD2 LEU A 112 4.757 -3.391 2.273 1.00 0.00 C ATOM 0 H LEU A 112 8.185 -0.218 -0.660 1.00 0.00 H new ATOM 0 HA LEU A 112 5.265 -0.388 -0.445 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.909 -2.657 0.118 1.00 0.00 H new ATOM 0 HB3 LEU A 112 7.136 -2.086 1.231 1.00 0.00 H new ATOM 0 HG LEU A 112 5.629 -1.522 2.860 1.00 0.00 H new ATOM 0 HD11 LEU A 112 3.202 -1.239 2.573 1.00 0.00 H new ATOM 0 HD12 LEU A 112 4.144 -0.097 1.586 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.390 -1.518 0.826 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.041 -3.425 3.095 1.00 0.00 H new ATOM 0 HD22 LEU A 112 4.308 -3.832 1.383 1.00 0.00 H new ATOM 0 HD23 LEU A 112 5.650 -3.954 2.546 1.00 0.00 H new ATOM 1767 N ILE A 113 5.396 1.465 1.188 1.00 0.00 N ATOM 1768 CA ILE A 113 5.477 2.640 2.056 1.00 0.00 C ATOM 1769 C ILE A 113 4.242 2.763 2.950 1.00 0.00 C ATOM 1770 O ILE A 113 3.125 2.478 2.520 1.00 0.00 O ATOM 1771 CB ILE A 113 5.622 3.928 1.217 1.00 0.00 C ATOM 1772 CG1 ILE A 113 6.848 3.829 0.303 1.00 0.00 C ATOM 1773 CG2 ILE A 113 5.719 5.156 2.115 1.00 0.00 C ATOM 1774 CD1 ILE A 113 7.146 5.104 -0.456 1.00 0.00 C ATOM 0 H ILE A 113 4.485 1.328 0.750 1.00 0.00 H new ATOM 0 HA ILE A 113 6.356 2.512 2.687 1.00 0.00 H new ATOM 0 HB ILE A 113 4.732 4.036 0.597 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.718 3.563 0.904 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.694 3.020 -0.411 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.820 6.050 1.499 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.818 5.234 2.723 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.588 5.063 2.766 1.00 0.00 H new ATOM 0 HD11 ILE A 113 8.027 4.958 -1.081 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.293 5.361 -1.084 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.333 5.913 0.250 1.00 0.00 H new ATOM 1786 N GLY A 114 4.449 3.195 4.197 1.00 0.00 N ATOM 1787 CA GLY A 114 3.341 3.351 5.121 1.00 0.00 C ATOM 1788 C GLY A 114 3.177 4.784 5.592 1.00 0.00 C ATOM 1789 O GLY A 114 4.162 5.473 5.859 1.00 0.00 O ATOM 0 H GLY A 114 5.363 3.438 4.579 1.00 0.00 H new ATOM 0 HA2 GLY A 114 2.420 3.023 4.639 1.00 0.00 H new ATOM 0 HA3 GLY A 114 3.497 2.704 5.984 1.00 0.00 H new ATOM 1793 N VAL A 115 1.930 5.233 5.697 1.00 0.00 N ATOM 1794 CA VAL A 115 1.638 6.583 6.141 1.00 0.00 C ATOM 1795 C VAL A 115 0.538 6.579 7.194 1.00 0.00 C ATOM 1796 O VAL A 115 -0.192 5.599 7.346 1.00 0.00 O ATOM 1797 CB VAL A 115 1.211 7.486 4.964 1.00 0.00 C ATOM 1798 CG1 VAL A 115 2.289 7.509 3.892 1.00 0.00 C ATOM 1799 CG2 VAL A 115 -0.118 7.025 4.382 1.00 0.00 C ATOM 0 H VAL A 115 1.105 4.675 5.478 1.00 0.00 H new ATOM 0 HA VAL A 115 2.555 6.983 6.574 1.00 0.00 H new ATOM 0 HB VAL A 115 1.080 8.500 5.342 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.971 8.150 3.070 1.00 0.00 H new ATOM 0 HG12 VAL A 115 3.216 7.895 4.316 1.00 0.00 H new ATOM 0 HG13 VAL A 115 2.454 6.498 3.520 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -0.398 7.676 3.554 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -0.022 6.001 4.021 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -0.887 7.067 5.153 1.00 0.00 H new ATOM 1809 N ASP A 116 0.429 7.682 7.913 1.00 0.00 N ATOM 1810 CA ASP A 116 -0.582 7.822 8.958 1.00 0.00 C ATOM 1811 C ASP A 116 -1.735 8.701 8.484 1.00 0.00 C ATOM 1812 O ASP A 116 -1.570 9.904 8.284 1.00 0.00 O ATOM 