USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 897 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 65 ASN : amide:sc= -0.0886 K(o=-0.83,f=-1.8) USER MOD Set 1.2: A 71 THR OG1 : rot 170:sc= 0.093 USER MOD Set 1.3: A 95 HIS : no HD1:sc= -0.836 K(o=-0.83,f=-5.7!) USER MOD Set 2.1: A 45 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 84 GLN : amide:sc= -0.313 X(o=-0.31,f=0.1) USER MOD Set 3.1: A 83 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 101 TYR OH : rot 150:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 HIS : no HD1:sc= -1.32 K(o=-1.3,f=-0.1) USER MOD Single : A 14 LYS NZ :NH3+ 166:sc=-0.00328 (180deg=-0.0842) USER MOD Single : A 21 THR OG1 : rot 56:sc= -1.36 USER MOD Single : A 22 SER OG : rot -44:sc= 0.118 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 70:sc= -1.95 USER MOD Single : A 48 SER OG : rot 23:sc= -2.57! USER MOD Single : A 52 THR OG1 : rot 150:sc= -0.0113 USER MOD Single : A 53 GLN : amide:sc= -1.28! X(o=-1.3!,f=-1) USER MOD Single : A 58 HIS : no HD1:sc= 0 X(o=0,f=-0.0096) USER MOD Single : A 60 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0558) USER MOD Single : A 62 HIS : no HD1:sc= -0.468 X(o=-0.47,f=-0.041) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 31:sc= 0.0887 USER MOD Single : A 73 CYS SG : rot -136:sc= 1.28 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc=-0.00324 X(o=-0.0032,f=0) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot -172:sc= 0.571 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 154:sc= 0 (180deg=-0.311) USER MOD Single : A 100 THR OG1 : rot 32:sc= 0.0835 USER MOD Single : A 108 ASN : amide:sc= -1.32 X(o=-1.3,f=-1.6!) USER MOD Single : A 109 SER OG : rot 12:sc= 0.935 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 CYS SG : rot 180:sc= -0.261 USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0.00169 USER MOD Single : A 126 SER OG : rot 180:sc= -0.101 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -21.757 -1.044 14.873 1.00 0.00 N ATOM 2 CA GLY A 1 -21.502 0.382 14.956 1.00 0.00 C ATOM 3 C GLY A 1 -20.129 0.693 15.519 1.00 0.00 C ATOM 4 O GLY A 1 -19.117 0.225 14.999 1.00 0.00 O ATOM 0 H1 GLY A 1 -22.707 -1.205 14.482 1.00 0.00 H new ATOM 0 H2 GLY A 1 -21.049 -1.488 14.254 1.00 0.00 H new ATOM 0 H3 GLY A 1 -21.698 -1.463 15.823 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -21.593 0.823 13.963 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -22.262 0.848 15.582 1.00 0.00 H new ATOM 8 N SER A 2 -20.095 1.487 16.584 1.00 0.00 N ATOM 9 CA SER A 2 -18.836 1.866 17.215 1.00 0.00 C ATOM 10 C SER A 2 -19.062 2.305 18.658 1.00 0.00 C ATOM 11 O SER A 2 -20.123 2.829 19.001 1.00 0.00 O ATOM 12 CB SER A 2 -18.164 2.992 16.426 1.00 0.00 C ATOM 13 OG SER A 2 -19.022 4.113 16.306 1.00 0.00 O ATOM 0 H SER A 2 -20.925 1.880 17.028 1.00 0.00 H new ATOM 0 HA SER A 2 -18.182 0.994 17.217 1.00 0.00 H new ATOM 0 HB2 SER A 2 -17.241 3.288 16.924 1.00 0.00 H new ATOM 0 HB3 SER A 2 -17.890 2.632 15.434 1.00 0.00 H new ATOM 0 HG SER A 2 -18.569 4.819 15.799 1.00 0.00 H new ATOM 19 N SER A 3 -18.057 2.089 19.501 1.00 0.00 N ATOM 20 CA SER A 3 -18.147 2.458 20.909 1.00 0.00 C ATOM 21 C SER A 3 -18.120 3.975 21.075 1.00 0.00 C ATOM 22 O SER A 3 -18.901 4.540 21.839 1.00 0.00 O ATOM 23 CB SER A 3 -16.997 1.828 21.697 1.00 0.00 C ATOM 24 OG SER A 3 -17.080 0.413 21.676 1.00 0.00 O ATOM 0 H SER A 3 -17.171 1.660 19.233 1.00 0.00 H new ATOM 0 HA SER A 3 -19.094 2.083 21.298 1.00 0.00 H new ATOM 0 HB2 SER A 3 -16.044 2.146 21.273 1.00 0.00 H new ATOM 0 HB3 SER A 3 -17.021 2.182 22.728 1.00 0.00 H new ATOM 0 HG SER A 3 -16.333 0.034 22.185 1.00 0.00 H new ATOM 30 N GLY A 4 -17.215 4.628 20.352 1.00 0.00 N ATOM 31 CA GLY A 4 -17.103 6.072 20.433 1.00 0.00 C ATOM 32 C GLY A 4 -16.724 6.547 21.821 1.00 0.00 C ATOM 33 O GLY A 4 -17.579 6.991 22.588 1.00 0.00 O ATOM 0 H GLY A 4 -16.558 4.182 19.712 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -16.356 6.416 19.718 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -18.052 6.524 20.144 1.00 0.00 H new ATOM 37 N SER A 5 -15.439 6.453 22.147 1.00 0.00 N ATOM 38 CA SER A 5 -14.949 6.872 23.456 1.00 0.00 C ATOM 39 C SER A 5 -13.530 7.424 23.354 1.00 0.00 C ATOM 40 O SER A 5 -12.667 6.831 22.706 1.00 0.00 O ATOM 41 CB SER A 5 -14.982 5.697 24.436 1.00 0.00 C ATOM 42 OG SER A 5 -16.313 5.371 24.796 1.00 0.00 O ATOM 0 H SER A 5 -14.718 6.091 21.523 1.00 0.00 H new ATOM 0 HA SER A 5 -15.602 7.663 23.825 1.00 0.00 H new ATOM 0 HB2 SER A 5 -14.501 4.829 23.985 1.00 0.00 H new ATOM 0 HB3 SER A 5 -14.411 5.949 25.330 1.00 0.00 H new ATOM 0 HG SER A 5 -16.307 4.616 25.421 1.00 0.00 H new ATOM 48 N SER A 6 -13.298 8.563 23.998 1.00 0.00 N ATOM 49 CA SER A 6 -11.985 9.198 23.977 1.00 0.00 C ATOM 50 C SER A 6 -11.755 10.010 25.249 1.00 0.00 C ATOM 51 O SER A 6 -12.668 10.201 26.050 1.00 0.00 O ATOM 52 CB SER A 6 -11.852 10.102 22.751 1.00 0.00 C ATOM 53 OG SER A 6 -12.788 11.166 22.797 1.00 0.00 O ATOM 0 H SER A 6 -14.001 9.065 24.540 1.00 0.00 H new ATOM 0 HA SER A 6 -11.230 8.414 23.925 1.00 0.00 H new ATOM 0 HB2 SER A 6 -10.841 10.505 22.701 1.00 0.00 H new ATOM 0 HB3 SER A 6 -12.007 9.516 21.845 1.00 0.00 H new ATOM 0 HG SER A 6 -12.681 11.730 22.003 1.00 0.00 H new ATOM 59 N GLY A 7 -10.526 10.485 25.426 1.00 0.00 N ATOM 60 CA GLY A 7 -10.196 11.270 26.601 1.00 0.00 C ATOM 61 C GLY A 7 -9.605 12.621 26.248 1.00 0.00 C ATOM 62 O GLY A 7 -8.670 13.087 26.900 1.00 0.00 O ATOM 0 H GLY A 7 -9.753 10.340 24.777 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -11.094 11.415 27.201 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -9.487 10.716 27.217 1.00 0.00 H new ATOM 66 N HIS A 8 -10.150 13.251 25.212 1.00 0.00 N ATOM 67 CA HIS A 8 -9.670 14.556 24.773 1.00 0.00 C ATOM 68 C HIS A 8 -10.612 15.161 23.736 1.00 0.00 C ATOM 69 O HIS A 8 -11.599 14.540 23.343 1.00 0.00 O ATOM 70 CB HIS A 8 -8.261 14.436 24.190 1.00 0.00 C ATOM 71 CG HIS A 8 -8.108 13.303 23.223 1.00 0.00 C ATOM 72 ND1 HIS A 8 -7.846 13.488 21.882 1.00 0.00 N ATOM 73 CD2 HIS A 8 -8.179 11.964 23.410 1.00 0.00 C ATOM 74 CE1 HIS A 8 -7.765 12.312 21.285 1.00 0.00 C ATOM 75 NE2 HIS A 8 -7.963 11.371 22.190 1.00 0.00 N ATOM 0 H HIS A 8 -10.924 12.879 24.661 1.00 0.00 H new ATOM 0 HA HIS A 8 -9.641 15.215 25.641 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -8.004 15.369 23.688 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -7.549 14.306 25.005 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -8.370 11.457 24.344 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -7.570 12.148 20.235 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -7.957 10.367 22.012 1.00 0.00 H new ATOM 83 N PHE A 9 -10.301 16.377 23.299 1.00 0.00 N ATOM 84 CA PHE A 9 -11.121 17.066 22.309 1.00 0.00 C ATOM 85 C PHE A 9 -11.442 16.147 21.134 1.00 0.00 C ATOM 86 O PHE A 9 -10.624 15.331 20.709 1.00 0.00 O ATOM 87 CB PHE A 9 -10.404 18.322 21.808 1.00 0.00 C ATOM 88 CG PHE A 9 -10.068 19.296 22.900 1.00 0.00 C ATOM 89 CD1 PHE A 9 -8.887 19.175 23.615 1.00 0.00 C ATOM 90 CD2 PHE A 9 -10.932 20.333 23.212 1.00 0.00 C ATOM 91 CE1 PHE A 9 -8.575 20.070 24.621 1.00 0.00 C ATOM 92 CE2 PHE A 9 -10.625 21.232 24.217 1.00 0.00 C ATOM 93 CZ PHE A 9 -9.445 21.100 24.922 1.00 0.00 C ATOM 0 H PHE A 9 -9.488 16.905 23.615 1.00 0.00 H new ATOM 0 HA PHE A 9 -12.057 17.356 22.787 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -9.486 18.028 21.299 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -11.033 18.819 21.069 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -8.203 18.372 23.383 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -11.856 20.441 22.664 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -7.652 19.964 25.171 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -11.307 22.036 24.450 1.00 0.00 H new ATOM 0 HZ PHE A 9 -9.203 21.801 25.707 1.00 0.00 H new ATOM 103 N PRO A 10 -12.664 16.281 20.596 1.00 0.00 N ATOM 104 CA PRO A 10 -13.123 15.472 19.463 1.00 0.00 C ATOM 105 C PRO A 10 -12.405 15.830 18.167 1.00 0.00 C ATOM 106 O PRO A 10 -12.721 15.297 17.103 1.00 0.00 O ATOM 107 CB PRO A 10 -14.612 15.815 19.363 1.00 0.00 C ATOM 108 CG PRO A 10 -14.730 17.171 19.967 1.00 0.00 C ATOM 109 CD PRO A 10 -13.690 17.233 21.052 1.00 0.00 C ATOM 0 HA PRO A 10 -12.925 14.411 19.613 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -14.950 15.813 18.327 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -15.222 15.088 19.899 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -14.562 17.947 19.220 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -15.728 17.332 20.374 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -13.284 18.239 21.163 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -14.102 16.947 22.020 1.00 0.00 H new ATOM 117 N ALA A 11 -11.438 16.737 18.262 1.00 0.00 N ATOM 118 CA ALA A 11 -10.674 17.164 17.096 1.00 0.00 C ATOM 119 C ALA A 11 -11.595 17.495 15.927 1.00 0.00 C ATOM 120 O ALA A 11 -11.434 16.965 14.828 1.00 0.00 O ATOM 121 CB ALA A 11 -9.676 16.088 16.696 1.00 0.00 C ATOM 0 H ALA A 11 -11.165 17.190 19.134 1.00 0.00 H new ATOM 0 HA ALA A 11 -10.128 18.069 17.362 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -9.113 16.420 15.824 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -8.990 15.903 17.522 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -10.209 15.169 16.454 1.00 0.00 H new ATOM 127 N ARG A 12 -12.562 18.373 16.172 1.00 0.00 N ATOM 128 CA ARG A 12 -13.510 18.773 15.139 1.00 0.00 C ATOM 129 C ARG A 12 -13.150 20.143 14.571 1.00 0.00 C ATOM 130 O ARG A 12 -14.020 20.989 14.363 1.00 0.00 O ATOM 131 CB ARG A 12 -14.931 18.802 15.705 1.00 0.00 C ATOM 132 CG ARG A 12 -15.650 17.466 15.614 1.00 0.00 C ATOM 133 CD ARG A 12 -17.009 17.516 16.295 1.00 0.00 C ATOM 134 NE ARG A 12 -16.919 18.040 17.656 1.00 0.00 N ATOM 135 CZ ARG A 12 -16.955 19.335 17.948 1.00 0.00 C ATOM 136 NH1 ARG A 12 -17.079 20.234 16.981 1.00 0.00 N ATOM 137 NH2 ARG A 12 -16.869 19.734 19.211 1.00 0.00 N ATOM 0 H ARG A 12 -12.710 18.821 17.076 1.00 0.00 H new ATOM 0 HA ARG A 12 -13.461 18.040 14.333 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -14.891 19.113 16.749 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -15.511 19.554 15.170 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -15.777 17.191 14.567 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -15.039 16.691 16.076 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -17.685 18.140 15.710 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -17.440 16.515 16.319 1.00 0.00 H new ATOM 0 HE ARG A 12 -16.823 17.375 18.423 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -17.147 19.932 16.009 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -17.106 21.228 17.209 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -16.775 19.046 19.958 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -16.897 20.729 19.435 1.00 0.00 H new ATOM 151 N VAL A 13 -11.862 20.354 14.322 1.00 0.00 N ATOM 152 CA VAL A 13 -11.386 21.620 13.777 1.00 0.00 C ATOM 153 C VAL A 13 -10.963 21.468 12.320 1.00 0.00 C ATOM 154 O VAL A 13 -10.220 20.550 11.970 1.00 0.00 O ATOM 155 CB VAL A 13 -10.199 22.170 14.590 1.00 0.00 C ATOM 156 CG1 VAL A 13 -9.671 23.452 13.964 1.00 0.00 C ATOM 157 CG2 VAL A 13 -10.606 22.403 16.037 1.00 0.00 C ATOM 0 H VAL A 13 -11.129 19.665 14.489 1.00 0.00 H new ATOM 0 HA VAL A 13 -12.217 22.323 13.839 1.00 0.00 H new ATOM 0 HB VAL A 13 -9.399 21.430 14.576 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -8.833 23.826 14.552 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -9.338 23.250 12.946 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.463 24.201 13.945 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -9.755 22.792 16.596 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -11.424 23.123 16.074 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -10.932 21.462 16.479 1.00 0.00 H new ATOM 167 N LYS A 14 -11.441 22.373 11.474 1.00 0.00 N ATOM 168 CA LYS A 14 -11.112 22.342 10.053 1.00 0.00 C ATOM 169 C LYS A 14 -9.602 22.312 9.845 1.00 0.00 C ATOM 170 O LYS A 14 -8.892 23.235 10.244 1.00 0.00 O ATOM 171 CB LYS A 14 -11.712 23.558 9.343 1.00 0.00 C ATOM 172 CG LYS A 14 -11.407 23.605 7.856 1.00 0.00 C ATOM 173 CD LYS A 14 -12.301 22.659 7.073 1.00 0.00 C ATOM 174 CE LYS A 14 -13.633 23.307 6.729 1.00 0.00 C ATOM 175 NZ LYS A 14 -13.496 24.313 5.639 1.00 0.00 N ATOM 0 H LYS A 14 -12.058 23.138 11.747 1.00 0.00 H new ATOM 0 HA LYS A 14 -11.538 21.434 9.627 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -12.793 23.554 9.484 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -11.333 24.466 9.812 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -11.542 24.622 7.488 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -10.363 23.341 7.689 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -11.796 22.355 6.156 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -12.475 21.755 7.656 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -14.343 22.538 6.426 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -14.043 23.788 7.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -14.438 24.557 5.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -13.037 25.169 6.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -12.917 23.917 4.871 1.00 0.00 H new ATOM 189 N VAL A 15 -9.116 21.246 9.217 1.00 0.00 N ATOM 190 CA VAL A 15 -7.690 21.098 8.953 1.00 0.00 C ATOM 191 C VAL A 15 -7.389 21.236 7.465 1.00 0.00 C ATOM 192 O VAL A 15 -8.010 20.576 6.633 1.00 0.00 O ATOM 193 CB VAL A 15 -7.166 19.736 9.448 1.00 0.00 C ATOM 194 CG1 VAL A 15 -7.832 18.600 8.687 1.00 0.00 C ATOM 195 CG2 VAL A 15 -5.653 19.666 9.311 1.00 0.00 C ATOM 0 H VAL A 15 -9.689 20.472 8.882 1.00 0.00 H new ATOM 0 HA VAL A 15 -7.183 21.894 9.498 1.00 0.00 H new ATOM 0 HB VAL A 15 -7.417 19.631 10.503 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -7.450 17.646 9.050 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -8.910 18.641 8.842 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.614 18.697 7.623 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.300 18.697 9.665 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -5.376 19.793 8.264 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.197 20.458 9.905 1.00 0.00 H new ATOM 205 N GLU A 16 -6.431 22.097 7.138 1.00 0.00 N ATOM 206 CA GLU A 16 -6.047 22.322 5.749 1.00 0.00 C ATOM 207 C GLU A 16 -4.690 21.692 5.451 1.00 0.00 C ATOM 208 O GLU A 16 -3.730 21.836 6.208 1.00 0.00 O ATOM 209 CB GLU A 16 -6.005 23.820 5.444 1.00 0.00 C ATOM 210 CG GLU A 16 -7.379 24.447 5.279 1.00 0.00 C ATOM 211 CD GLU A 16 -7.348 25.708 4.437 1.00 0.00 C ATOM 212 OE1 GLU A 16 -6.813 26.729 4.916 1.00 0.00 O ATOM 213 OE2 GLU A 16 -7.858 25.672 3.298 1.00 0.00 O ATOM 0 H GLU A 16 -5.906 22.650 7.816 1.00 0.00 H new ATOM 0 HA GLU A 16 -6.795 21.850 5.111 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -5.476 24.331 6.248 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -5.430 23.980 4.532 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -8.051 23.723 4.818 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -7.788 24.681 6.262 1.00 0.00 H new ATOM 220 N PRO A 17 -4.606 20.975 4.320 1.00 0.00 N ATOM 221 CA PRO A 17 -3.372 20.308 3.895 1.00 0.00 C ATOM 222 C PRO A 17 -2.297 21.300 3.461 1.00 0.00 C ATOM 223 O PRO A 17 -2.560 22.210 2.676 1.00 0.00 O ATOM 224 CB PRO A 17 -3.821 19.454 2.707 1.00 0.00 C ATOM 225 CG PRO A 17 -5.029 20.147 2.178 1.00 0.00 C ATOM 226 CD PRO A 17 -5.710 20.761 3.369 1.00 0.00 C ATOM 0 HA PRO A 17 -2.920 19.734 4.704 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -3.040 19.387 1.950 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -4.053 18.435 3.017 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -4.753 20.910 1.450 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -5.690 19.445 1.670 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -6.205 21.697 3.111 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -6.473 20.100 3.781 1.00 0.00 H new ATOM 234 N ALA A 18 -1.087 21.117 3.979 1.00 0.00 N ATOM 235 CA ALA A 18 0.028 21.994 3.643 1.00 0.00 C ATOM 236 C ALA A 18 0.901 21.380 2.554 1.00 0.00 C ATOM 237 O ALA A 18 2.034 21.809 2.337 1.00 0.00 O ATOM 238 CB ALA A 18 0.858 22.290 4.883 1.00 0.00 C ATOM 0 H ALA A 18 -0.854 20.370 4.633 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.380 22.929 3.260 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.687 22.946 4.618 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.233 22.779 5.631 1.00 0.00 H new ATOM 0 HB3 ALA A 18 1.249 21.358 5.290 1.00 0.00 H new ATOM 244 N VAL A 19 0.366 20.372 1.871 1.00 0.00 N ATOM 245 CA VAL A 19 1.097 19.699 0.804 1.00 0.00 C ATOM 246 C VAL A 19 0.153 19.236 -0.301 1.00 0.00 C ATOM 247 O VAL A 19 -1.043 19.054 -0.073 1.00 0.00 O ATOM 248 CB VAL A 19 1.879 18.485 1.338 1.00 0.00 C ATOM 249 CG1 VAL A 19 0.924 17.388 1.784 1.00 0.00 C ATOM 250 CG2 VAL A 19 2.843 17.966 0.282 1.00 0.00 C ATOM 0 H VAL A 19 -0.571 20.004 2.038 1.00 0.00 H new ATOM 0 HA VAL A 19 1.801 20.424 0.397 1.00 0.00 H new ATOM 0 HB VAL A 19 2.460 18.802 2.204 1.00 0.00 H new ATOM 0 HG11 VAL A 19 1.495 16.538 2.158 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.278 17.768 2.575 1.00 0.00 H new ATOM 0 HG13 VAL A 19 0.314 17.071 0.938 1.00 0.00 H new ATOM 0 HG21 VAL A 19 3.387 17.108 0.677 1.00 0.00 H new ATOM 0 HG22 VAL A 19 2.284 17.665 -0.604 1.00 0.00 H new ATOM 0 HG23 VAL A 19 3.549 18.753 0.016 1.00 0.00 H new ATOM 260 N ASP A 20 0.699 19.047 -1.497 1.00 0.00 N ATOM 261 CA ASP A 20 -0.094 18.603 -2.637 1.00 0.00 C ATOM 262 C ASP A 20 -0.484 17.136 -2.490 1.00 0.00 C ATOM 263 O ASP A 20 -1.664 16.804 -2.372 1.00 0.00 O ATOM 264 CB ASP A 20 0.685 18.809 -3.938 1.00 0.00 C ATOM 265 CG ASP A 20 0.738 20.265 -4.357 1.00 0.00 C ATOM 266 OD1 ASP A 20 0.730 21.140 -3.465 1.00 0.00 O ATOM 267 OD2 ASP A 20 0.789 20.530 -5.576 1.00 0.00 O ATOM 0 H ASP A 20 1.687 19.194 -1.702 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.005 19.200 -2.669 1.00 0.00 H new ATOM 0 HB2 ASP A 20 1.700 18.433 -3.814 1.00 0.00 H new ATOM 0 HB3 ASP A 20 0.223 18.222 -4.732 1.00 0.00 H new ATOM 272 N THR A 21 0.516 16.259 -2.500 1.00 0.00 N ATOM 273 CA THR A 21 0.278 14.827 -2.370 1.00 0.00 C ATOM 274 C THR A 21 -0.923 14.392 -3.202 1.00 0.00 C ATOM 275 O THR A 21 -1.815 13.702 -2.708 1.00 0.00 O ATOM 276 CB THR A 21 0.042 14.428 -0.901 1.00 0.00 C ATOM 277 OG1 THR A 21 -0.647 15.478 -0.213 1.00 0.00 O ATOM 278 CG2 THR A 21 1.361 14.137 -0.201 1.00 0.00 C ATOM 0 H THR A 21 1.498 16.516 -2.597 1.00 0.00 H new ATOM 0 HA THR A 21 1.172 14.323 -2.736 1.00 0.00 H new ATOM 0 HB THR A 21 -0.567 13.524 -0.886 1.00 0.00 H new ATOM 0 HG1 THR A 21 -1.483 15.682 -0.681 1.00 0.00 H new ATOM 0 HG21 THR A 21 1.169 13.857 0.835 1.00 0.00 H new ATOM 0 HG22 THR A 21 1.870 13.318 -0.710 1.00 0.00 H new ATOM 0 HG23 THR A 21 1.990 15.027 -0.226 1.00 0.00 H new ATOM 286 N SER A 22 -0.939 14.799 -4.467 1.00 0.00 N ATOM 287 CA SER A 22 -2.033 14.453 -5.367 1.00 0.00 C ATOM 288 C SER A 22 -1.504 13.780 -6.631 1.00 0.00 C ATOM 289 O SER A 22 -2.275 13.391 -7.509 1.00 0.00 O ATOM 290 CB SER A 22 -2.832 15.704 -5.738 1.00 0.00 C ATOM 291 OG SER A 22 -4.101 15.360 -6.265 1.00 0.00 O ATOM 0 H SER A 22 -0.207 15.368 -4.892 1.00 0.00 H new ATOM 0 HA SER A 22 -2.689 13.752 -4.850 1.00 0.00 H new ATOM 0 HB2 SER A 22 -2.959 16.333 -4.857 1.00 0.00 H new ATOM 0 HB3 SER A 22 -2.277 16.290 -6.471 1.00 0.00 H new ATOM 0 HG SER A 22 -4.001 14.626 -6.907 1.00 0.00 H new ATOM 297 N ARG A 23 -0.185 13.646 -6.715 1.00 0.00 N ATOM 298 CA ARG A 23 0.448 13.022 -7.870 1.00 0.00 C ATOM 299 C ARG A 23 1.423 11.933 -7.433 1.00 0.00 C ATOM 300 O ARG A 23 2.330 11.563 -8.180 1.00 0.00 O ATOM 301 CB ARG A 23 1.181 14.072 -8.707 1.00 0.00 C ATOM 302 CG ARG A 23 0.251 15.043 -9.416 1.00 0.00 C ATOM 303 CD ARG A 23 1.028 16.145 -10.119 1.00 0.00 C ATOM 304 NE ARG A 23 0.144 17.146 -10.710 1.00 0.00 N ATOM 305 CZ ARG A 23 -0.463 18.097 -10.008 1.00 0.00 C ATOM 306 NH1 ARG A 23 -0.282 18.175 -8.697 1.00 0.00 N ATOM 307 NH2 ARG A 23 -1.253 18.972 -10.617 1.00 0.00 N ATOM 0 H ARG A 23 0.467 13.961 -5.996 1.00 0.00 H new ATOM 0 HA ARG A 23 -0.333 12.564 -8.477 1.00 0.00 H new ATOM 0 HB2 ARG A 23 1.855 14.634 -8.060 1.00 0.00 H new ATOM 0 HB3 ARG A 23 1.799 13.566 -9.449 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -0.355 14.503 -10.143 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -0.436 15.484 -8.694 1.00 0.00 H new ATOM 0 HD2 ARG A 23 1.697 16.628 -9.407 1.00 0.00 H new ATOM 0 HD3 ARG A 23 1.653 15.708 -10.898 1.00 0.00 H new ATOM 0 HE ARG A 23 -0.016 17.113 -11.717 1.00 0.00 H new ATOM 0 HH11 ARG A 23 0.324 17.504 -8.225 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -0.749 18.906 -8.160 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -1.395 18.915 -11.625 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -1.718 19.701 -10.077 1.00 0.00 H new ATOM 321 N ILE A 24 1.230 11.424 -6.221 1.00 0.00 N ATOM 322 CA ILE A 24 2.092 10.378 -5.686 1.00 0.00 C ATOM 323 C ILE A 24 1.716 9.013 -6.252 1.00 0.00 C ATOM 324 O ILE A 24 0.590 8.546 -6.080 1.00 0.00 O ATOM 325 CB ILE A 24 2.021 10.321 -4.149 1.00 0.00 C ATOM 326 CG1 ILE A 24 2.576 11.612 -3.543 1.00 0.00 C ATOM 327 CG2 ILE A 24 2.786 9.113 -3.627 1.00 0.00 C ATOM 328 CD1 ILE A 24 2.787 11.535 -2.047 1.00 0.00 C ATOM 0 H ILE A 24 0.484 11.719 -5.591 1.00 0.00 H new ATOM 0 HA ILE A 24 3.111 10.625 -5.985 1.00 0.00 H new ATOM 0 HB ILE A 24 0.977 10.221 -3.852 1.00 0.00 H new ATOM 0 HG12 ILE A 24 3.525 11.851 -4.024 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.891 12.431 -3.764 1.00 0.00 H new ATOM 0 HG21 ILE A 24 2.726 9.087 -2.539 1.00 0.00 H new ATOM 0 HG22 ILE A 24 2.350 8.202 -4.036 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.830 9.184 -3.931 1.00 0.00 H new ATOM 0 HD11 ILE A 24 3.182 12.485 -1.686 1.00 0.00 H new ATOM 0 HD12 ILE A 24 1.837 11.327 -1.556 1.00 0.00 H new ATOM 0 HD13 ILE A 24 3.495 10.738 -1.820 1.00 0.00 H new ATOM 340 N LYS A 25 2.667 8.375 -6.927 1.00 0.00 N ATOM 341 CA LYS A 25 2.438 7.062 -7.516 1.00 0.00 C ATOM 342 C LYS A 25 3.244 5.991 -6.788 1.00 0.00 C ATOM 343 O LYS A 25 4.347 6.249 -6.307 1.00 0.00 O ATOM 344 CB LYS A 25 2.811 7.074 -9.000 1.00 0.00 C ATOM 345 CG LYS A 25 1.770 7.740 -9.883 1.00 0.00 C ATOM 346 CD LYS A 25 2.383 8.263 -11.171 1.00 0.00 C ATOM 347 CE LYS A 25 1.376 9.063 -11.984 1.00 0.00 C ATOM 348 NZ LYS A 25 1.837 9.275 -13.384 1.00 0.00 N ATOM 0 H LYS A 25 3.604 8.747 -7.079 1.00 0.00 H new ATOM 0 HA LYS A 25 1.379 6.826 -7.415 1.00 0.00 H new ATOM 0 HB2 LYS A 25 3.763 7.590 -9.123 1.00 0.00 H new ATOM 0 HB3 LYS A 25 2.959 6.048 -9.337 1.00 0.00 H new ATOM 0 HG2 LYS A 25 0.981 7.026 -10.118 1.00 0.00 H new ATOM 0 HG3 LYS A 25 1.304 8.563 -9.341 1.00 0.00 H new ATOM 0 HD2 LYS A 25 3.243 8.890 -10.937 1.00 0.00 H new ATOM 0 HD3 LYS A 25 2.750 7.427 -11.766 1.00 0.00 H new ATOM 0 HE2 LYS A 25 0.419 8.541 -11.992 1.00 0.00 H new ATOM 0 HE3 LYS A 25 1.209 10.028 -11.