1813 CB ASP A 116 0.038 8.412 10.227 1.00 0.00 C ATOM 1814 CG ASP A 116 0.961 9.580 9.937 1.00 0.00 C ATOM 1815 OD1 ASP A 116 0.825 10.190 8.856 1.00 0.00 O ATOM 1816 OD2 ASP A 116 1.818 9.885 10.792 1.00 0.00 O ATOM 0 H ASP A 116 1.028 8.499 7.795 1.00 0.00 H new ATOM 0 HA ASP A 116 -0.973 6.830 9.184 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -0.757 8.740 10.897 1.00 0.00 H new ATOM 0 HB3 ASP A 116 0.595 7.635 10.750 1.00 0.00 H new ATOM 1821 N ALA A 117 -2.902 8.091 8.305 1.00 0.00 N ATOM 1822 CA ALA A 117 -4.082 8.820 7.854 1.00 0.00 C ATOM 1823 C ALA A 117 -4.505 9.870 8.876 1.00 0.00 C ATOM 1824 O ALA A 117 -4.845 10.998 8.519 1.00 0.00 O ATOM 1825 CB ALA A 117 -5.228 7.853 7.582 1.00 0.00 C ATOM 0 H ALA A 117 -3.056 7.095 8.465 1.00 0.00 H new ATOM 0 HA ALA A 117 -3.827 9.336 6.928 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -6.102 8.410 7.246 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -4.930 7.144 6.809 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -5.472 7.312 8.496 1.00 0.00 H new ATOM 1831 N ASP A 118 -4.482 9.491 10.150 1.00 0.00 N ATOM 1832 CA ASP A 118 -4.865 10.398 11.228 1.00 0.00 C ATOM 1833 C ASP A 118 -4.042 11.682 11.183 1.00 0.00 C ATOM 1834 O ASP A 118 -4.582 12.771 10.988 1.00 0.00 O ATOM 1835 CB ASP A 118 -4.690 9.713 12.585 1.00 0.00 C ATOM 1836 CG ASP A 118 -5.785 10.084 13.565 1.00 0.00 C ATOM 1837 OD1 ASP A 118 -6.033 11.295 13.748 1.00 0.00 O ATOM 1838 OD2 ASP A 118 -6.395 9.164 14.151 1.00 0.00 O ATOM 0 H ASP A 118 -4.202 8.561 10.462 1.00 0.00 H new ATOM 0 HA ASP A 118 -5.915 10.659 11.092 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.682 8.632 12.445 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -3.722 9.987 13.005 1.00 0.00 H new ATOM 1843 N SER A 119 -2.732 11.547 11.366 1.00 0.00 N ATOM 1844 CA SER A 119 -1.836 12.697 11.345 1.00 0.00 C ATOM 1845 C SER A 119 -1.823 13.350 9.966 1.00 0.00 C ATOM 1846 O SER A 119 -1.877 14.574 9.848 1.00 0.00 O ATOM 1847 CB SER A 119 -0.420 12.274 11.739 1.00 0.00 C ATOM 1848 OG SER A 119 0.533 13.245 11.344 1.00 0.00 O ATOM 0 H SER A 119 -2.268 10.653 11.530 1.00 0.00 H new ATOM 0 HA SER A 119 -2.202 13.426 12.068 1.00 0.00 H new ATOM 0 HB2 SER A 119 -0.368 12.128 12.818 1.00 0.00 H new ATOM 0 HB3 SER A 119 -0.181 11.317 11.276 1.00 0.00 H new ATOM 0 HG SER A 119 1.429 12.951 11.609 1.00 0.00 H new ATOM 1854 N GLY A 120 -1.751 12.525 8.928 1.00 0.00 N ATOM 1855 CA GLY A 120 -1.734 13.041 7.571 1.00 0.00 C ATOM 1856 C GLY A 120 -0.336 13.384 7.095 1.00 0.00 C ATOM 1857 O GLY A 120 -0.004 14.556 6.916 1.00 0.00 O ATOM 0 H GLY A 120 -1.704 11.509 9.001 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -2.171 12.302 6.900 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -2.361 13.931 7.517 1.00 0.00 H new ATOM 1861 N ASP A 121 0.484 12.359 6.886 1.00 0.00 N ATOM 1862 CA ASP A 121 1.854 12.556 6.425 1.00 0.00 C ATOM 1863 C ASP A 121 2.560 11.215 6.242 1.00 0.00 C ATOM 1864 O ASP A 121 2.102 10.185 6.737 1.00 0.00 O ATOM 1865 CB ASP A 121 2.620 13.453 7.414 1.00 0.00 C ATOM 1866 CG ASP A 121 4.056 13.015 7.649 1.00 0.00 C ATOM 1867 OD1 ASP A 121 4.924 13.347 6.813 1.00 0.00 O ATOM 1868 OD2 ASP A 121 4.311 12.340 8.669 1.00 0.00 O ATOM 0 H ASP A 121 0.224 11.383 7.029 1.00 0.00 H new ATOM 0 HA ASP A 121 1.830 13.054 5.456 1.00 0.00 H new ATOM 0 HB2 ASP A 121 2.618 14.476 7.039 1.00 