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 1.124 9.824 -13.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 2.738 9.795 -13.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 1.972 8.354 -13.848 1.00 0.00 H new ATOM 362 N VAL A 26 2.685 4.787 -6.710 1.00 0.00 N ATOM 363 CA VAL A 26 3.353 3.676 -6.043 1.00 0.00 C ATOM 364 C VAL A 26 3.309 2.414 -6.898 1.00 0.00 C ATOM 365 O VAL A 26 2.237 1.957 -7.295 1.00 0.00 O ATOM 366 CB VAL A 26 2.713 3.377 -4.674 1.00 0.00 C ATOM 367 CG1 VAL A 26 2.718 4.622 -3.799 1.00 0.00 C ATOM 368 CG2 VAL A 26 1.299 2.845 -4.852 1.00 0.00 C ATOM 0 H VAL A 26 1.771 4.557 -7.101 1.00 0.00 H new ATOM 0 HA VAL A 26 4.391 3.974 -5.894 1.00 0.00 H new ATOM 0 HB VAL A 26 3.305 2.610 -4.175 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.262 4.392 -2.836 1.00 0.00 H new ATOM 0 HG12 VAL A 26 3.745 4.954 -3.644 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.151 5.413 -4.289 1.00 0.00 H new ATOM 0 HG21 VAL A 26 0.862 2.639 -3.875 1.00 0.00 H new ATOM 0 HG22 VAL A 26 0.693 3.588 -5.371 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.327 1.926 -5.438 1.00 0.00 H new ATOM 378 N PHE A 27 4.482 1.855 -7.178 1.00 0.00 N ATOM 379 CA PHE A 27 4.578 0.646 -7.987 1.00 0.00 C ATOM 380 C PHE A 27 5.367 -0.436 -7.256 1.00 0.00 C ATOM 381 O PHE A 27 6.330 -0.146 -6.547 1.00 0.00 O ATOM 382 CB PHE A 27 5.241 0.957 -9.330 1.00 0.00 C ATOM 383 CG PHE A 27 6.409 1.895 -9.220 1.00 0.00 C ATOM 384 CD1 PHE A 27 6.224 3.265 -9.305 1.00 0.00 C ATOM 385 CD2 PHE A 27 7.692 1.406 -9.031 1.00 0.00 C ATOM 386 CE1 PHE A 27 7.297 4.131 -9.203 1.00 0.00 C ATOM 387 CE2 PHE A 27 8.768 2.267 -8.928 1.00 0.00 C ATOM 388 CZ PHE A 27 8.570 3.631 -9.015 1.00 0.00 C ATOM 0 H PHE A 27 5.379 2.220 -6.857 1.00 0.00 H new ATOM 0 HA PHE A 27 3.568 0.277 -8.165 1.00 0.00 H new ATOM 0 HB2 PHE A 27 5.576 0.025 -9.785 1.00 0.00 H new ATOM 0 HB3 PHE A 27 4.499 1.391 -10.000 1.00 0.00 H new ATOM 0 HD1 PHE A 27 5.230 3.661 -9.453 1.00 0.00 H new ATOM 0 HD2 PHE A 27 7.853 0.340 -8.963 1.00 0.00 H new ATOM 0 HE1 PHE A 27 7.139 5.197 -9.270 1.00 0.00 H new ATOM 0 HE2 PHE A 27 9.763 1.874 -8.780 1.00 0.00 H new ATOM 0 HZ PHE A 27 9.410 4.306 -8.936 1.00 0.00 H new ATOM 398 N GLY A 28 4.951 -1.687 -7.434 1.00 0.00 N ATOM 399 CA GLY A 28 5.629 -2.794 -6.785 1.00 0.00 C ATOM 400 C GLY A 28 4.661 -3.788 -6.174 1.00 0.00 C ATOM 401 O GLY A 28 3.473 -3.511 -6.014 1.00 0.00 O ATOM 0 H GLY A 28 4.157 -1.953 -8.016 1.00 0.00 H new ATOM 0 HA2 GLY A 28 6.260 -3.306 -7.511 1.00 0.00 H new ATOM 0 HA3 GLY A 28 6.287 -2.407 -6.007 1.00 0.00 H new ATOM 405 N PRO A 29 5.172 -4.978 -5.824 1.00 0.00 N ATOM 406 CA PRO A 29 4.362 -6.042 -5.224 1.00 0.00 C ATOM 407 C PRO A 29 3.921 -5.703 -3.804 1.00 0.00 C ATOM 408 O PRO A 29 2.807 -6.029 -3.395 1.00 0.00 O ATOM 409 CB PRO A 29 5.306 -7.246 -5.218 1.00 0.00 C ATOM 410 CG PRO A 29 6.673 -6.656 -5.203 1.00 0.00 C ATOM 411 CD PRO A 29 6.580 -5.376 -5.987 1.00 0.00 C ATOM 0 HA PRO A 29 3.437 -6.211 -5.776 1.00 0.00 H new ATOM 0 HB2 PRO A 29 5.138 -7.877 -4.345 1.00 0.00 H new ATOM 0 HB3 PRO A 29 5.155 -7.872 -6.097 1.00 0.00 H new ATOM 0 HG2 PRO A 29 7.005 -6.465 -4.182 1.00 0.00 H new ATOM 0 HG3 PRO A 29 7.397 -7.337 -5.651 1.00 0.00 H new ATOM 0 HD2 PRO A 29 7.260 -4.617 -5.599 1.00 0.00 H new ATOM 0 HD3 PRO A 29 6.836 -5.527 -7.036 1.00 0.00 H new ATOM 419 N GLY A 30 4.802 -5.045 -3.056 1.00 0.00 N ATOM 420 CA GLY A 30 4.484 -4.673 -1.690 1.00 0.00 C ATOM 421 C GLY A 30 3.234 -3.821 -1.597 1.00 0.00 C ATOM 422 O GLY A 30 2.645 -3.688 -0.524 1.00 0.00 O ATOM 0 H GLY A 30 5.730 -4.763 -3.372 1.00 0.00 H new ATOM 0 HA2 GLY A 30 4.350 -5.575 -1.093 1.00 0.00 H new ATOM 0 HA3 GLY A 30 5.324 -4.128 -1.260 1.00 0.00 H new ATOM 426 N ILE A 31 2.829 -3.243 -2.722 1.00 0.00 N ATOM 427 CA ILE A 31 1.641 -2.399 -2.762 1.00 0.00 C ATOM 428 C ILE A 31 0.595 -2.967 -3.716 1.00 0.00 C ATOM 429 O ILE A 31 -0.592 -2.662 -3.604 1.00 0.00 O ATOM 430 CB ILE A 31 1.985 -0.962 -3.194 1.00 0.00 C ATOM 431 CG1 ILE A 31 0.855 -0.005 -2.808 1.00 0.00 C ATOM 432 CG2 ILE A 31 2.246 -0.906 -4.692 1.00 0.00 C ATOM 433 CD1 ILE A 31 0.710 0.188 -1.315 1.00 0.00 C ATOM 0 H ILE A 31 3.306 -3.343 -3.618 1.00 0.00 H new ATOM 0 HA ILE A 31 1.235 -2.378 -1.751 1.00 0.00 H new ATOM 0 HB ILE A 31 2.892 -0.651 -2.676 1.00 0.00 H new ATOM 0 HG12 ILE A 31 1.034 0.963 -3.276 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.085 -0.384 -3.210 1.00 0.00 H new ATOM 0 HG21 ILE A 31 2.488 0.117 -4.981 1.00 0.00 H new ATOM 0 HG22 ILE A 31 3.081 -1.560 -4.940 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.356 -1.234 -5.229 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.110 0.878 -1.115 1.00 0.00 H new ATOM 0 HD12 ILE A 31 0.500 -0.772 -0.843 1.00 0.00 H new ATOM 0 HD13 ILE A 31 1.636 0.597 -0.909 1.00 0.00 H new ATOM 445 N GLU A 32 1.045 -3.797 -4.652 1.00 0.00 N ATOM 446 CA GLU A 32 0.147 -4.409 -5.625 1.00 0.00 C ATOM 447 C GLU A 32 -0.423 -5.720 -5.090 1.00 0.00 C ATOM 448 O GLU A 32 -1.638 -5.902 -5.028 1.00 0.00 O ATOM 449 CB GLU A 32 0.881 -4.660 -6.943 1.00 0.00 C ATOM 450 CG GLU A 32 1.173 -3.392 -7.728 1.00 0.00 C ATOM 451 CD GLU A 32 0.057 -3.031 -8.688 1.00 0.00 C ATOM 452 OE1 GLU A 32 -0.695 -3.942 -9.094 1.00 0.00 O ATOM 453 OE2 GLU A 32 -0.064 -1.837 -9.035 1.00 0.00 O ATOM 0 H GLU A 32 2.025 -4.061 -4.757 1.00 0.00 H new ATOM 0 HA GLU A 32 -0.678 -3.719 -5.803 1.00 0.00 H new ATOM 0 HB2 GLU A 32 1.820 -5.172 -6.734 1.00 0.00 H new ATOM 0 HB3 GLU A 32 0.283 -5.330 -7.561 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.331 -2.567 -7.033 1.00 0.00 H new ATOM 0 HG3 GLU A 32 2.100 -3.520 -8.286 1.00 0.00 H new ATOM 460 N GLY A 33 0.465 -6.631 -4.705 1.00 0.00 N ATOM 461 CA GLY A 33 0.033 -7.914 -4.181 1.00 0.00 C ATOM 462 C GLY A 33 0.450 -9.072 -5.065 1.00 0.00 C ATOM 463 O GLY A 33 -0.307 -10.025 -5.252 1.00 0.00 O ATOM 0 H GLY A 33 1.476 -6.504 -4.746 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.449 -8.054 -3.184 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -1.052 -7.913 -4.076 1.00 0.00 H new ATOM 467 N LYS A 34 1.658 -8.990 -5.613 1.00 0.00 N ATOM 468 CA LYS A 34 2.176 -10.039 -6.484 1.00 0.00 C ATOM 469 C LYS A 34 3.000 -11.047 -5.690 1.00 0.00 C ATOM 470 O LYS A 34 2.580 -12.188 -5.492 1.00 0.00 O ATOM 471 CB LYS A 34 3.030 -9.430 -7.598 1.00 0.00 C ATOM 472 CG LYS A 34 2.554 -8.060 -8.050 1.00 0.00 C ATOM 473 CD LYS A 34 2.786 -7.852 -9.537 1.00 0.00 C ATOM 474 CE LYS A 34 1.851 -6.794 -10.104 1.00 0.00 C ATOM 475 NZ LYS A 34 2.126 -6.525 -11.543 1.00 0.00 N ATOM 0 H LYS A 34 2.297 -8.208 -5.469 1.00 0.00 H new ATOM 0 HA LYS A 34 1.328 -10.560 -6.929 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.061 -9.351 -7.252 1.00 0.00 H new ATOM 0 HB3 LYS A 34 3.031 -10.105 -8.454 1.00 0.00 H new ATOM 0 HG2 LYS A 34 1.492 -7.951 -7.828 1.00 0.00 H new ATOM 0 HG3 LYS A 34 3.078 -7.288 -7.487 1.00 0.00 H new ATOM 0 HD2 LYS A 34 3.821 -7.554 -9.707 1.00 0.00 H new ATOM 0 HD3 LYS A 34 2.635 -8.793 -10.065 1.00 0.00 H new ATOM 0 HE2 LYS A 34 0.818 -7.122 -9.987 1.00 0.00 H new ATOM 0 HE3 LYS A 34 1.959 -5.871 -9.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 1.468 -5.799 -11.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 3.104 -6.188 -11.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 1.998 -7.400 -12.090 1.00 0.00 H new ATOM 489 N ASP A 35 4.173 -10.619 -5.237 1.00 0.00 N ATOM 490 CA ASP A 35 5.055 -11.485 -4.462 1.00 0.00 C ATOM 491 C ASP A 35 4.951 -11.172 -2.973 1.00 0.00 C ATOM 492 O ASP A 35 5.931 -11.280 -2.235 1.00 0.00 O ATOM 493 CB ASP A 35 6.502 -11.324 -4.930 1.00 0.00 C ATOM 494 CG ASP A 35 6.688 -11.718 -6.382 1.00 0.00 C ATOM 495 OD1 ASP A 35 6.109 -12.743 -6.797 1.00 0.00 O ATOM 496 OD2 ASP A 35 7.414 -11.001 -7.103 1.00 0.00 O ATOM 0 H ASP A 35 4.535 -9.678 -5.393 1.00 0.00 H new ATOM 0 HA ASP A 35 4.743 -12.517 -4.621 1.00 0.00 H new ATOM 0 HB2 ASP A 35 6.811 -10.287 -4.795 1.00 0.00 H new ATOM 0 HB3 ASP A 35 7.153 -11.935 -4.305 1.00 0.00 H new ATOM 501 N VAL A 36 3.757 -10.783 -2.536 1.00 0.00 N ATOM 502 CA VAL A 36 3.525 -10.454 -1.135 1.00 0.00 C ATOM 503 C VAL A 36 3.087 -11.684 -0.348 1.00 0.00 C ATOM 504 O VAL A 36 2.497 -11.569 0.727 1.00 0.00 O ATOM 505 CB VAL A 36 2.457 -9.355 -0.986 1.00 0.00 C ATOM 506 CG1 VAL A 36 2.475 -8.780 0.422 1.00 0.00 C ATOM 507 CG2 VAL A 36 2.671 -8.261 -2.020 1.00 0.00 C ATOM 0 H VAL A 36 2.935 -10.688 -3.133 1.00 0.00 H new ATOM 0 HA VAL A 36 4.470 -10.087 -0.735 1.00 0.00 H new ATOM 0 HB VAL A 36 1.477 -9.800 -1.158 1.00 0.00 H new ATOM 0 HG11 VAL A 36 1.714 -8.005 0.508 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.269 -9.573 1.141 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.455 -8.350 0.627 1.00 0.00 H new ATOM 0 HG21 VAL A 36 1.907 -7.493 -1.900 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.657 -7.817 -1.882 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.602 -8.688 -3.021 1.00 0.00 H new ATOM 517 N PHE A 37 3.379 -12.862 -0.889 1.00 0.00 N ATOM 518 CA PHE A 37 3.015 -14.115 -0.238 1.00 0.00 C ATOM 519 C PHE A 37 3.366 -14.078 1.247 1.00 0.00 C ATOM 520 O PHE A 37 4.305 -13.395 1.657 1.00 0.00 O ATOM 521 CB PHE A 37 3.724 -15.290 -0.913 1.00 0.00 C ATOM 522 CG PHE A 37 3.759 -15.190 -2.411 1.00 0.00 C ATOM 523 CD1 PHE A 37 2.586 -15.225 -3.148 1.00 0.00 C ATOM 524 CD2 PHE A 37 4.964 -15.061 -3.082 1.00 0.00 C ATOM 525 CE1 PHE A 37 2.614 -15.132 -4.527 1.00 0.00 C ATOM 526 CE2 PHE A 37 4.998 -14.967 -4.461 1.00 0.00 C ATOM 527 CZ PHE A 37 3.822 -15.004 -5.184 1.00 0.00 C ATOM 0 H PHE A 37 3.867 -12.975 -1.777 1.00 0.00 H new ATOM 0 HA PHE A 37 1.937 -14.247 -0.335 1.00 0.00 H new ATOM 0 HB2 PHE A 37 4.745 -15.352 -0.537 1.00 0.00 H new ATOM 0 HB3 PHE A 37 3.224 -16.216 -0.630 1.00 0.00 H new ATOM 0 HD1 PHE A 37 1.639 -15.326 -2.639 1.00 0.00 H new ATOM 0 HD2 PHE A 37 5.887 -15.034 -2.522 1.00 0.00 H new ATOM 0 HE1 PHE A 37 1.693 -15.159 -5.090 1.00 0.00 H new ATOM 0 HE2 PHE A 37 5.944 -14.865 -4.972 1.00 0.00 H new ATOM 0 HZ PHE A 37 3.847 -14.933 -6.261 1.00 0.00 H new ATOM 537 N ARG A 38 2.605 -14.817 2.047 1.00 0.00 N ATOM 538 CA ARG A 38 2.834 -14.869 3.486 1.00 0.00 C ATOM 539 C ARG A 38 4.274 -15.269 3.793 1.00 0.00 C ATOM 540 O ARG A 38 4.841 -16.137 3.131 1.00 0.00 O ATOM 541 CB ARG A 38 1.868 -15.856 4.143 1.00 0.00 C ATOM 542 CG ARG A 38 1.729 -15.665 5.644 1.00 0.00 C ATOM 543 CD ARG A 38 0.886 -16.765 6.270 1.00 0.00 C ATOM 544 NE ARG A 38 0.955 -16.744 7.729 1.00 0.00 N ATOM 545 CZ ARG A 38 0.580 -17.761 8.497 1.00 0.00 C ATOM 546 NH1 ARG A 38 0.113 -18.874 7.948 1.00 0.00 N ATOM 547 NH2 ARG A 38 0.673 -17.666 9.817 1.00 0.00 N ATOM 0 H ARG A 38 1.824 -15.388 1.723 1.00 0.00 H new ATOM 0 HA ARG A 38 2.657 -13.873 3.893 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.887 -15.753 3.680 1.00 0.00 H new ATOM 0 HB3 ARG A 38 2.209 -16.872 3.945 1.00 0.00 H new ATOM 0 HG2 ARG A 38 2.717 -15.656 6.104 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.274 -14.696 5.848 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -0.151 -16.651 5.954 1.00 0.00 H new ATOM 0 HD3 ARG A 38 1.226 -17.734 5.905 1.00 0.00 H new ATOM 0 HE ARG A 38 1.311 -15.903 8.183 1.00 0.00 H new ATOM 0 HH11 ARG A 38 0.041 -18.951 6.933 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -0.174 -19.653 8.540 1.00 0.00 H new ATOM 0 HH21 ARG A 38 1.033 -16.812 10.243 1.00 0.00 H new ATOM 0 HH22 ARG A 38 0.385 -18.447 10.406 1.00 0.00 H new ATOM 561 N GLU A 39 4.859 -14.628 4.801 1.00 0.00 N ATOM 562 CA GLU A 39 6.233 -14.917 5.195 1.00 0.00 C ATOM 563 C GLU A 39 7.199 -14.626 4.050 1.00 0.00 C ATOM 564 O GLU A 39 8.251 -15.255 3.936 1.00 0.00 O ATOM 565 CB GLU A 39 6.366 -16.378 5.630 1.00 0.00 C ATOM 566 CG GLU A 39 5.717 -16.675 6.971 1.00 0.00 C ATOM 567 CD GLU A 39 6.549 -16.190 8.142 1.00 0.00 C ATOM 568 OE1 GLU A 39 7.107 -15.076 8.051 1.00 0.00 O ATOM 569 OE2 GLU A 39 6.642 -16.922 9.149 1.00 0.00 O ATOM 0 H GLU A 39 4.403 -13.906 5.359 1.00 0.00 H new ATOM 0 HA GLU A 39 6.487 -14.271 6.035 1.00 0.00 H new ATOM 0 HB2 GLU A 39 5.918 -17.017 4.869 1.00 0.00 H new ATOM 0 HB3 GLU A 39 7.423 -16.638 5.682 1.00 0.00 H new ATOM 0 HG2 GLU A 39 4.735 -16.203 7.008 1.00 0.00 H new ATOM 0 HG3 GLU A 39 5.558 -17.749 7.063 1.00 0.00 H new ATOM 576 N ALA A 40 6.833 -13.669 3.204 1.00 0.00 N ATOM 577 CA ALA A 40 7.667 -13.293 2.069 1.00 0.00 C ATOM 578 C ALA A 40 8.122 -11.841 2.179 1.00 0.00 C ATOM 579 O ALA A 40 7.413 -10.997 2.729 1.00 0.00 O ATOM 580 CB ALA A 40 6.916 -13.515 0.765 1.00 0.00 C ATOM 0 H ALA A 40 5.965 -13.140 3.283 1.00 0.00 H new ATOM 0 HA ALA A 40 8.554 -13.926 2.077 1.00 0.00 H new ATOM 0 HB1 ALA A 40 7.551 -13.230 -0.074 1.00 0.00 H new ATOM 0 HB2 ALA A 40 6.647 -14.567 0.675 1.00 0.00 H new ATOM 0 HB3 ALA A 40 6.011 -12.907 0.758 1.00 0.00 H new ATOM 586 N THR A 41 9.309 -11.556 1.652 1.00 0.00 N ATOM 587 CA THR A 41 9.858 -10.207 1.693 1.00 0.00 C ATOM 588 C THR A 41 9.358 -9.374 0.519 1.00 0.00 C ATOM 589 O THR A 41 9.855 -9.496 -0.601 1.00 0.00 O ATOM 590 CB THR A 41 11.399 -10.227 1.673 1.00 0.00 C ATOM 591 OG1 THR A 41 11.892 -11.004 2.770 1.00 0.00 O ATOM 592 CG2 THR A 41 11.959 -8.815 1.752 1.00 0.00 C ATOM 0 H THR A 41 9.908 -12.242 1.192 1.00 0.00 H new ATOM 0 HA THR A 41 9.519 -9.756 2.626 1.00 0.00 H new ATOM 0 HB THR A 41 11.723 -10.677 0.735 1.00 0.00 H new ATOM 0 HG1 THR A 41 12.872 -11.014 2.750 1.00 0.00 H new ATOM 0 HG21 THR A 41 13.048 -8.854 1.736 1.00 0.00 H new ATOM 0 HG22 THR A 41 11.604 -8.235 0.900 1.00 0.00 H new ATOM 0 HG23 THR A 41 11.626 -8.343 2.676 1.00 0.00 H new ATOM 600 N THR A 42 8.369 -8.524 0.781 1.00 0.00 N ATOM 601 CA THR A 42 7.801 -7.670 -0.254 1.00 0.00 C ATOM 602 C THR A 42 8.029 -6.196 0.062 1.00 0.00 C ATOM 603 O THR A 42 7.965 -5.783 1.220 1.00 0.00 O ATOM 604 CB THR A 42 6.290 -7.919 -0.421 1.00 0.00 C ATOM 605 OG1 THR A 42 5.813 -7.268 -1.604 1.00 0.00 O ATOM 606 CG2 THR A 42 5.521 -7.410 0.789 1.00 0.00 C ATOM 0 H THR A 42 7.945 -8.409 1.702 1.00 0.00 H new ATOM 0 HA THR A 42 8.309 -7.922 -1.185 1.00 0.00 H new ATOM 0 HB THR A 42 6.129 -8.993 -0.509 1.00 0.00 H new ATOM 0 HG1 THR A 42 6.166 -7.727 -2.395 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.456 -7.597 0.648 1.00 0.00 H new ATOM 0 HG22 THR A 42 5.865 -7.929 1.684 1.00 0.00 H new ATOM 0 HG23 THR A 42 5.690 -6.339 0.903 1.00 0.00 H new ATOM 614 N ASP A 43 8.295 -5.408 -0.974 1.00 0.00 N ATOM 615 CA ASP A 43 8.531 -3.979 -0.806 1.00 0.00 C ATOM 616 C ASP A 43 8.080 -3.205 -2.041 1.00 0.00 C ATOM 617 O ASP A 43 8.018 -3.753 -3.142 1.00 0.00 O ATOM 618 CB ASP A 43 10.013 -3.713 -0.536 1.00 0.00 C ATOM 619 CG ASP A 43 10.903 -4.193 -1.666 1.00 0.00 C ATOM 620 OD1 ASP A 43 10.397 -4.338 -2.799 1.00 0.00 O ATOM 621 OD2 ASP A 43 12.104 -4.424 -1.418 1.00 0.00 O ATOM 0 H ASP A 43 8.353 -5.735 -1.939 1.00 0.00 H new ATOM 0 HA ASP A 43 7.947 -3.638 0.049 1.00 0.00 H new ATOM 0 HB2 ASP A 43 10.166 -2.644 -0.386 1.00 0.00 H new ATOM 0 HB3 ASP A 43 10.306 -4.210 0.389 1.00 0.00 H new ATOM 626 N PHE A 44 7.764 -1.928 -1.851 1.00 0.00 N ATOM 627 CA PHE A 44 7.316 -1.080 -2.949 1.00 0.00 C ATOM 628 C PHE A 44 8.170 0.182 -3.044 1.00 0.00 C ATOM 629 O PHE A 44 9.003 0.450 -2.177 1.00 0.00 O ATOM 630 CB PHE A 44 5.846 -0.701 -2.761 1.00 0.00 C ATOM 631 CG PHE A 44 5.558 -0.051 -1.438 1.00 0.00 C ATOM 632 CD1 PHE A 44 5.373 -0.820 -0.300 1.00 0.00 C ATOM 633 CD2 PHE A 44 5.472 1.327 -1.333 1.00 0.00 C ATOM 634 CE1 PHE A 44 5.107 -0.224 0.919 1.00 0.00 C ATOM 635 CE2 PHE A 44 5.207 1.929 -0.116 1.00 0.00 C ATOM 636 CZ PHE A 44 5.025 1.151 1.011 1.00 0.00 C ATOM 0 H PHE A 44 7.810 -1.458 -0.947 1.00 0.00 H new ATOM 0 HA PHE A 44 7.424 -1.642 -3.877 1.00 0.00 H new ATOM 0 HB2 PHE A 44 5.549 -0.024 -3.562 1.00 0.00 H new ATOM 0 HB3 PHE A 44 5.233 -1.597 -2.857 1.00 0.00 H new ATOM 0 HD1 PHE A 44 5.437 -1.896 -0.366 1.00 0.00 H new ATOM 0 HD2 PHE A 44 5.613 1.939 -2.212 1.00 0.00 H new ATOM 0 HE1 PHE A 44 4.963 -0.834 1.799 1.00 0.00 H new ATOM 0 HE2 PHE A 44 5.143 3.005 -0.047 1.00 0.00 H new ATOM 0 HZ PHE A 44 4.819 1.618 1.963 1.00 0.00 H new ATOM 646 N THR A 45 7.957 0.955 -4.105 1.00 0.00 N ATOM 647 CA THR A 45 8.706 2.187 -4.315 1.00 0.00 C ATOM 648 C THR A 45 7.770 3.372 -4.519 1.00 0.00 C ATOM 649 O THR A 45 6.867 3.326 -5.355 1.00 0.00 O ATOM 650 CB THR A 45 9.644 2.073 -5.532 1.00 0.00 C ATOM 651 OG1 THR A 45 10.429 0.879 -5.435 1.00 0.00 O ATOM 652 CG2 THR A 45 10.560 3.283 -5.625 1.00 0.00 C ATOM 0 H THR A 45 7.272 0.749 -4.832 1.00 0.00 H new ATOM 0 HA THR A 45 9.304 2.350 -3.418 1.00 0.00 H new ATOM 0 HB THR A 45 9.031 2.032 -6.433 1.00 0.00 H new ATOM 0 HG1 THR A 45 11.022 0.813 -6.213 1.00 0.00 H new ATOM 0 HG21 THR A 45 11.213 3.179 -6.492 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.960 4.187 -5.729 1.00 0.00 H new ATOM 0 HG23 THR A 45 11.165 3.351 -4.721 1.00 0.00 H new ATOM 660 N VAL A 46 7.991 4.434 -3.751 1.00 0.00 N ATOM 661 CA VAL A 46 7.167 5.633 -3.849 1.00 0.00 C ATOM 662 C VAL A 46 7.887 6.733 -4.621 1.00 0.00 C ATOM 663 O VAL A 46 8.961 7.183 -4.224 1.00 0.00 O ATOM 664 CB VAL A 46 6.784 6.166 -2.455 1.00 0.00 C ATOM 665 CG1 VAL A 46 5.942 7.427 -2.579 1.00 0.00 C ATOM 666 CG2 VAL A 46 6.047 5.099 -1.661 1.00 0.00 C ATOM 0 H VAL A 46 8.734 4.489 -3.054 1.00 0.00 H new ATOM 0 HA VAL A 46 6.260 5.351 -4.384 1.00 0.00 H new ATOM 0 HB VAL A 46 7.698 6.419 -1.918 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.681 7.789 -1.585 1.00 0.00 H new ATOM 0 HG12 VAL A 46 6.510 8.193 -3.107 1.00 0.00 H new ATOM 0 HG13 VAL A 46 5.031 7.203 -3.134 1.00 0.00 H new ATOM 0 HG21 VAL A 46 5.784 5.493 -0.679 1.00 0.00 H new ATOM 0 HG22 VAL A 46 5.139 4.812 -2.192 1.00 0.00 H new ATOM 0 HG23 VAL A 46 6.689 4.226 -1.542 1.00 0.00 H new ATOM 676 N ASP A 47 7.287 7.160 -5.727 1.00 0.00 N ATOM 677 CA ASP A 47 7.870 8.209 -6.556 1.00 0.00 C ATOM 678 C ASP A 47 7.333 9.580 -6.155 1.00 0.00 C ATOM 679 O ASP A 47 6.123 9.804 -6.144 1.00 0.00 O ATOM 680 CB ASP A 47 7.576 7.944 -8.033 1.00 0.00 C ATOM 681 CG ASP A 47 8.634 8.527 -8.948 1.00 0.00 C ATOM 682 OD1 ASP A 47 8.724 9.770 -9.035 1.00 0.00 O ATOM 683 OD2 ASP A 47 9.372 7.741 -9.579 1.00 0.00 O ATOM 0 H ASP A 47 6.398 6.796 -6.070 1.00 0.00 H new ATOM 0 HA ASP A 47 8.949 8.202 -6.402 1.00 0.00 H new ATOM 0 HB2 ASP A 47 7.508 6.869 -8.200 1.00 0.00 H new ATOM 0 HB3 ASP A 47 6.605 8.368 -8.289 1.00 0.00 H new ATOM 688 N SER A 48 8.242 10.492 -5.826 1.00 0.00 N ATOM 689 CA SER A 48 7.859 11.840 -5.420 1.00 0.00 C ATOM 690 C SER A 48 8.705 12.885 -6.140 1.00 0.00 C ATOM 691 O SER A 48 9.934 12.809 -6.145 1.00 0.00 O ATOM 692 CB SER A 48 8.010 12.001 -3.906 1.00 0.00 C ATOM 693 OG SER A 48 9.245 11.471 -3.457 1.00 0.00 O ATOM 0 H SER A 48 9.248 10.323 -5.832 1.00 0.00 H new ATOM 0 HA SER A 48 6.815 11.992 -5.693 1.00 0.00 H new ATOM 0 HB2 SER A 48 7.946 13.056 -3.641 1.00 0.00 H new ATOM 0 HB3 SER A 48 7.188 11.495 -3.400 1.00 0.00 H new ATOM 0 HG SER A 48 9.882 11.450 -4.201 1.00 0.00 H new ATOM 699 N ARG A 49 8.038 13.860 -6.748 1.00 0.00 N ATOM 700 CA ARG A 49 8.727 14.921 -7.473 1.00 0.00 C ATOM 701 C ARG A 49 8.529 16.268 -6.784 1.00 0.00 C ATOM 702 O ARG A 49 9.445 16.823 -6.177 1.00 0.00 O ATOM 703 CB ARG A 49 8.221 14.994 -8.915 1.00 0.00 C ATOM 704 CG ARG A 49 9.095 14.242 -9.906 1.00 0.00 C ATOM 705 CD ARG A 49 8.303 13.804 -11.127 1.00 0.00 C ATOM 706 NE ARG A 49 9.141 13.119 -12.107 1.00 0.00 N ATOM 707 CZ ARG A 49 8.696 12.690 -13.283 1.00 0.00 C ATOM 708 NH1 ARG A 49 7.428 12.874 -13.623 1.00 0.00 N ATOM 709 NH2 ARG A 49 9.521 12.075 -14.121 1.00 0.00 N ATOM 0 H ARG A 49 7.021 13.937 -6.753 1.00 0.00 H new ATOM 0 HA ARG A 49 9.792 14.689 -7.480 1.00 0.00 H new ATOM 0 HB2 ARG A 49 7.209 14.591 -8.957 1.00 0.00 H new ATOM 0 HB3 ARG A 49 8.160 16.039 -9.217 1.00 0.00 H new ATOM 0 HG2 ARG A 49 9.924 14.878 -10.217 1.00 0.00 H new ATOM 0 HG3 ARG A 49 9.529 13.368 -9.420 1.00 0.00 H new ATOM 0 HD2 ARG A 49 7.494 13.142 -10.816 1.00 0.00 H new ATOM 0 HD3 ARG A 49 7.841 14.675 -11.591 1.00 0.00 H new ATOM 0 HE ARG A 49 10.122 12.961 -11.876 1.00 0.00 H new ATOM 0 HH11 ARG A 49 6.791 13.346 -12.981 1.00 0.00 H new ATOM 0 HH12 ARG A 49 7.089 12.544 -14.527 1.00 0.00 H new ATOM 0 HH21 ARG A 49 10.497 11.931 -13.862 1.00 0.00 H new ATOM 0 HH22 ARG A 49 9.179 11.746 -15.024 1.00 0.00 H new ATOM 723 N PRO A 50 7.304 16.807 -6.880 1.00 0.00 N ATOM 724 CA PRO A 50 6.957 18.095 -6.273 1.00 0.00 C ATOM 725 C PRO A 50 6.914 18.026 -4.750 1.00 0.00 C ATOM 726 O PRO A 50 6.597 19.011 -4.082 1.00 0.00 O ATOM 727 CB PRO A 50 5.563 18.388 -6.834 1.00 0.00 C ATOM 728 CG PRO A 50 4.998 17.049 -7.162 1.00 0.00 C ATOM 729 CD PRO A 50 6.165 16.201 -7.588 1.00 0.00 C ATOM 0 HA PRO A 50 7.694 18.865 -6.502 1.00 0.00 H new ATOM 0 HB2 PRO A 50 4.944 18.911 -6.105 1.00 0.00 H new ATOM 0 HB3 PRO A 50 5.618 19.022 -7.719 1.00 0.00 H new ATOM 0 HG2 PRO A 50 4.495 16.615 -6.298 1.00 0.00 H new ATOM 0 HG3 PRO A 50 4.257 17.122 -7.958 1.00 0.00 H new ATOM 0 HD2 PRO A 50 6.027 15.157 -7.307 1.00 0.00 H new ATOM 0 HD3 PRO A 50 6.305 16.224 -8.669 1.00 0.00 H new ATOM 737 N LEU A 51 7.235 16.857 -4.207 1.00 0.00 N ATOM 738 CA LEU A 51 7.234 16.658 -2.762 1.00 0.00 C ATOM 739 C LEU A 51 8.658 16.603 -2.218 1.00 0.00 C ATOM 740 O LEU A 51 8.967 17.209 -1.192 1.00 0.00 O ATOM 741 CB LEU A 51 6.489 15.371 -2.404 1.00 0.00 C ATOM 742 CG LEU A 51 5.178 15.124 -3.151 1.00 0.00 C ATOM 743 CD1 LEU A 51 4.472 13.896 -2.599 1.00 0.00 C ATOM 744 CD2 LEU A 51 4.275 16.346 -3.060 1.00 0.00 C ATOM 0 H LEU A 51 7.499 16.032 -4.746 1.00 0.00 H new ATOM 0 HA LEU A 51 6.723 17.505 -2.305 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.154 14.527 -2.589 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.278 15.383 -1.335 1.00 0.00 H new ATOM 0 HG LEU A 51 5.409 14.944 -4.201 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.541 13.736 -3.143 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.115 