0.00 H new ATOM 0 HB3 ASP A 121 2.091 13.462 8.367 1.00 0.00 H new ATOM 1873 N VAL A 122 3.679 11.239 5.528 1.00 0.00 N ATOM 1874 CA VAL A 122 4.452 10.034 5.276 1.00 0.00 C ATOM 1875 C VAL A 122 5.421 9.757 6.420 1.00 0.00 C ATOM 1876 O VAL A 122 6.382 10.498 6.627 1.00 0.00 O ATOM 1877 CB VAL A 122 5.244 10.146 3.961 1.00 0.00 C ATOM 1878 CG1 VAL A 122 5.906 8.822 3.625 1.00 0.00 C ATOM 1879 CG2 VAL A 122 4.337 10.602 2.829 1.00 0.00 C ATOM 0 H VAL A 122 4.071 12.084 5.113 1.00 0.00 H new ATOM 0 HA VAL A 122 3.744 9.209 5.197 1.00 0.00 H new ATOM 0 HB VAL A 122 6.026 10.894 4.090 1.00 0.00 H new ATOM 0 HG11 VAL A 122 6.462 8.919 2.692 1.00 0.00 H new ATOM 0 HG12 VAL A 122 6.589 8.543 4.427 1.00 0.00 H new ATOM 0 HG13 VAL A 122 5.143 8.052 3.514 1.00 0.00 H new ATOM 0 HG21 VAL A 122 4.914 10.676 1.907 1.00 0.00 H new ATOM 0 HG22 VAL A 122 3.531 9.881 2.696 1.00 0.00 H new ATOM 0 HG23 VAL A 122 3.915 11.577 3.071 1.00 0.00 H new ATOM 1889 N VAL A 123 5.161 8.686 7.163 1.00 0.00 N ATOM 1890 CA VAL A 123 6.009 8.313 8.287 1.00 0.00 C ATOM 1891 C VAL A 123 7.088 7.325 7.863 1.00 0.00 C ATOM 1892 O VAL A 123 8.221 7.386 8.340 1.00 0.00 O ATOM 1893 CB VAL A 123 5.185 7.695 9.432 1.00 0.00 C ATOM 1894 CG1 VAL A 123 6.049 7.501 10.669 1.00 0.00 C ATOM 1895 CG2 VAL A 123 3.976 8.562 9.748 1.00 0.00 C ATOM 0 H VAL A 123 4.370 8.062 7.006 1.00 0.00 H new ATOM 0 HA VAL A 123 6.481 9.230 8.641 1.00 0.00 H new ATOM 0 HB VAL A 123 4.828 6.717 9.110 1.00 0.00 H new ATOM 0 HG11 VAL A 123 5.449 7.063 11.467 1.00 0.00 H new ATOM 0 HG12 VAL A 123 6.879 6.835 10.432 1.00 0.00 H new ATOM 0 HG13 VAL A 123 6.439 8.465 10.995 1.00 0.00 H new ATOM 0 HG21 VAL A 123 3.406 8.110 10.559 1.00 0.00 H new ATOM 0 HG22 VAL A 123 4.309 9.555 10.049 1.00 0.00 H new ATOM 0 HG23 VAL A 123 3.345 8.643 8.863 1.00 0.00 H new ATOM 1905 N THR A 124 6.731 6.416 6.964 1.00 0.00 N ATOM 1906 CA THR A 124 7.667 5.414 6.474 1.00 0.00 C ATOM 1907 C THR A 124 7.902 5.596 4.980 1.00 0.00 C ATOM 1908 O THR A 124 7.058 6.148 4.276 1.00 0.00 O ATOM 1909 CB THR A 124 7.142 3.999 6.765 1.00 0.00 C ATOM 1910 OG1 THR A 124 6.597 3.409 5.597 1.00 0.00 O ATOM 1911 CG2 THR A 124 6.070 3.957 7.836 1.00 0.00 C ATOM 0 H THR A 124 5.797 6.353 6.559 1.00 0.00 H new ATOM 0 HA THR A 124 8.616 5.543 6.994 1.00 0.00 H new ATOM 0 HB THR A 124 8.012 3.446 7.121 1.00 0.00 H new ATOM 0 HG1 THR A 124 6.271 2.509 5.807 1.00 0.00 H new ATOM 0 HG21 THR A 124 5.747 2.927 7.988 1.00 0.00 H new ATOM 0 HG22 THR A 124 6.472 4.353 8.769 1.00 0.00 H new ATOM 0 HG23 THR A 124 5.219 4.561 7.523 1.00 0.00 H new ATOM 1919 N THR A 125 9.049 5.133 4.502 1.00 0.00 N ATOM 1920 CA THR A 125 9.385 5.253 3.089 1.00 0.00 C ATOM 1921 C THR A 125 10.402 4.192 2.684 1.00 0.00 C ATOM 1922 O THR A 125 11.334 4.461 1.925 1.00 0.00 O ATOM 1923 CB THR A 125 9.924 6.652 2.792 1.00 0.00 C ATOM 1924 OG1 THR A 125 11.033 6.950 3.622 1.00 0.00 O ATOM 1925 CG2 THR A 125 8.890 7.740 2.997 1.00 0.00 C ATOM 0 H THR A 125 9.761 4.672 5.069 1.00 0.00 H new ATOM 0 HA THR A 125 8.479 5.096 2.504 1.00 0.00 H new ATOM 0 HB THR A 125 10.214 6.637 1.741 1.00 0.00 H new ATOM 0 HG1 THR A 125 11.364 7.849 3.415 1.00 0.00 H new ATOM 0 HG21 THR A 125 9.333 8.710 2.770 1.00 0.00 H new ATOM 0 HG22 THR A 125 8.042 7.565 2.336 1.00 0.00 H new ATOM 0 HG23 THR A 125 8.551 7.729 4.033 1.00 0.00 H new ATOM 1933 N ARG A 126 10.205 