13.024 -2.716 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.253 14.047 -1.542 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.346 16.153 -3.597 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.052 16.557 -2.014 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.779 17.205 -3.504 1.00 0.00 H new ATOM 756 N THR A 52 9.524 15.874 -2.915 1.00 0.00 N ATOM 757 CA THR A 52 10.916 15.740 -2.504 1.00 0.00 C ATOM 758 C THR A 52 11.849 15.757 -3.709 1.00 0.00 C ATOM 759 O THR A 52 11.410 15.595 -4.847 1.00 0.00 O ATOM 760 CB THR A 52 11.145 14.441 -1.709 1.00 0.00 C ATOM 761 OG1 THR A 52 12.408 14.493 -1.037 1.00 0.00 O ATOM 762 CG2 THR A 52 11.104 13.230 -2.629 1.00 0.00 C ATOM 0 H THR A 52 9.286 15.367 -3.767 1.00 0.00 H new ATOM 0 HA THR A 52 11.140 16.593 -1.863 1.00 0.00 H new ATOM 0 HB THR A 52 10.347 14.346 -0.973 1.00 0.00 H new ATOM 0 HG1 THR A 52 12.361 13.967 -0.211 1.00 0.00 H new ATOM 0 HG21 THR A 52 11.268 12.324 -2.046 1.00 0.00 H new ATOM 0 HG22 THR A 52 10.131 13.176 -3.117 1.00 0.00 H new ATOM 0 HG23 THR A 52 11.884 13.321 -3.385 1.00 0.00 H new ATOM 770 N GLN A 53 13.138 15.952 -3.451 1.00 0.00 N ATOM 771 CA GLN A 53 14.133 15.989 -4.516 1.00 0.00 C ATOM 772 C GLN A 53 15.297 15.053 -4.207 1.00 0.00 C ATOM 773 O GLN A 53 15.852 14.419 -5.104 1.00 0.00 O ATOM 774 CB GLN A 53 14.649 17.416 -4.711 1.00 0.00 C ATOM 775 CG GLN A 53 13.548 18.431 -4.974 1.00 0.00 C ATOM 776 CD GLN A 53 12.953 18.298 -6.362 1.00 0.00 C ATOM 777 OE1 GLN A 53 13.578 18.666 -7.357 1.00 0.00 O ATOM 778 NE2 GLN A 53 11.736 17.770 -6.437 1.00 0.00 N ATOM 0 H GLN A 53 13.518 16.087 -2.514 1.00 0.00 H new ATOM 0 HA GLN A 53 13.655 15.653 -5.437 1.00 0.00 H new ATOM 0 HB2 GLN A 53 15.205 17.717 -3.823 1.00 0.00 H new ATOM 0 HB3 GLN A 53 15.350 17.429 -5.545 1.00 0.00 H new ATOM 0 HG2 GLN A 53 12.760 18.307 -4.231 1.00 0.00 H new ATOM 0 HG3 GLN A 53 13.949 19.437 -4.849 1.00 0.00 H new ATOM 0 HE21 GLN A 53 11.253 17.478 -5.587 1.00 0.00 H new ATOM 0 HE22 GLN A 53 11.284 17.656 -7.344 1.00 0.00 H new ATOM 787 N VAL A 54 15.661 14.971 -2.931 1.00 0.00 N ATOM 788 CA VAL A 54 16.759 14.111 -2.503 1.00 0.00 C ATOM 789 C VAL A 54 16.324 13.189 -1.370 1.00 0.00 C ATOM 790 O VAL A 54 17.073 12.960 -0.421 1.00 0.00 O ATOM 791 CB VAL A 54 17.972 14.939 -2.041 1.00 0.00 C ATOM 792 CG1 VAL A 54 18.402 15.911 -3.129 1.00 0.00 C ATOM 793 CG2 VAL A 54 17.652 15.678 -0.750 1.00 0.00 C ATOM 0 H VAL A 54 15.212 15.489 -2.176 1.00 0.00 H new ATOM 0 HA VAL A 54 17.047 13.510 -3.366 1.00 0.00 H new ATOM 0 HB VAL A 54 18.801 14.259 -1.847 1.00 0.00 H new ATOM 0 HG11 VAL A 54 19.260 16.487 -2.784 1.00 0.00 H new ATOM 0 HG12 VAL A 54 18.675 15.355 -4.026 1.00 0.00 H new ATOM 0 HG13 VAL A 54 17.579 16.588 -3.358 1.00 0.00 H new ATOM 0 HG21 VAL A 54 18.520 16.258 -0.438 1.00 0.00 H new ATOM 0 HG22 VAL A 54 16.808 16.348 -0.914 1.00 0.00 H new ATOM 0 HG23 VAL A 54 17.398 14.958 0.028 1.00 0.00 H new ATOM 803 N GLY A 55 15.108 12.662 -1.475 1.00 0.00 N ATOM 804 CA GLY A 55 14.595 11.770 -0.452 1.00 0.00 C ATOM 805 C GLY A 55 14.405 12.465 0.881 1.00 0.00 C ATOM 806 O GLY A 55 14.930 13.556 1.101 1.00 0.00 O ATOM 0 H GLY A 55 14.469 12.837 -2.250 1.00 0.00 H new ATOM 0 HA2 GLY A 55 13.642 11.355 -0.781 1.00 0.00 H new ATOM 0 HA3 GLY A 55 15.281 10.933 -0.327 1.00 0.00 H new ATOM 810 N GLY A 56 13.651 11.833 1.775 1.00 0.00 N ATOM 811 CA GLY A 56 13.405 12.414 3.082 1.00 0.00 C ATOM 812 C GLY A 56 12.902 11.394 4.084 1.00 0.00 C ATOM 813 O GLY A 56 12.897 10.194 3.810 1.00 0.00 O ATOM 0 H GLY A 56 13.206 10.929 1.618 1.00 0.00 H new ATOM 0 HA2 GLY A 56 14.325 12.863 3.456 1.00 0.00 H new ATOM 0 HA3 GLY A 56 12.674 13.217 2.988 1.00 0.00 H new ATOM 817 N ASP A 57 12.479 11.871 5.250 1.00 0.00 N ATOM 818 CA ASP A 57 11.972 10.992 6.297 1.00 0.00 C ATOM 819 C ASP A 57 10.548 11.376 6.686 1.00 0.00 C ATOM 820 O ASP A 57 10.181 11.331 7.861 1.00 0.00 O ATOM 821 CB ASP A 57 12.883 11.049 7.525 1.00 0.00 C ATOM 822 CG ASP A 57 14.311 10.653 7.205 1.00 0.00 C ATOM 823 OD1 ASP A 57 15.077 11.522 6.740 1.00 0.00 O ATOM 824 OD2 ASP A 57 14.662 9.473 7.419 1.00 0.00 O ATOM 0 H ASP A 57 12.477 12.861 5.494 1.00 0.00 H new ATOM 0 HA ASP A 57 11.961 9.973 5.909 1.00 0.00 H new ATOM 0 HB2 ASP A 57 12.872 12.059 7.935 1.00 0.00 H new ATOM 0 HB3 ASP A 57 12.490 10.387 8.297 1.00 0.00 H new ATOM 829 N HIS A 58 9.750 11.754 5.693 1.00 0.00 N ATOM 830 CA HIS A 58 8.365 12.146 5.932 1.00 0.00 C ATOM 831 C HIS A 58 7.402 11.092 5.396 1.00 0.00 C ATOM 832 O HIS A 58 6.257 11.397 5.059 1.00 0.00 O ATOM 833 CB HIS A 58 8.076 13.498 5.278 1.00 0.00 C ATOM 834 CG HIS A 58 8.418 14.669 6.146 1.00 0.00 C ATOM 835 ND1 HIS A 58 7.519 15.671 6.446 1.00 0.00 N ATOM 836 CD2 HIS A 58 9.568 14.994 6.782 1.00 0.00 C ATOM 837 CE1 HIS A 58 8.102 16.563 7.227 1.00 0.00 C ATOM 838 NE2 HIS A 58 9.346 16.175 7.447 1.00 0.00 N ATOM 0 H HIS A 58 10.038 11.797 4.715 1.00 0.00 H new ATOM 0 HA HIS A 58 8.218 12.233 7.009 1.00 0.00 H new ATOM 0 HB2 HIS A 58 8.639 13.570 4.347 1.00 0.00 H new ATOM 0 HB3 HIS A 58 7.019 13.547 5.016 1.00 0.00 H new ATOM 0 HD2 HIS A 58 10.489 14.430 6.769 1.00 0.00 H new ATOM 0 HE1 HIS A 58 7.640 17.457 7.619 1.00 0.00 H new ATOM 0 HE2 HIS A 58 10.030 16.672 8.018 1.00 0.00 H new ATOM 846 N ILE A 59 7.872 9.852 5.320 1.00 0.00 N ATOM 847 CA ILE A 59 7.052 8.753 4.826 1.00 0.00 C ATOM 848 C ILE A 59 6.761 7.743 5.931 1.00 0.00 C ATOM 849 O ILE A 59 7.676 7.224 6.569 1.00 0.00 O ATOM 850 CB ILE A 59 7.731 8.028 3.649 1.00 0.00 C ATOM 851 CG1 ILE A 59 7.889 8.976 2.459 1.00 0.00 C ATOM 852 CG2 ILE A 59 6.930 6.798 3.251 1.00 0.00 C ATOM 853 CD1 ILE A 59 6.589 9.611 2.017 1.00 0.00 C ATOM 0 H ILE A 59 8.817 9.583 5.594 1.00 0.00 H new ATOM 0 HA ILE A 59 6.115 9.190 4.481 1.00 0.00 H new ATOM 0 HB ILE A 59 8.723 7.705 3.965 1.00 0.00 H new ATOM 0 HG12 ILE A 59 8.597 9.762 2.722 1.00 0.00 H new ATOM 0 HG13 ILE A 59 8.319 8.427 1.622 1.00 0.00 H new ATOM 0 HG21 ILE A 59 7.423 6.297 2.418 1.00 0.00 H new ATOM 0 HG22 ILE A 59 6.866 6.116 4.099 1.00 0.00 H new ATOM 0 HG23 ILE A 59 5.926 7.099 2.951 1.00 0.00 H new ATOM 0 HD11 ILE A 59 6.776 10.271 1.170 1.00 0.00 H new ATOM 0 HD12 ILE A 59 5.885 8.832 1.722 1.00 0.00 H new ATOM 0 HD13 ILE A 59 6.168 10.188 2.840 1.00 0.00 H new ATOM 865 N LYS A 60 5.480 7.469 6.152 1.00 0.00 N ATOM 866 CA LYS A 60 5.066 6.519 7.178 1.00 0.00 C ATOM 867 C LYS A 60 4.010 5.560 6.637 1.00 0.00 C ATOM 868 O LYS A 60 3.079 5.972 5.947 1.00 0.00 O ATOM 869 CB LYS A 60 4.518 7.261 8.398 1.00 0.00 C ATOM 870 CG LYS A 60 3.889 6.347 9.435 1.00 0.00 C ATOM 871 CD LYS A 60 4.939 5.722 10.338 1.00 0.00 C ATOM 872 CE LYS A 60 4.306 4.831 11.396 1.00 0.00 C ATOM 873 NZ LYS A 60 3.558 5.622 12.412 1.00 0.00 N ATOM 0 H LYS A 60 4.710 7.892 5.634 1.00 0.00 H new ATOM 0 HA LYS A 60 5.940 5.940 7.475 1.00 0.00 H new ATOM 0 HB2 LYS A 60 5.327 7.823 8.864 1.00 0.00 H new ATOM 0 HB3 LYS A 60 3.775 7.987 8.068 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.180 6.914 10.038 1.00 0.00 H new ATOM 0 HG3 LYS A 60 3.324 5.561 8.934 1.00 0.00 H new ATOM 0 HD2 LYS A 60 5.635 5.137 9.737 1.00 0.00 H new ATOM 0 HD3 LYS A 60 5.518 6.508 10.822 1.00 0.00 H new ATOM 0 HE2 LYS A 60 3.630 4.123 10.917 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.082 4.246 11.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.257 4.996 13.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.173 6.371 12.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 2.721 6.052 11.970 1.00 0.00 H new ATOM 887 N ALA A 61 4.162 4.278 6.957 1.00 0.00 N ATOM 888 CA ALA A 61 3.220 3.262 6.506 1.00 0.00 C ATOM 889 C ALA A 61 2.741 2.403 7.671 1.00 0.00 C ATOM 890 O ALA A 61 3.496 2.127 8.604 1.00 0.00 O ATOM 891 CB ALA A 61 3.856 2.391 5.432 1.00 0.00 C ATOM 0 H ALA A 61 4.929 3.920 7.527 1.00 0.00 H new ATOM 0 HA ALA A 61 2.353 3.768 6.081 1.00 0.00 H new ATOM 0 HB1 ALA A 61 3.141 1.637 5.105 1.00 0.00 H new ATOM 0 HB2 ALA A 61 4.143 3.012 4.583 1.00 0.00 H new ATOM 0 HB3 ALA A 61 4.741 1.900 5.838 1.00 0.00 H new ATOM 897 N HIS A 62 1.481 1.983 7.611 1.00 0.00 N ATOM 898 CA HIS A 62 0.901 1.154 8.662 1.00 0.00 C ATOM 899 C HIS A 62 0.011 0.067 8.068 1.00 0.00 C ATOM 900 O HIS A 62 -1.085 0.346 7.579 1.00 0.00 O ATOM 901 CB HIS A 62 0.093 2.016 9.633 1.00 0.00 C ATOM 902 CG HIS A 62 -0.516 1.240 10.760 1.00 0.00 C ATOM 903 ND1 HIS A 62 -0.030 1.279 12.050 1.00 0.00 N ATOM 904 CD2 HIS A 62 -1.579 0.402 10.784 1.00 0.00 C ATOM 905 CE1 HIS A 62 -0.767 0.497 12.819 1.00 0.00 C ATOM 906 NE2 HIS A 62 -1.713 -0.047 12.075 1.00 0.00 N ATOM 0 H HIS A 62 0.843 2.203 6.846 1.00 0.00 H new ATOM 0 HA HIS A 62 1.716 0.675 9.204 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.741 2.790 10.044 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -0.699 2.523 9.082 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -2.205 0.136 9.945 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -0.621 0.331 13.876 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -2.427 -0.696 12.406 1.00 0.00 H new ATOM 914 N ILE A 63 0.488 -1.172 8.113 1.00 0.00 N ATOM 915 CA ILE A 63 -0.264 -2.300 7.579 1.00 0.00 C ATOM 916 C ILE A 63 -1.291 -2.803 8.588 1.00 0.00 C ATOM 917 O ILE A 63 -1.089 -2.700 9.798 1.00 0.00 O ATOM 918 CB ILE A 63 0.666 -3.463 7.187 1.00 0.00 C ATOM 919 CG1 ILE A 63 1.647 -3.017 6.101 1.00 0.00 C ATOM 920 CG2 ILE A 63 -0.149 -4.658 6.714 1.00 0.00 C ATOM 921 CD1 ILE A 63 2.956 -3.776 6.120 1.00 0.00 C ATOM 0 H ILE A 63 1.392 -1.420 8.514 1.00 0.00 H new ATOM 0 HA ILE A 63 -0.779 -1.942 6.688 1.00 0.00 H new ATOM 0 HB ILE A 63 1.237 -3.763 8.065 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.178 -3.142 5.125 1.00 0.00 H new ATOM 0 HG13 ILE A 63 1.851 -1.953 6.222 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.523 -5.471 6.441 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.810 -4.987 7.515 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -0.744 -4.372 5.847 1.00 0.00 H new ATOM 0 HD11 ILE A 63 3.602 -3.407 5.323 1.00 0.00 H new ATOM 0 HD12 ILE A 63 3.447 -3.630 7.082 1.00 0.00 H new ATOM 0 HD13 ILE A 63 2.763 -4.838 5.968 1.00 0.00 H new ATOM 933 N ALA A 64 -2.392 -3.350 8.083 1.00 0.00 N ATOM 934 CA ALA A 64 -3.448 -3.872 8.940 1.00 0.00 C ATOM 935 C ALA A 64 -3.918 -5.242 8.459 1.00 0.00 C ATOM 936 O ALA A 64 -4.617 -5.350 7.453 1.00 0.00 O ATOM 937 CB ALA A 64 -4.617 -2.899 8.990 1.00 0.00 C ATOM 0 H ALA A 64 -2.575 -3.443 7.084 1.00 0.00 H new ATOM 0 HA ALA A 64 -3.042 -3.988 9.945 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -5.399 -3.302 9.634 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -4.277 -1.942 9.387 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -5.014 -2.755 7.985 1.00 0.00 H new ATOM 943 N ASN A 65 -3.527 -6.284 9.185 1.00 0.00 N ATOM 944 CA ASN A 65 -3.908 -7.647 8.831 1.00 0.00 C ATOM 945 C ASN A 65 -5.350 -7.932 9.239 1.00 0.00 C ATOM 946 O ASN A 65 -5.904 -7.300 10.138 1.00 0.00 O ATOM 947 CB ASN A 65 -2.968 -8.651 9.502 1.00 0.00 C ATOM 948 CG ASN A 65 -1.593 -8.673 8.864 1.00 0.00 C ATOM 949 OD1 ASN A 65 -1.456 -8.498 7.653 1.00 0.00 O ATOM 950 ND2 ASN A 65 -0.566 -8.888 9.677 1.00 0.00 N ATOM 0 H ASN A 65 -2.947 -6.211 10.021 1.00 0.00 H new ATOM 0 HA ASN A 65 -3.828 -7.751 7.749 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -2.871 -8.403 10.559 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.407 -9.647 9.447 1.00 0.00 H new ATOM 0 HD21 ASN A 65 0.383 -8.913 9.304 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -0.726 -9.028 10.675 1.00 0.00 H new ATOM 957 N PRO A 66 -5.974 -8.908 8.562 1.00 0.00 N ATOM 958 CA PRO A 66 -7.359 -9.301 8.837 1.00 0.00 C ATOM 959 C PRO A 66 -7.507 -10.004 10.182 1.00 0.00 C ATOM 960 O PRO A 66 -8.620 -10.228 10.657 1.00 0.00 O ATOM 961 CB PRO A 66 -7.689 -10.261 7.692 1.00 0.00 C ATOM 962 CG PRO A 66 -6.371 -10.809 7.265 1.00 0.00 C ATOM 963 CD PRO A 66 -5.375 -9.704 7.478 1.00 0.00 C ATOM 0 HA PRO A 66 -8.024 -8.439 8.894 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -8.360 -11.055 8.022 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -8.187 -9.743 6.872 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -6.107 -11.690 7.849 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -6.396 -11.116 6.219 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -4.397 -10.094 7.759 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -5.234 -9.111 6.575 1.00 0.00 H new ATOM 971 N SER A 67 -6.377 -10.351 10.790 1.00 0.00 N ATOM 972 CA SER A 67 -6.381 -11.033 12.079 1.00 0.00 C ATOM 973 C SER A 67 -6.457 -10.028 13.225 1.00 0.00 C ATOM 974 O SER A 67 -6.851 -10.368 14.339 1.00 0.00 O ATOM 975 CB SER A 67 -5.128 -11.898 12.226 1.00 0.00 C ATOM 976 OG SER A 67 -5.415 -13.096 12.927 1.00 0.00 O ATOM 0 H SER A 67 -5.447 -10.171 10.411 1.00 0.00 H new ATOM 0 HA SER A 67 -7.262 -11.673 12.121 1.00 0.00 H new ATOM 0 HB2 SER A 67 -4.729 -12.136 11.240 1.00 0.00 H new ATOM 0 HB3 SER A 67 -4.356 -11.339 12.755 1.00 0.00 H new ATOM 0 HG SER A 67 -4.599 -13.632 13.006 1.00 0.00 H new ATOM 982 N GLY A 68 -6.075 -8.786 12.941 1.00 0.00 N ATOM 983 CA GLY A 68 -6.106 -7.750 13.956 1.00 0.00 C ATOM 984 C GLY A 68 -4.721 -7.257 14.325 1.00 0.00 C ATOM 985 O GLY A 68 -4.577 -6.262 15.035 1.00 0.00 O ATOM 0 H GLY A 68 -5.745 -8.480 12.026 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -6.703 -6.912 13.597 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -6.601 -8.134 14.848 1.00 0.00 H new ATOM 989 N ALA A 69 -3.698 -7.957 13.844 1.00 0.00 N ATOM 990 CA ALA A 69 -2.318 -7.585 14.127 1.00 0.00 C ATOM 991 C ALA A 69 -1.817 -6.540 13.136 1.00 0.00 C ATOM 992 O ALA A 69 -2.561 -6.089 12.266 1.00 0.00 O ATOM 993 CB ALA A 69 -1.423 -8.815 14.098 1.00 0.00 C ATOM 0 H ALA A 69 -3.800 -8.785 13.257 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.283 -7.148 15.125 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.395 -8.522 14.311 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -1.760 -9.528 14.850 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -1.472 -9.277 13.112 1.00 0.00 H new ATOM 999 N SER A 70 -0.550 -6.159 13.274 1.00 0.00 N ATOM 1000 CA SER A 70 0.049 -5.164 12.393 1.00 0.00 C ATOM 1001 C SER A 70 1.460 -5.578 11.986 1.00 0.00 C ATOM 1002 O SER A 70 2.306 -5.861 12.834 1.00 0.00 O ATOM 1003 CB SER A 70 0.085 -3.798 13.082 1.00 0.00 C ATOM 1004 OG SER A 70 0.664 -3.893 14.372 1.00 0.00 O ATOM 0 H SER A 70 0.081 -6.525 13.988 1.00 0.00 H new ATOM 0 HA SER A 70 -0.564 -5.094 11.494 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.656 -3.096 12.475 1.00 0.00 H new ATOM 0 HB3 SER A 70 -0.927 -3.401 13.162 1.00 0.00 H new ATOM 0 HG SER A 70 1.326 -4.616 14.381 1.00 0.00 H new ATOM 1010 N THR A 71 1.706 -5.611 10.680 1.00 0.00 N ATOM 1011 CA THR A 71 3.012 -5.991 10.158 1.00 0.00 C ATOM 1012 C THR A 71 3.999 -4.833 10.248 1.00 0.00 C ATOM 1013 O THR A 71 3.680 -3.704 9.877 1.00 0.00 O ATOM 1014 CB THR A 71 2.918 -6.457 8.693 1.00 0.00 C ATOM 1015 OG1 THR A 71 1.941 -7.496 8.571 1.00 0.00 O ATOM 1016 CG2 THR A 71 4.266 -6.960 8.197 1.00 0.00 C ATOM 0 H THR A 71 1.017 -5.379 9.964 1.00 0.00 H new ATOM 0 HA THR A 71 3.369 -6.818 10.773 1.00 0.00 H new ATOM 0 HB THR A 71 2.619 -5.605 8.083 1.00 0.00 H new ATOM 0 HG1 THR A 71 1.770 -7.675 7.623 1.00 0.00 H new ATOM 0 HG21 THR A 71 4.175 -7.284 7.160 1.00 0.00 H new ATOM 0 HG22 THR A 71 5.001 -6.157 8.263 1.00 0.00 H new ATOM 0 HG23 THR A 71 4.590 -7.800 8.812 1.00 0.00 H new ATOM 1024 N GLU A 72 5.199 -5.120 10.744 1.00 0.00 N ATOM 1025 CA GLU A 72 6.231 -4.100 10.883 1.00 0.00 C ATOM 1026 C GLU A 72 6.712 -3.623 9.515 1.00 0.00 C ATOM 1027 O GLU A 72 7.087 -4.429 8.662 1.00 0.00 O ATOM 1028 CB GLU A 72 7.412 -4.645 11.690 1.00 0.00 C ATOM 1029 CG GLU A 72 8.338 -3.563 12.219 1.00 0.00 C ATOM 1030 CD GLU A 72 9.185 -4.038 13.384 1.00 0.00 C ATOM 1031 OE1 GLU A 72 9.406 -5.262 13.497 1.00 0.00 O ATOM 1032 OE2 GLU A 72 9.628 -3.186 14.182 1.00 0.00 O ATOM 0 H GLU A 72 5.480 -6.050 11.056 1.00 0.00 H new ATOM 0 HA GLU A 72 5.799 -3.251 11.413 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.030 -5.227 12.529 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.985 -5.328 11.063 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.991 -3.224 11.415 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.745 -2.704 12.532 1.00 0.00 H new ATOM 1039 N CYS A 73 6.699 -2.310 9.315 1.00 0.00 N ATOM 1040 CA CYS A 73 7.132 -1.725 8.051 1.00 0.00 C ATOM 1041 C CYS A 73 8.536 -1.141 8.175 1.00 0.00 C ATOM 1042 O CYS A 73 8.913 -0.622 9.226 1.00 0.00 O ATOM 1043 CB CYS A 73 6.152 -0.639 7.605 1.00 0.00 C ATOM 1044 SG CYS A 73 6.076 0.787 8.714 1.00 0.00 S ATOM 0 H CYS A 73 6.393 -1.630 10.012 1.00 0.00 H new ATOM 0 HA CYS A 73 7.152 -2.516 7.301 1.00 0.00 H new ATOM 0 HB2 CYS A 73 6.434 -0.297 6.609 1.00 0.00 H new ATOM 0 HB3 CYS A 73 5.156 -1.075 7.522 1.00 0.00 H new ATOM 0 HG CYS A 73 4.835 1.125 8.901 1.00 0.00 H new ATOM 1050 N PHE A 74 9.306 -1.230 7.096 1.00 0.00 N ATOM 1051 CA PHE A 74 10.669 -0.713 7.085 1.00 0.00 C ATOM 1052 C PHE A 74 10.877 0.246 5.916 1.00 0.00 C ATOM 1053 O PHE A 74 11.077 -0.178 4.778 1.00 0.00 O ATOM 1054 CB PHE A 74 11.674 -1.864 7.000 1.00 0.00 C ATOM 1055 CG PHE A 74 11.588 -2.820 8.154 1.00 0.00 C ATOM 1056 CD1 PHE A 74 10.528 -3.706 8.261 1.00 0.00 C ATOM 1057 CD2 PHE A 74 12.568 -2.834 9.134 1.00 0.00 C ATOM 1058 CE1 PHE A 74 10.446 -4.588 9.322 1.00 0.00 C ATOM 1059 CE2 PHE A 74 12.492 -3.714 10.197 1.00 0.00 C ATOM 1060 CZ PHE A 74 11.429 -4.591 10.292 1.00 0.00 C ATOM 0 H PHE A 74 9.009 -1.655 6.218 1.00 0.00 H new ATOM 0 HA PHE A 74 10.831 -0.167 8.014 1.00 0.00 H new ATOM 0 HB2 PHE A 74 11.510 -2.411 6.072 1.00 0.00 H new ATOM 0 HB3 PHE A 74 12.682 -1.453 6.953 1.00 0.00 H new ATOM 0 HD1 PHE A 74 9.756 -3.707 7.506 1.00 0.00 H new ATOM 0 HD2 PHE A 74 13.401 -2.149 9.066 1.00 0.00 H new ATOM 0 HE1 PHE A 74 9.615 -5.274 9.392 1.00 0.00 H new ATOM 0 HE2 PHE A 74 13.263 -3.716 10.953 1.00 0.00 H new ATOM 0 HZ PHE A 74 11.367 -5.278 11.123 1.00 0.00 H new ATOM 1070 N VAL A 75 10.828 1.543 6.206 1.00 0.00 N ATOM 1071 CA VAL A 75 11.011 2.563 5.181 1.00 0.00 C ATOM 1072 C VAL A 75 12.491 2.801 4.901 1.00 0.00 C ATOM 1073 O VAL A 75 13.299 2.912 5.823 1.00 0.00 O ATOM 1074 CB VAL A 75 10.357 3.895 5.592 1.00 0.00 C ATOM 1075 CG1 VAL A 75 10.596 4.958 4.530 1.00 0.00 C ATOM 1076 CG2 VAL A 75 8.868 3.703 5.839 1.00 0.00 C ATOM 0 H VAL A 75 10.663 1.911 7.143 1.00 0.00 H new ATOM 0 HA VAL A 75 10.528 2.193 4.277 1.00 0.00 H new ATOM 0 HB VAL A 75 10.816 4.234 6.521 1.00 0.00 H new ATOM 0 HG11 VAL A 75 10.126 5.892 4.838 1.00 0.00 H new ATOM 0 HG12 VAL A 75 11.668 5.114 4.406 1.00 0.00 H new ATOM 0 HG13 VAL A 75 10.165 4.630 3.584 1.00 0.00 H new ATOM 0 HG21 VAL A 75 8.422 4.654 6.129 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.392 3.341 4.928 1.00 0.00 H new ATOM 0 HG23 VAL A 75 8.722 2.976 6.638 1.00 0.00 H new ATOM 1086 N THR A 76 12.840 2.879 3.620 1.00 0.00 N ATOM 1087 CA THR A 76 14.223 3.103 3.218 1.00 0.00 C ATOM 1088 C THR A 76 14.315 4.185 2.148 1.00 0.00 C ATOM 1089 O THR A 76 13.902 3.979 1.006 1.00 0.00 O ATOM 1090 CB THR A 76 14.869 1.811 2.683 1.00 0.00 C ATOM 1091 OG1 THR A 76 14.866 0.804 3.701 1.00 0.00 O ATOM 1092 CG2 THR A 76 16.296 2.070 2.223 1.00 0.00 C ATOM 0 H THR A 76 12.184 2.790 2.844 1.00 0.00 H new ATOM 0 HA THR A 76 14.763 3.428 4.108 1.00 0.00 H new ATOM 0 HB THR A 76 14.286 1.466 1.829 1.00 0.00 H new ATOM 0 HG1 THR A 76 15.277 -0.015 3.353 1.00 0.00 H new ATOM 0 HG21 THR A 76 16.732 1.143 1.849 1.00 0.00 H new ATOM 0 HG22 THR A 76 16.292 2.816 1.428 1.00 0.00 H new ATOM 0 HG23 THR A 76 16.888 2.437 3.062 1.00 0.00 H new ATOM 1100 N ASP A 77 14.860 5.337 2.523 1.00 0.00 N ATOM 1101 CA ASP A 77 15.009 6.451 1.594 1.00 0.00 C ATOM 1102 C ASP A 77 16.300 6.322 0.792 1.00 0.00 C ATOM 1103 O ASP A 77 17.377 6.138 1.357 1.00 0.00 O ATOM 1104 CB ASP A 77 14.995 7.779 2.351 1.00 0.00 C ATOM 1105 CG ASP A 77 15.906 7.765 3.563 1.00 0.00 C ATOM 1106 OD1 ASP A 77 17.137 7.871 3.382 1.00 0.00 O ATOM 1107 OD2 ASP A 77 15.387 7.648 4.693 1.00 0.00 O ATOM 0 H ASP A 77 15.206 5.524 3.464 1.00 0.00 H new ATOM 0 HA ASP A 77 14.168 6.428 0.900 1.00 0.00 H new ATOM 0 HB2 ASP A 77 15.302 8.580 1.679 1.00 0.00 H new ATOM 0 HB3 ASP A 77 13.976 8.002 2.668 1.00 0.00 H new ATOM 1112 N ASN A 78 16.183 6.418 -0.529 1.00 0.00 N ATOM 1113 CA ASN A 78 17.341 6.310 -1.408 1.00 0.00 C ATOM 1114 C ASN A 78 18.021 7.664 -1.581 1.00 0.00 C ATOM 1115 O ASN A 78 18.905 7.824 -2.423 1.00 0.00 O ATOM 1116 CB ASN A 78 16.922 5.759 -2.773 1.00 0.00 C ATOM 1117 CG ASN A 78 16.395 4.340 -2.686 1.00 0.00 C ATOM 1118 OD1 ASN A 78 17.166 3.383 -2.606 1.00 0.00 O ATOM 1119 ND2 ASN A 78 15.075 4.196 -2.703 1.00 0.00 N ATOM 0 H ASN A 78 15.298 6.570 -1.013 1.00 0.00 H new ATOM 0 HA ASN A 78 18.051 5.623 -0.949 1.00 0.00 H new ATOM 0 HB2 ASN A 78 16.154 6.403 -3.202 1.00 0.00 H new ATOM 0 HB3 ASN A 78 17.776 5.786 -3.450 1.00 0.00 H new ATOM 0 HD21 ASN A 78 14.663 3.265 -2.649 1.00 0.00 H new ATOM 0 HD22 ASN A 78 14.473 5.017 -2.770 1.00 0.00 H new ATOM 1126 N ALA A 79 17.602 8.637 -0.778 1.00 0.00 N ATOM 1127 CA ALA A 79 18.172 9.977 -0.841 1.00 0.00 C ATOM 1128 C ALA A 79 18.295 10.456 -2.283 1.00 0.00 C ATOM 1129 O ALA A 79 19.168 11.260 -2.609 1.00 0.00 O ATOM 1130 CB ALA A 79 19.531 10.005 -0.156 1.00 0.00 C ATOM 0 H ALA A 79 16.870 8.522 -0.077 1.00 0.00 H new ATOM 0 HA ALA A 79 17.498 10.656 -0.318 1.00 0.00 H new ATOM 0 HB1 ALA A 79 19.945 11.012 -0.210 1.00 0.00 H new ATOM 0 HB2 ALA A 79 19.418 9.715 0.889 1.00 0.00 H new ATOM 0 HB3 ALA A 79 20.204 9.308 -0.655 1.00 0.00 H new ATOM 1136 N ASP A 80 17.415 9.955 -3.144 1.00 0.00 N ATOM 1137 CA ASP A 80 17.424 10.332 -4.553 1.00 0.00 C ATOM 1138 C ASP A 80 16.125 11.032 -4.937 1.00 0.00 C ATOM 1139 O ASP A 80 16.109 11.901 -5.808 1.00 0.00 O ATOM 1140 CB ASP A 80 17.632 9.097 -5.431 1.00 0.00 C ATOM 1141 CG ASP A 80 17.960 9.457 -6.867 1.00 0.00 C ATOM 1142 OD1 ASP A 80 19.028 10.063 -7.098 1.00 0.00 O ATOM 1143 OD2 ASP A 80 17.150 9.132 -7.760 1.00 0.00 O ATOM 0 H ASP A 80 16.687 9.287 -2.891 1.00 0.00 H new ATOM 0 HA ASP A 80 18.249 11.026 -4.713 1.00 0.00 H new ATOM 0 HB2 ASP A 80 18.439 8.492 -5.017 1.00 0.00 H new ATOM 0 HB3 ASP A 80 16.731 8.484 -5.410 1.00 0.00 H new ATOM 1148 N GLY A 81 15.034 10.647 -4.281 1.00 0.00 N ATOM 1149 CA GLY A 81 13.745 11.247 -4.568 1.00 0.00 C ATOM 1150 C GLY A 81 12.597 10.277 -4.369 1.00 0.00 