2.983 3.196 1.00 0.00 N ATOM 1934 CA ARG A 126 11.088 1.862 2.899 1.00 0.00 C ATOM 1935 C ARG A 126 10.528 0.577 3.497 1.00 0.00 C ATOM 1936 O ARG A 126 11.273 -0.271 3.989 1.00 0.00 O ATOM 1937 CB ARG A 126 12.497 2.124 3.441 1.00 0.00 C ATOM 1938 CG ARG A 126 12.517 2.827 4.790 1.00 0.00 C ATOM 1939 CD ARG A 126 11.709 2.068 5.831 1.00 0.00 C ATOM 1940 NE ARG A 126 12.137 2.380 7.192 1.00 0.00 N ATOM 1941 CZ ARG A 126 13.193 1.825 7.783 1.00 0.00 C ATOM 1942 NH1 ARG A 126 13.933 0.934 7.135 1.00 0.00 N ATOM 1943 NH2 ARG A 126 13.511 2.164 9.025 1.00 0.00 N ATOM 0 H ARG A 126 9.435 2.753 3.824 1.00 0.00 H new ATOM 0 HA ARG A 126 11.149 1.752 1.816 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.024 1.174 3.529 1.00 0.00 H new ATOM 0 HB3 ARG A 126 13.047 2.728 2.719 1.00 0.00 H new ATOM 0 HG2 ARG A 126 13.547 2.929 5.132 1.00 0.00 H new ATOM 0 HG3 ARG A 126 12.116 3.835 4.681 1.00 0.00 H new ATOM 0 HD2 ARG A 126 10.653 2.312 5.718 1.00 0.00 H new ATOM 0 HD3 ARG A 126 11.809 0.997 5.657 1.00 0.00 H new ATOM 0 HE ARG A 126 11.595 3.063 7.721 1.00 0.00 H new ATOM 0 HH11 ARG A 126 13.694 0.671 6.179 1.00 0.00 H new ATOM 0 HH12 ARG A 126 14.741 0.512 7.593 1.00 0.00 H new ATOM 0 HH21 ARG A 126 12.947 2.850 9.527 1.00 0.00 H new ATOM 0 HH22 ARG A 126 14.320 1.739 9.478 1.00 0.00 H new ATOM 1957 N ALA A 127 9.206 0.445 3.455 1.00 0.00 N ATOM 1958 CA ALA A 127 8.536 -0.728 3.998 1.00 0.00 C ATOM 1959 C ALA A 127 8.733 -1.957 3.115 1.00 0.00 C ATOM 1960 O ALA A 127 8.318 -3.058 3.478 1.00 0.00 O ATOM 1961 CB ALA A 127 7.051 -0.445 4.193 1.00 0.00 C ATOM 0 H ALA A 127 8.578 1.138 3.049 1.00 0.00 H new ATOM 0 HA ALA A 127 8.988 -0.946 4.965 1.00 0.00 H new ATOM 0 HB1 ALA A 127 6.562 -1.330 4.599 1.00 0.00 H new ATOM 0 HB2 ALA A 127 6.927 0.388 4.885 1.00 0.00 H new ATOM 0 HB3 ALA A 127 6.600 -0.190 3.234 1.00 0.00 H new ATOM 1967 N ARG A 128 9.369 -1.775 1.962 1.00 0.00 N ATOM 1968 CA ARG A 128 9.613 -2.886 1.054 1.00 0.00 C ATOM 1969 C ARG A 128 10.470 -3.951 1.735 1.00 0.00 C ATOM 1970 O ARG A 128 10.245 -5.147 1.570 1.00 0.00 O ATOM 1971 CB ARG A 128 10.293 -2.383 -0.235 1.00 0.00 C ATOM 1972 CG ARG A 128 11.821 -2.446 -0.213 1.00 0.00 C ATOM 1973 CD ARG A 128 12.463 -1.235 -0.870 1.00 0.00 C ATOM 1974 NE ARG A 128 11.791 0.015 -0.519 1.00 0.00 N ATOM 1975 CZ ARG A 128 11.931 1.147 -1.207 1.00 0.00 C ATOM 1976 NH1 ARG A 128 12.716 1.190 -2.276 1.00 0.00 N ATOM 1977 NH2 ARG A 128 11.282 2.238 -0.825 1.00 0.00 N ATOM 0 H ARG A 128 9.722 -0.875 1.637 1.00 0.00 H new ATOM 0 HA ARG A 128 8.657 -3.335 0.786 1.00 0.00 H new ATOM 0 HB2 ARG A 128 9.930 -2.973 -1.076 1.00 0.00 H new ATOM 0 HB3 ARG A 128 9.987 -1.352 -0.413 1.00 0.00 H new ATOM 0 HG2 ARG A 128 12.164 -2.520 0.819 1.00 0.00 H new ATOM 0 HG3 ARG A 128 12.152 -3.350 -0.724 1.00 0.00 H new ATOM 0 HD2 ARG A 128 13.510 -1.177 -0.572 1.00 0.00 H new ATOM 0 HD3 ARG A 128 12.446 -1.361 -1.953 1.00 0.00 H new ATOM 0 HE ARG A 128 11.181 0.021 0.298 1.00 0.00 H new ATOM 0 HH11 ARG A 128 13.216 0.353 -2.575 1.00 0.00 H new ATOM 0 HH12 ARG A 128 12.819 2.060 -2.799 1.00 0.00 H new ATOM 0 HH21 ARG A 128 10.676 2.210 -0.005 1.00 0.00 H new ATOM 0 HH22 ARG A 128 11.389 3.105 -1.351 1.00 0.00 H new ATOM 1991 N ALA A 129 11.465 -3.490 2.485 1.00 0.00 N ATOM 1992 CA ALA A 129 12.386 -4.369 3.188 1.00 0.00 C ATOM 1993 C ALA A 129 11.851 -4.804 4.549 1.00 0.00 C ATOM 