C ATOM 1151 O GLY A 81 11.431 10.674 -4.369 1.00 0.00 O ATOM 0 H GLY A 81 15.021 9.930 -3.556 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.600 12.114 -3.924 1.00 0.00 H new ATOM 0 HA3 GLY A 81 13.737 11.609 -5.596 1.00 0.00 H new ATOM 1155 N THR A 82 12.925 9.000 -4.200 1.00 0.00 N ATOM 1156 CA THR A 82 11.913 7.971 -4.002 1.00 0.00 C ATOM 1157 C THR A 82 12.092 7.275 -2.657 1.00 0.00 C ATOM 1158 O THR A 82 13.114 7.443 -1.992 1.00 0.00 O ATOM 1159 CB THR A 82 11.959 6.915 -5.123 1.00 0.00 C ATOM 1160 OG1 THR A 82 13.258 6.314 -5.177 1.00 0.00 O ATOM 1161 CG2 THR A 82 11.628 7.541 -6.469 1.00 0.00 C ATOM 0 H THR A 82 13.884 8.654 -4.196 1.00 0.00 H new ATOM 0 HA THR A 82 10.945 8.472 -4.023 1.00 0.00 H new ATOM 0 HB THR A 82 11.214 6.150 -4.903 1.00 0.00 H new ATOM 0 HG1 THR A 82 13.278 5.643 -5.891 1.00 0.00 H new ATOM 0 HG21 THR A 82 11.667 6.777 -7.245 1.00 0.00 H new ATOM 0 HG22 THR A 82 10.627 7.972 -6.434 1.00 0.00 H new ATOM 0 HG23 THR A 82 12.352 8.324 -6.694 1.00 0.00 H new ATOM 1169 N TYR A 83 11.092 6.495 -2.263 1.00 0.00 N ATOM 1170 CA TYR A 83 11.138 5.775 -0.996 1.00 0.00 C ATOM 1171 C TYR A 83 10.904 4.282 -1.208 1.00 0.00 C ATOM 1172 O TYR A 83 10.116 3.883 -2.065 1.00 0.00 O ATOM 1173 CB TYR A 83 10.093 6.334 -0.029 1.00 0.00 C ATOM 1174 CG TYR A 83 10.151 7.838 0.122 1.00 0.00 C ATOM 1175 CD1 TYR A 83 9.467 8.670 -0.756 1.00 0.00 C ATOM 1176 CD2 TYR A 83 10.889 8.425 1.141 1.00 0.00 C ATOM 1177 CE1 TYR A 83 9.518 10.044 -0.622 1.00 0.00 C ATOM 1178 CE2 TYR A 83 10.944 9.798 1.283 1.00 0.00 C ATOM 1179 CZ TYR A 83 10.257 10.604 0.399 1.00 0.00 C ATOM 1180 OH TYR A 83 10.310 11.972 0.536 1.00 0.00 O ATOM 0 H TYR A 83 10.240 6.345 -2.803 1.00 0.00 H new ATOM 0 HA TYR A 83 12.130 5.911 -0.566 1.00 0.00 H new ATOM 0 HB2 TYR A 83 9.100 6.050 -0.377 1.00 0.00 H new ATOM 0 HB3 TYR A 83 10.232 5.873 0.949 1.00 0.00 H new ATOM 0 HD1 TYR A 83 8.886 8.235 -1.556 1.00 0.00 H new ATOM 0 HD2 TYR A 83 11.429 7.798 1.834 1.00 0.00 H new ATOM 0 HE1 TYR A 83 8.982 10.677 -1.314 1.00 0.00 H new ATOM 0 HE2 TYR A 83 11.522 10.238 2.082 1.00 0.00 H new ATOM 0 HH TYR A 83 10.872 12.202 1.305 1.00 0.00 H new ATOM 1190 N GLN A 84 11.594 3.464 -0.420 1.00 0.00 N ATOM 1191 CA GLN A 84 11.461 2.016 -0.521 1.00 0.00 C ATOM 1192 C GLN A 84 11.042 1.412 0.815 1.00 0.00 C ATOM 1193 O GLN A 84 11.801 1.435 1.784 1.00 0.00 O ATOM 1194 CB GLN A 84 12.780 1.393 -0.984 1.00 0.00 C ATOM 1195 CG GLN A 84 12.655 -0.068 -1.387 1.00 0.00 C ATOM 1196 CD GLN A 84 12.311 -0.241 -2.853 1.00 0.00 C ATOM 1197 OE1 GLN A 84 13.024 0.246 -3.731 1.00 0.00 O ATOM 1198 NE2 GLN A 84 11.215 -0.939 -3.126 1.00 0.00 N ATOM 0 H GLN A 84 12.250 3.779 0.295 1.00 0.00 H new ATOM 0 HA GLN A 84 10.686 1.799 -1.256 1.00 0.00 H new ATOM 0 HB2 GLN A 84 13.164 1.963 -1.830 1.00 0.00 H new ATOM 0 HB3 GLN A 84 13.514 1.479 -0.182 1.00 0.00 H new ATOM 0 HG2 GLN A 84 13.593 -0.581 -1.175 1.00 0.00 H new ATOM 0 HG3 GLN A 84 11.886 -0.544 -0.779 1.00 0.00 H new ATOM 0 HE21 GLN A 84 10.654 -1.325 -2.367 1.00 0.00 H new ATOM 0 HE22 GLN A 84 10.934 -1.090 -4.095 1.00 0.00 H new ATOM 1207 N VAL A 85 9.828 0.874 0.861 1.00 0.00 N ATOM 1208 CA VAL A 85 9.307 0.264 2.078 1.00 0.00 C ATOM 1209 C VAL A 85 9.205 -1.251 1.934 1.00 0.00 C ATOM 1210 O VAL A 85 8.631 -1.754 0.970 1.00 0.00 O ATOM 1211 CB VAL A 85 7.921 0.828 2.441 1.00 0.00 C ATOM 1212 CG1 VAL A 85 7.399 0.185 3.716 1.00 0.00 C ATOM 1213 CG2 VAL A 85 7.983 2.342 2.584 1.00 0.00 C ATOM 0 H VAL A 85 9.186 0.848 0.069 1.00 0.00 H new ATOM 0 HA VAL A 85 10.009 0.504 2.877 1.00 0.00 H new ATOM 0 HB VAL A 85 7.229 0.590 1.634 1.00 0.00 H new ATOM 0 HG11 VAL A 85 6.419 0.597 3.956 1.00 0.00 H new ATOM 0 HG12 VAL A 85 7.315 -0.892 3.572 1.00 0.00 H new ATOM 0 HG13 VAL A 85 8.089 0.389 4.535 1.00 0.00 H new ATOM 0 HG21 VAL A 85 6.995 2.724 2.841 1.00 0.00 H new ATOM 0 HG22 VAL A 85 8.689 2.604 3.372 1.00 0.00 H new ATOM 0 HG23 VAL A 85 8.309 2.783 1.642 1.00 0.00 H new ATOM 1223 N GLU A 86 9.766 -1.971 2.901 1.00 0.00 N ATOM 1224 CA GLU A 86 9.738 -3.429 2.881 1.00 0.00 C ATOM 1225 C GLU A 86 9.069 -3.977 4.138 1.00 0.00 C ATOM 1226 O GLU A 86 9.313 -3.496 5.245 1.00 0.00 O ATOM 1227 CB GLU A 86 11.157 -3.986 2.760 1.00 0.00 C ATOM 1228 CG GLU A 86 11.220 -5.504 2.797 1.00 0.00 C ATOM 1229 CD GLU A 86 12.537 -6.021 3.343 1.00 0.00 C ATOM 1230 OE1 GLU A 86 13.517 -6.081 2.572 1.00 0.00 O ATOM 1231 OE2 GLU A 86 12.587 -6.364 4.543 1.00 0.00 O ATOM 0 H GLU A 86 10.245 -1.569 3.707 1.00 0.00 H new ATOM 0 HA GLU A 86 9.157 -3.745 2.015 1.00 0.00 H new ATOM 0 HB2 GLU A 86 11.598 -3.635 1.827 1.00 0.00 H new ATOM 0 HB3 GLU A 86 11.766 -3.586 3.571 1.00 0.00 H new ATOM 0 HG2 GLU A 86 10.403 -5.883 3.411 1.00 0.00 H new ATOM 0 HG3 GLU A 86 11.070 -5.895 1.791 1.00 0.00 H new ATOM 1238 N TYR A 87 8.225 -4.987 3.959 1.00 0.00 N ATOM 1239 CA TYR A 87 7.518 -5.600 5.078 1.00 0.00 C ATOM 1240 C TYR A 87 7.219 -7.069 4.794 1.00 0.00 C ATOM 1241 O TYR A 87 7.058 -7.471 3.642 1.00 0.00 O ATOM 1242 CB TYR A 87 6.216 -4.848 5.360 1.00 0.00 C ATOM 1243 CG TYR A 87 5.140 -5.092 4.326 1.00 0.00 C ATOM 1244 CD1 TYR A 87 4.329 -6.218 4.392 1.00 0.00 C ATOM 1245 CD2 TYR A 87 4.935 -4.196 3.284 1.00 0.00 C ATOM 1246 CE1 TYR A 87 3.345 -6.445 3.449 1.00 0.00 C ATOM 1247 CE2 TYR A 87 3.952 -4.414 2.338 1.00 0.00 C ATOM 1248 CZ TYR A 87 3.160 -5.540 2.424 1.00 0.00 C ATOM 1249 OH TYR A 87 2.181 -5.762 1.484 1.00 0.00 O ATOM 0 H TYR A 87 8.014 -5.399 3.050 1.00 0.00 H new ATOM 0 HA TYR A 87 8.161 -5.542 5.957 1.00 0.00 H new ATOM 0 HB2 TYR A 87 5.840 -5.143 6.340 1.00 0.00 H new ATOM 0 HB3 TYR A 87 6.426 -3.780 5.408 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.470 -6.928 5.194 1.00 0.00 H new ATOM 0 HD2 TYR A 87 5.555 -3.314 3.212 1.00 0.00 H new ATOM 0 HE1 TYR A 87 2.724 -7.326 3.514 1.00 0.00 H new ATOM 0 HE2 TYR A 87 3.804 -3.707 1.535 1.00 0.00 H new ATOM 0 HH TYR A 87 2.263 -5.102 0.765 1.00 0.00 H new ATOM 1259 N THR A 88 7.146 -7.866 5.855 1.00 0.00 N ATOM 1260 CA THR A 88 6.867 -9.291 5.723 1.00 0.00 C ATOM 1261 C THR A 88 5.615 -9.680 6.500 1.00 0.00 C ATOM 1262 O THR A 88 5.639 -9.848 7.719 1.00 0.00 O ATOM 1263 CB THR A 88 8.051 -10.144 6.218 1.00 0.00 C ATOM 1264 OG1 THR A 88 9.286 -9.574 5.769 1.00 0.00 O ATOM 1265 CG2 THR A 88 7.934 -11.575 5.715 1.00 0.00 C ATOM 0 H THR A 88 7.276 -7.549 6.816 1.00 0.00 H new ATOM 0 HA THR A 88 6.708 -9.485 4.662 1.00 0.00 H new ATOM 0 HB THR A 88 8.032 -10.156 7.308 1.00 0.00 H new ATOM 0 HG1 THR A 88 10.034 -10.121 6.089 1.00 0.00 H new ATOM 0 HG21 THR A 88 8.781 -12.158 6.077 1.00 0.00 H new ATOM 0 HG22 THR A 88 7.007 -12.015 6.082 1.00 0.00 H new ATOM 0 HG23 THR A 88 7.931 -11.578 4.625 1.00 0.00 H new ATOM 1273 N PRO A 89 4.493 -9.829 5.780 1.00 0.00 N ATOM 1274 CA PRO A 89 3.210 -10.202 6.382 1.00 0.00 C ATOM 1275 C PRO A 89 3.199 -11.644 6.877 1.00 0.00 C ATOM 1276 O PRO A 89 3.594 -12.561 6.157 1.00 0.00 O ATOM 1277 CB PRO A 89 2.214 -10.024 5.233 1.00 0.00 C ATOM 1278 CG PRO A 89 3.028 -10.189 3.997 1.00 0.00 C ATOM 1279 CD PRO A 89 4.391 -9.644 4.322 1.00 0.00 C ATOM 0 HA PRO A 89 2.981 -9.598 7.260 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.416 -10.764 5.283 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.741 -9.043 5.267 1.00 0.00 H new ATOM 0 HG2 PRO A 89 3.087 -11.238 3.706 1.00 0.00 H new ATOM 0 HG3 PRO A 89 2.582 -9.650 3.161 1.00 0.00 H new ATOM 0 HD2 PRO A 89 5.176 -10.183 3.792 1.00 0.00 H new ATOM 0 HD3 PRO A 89 4.481 -8.594 4.043 1.00 0.00 H new ATOM 1287 N PHE A 90 2.744 -11.838 8.111 1.00 0.00 N ATOM 1288 CA PHE A 90 2.683 -13.169 8.703 1.00 0.00 C ATOM 1289 C PHE A 90 1.266 -13.731 8.631 1.00 0.00 C ATOM 1290 O PHE A 90 0.880 -14.572 9.442 1.00 0.00 O ATOM 1291 CB PHE A 90 3.153 -13.126 10.158 1.00 0.00 C ATOM 1292 CG PHE A 90 2.717 -11.890 10.892 1.00 0.00 C ATOM 1293 CD1 PHE A 90 1.469 -11.829 11.491 1.00 0.00 C ATOM 1294 CD2 PHE A 90 3.554 -10.790 10.984 1.00 0.00 C ATOM 1295 CE1 PHE A 90 1.064 -10.694 12.168 1.00 0.00 C ATOM 1296 CE2 PHE A 90 3.155 -9.653 11.659 1.00 0.00 C ATOM 1297 CZ PHE A 90 1.908 -9.604 12.251 1.00 0.00 C ATOM 0 H PHE A 90 2.412 -11.090 8.720 1.00 0.00 H new ATOM 0 HA PHE A 90 3.344 -13.823 8.135 1.00 0.00 H new ATOM 0 HB2 PHE A 90 2.772 -14.003 10.681 1.00 0.00 H new ATOM 0 HB3 PHE A 90 4.241 -13.189 10.182 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.805 -12.678 11.428 1.00 0.00 H new ATOM 0 HD2 PHE A 90 4.530 -10.822 10.523 1.00 0.00 H new ATOM 0 HE1 PHE A 90 0.089 -10.660 12.631 1.00 0.00 H new ATOM 0 HE2 PHE A 90 3.818 -8.803 11.724 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.594 -8.715 12.778 1.00 0.00 H new ATOM 1307 N GLU A 91 0.498 -13.260 7.654 1.00 0.00 N ATOM 1308 CA GLU A 91 -0.876 -13.715 7.477 1.00 0.00 C ATOM 1309 C GLU A 91 -1.304 -13.599 6.016 1.00 0.00 C ATOM 1310 O GLU A 91 -1.128 -12.555 5.387 1.00 0.00 O ATOM 1311 CB GLU A 91 -1.823 -12.904 8.363 1.00 0.00 C ATOM 1312 CG GLU A 91 -1.960 -13.455 9.772 1.00 0.00 C ATOM 1313 CD GLU A 91 -2.658 -14.801 9.807 1.00 0.00 C ATOM 1314 OE1 GLU A 91 -3.833 -14.872 9.391 1.00 0.00 O ATOM 1315 OE2 GLU A 91 -2.028 -15.784 10.250 1.00 0.00 O ATOM 0 H GLU A 91 0.803 -12.564 6.974 1.00 0.00 H new ATOM 0 HA GLU A 91 -0.925 -14.764 7.770 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -1.465 -11.876 8.417 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.808 -12.874 7.896 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -0.970 -13.552 10.218 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -2.517 -12.745 10.383 1.00 0.00 H new ATOM 1322 N LYS A 92 -1.867 -14.678 5.483 1.00 0.00 N ATOM 1323 CA LYS A 92 -2.321 -14.699 4.098 1.00 0.00 C ATOM 1324 C LYS A 92 -3.732 -14.131 3.979 1.00 0.00 C ATOM 1325 O LYS A 92 -4.715 -14.830 4.219 1.00 0.00 O ATOM 1326 CB LYS A 92 -2.288 -16.128 3.551 1.00 0.00 C ATOM 1327 CG LYS A 92 -2.753 -17.173 4.550 1.00 0.00 C ATOM 1328 CD LYS A 92 -3.178 -18.457 3.856 1.00 0.00 C ATOM 1329 CE LYS A 92 -4.628 -18.391 3.402 1.00 0.00 C ATOM 1330 NZ LYS A 92 -5.110 -19.705 2.894 1.00 0.00 N ATOM 0 H LYS A 92 -2.020 -15.550 5.990 1.00 0.00 H new ATOM 0 HA LYS A 92 -1.646 -14.075 3.511 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -2.917 -16.182 2.662 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -1.271 -16.365 3.237 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -1.949 -17.388 5.254 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -3.587 -16.778 5.129 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -2.534 -18.637 2.995 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -3.046 -19.300 4.535 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -5.255 -18.071 4.234 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -4.730 -17.639 2.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -6.142 -19.764 3.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -4.868 -19.798 1.