1994 O ALA A 129 11.740 -5.994 4.839 1.00 0.00 O ATOM 1995 CB ALA A 129 13.720 -3.659 3.356 1.00 0.00 C ATOM 0 H ALA A 129 11.654 -2.497 2.621 1.00 0.00 H new ATOM 0 HA ALA A 129 12.509 -5.273 2.591 1.00 0.00 H new ATOM 0 HB1 ALA A 129 14.416 -4.312 3.882 1.00 0.00 H new ATOM 0 HB2 ALA A 129 14.126 -3.411 2.375 1.00 0.00 H new ATOM 0 HB3 ALA A 129 13.575 -2.744 3.931 1.00 0.00 H new ATOM 2001 N THR A 130 11.556 -3.820 5.388 1.00 0.00 N ATOM 2002 CA THR A 130 11.074 -4.045 6.731 1.00 0.00 C ATOM 2003 C THR A 130 9.923 -5.036 6.798 1.00 0.00 C ATOM 2004 O THR A 130 9.966 -5.981 7.580 1.00 0.00 O ATOM 2005 CB THR A 130 10.681 -2.710 7.342 1.00 0.00 C ATOM 2006 OG1 THR A 130 9.702 -2.063 6.554 1.00 0.00 O ATOM 2007 CG2 THR A 130 11.854 -1.764 7.499 1.00 0.00 C ATOM 0 H THR A 130 11.648 -2.834 5.146 1.00 0.00 H new ATOM 0 HA THR A 130 11.883 -4.498 7.304 1.00 0.00 H new ATOM 0 HB THR A 130 10.288 -2.945 8.331 1.00 0.00 H new ATOM 0 HG1 THR A 130 8.952 -1.790 7.123 1.00 0.00 H new ATOM 0 HG21 THR A 130 11.510 -0.828 7.940 1.00 0.00 H new ATOM 0 HG22 THR A 130 12.603 -2.218 8.148 1.00 0.00 H new ATOM 0 HG23 THR A 130 12.294 -1.564 6.522 1.00 0.00 H new ATOM 2015 N LEU A 131 8.899 -4.832 5.991 1.00 0.00 N ATOM 2016 CA LEU A 131 7.757 -5.734 6.002 1.00 0.00 C ATOM 2017 C LEU A 131 8.211 -7.184 5.842 1.00 0.00 C ATOM 2018 O LEU A 131 7.602 -8.100 6.395 1.00 0.00 O ATOM 2019 CB LEU A 131 6.775 -5.369 4.887 1.00 0.00 C ATOM 2020 CG LEU A 131 5.558 -6.288 4.769 1.00 0.00 C ATOM 2021 CD1 LEU A 131 4.326 -5.495 4.361 1.00 0.00 C ATOM 2022 CD2 LEU A 131 5.830 -7.404 3.771 1.00 0.00 C ATOM 0 H LEU A 131 8.831 -4.061 5.327 1.00 0.00 H new ATOM 0 HA LEU A 131 7.254 -5.630 6.963 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.427 -4.349 5.050 1.00 0.00 H new ATOM 0 HB3 LEU A 131 7.309 -5.375 3.937 1.00 0.00 H new ATOM 0 HG LEU A 131 5.369 -6.736 5.745 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.471 -6.166 4.282 1.00 0.00 H new ATOM 0 HD12 LEU A 131 4.120 -4.731 5.111 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.503 -5.018 3.397 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.954 -8.049 3.699 1.00 0.00 H new ATOM 0 HD22 LEU A 131 6.045 -6.973 2.793 1.00 0.00 H new ATOM 0 HD23 LEU A 131 6.686 -7.990 4.105 1.00 0.00 H new ATOM 2034 N VAL A 132 9.286 -7.383 5.084 1.00 0.00 N ATOM 2035 CA VAL A 132 9.825 -8.712 4.852 1.00 0.00 C ATOM 2036 C VAL A 132 10.862 -9.094 5.903 1.00 0.00 C ATOM 2037 O VAL A 132 10.967 -10.256 6.298 1.00 0.00 O ATOM 2038 CB VAL A 132 10.482 -8.822 3.461 1.00 0.00 C ATOM 2039 CG1 VAL A 132 10.006 -10.069 2.735 1.00 0.00 C ATOM 2040 CG2 VAL A 132 10.227 -7.581 2.624 1.00 0.00 C ATOM 0 H VAL A 132 9.800 -6.634 4.620 1.00 0.00 H new ATOM 0 HA VAL A 132 8.978 -9.395 4.913 1.00 0.00 H new ATOM 0 HB VAL A 132 11.559 -8.903 3.612 1.00 0.00 H new ATOM 0 HG11 VAL A 132 10.483 -10.125 1.757 1.00 0.00 H new ATOM 0 HG12 VAL A 132 10.269 -10.952 3.318 1.00 0.00 H new ATOM 0 HG13 VAL A 132 8.924 -10.026 2.609 1.00 0.00 H new ATOM 0 HG21 VAL A 132 10.705 -7.694 1.651 1.00 0.00 H new ATOM 0 HG22 VAL A 132 9.154 -7.448 2.488 1.00 0.00 H new ATOM 0 HG23 VAL A 132 10.639 -6.709 3.131 1.00 0.00 H new ATOM 2050 N LYS A 133 11.668 -8.114 6.299 1.00 0.00 N ATOM 2051 CA LYS A 133 12.752 -8.345 7.245 1.00 0.00 C ATOM 2052 C LYS A 133 12.411 -7.900 8.669 1.00 0.00 C ATOM 2053 O LYS A 133 13.305 -7.713 9.495 1.00 0.00 O ATOM 2054 CB LYS A 133 14.004 -7.622 6.748 1.00 0.00 C ATOM 2055 CG LYS A 133 14.239 -7.781 5.252 1.00 0.00 C ATOM 2056 CD LYS A 133 14.696 -9.189 4.907 1.00 0.00 C ATOM 2057 CE LYS A 133 14.922 -9.352 3.413 1.00 0.00 C ATOM 2058 NZ LYS A 133 15.099 -10.780 3.031 1.00 0.00 N ATOM 0 H LYS A 133 11.590 -7.149 5.978 1.00 0.00 H new ATOM 0 HA LYS A 133 12.924 -9.420 7.296 1.00 0.00 H new ATOM 0 HB2 LYS A 133 13.920 -6.561 6.985 1.00 0.00 H new ATOM 0 HB3 LYS A 133 14.872 -8.001 7.287 1.00 0.00 H new ATOM 0 HG2 LYS A 133 13.320 -7.553 4.712 1.00 0.00 H new ATOM 0 HG3 LYS A 133 14.989 -7.063 4.922 1.00 0.00 H new ATOM 0 HD2 LYS A 133 15.618 -9.414 5.442 1.00 0.00 H new ATOM 0 HD3 LYS A 133 13.949 -9.908 5.243 1.00 0.00 H new ATOM 0 HE2 LYS A 133 14.075 -8.933 2.870 1.00 0.00 H new ATOM 0 HE3 LYS A 133 15.804 -8.785 3.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 15.251 -10.849 2.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 15.923 -11.173 3.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 14.248 -11.317 3.292 1.00 0.00 H new ATOM 2072 N ASP A 134 11.126 -7.751 8.960 1.00 0.00 N ATOM 2073 CA ASP A 134 10.690 -7.350 10.298 1.00 0.00 C ATOM 2074 C ASP A 134 9.637 -8.317 10.834 1.00 0.00 C ATOM 2075 O ASP A 134 8.441 -8.028 10.799 1.00 0.00 O ATOM 2076 CB ASP A 134 10.129 -5.926 10.292 1.00 0.00 C ATOM 2077 CG ASP A 134 11.176 -4.890 9.930 1.00 0.00 C ATOM 2078 OD1 ASP A 134 12.206 -5.270 9.335 1.00 0.00 O ATOM 2079 OD2 ASP A 134 10.968 -3.700 10.247 1.00 0.00 O ATOM 0 H ASP A 134 10.368 -7.900 8.294 1.00 0.00 H new ATOM 0 HA ASP A 134 11.563 -7.376 10.951 1.00 0.00 H new ATOM 0 HB2 ASP A 134 9.304 -5.867 9.582 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.720 -5.696 11.276 1.00 0.00 H new ATOM 2084 N PRO A 135 10.072 -9.487 11.332 1.00 0.00 N ATOM 2085 CA PRO A 135 9.167 -10.503 11.868 1.00 0.00 C ATOM 2086 C PRO A 135 8.740 -10.226 13.309 1.00 0.00 C ATOM 2087 O PRO A 135 8.070 -11.051 13.931 1.00 0.00 O ATOM 2088 CB PRO A 135 10.012 -11.772 11.800 1.00 0.00 C ATOM 2089 CG PRO A 135 11.412 -11.299 11.999 1.00 0.00 C ATOM 2090 CD PRO A 135 11.484 -9.916 11.401 1.00 0.00 C ATOM 0 HA PRO A 135 8.231 -10.550 11.311 1.00 0.00 H new ATOM 0 HB2 PRO A 135 9.720 -12.485 12.571 1.00 0.00 H new ATOM 0 HB3 PRO A 135 9.896 -12.275 10.840 1.00 0.00 H new ATOM 0 HG2 PRO A 135 11.668 -11.278 13.058 1.00 0.00 H new ATOM 0 HG3 PRO A 135 12.121 -11.969 11.513 1.00 0.00 H new ATOM 0 HD2 PRO A 135 12.077 -9.243 12.020 1.00 0.00 H new ATOM 0 HD3 PRO A 135 11.946 -9.931 10.414 1.00 0.00 H new ATOM 2098 N GLU A 136 9.127 -9.068 13.841 1.00 0.00 N ATOM 2099 CA GLU A 136 8.773 -8.708 15.206 1.00 0.00 C ATOM 2100 C GLU A 136 7.826 -7.514 15.225 1.00 0.00 C ATOM 2101 O GLU A 136 7.050 -7.342 16.165 1.00 0.00 O ATOM 2102 CB GLU A 136 10.033 -8.388 16.010 1.00 0.00 C ATOM 2103 CG GLU A 136 11.090 -9.478 15.943 1.00 0.00 C ATOM 2104 CD GLU A 136 12.300 -9.170 16.803 1.00 0.00 C ATOM 2105 OE1 GLU A 136 12.656 -7.979 16.922 1.00 0.00 O ATOM 2106 OE2 GLU A 136 12.892 -10.120 17.356 1.00 0.00 O ATOM 0 H GLU A 136 9.683 -8.369 13.348 1.00 0.00 H new ATOM 0 HA GLU A 136 8.264 -9.558 15.661 1.00 0.00 H new ATOM 0 HB2 GLU A 136 10.461 -7.455 15.643 1.00 0.00 H new ATOM 0 HB3 GLU A 136 9.757 -8.224 17.052 1.00 0.00 H new ATOM 0 HG2 GLU A 136 10.652 -10.424 16.263 1.00 0.00 H new ATOM 0 HG3 GLU A 136 11.408 -9.608 14.908 1.00 0.00 H new ATOM 2113 N GLY A 137 7.901 -6.684 14.189 1.00 0.00 N ATOM 2114 CA GLY A 137 7.049 -5.514 14.122 1.00 0.00 C ATOM 2115 C GLY A 137 7.290 -4.577 15.285 1.00 0.00 C ATOM 2116 O GLY A 137 6.429 -3.765 15.629 1.00 0.00 O ATOM 0 H GLY A 137 8.535 -6.801 13.398 1.00 0.00 H new ATOM 0 HA2 GLY A 137 7.230 -4.986 13.186 1.00 0.00 H new ATOM 0 HA3 GLY A 137 6.004 -5.825 14.116 1.00 0.00 H new ATOM 2120 N GLU A 138 8.465 -4.695 15.899 1.00 0.00 N ATOM 2121 CA GLU A 138 8.817 -3.855 17.039 1.00 0.00 C ATOM 2122 C GLU A 138 8.860 -2.376 16.652 1.00 0.00 C ATOM 2123 O GLU A 138 8.863 -1.502 17.520 1.00 0.00 O ATOM 2124 CB GLU A 138 10.158 -4.293 17.642 1.00 0.00 C ATOM 2125 CG GLU A 138 11.361 -4.044 16.745 1.00 0.00 C ATOM 2126 CD GLU A 138 12.458 -5.070 16.948 1.00 0.00 C ATOM 2127 OE1 GLU A 138 12.895 -5.253 18.103 1.00 0.00 O ATOM 2128 OE2 GLU A 138 12.879 -5.693 15.950 1.00 0.00 O ATOM 0 H GLU A 138 9.187 -5.362 15.627 1.00 0.00 H new ATOM 0 HA GLU A 138 8.040 -3.979 17.793 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.308 -3.767 18.585 1.00 0.00 H new ATOM 0 HB3 GLU A 138 10.108 -5.357 17.875 1.00 0.00 H new ATOM 0 HG2 GLU A 138 11.042 -4.059 15.703 1.00 0.00 H new ATOM 0 HG3 GLU A 138 11.758 -3.048 16.943 1.00 0.00 H new ATOM 2135 N GLN A 139 8.887 -2.096 15.350 1.00 0.00 N ATOM 2136 CA GLN A 139 8.921 -0.723 14.863 1.00 0.00 C ATOM 2137 C GLN A 139 7.914 -0.531 13.736 1.00 0.00 C ATOM 2138 O GLN A 139 8.046 0.392 12.946 1.00 0.00 O ATOM 2139 CB GLN A 139 10.316 -0.375 14.341 1.00 0.00 C ATOM 2140 CG GLN A 139 11.445 -1.192 14.949 1.00 0.00 C ATOM 2141 CD GLN A 139 12.681 -0.360 15.228 1.00 0.00 C ATOM 2142 OE1 GLN A 139 13.389 0.050 14.308 1.00 0.00 O ATOM 2143 NE2 GLN A 139 12.948 -0.106 16.503 1.00 0.00 N ATOM 0 H GLN A 139 8.886 -2.804 14.615 1.00 0.00 H new ATOM 0 HA GLN A 139 8.667 -0.067 15.695 1.00 0.00 H new ATOM 0 HB2 GLN A 139 10.329 -0.512 13.260 1.00 0.00 H new ATOM 0 HB3 GLN A 139 10.507 0.681 14.531 1.00 0.00 H new ATOM 0 HG2 GLN A 139 11.100 -1.647 15.878 1.00 0.00 H new ATOM 0 HG3 GLN A 139 11.705 -2.006 14.272 1.00 0.00 H new ATOM 0 HE21 GLN A 139 12.334 -0.466 17.234 1.00 0.00 H new ATOM 0 HE22 GLN A 139 13.767 0.449 16.752 1.00 0.00 H new ATOM 2152 N PHE A 140 6.931 -1.431 13.663 1.00 0.00 N ATOM 2153 CA PHE A 140 5.893 -1.415 12.617 1.00 0.00 C ATOM 2154 C PHE A 140 5.737 -0.075 11.911 1.00 0.00 C ATOM 2155 O PHE A 140 5.866 -0.019 10.690 1.00 0.00 O ATOM 2156 CB PHE A 140 4.566 -1.927 13.168 1.00 0.00 C ATOM 2157 CG PHE A 140 3.379 -1.663 12.283 1.00 0.00 C ATOM 2158 CD1 PHE A 140 2.657 -0.486 12.399 1.00 0.00 C ATOM 2159 CD2 PHE A 140 2.985 -2.595 11.338 1.00 0.00 C ATOM 2160 CE1 PHE A 140 1.564 -0.245 11.589 1.00 0.00 C ATOM 2161 CE2 PHE A 140 1.892 -2.359 10.525 1.00 0.00 C ATOM 2162 CZ PHE A 140 1.180 -1.182 10.651 1.00 0.00 C ATOM 0 H PHE A 140 6.828 -2.197 14.329 1.00 0.00 H new ATOM 0 HA PHE A 140 6.236 -2.098 11.840 1.00 0.00 H new ATOM 0 HB2 PHE A 140 4.647 -3.001 13.335 1.00 0.00 H new ATOM 0 HB3 PHE A 140 4.388 -1.466 14.140 1.00 0.00 H new ATOM 0 HD1 PHE A 140 2.952 0.251 13.131 1.00 0.00 H new ATOM 0 HD2 PHE A 140 3.538 -3.517 11.235 1.00 0.00 H new ATOM 0 HE1 PHE A 140 1.010 0.677 11.690 1.00 0.00 H new ATOM 0 HE2 PHE A 140 1.595 -3.094 9.792 1.00 0.00 H new ATOM 0 HZ PHE A 140 0.325 -0.995 10.017 1.00 0.00 H new ATOM 2172 N PRO A 141 5.492 1.030 12.624 1.00 0.00 N ATOM 2173 CA PRO A 141 5.377 2.329 11.965 1.00 0.00 C ATOM 2174 C PRO A 141 6.662 2.685 11.209 1.00 0.00 C ATOM 2175 O PRO A 141 6.776 3.776 10.653 1.00 0.00 O ATOM 2176 CB PRO A 141 5.145 3.311 13.118 1.00 0.00 C ATOM 2177 CG PRO A 141 5.586 2.585 14.347 1.00 0.00 C ATOM 2178 CD PRO A 141 5.336 1.126 14.083 1.00 0.00 C ATOM 0 HA PRO A 141 4.578 2.346 11.224 1.00 0.00 H new ATOM 0 HB2 PRO A 141 5.717 4.228 12.976 1.00 0.00 H new ATOM 0 HB3 PRO A 141 4.096 3.598 13.186 1.00 0.00 H new ATOM 0 HG2 PRO A 141 6.641 2.769 14.551 1.00 0.00 H new ATOM 0 HG3 PRO A 141 5.029 2.924 15.221 1.00 0.00 H new ATOM 0 HD2 PRO A 141 6.049 0.491 14.609 1.00 0.00 H new ATOM 0 HD3 PRO A 141 4.340 0.821 14.405 1.00 0.00 H new ATOM 2186 N TRP A 142 7.621 1.737 11.199 1.00 0.00 N ATOM 2187 CA TRP A 142 8.921 1.891 10.530 1.00 0.00 C ATOM 2188 C TRP A 142 9.161 3.319 10.041 1.00 0.00 C ATOM 2189 O TRP A 142 9.266 3.571 8.842 1.00 0.00 O ATOM 2190 CB TRP A 142 9.031 0.891 9.376 1.00 0.00 C ATOM 2191 CG TRP A 142 8.395 -0.436 9.691 1.00 0.00 C ATOM 2192 CD1 TRP A 142 8.574 -1.187 10.823 1.00 0.00 C ATOM 2193 CD2 TRP A 142 7.474 -1.164 8.870 1.00 0.00 C ATOM 2194 NE1 TRP A 142 7.801 -2.324 10.761 1.00 0.00 N ATOM 2195 CE2 TRP A 142 7.125 -2.335 9.570 1.00 0.00 C ATOM 2196 CE3 TRP A 142 6.904 -0.938 7.613 1.00 0.00 C ATOM 2197 CZ2 TRP A 142 6.235 -3.274 9.055 1.00 0.00 C ATOM 2198 CZ3 TRP A 142 6.021 -1.873 7.104 1.00 0.00 C ATOM 2199 CH2 TRP A 142 5.695 -3.027 7.824 1.00 0.00 C ATOM 0 H TRP A 142 7.510 0.835 11.661 1.00 0.00 H new ATOM 0 HA TRP A 142 9.699 1.682 11.264 1.00 0.00 H new ATOM 0 HB2 TRP A 142 8.559 1.313 8.489 1.00 0.00 H new ATOM 0 HB3 TRP A 142 10.083 0.736 9.134 1.00 0.00 H new ATOM 0 HD1 TRP A 142 9.226 -0.925 11.643 1.00 0.00 H new ATOM 0 HE1 TRP A 142 7.741 -3.041 11.484 1.00 0.00 H new ATOM 0 HE3 TRP A 142 7.149 -0.049 7.050 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 5.980 -4.166 9.609 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 5.576 -1.709 6.134 1.00 0.00 H new ATOM 0 HH2 TRP A 142 5.002 -3.738 7.398 1.00 0.00 H new ATOM 2210 N LYS A 143 9.241 4.244 10.992 1.00 0.00 N ATOM 2211 CA LYS A 143 9.461 5.654 10.684 1.00 0.00 C ATOM 2212 C LYS A 143 10.913 5.910 10.280 1.00 0.00 C ATOM 2213 O LYS A 143 11.671 4.970 10.056 1.00 0.00 O ATOM 2214 CB LYS A 143 9.096 6.529 11.889 1.00 0.00 C ATOM 2215 CG LYS A 143 7.931 5.996 12.710 1.00 0.00 C ATOM 2216 CD LYS A 143 8.412 5.241 13.941 1.00 0.00 C ATOM 2217 CE LYS A 143 7.836 5.829 15.219 1.00 0.00 C ATOM 2218 NZ LYS A 143 6.665 5.051 15.710 1.00 0.00 N ATOM 0 H LYS A 143 9.156 4.041 11.988 1.00 0.00 H new ATOM 0 HA LYS A 143 8.818 5.915 9.844 1.00 0.00 H new ATOM 0 HB2 LYS A 143 9.969 6.623 12.535 1.00 0.00 H new ATOM 0 HB3 LYS A 143 8.851 7.531 11.537 1.00 0.00 H new ATOM 0 HG2 LYS A 143 7.292 6.824 13.017 1.00 0.00 H new ATOM 0 HG3 LYS A 143 7.322 5.336 12.093 1.00 0.00 H new ATOM 0 HD2 LYS A 143 8.125 4.193 13.861 1.00 0.00 H new ATOM 0 HD3 LYS A 143 9.501 5.271 13.985 1.00 0.00 H new ATOM 0 HE2 LYS A 143 8.607 5.849 15.989 1.00 0.00 H new ATOM 0 HE3 LYS A 143 7.537 6.862 15.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 6.291 5.494 16.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 5.925 5.039 14.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 6.960 4.076 15.921 1.00 0.00 H new