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -4.657 -20.472 3.431 1.00 0.00 H new ATOM 1344 N GLY A 93 -3.823 -12.857 3.606 1.00 0.00 N ATOM 1345 CA GLY A 93 -5.117 -12.218 3.461 1.00 0.00 C ATOM 1346 C GLY A 93 -5.010 -10.812 2.903 1.00 0.00 C ATOM 1347 O GLY A 93 -3.968 -10.424 2.374 1.00 0.00 O ATOM 0 H GLY A 93 -3.024 -12.257 3.402 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -5.744 -12.820 2.803 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -5.613 -12.184 4.431 1.00 0.00 H new ATOM 1351 N LEU A 94 -6.090 -10.047 3.020 1.00 0.00 N ATOM 1352 CA LEU A 94 -6.114 -8.677 2.521 1.00 0.00 C ATOM 1353 C LEU A 94 -5.884 -7.681 3.654 1.00 0.00 C ATOM 1354 O LEU A 94 -6.699 -7.568 4.570 1.00 0.00 O ATOM 1355 CB LEU A 94 -7.450 -8.386 1.835 1.00 0.00 C ATOM 1356 CG LEU A 94 -7.765 -6.912 1.577 1.00 0.00 C ATOM 1357 CD1 LEU A 94 -6.787 -6.326 0.571 1.00 0.00 C ATOM 1358 CD2 LEU A 94 -9.197 -6.751 1.088 1.00 0.00 C ATOM 0 H LEU A 94 -6.960 -10.352 3.456 1.00 0.00 H new ATOM 0 HA LEU A 94 -5.308 -8.567 1.795 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.468 -8.913 0.881 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -8.249 -8.806 2.446 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.659 -6.367 2.515 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.026 -5.277 0.400 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.772 -6.408 0.960 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.860 -6.873 -0.369 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.404 -5.696 0.909 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.330 -7.309 0.161 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.884 -7.133 1.843 1.00 0.00 H new ATOM 1370 N HIS A 95 -4.769 -6.960 3.584 1.00 0.00 N ATOM 1371 CA HIS A 95 -4.433 -5.971 4.603 1.00 0.00 C ATOM 1372 C HIS A 95 -4.688 -4.557 4.091 1.00 0.00 C ATOM 1373 O HIS A 95 -4.742 -4.322 2.884 1.00 0.00 O ATOM 1374 CB HIS A 95 -2.971 -6.118 5.023 1.00 0.00 C ATOM 1375 CG HIS A 95 -2.438 -7.509 4.864 1.00 0.00 C ATOM 1376 ND1 HIS A 95 -3.102 -8.626 5.325 1.00 0.00 N ATOM 1377 CD2 HIS A 95 -1.299 -7.960 4.288 1.00 0.00 C ATOM 1378 CE1 HIS A 95 -2.393 -9.705 5.041 1.00 0.00 C ATOM 1379 NE2 HIS A 95 -1.295 -9.328 4.412 1.00 0.00 N ATOM 0 H HIS A 95 -4.083 -7.042 2.833 1.00 0.00 H new ATOM 0 HA HIS A 95 -5.071 -6.146 5.469 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -2.361 -5.435 4.432 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -2.869 -5.816 6.065 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -0.536 -7.357 3.819 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -2.665 -10.722 5.282 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -0.562 -9.952 4.073 1.00 0.00 H new ATOM 1387 N VAL A 96 -4.845 -3.617 5.018 1.00 0.00 N ATOM 1388 CA VAL A 96 -5.095 -2.225 4.662 1.00 0.00 C ATOM 1389 C VAL A 96 -3.880 -1.355 4.962 1.00 0.00 C ATOM 1390 O VAL A 96 -3.579 -1.068 6.121 1.00 0.00 O ATOM 1391 CB VAL A 96 -6.314 -1.663 5.415 1.00 0.00 C ATOM 1392 CG1 VAL A 96 -6.516 -0.192 5.083 1.00 0.00 C ATOM 1393 CG2 VAL A 96 -7.562 -2.468 5.086 1.00 0.00 C ATOM 0 H VAL A 96 -4.803 -3.794 6.022 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.298 -2.204 3.591 1.00 0.00 H new ATOM 0 HB VAL A 96 -6.127 -1.747 6.486 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -7.382 0.188 5.625 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.630 0.372 5.375 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.681 -0.080 4.011 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -8.414 -2.056 5.627 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.755 -2.419 4.014 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.413 -3.507 5.380 1.00 0.00 H new ATOM 1403 N VAL A 97 -3.183 -0.937 3.910 1.00 0.00 N ATOM 1404 CA VAL A 97 -2.001 -0.097 4.060 1.00 0.00 C ATOM 1405 C VAL A 97 -2.363 1.381 3.980 1.00 0.00 C ATOM 1406 O VAL A 97 -2.834 1.860 2.949 1.00 0.00 O ATOM 1407 CB VAL A 97 -0.946 -0.415 2.983 1.00 0.00 C ATOM 1408 CG1 VAL A 97 0.231 0.542 3.089 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -0.482 -1.859 3.103 1.00 0.00 C ATOM 0 H VAL A 97 -3.417 -1.167 2.944 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.583 -0.313 5.043 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.402 -0.284 2.002 1.00 0.00 H new ATOM 0 HG11 VAL A 97 0.966 0.302 2.320 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.118 1.565 2.950 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.691 0.446 4.073 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.263 -2.067 2.335 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -0.043 -2.019 4.088 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.334 -2.527 2.973 1.00 0.00 H new ATOM 1419 N GLU A 98 -2.139 2.100 5.075 1.00 0.00 N ATOM 1420 CA GLU A 98 -2.442 3.526 5.128 1.00 0.00 C ATOM 1421 C GLU A 98 -1.166 4.357 5.040 1.00 0.00 C ATOM 1422 O GLU A 98 -0.328 4.326 5.942 1.00 0.00 O ATOM 1423 CB GLU A 98 -3.195 3.862 6.417 1.00 0.00 C ATOM 1424 CG GLU A 98 -4.676 3.527 6.361 1.00 0.00 C ATOM 1425 CD GLU A 98 -5.284 3.339 7.738 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -4.815 2.447 8.476 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -6.228 4.083 8.077 1.00 0.00 O ATOM 0 H GLU A 98 -1.749 1.719 5.937 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.073 3.769 4.273 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -2.740 3.320 7.246 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -3.079 4.925 6.629 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -5.206 4.324 5.840 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.817 2.617 5.778 1.00 0.00 H new ATOM 1434 N VAL A 99 -1.024 5.100 3.947 1.00 0.00 N ATOM 1435 CA VAL A 99 0.149 5.941 3.740 1.00 0.00 C ATOM 1436 C VAL A 99 -0.177 7.409 3.988 1.00 0.00 C ATOM 1437 O VAL A 99 -1.242 7.894 3.604 1.00 0.00 O ATOM 1438 CB VAL A 99 0.707 5.784 2.314 1.00 0.00 C ATOM 1439 CG1 VAL A 99 2.051 6.485 2.186 1.00 0.00 C ATOM 1440 CG2 VAL A 99 0.829 4.312 1.948 1.00 0.00 C ATOM 0 H VAL A 99 -1.707 5.137 3.191 1.00 0.00 H new ATOM 0 HA VAL A 99 0.904 5.614 4.455 1.00 0.00 H new ATOM 0 HB VAL A 99 0.011 6.252 1.618 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.430 6.363 1.171 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.930 7.546 2.403 1.00 0.00 H new ATOM 0 HG13 VAL A 99 2.758 6.049 2.892 1.00 0.00 H new ATOM 0 HG21 VAL A 99 1.225 4.220 0.937 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.503 3.818 2.648 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.153 3.842 1.997 1.00 0.00 H new ATOM 1450 N THR A 100 0.748 8.115 4.632 1.00 0.00 N ATOM 1451 CA THR A 100 0.559 9.529 4.932 1.00 0.00 C ATOM 1452 C THR A 100 1.849 10.312 4.719 1.00 0.00 C ATOM 1453 O THR A 100 2.884 9.995 5.306 1.00 0.00 O ATOM 1454 CB THR A 100 0.079 9.736 6.380 1.00 0.00 C ATOM 1455 OG1 THR A 100 0.890 8.973 7.280 1.00 0.00 O ATOM 1456 CG2 THR A 100 -1.379 9.327 6.531 1.00 0.00 C ATOM 0 H THR A 100 1.635 7.730 4.956 1.00 0.00 H new ATOM 0 HA THR A 100 -0.205 9.899 4.248 1.00 0.00 H new ATOM 0 HB THR A 100 0.169 10.795 6.621 1.00 0.00 H new ATOM 0 HG1 THR A 100 1.804 8.917 6.930 1.00 0.00 H new ATOM 0 HG21 THR A 100 -1.695 9.482 7.562 1.00 0.00 H new ATOM 0 HG22 THR A 100 -1.997 9.931 5.867 1.00 0.00 H new ATOM 0 HG23 THR A 100 -1.490 8.274 6.272 1.00 0.00 H new ATOM 1464 N TYR A 101 1.781 11.338 3.877 1.00 0.00 N ATOM 1465 CA TYR A 101 2.944 12.166 3.586 1.00 0.00 C ATOM 1466 C TYR A 101 2.822 13.532 4.254 1.00 0.00 C ATOM 1467 O TYR A 101 2.069 14.394 3.799 1.00 0.00 O ATOM 1468 CB TYR A 101 3.109 12.339 2.075 1.00 0.00 C ATOM 1469 CG TYR A 101 4.439 12.936 1.674 1.00 0.00 C ATOM 1470 CD1 TYR A 101 4.750 14.255 1.980 1.00 0.00 C ATOM 1471 CD2 TYR A 101 5.383 12.181 0.990 1.00 0.00 C ATOM 1472 CE1 TYR A 101 5.964 14.805 1.615 1.00 0.00 C ATOM 1473 CE2 TYR A 101 6.600 12.722 0.623 1.00 0.00 C ATOM 1474 CZ TYR A 101 6.886 14.034 0.938 1.00 0.00 C ATOM 1475 OH TYR A 101 8.096 14.577 0.572 1.00 0.00 O ATOM 0 H TYR A 101 0.932 11.615 3.384 1.00 0.00 H new ATOM 0 HA TYR A 101 3.824 11.663 3.986 1.00 0.00 H new ATOM 0 HB2 TYR A 101 2.996 11.368 1.592 1.00 0.00 H new ATOM 0 HB3 TYR A 101 2.307 12.976 1.701 1.00 0.00 H new ATOM 0 HD1 TYR A 101 4.031 14.860 2.512 1.00 0.00 H new ATOM 0 HD2 TYR A 101 5.162 11.154 0.741 1.00 0.00 H new ATOM 0 HE1 TYR A 101 6.190 15.833 1.858 1.00 0.00 H new ATOM 0 HE2 TYR A 101 7.324 12.121 0.092 1.00 0.00 H new ATOM 0 HH TYR A 101 8.778 13.874 0.555 1.00 0.00 H new ATOM 1485 N ASP A 102 3.567 13.723 5.337 1.00 0.00 N ATOM 1486 CA ASP A 102 3.545 14.984 6.069 1.00 0.00 C ATOM 1487 C ASP A 102 2.184 15.209 6.721 1.00 0.00 C ATOM 1488 O ASP A 102 1.591 16.279 6.588 1.00 0.00 O ATOM 1489 CB ASP A 102 3.875 16.147 5.133 1.00 0.00 C ATOM 1490 CG ASP A 102 4.031 17.460 5.874 1.00 0.00 C ATOM 1491 OD1 ASP A 102 4.845 17.515 6.820 1.00 0.00 O ATOM 1492 OD2 ASP A 102 3.340 18.434 5.508 1.00 0.00 O ATOM 0 H ASP A 102 4.194 13.020 5.728 1.00 0.00 H new ATOM 0 HA ASP A 102 4.300 14.934 6.854 1.00 0.00 H new ATOM 0 HB2 ASP A 102 4.796 15.926 4.594 1.00 0.00 H new ATOM 0 HB3 ASP A 102 3.086 16.245 4.388 1.00 0.00 H new ATOM 1497 N ASP A 103 1.696 14.194 7.426 1.00 0.00 N ATOM 1498 CA ASP A 103 0.406 14.281 8.099 1.00 0.00 C ATOM 1499 C ASP A 103 -0.720 14.489 7.091 1.00 0.00 C ATOM 1500 O ASP A 103 -1.759 15.065 7.414 1.00 0.00 O ATOM 1501 CB ASP A 103 0.413 15.424 9.116 1.00 0.00 C ATOM 1502 CG ASP A 103 1.149 15.060 10.391 1.00 0.00 C ATOM 1503 OD1 ASP A 103 2.393 14.964 10.351 1.00 0.00 O ATOM 1504 OD2 ASP A 103 0.480 14.871 11.428 1.00 0.00 O ATOM 0 H ASP A 103 2.175 13.301 7.546 1.00 0.00 H new ATOM 0 HA ASP A 103 0.233 13.340 8.622 1.00 0.00 H new ATOM 0 HB2 ASP A 103 0.879 16.302 8.669 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -0.614 15.697 9.358 1.00 0.00 H new ATOM 1509 N VAL A 104 -0.506 14.016 5.867 1.00 0.00 N ATOM 1510 CA VAL A 104 -1.503 14.149 4.811 1.00 0.00 C ATOM 1511 C VAL A 104 -1.591 12.877 3.975 1.00 0.00 C ATOM 1512 O VAL A 104 -0.625 12.454 3.340 1.00 0.00 O ATOM 1513 CB VAL A 104 -1.184 15.338 3.885 1.00 0.00 C ATOM 1514 CG1 VAL A 104 -2.208 15.431 2.764 1.00 0.00 C ATOM 1515 CG2 VAL A 104 -1.134 16.633 4.681 1.00 0.00 C ATOM 0 H VAL A 104 0.349 13.537 5.582 1.00 0.00 H new ATOM 0 HA VAL A 104 -2.461 14.326 5.300 1.00 0.00 H new ATOM 0 HB VAL A 104 -0.204 15.175 3.437 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -1.967 16.277 2.120 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -2.191 14.512 2.178 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.202 15.571 3.190 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -0.908 17.463 4.012 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -2.099 16.804 5.158 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -0.360 16.561 5.445 1.00 0.00 H new ATOM 1525 N PRO A 105 -2.777 12.251 3.973 1.00 0.00 N ATOM 1526 CA PRO A 105 -3.021 11.018 3.218 1.00 0.00 C ATOM 1527 C PRO A 105 -3.032 11.254 1.711 1.00 0.00 C ATOM 1528 O PRO A 105 -3.362 12.346 1.247 1.00 0.00 O ATOM 1529 CB PRO A 105 -4.404 10.574 3.700 1.00 0.00 C ATOM 1530 CG PRO A 105 -5.067 11.828 4.155 1.00 0.00 C ATOM 1531 CD PRO A 105 -3.972 12.699 4.708 1.00 0.00 C ATOM 0 HA PRO A 105 -2.239 10.277 3.384 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -4.968 10.096 2.899 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -4.327 9.850 4.511 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -5.578 12.321 3.328 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -5.820 11.618 4.915 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -4.175 13.756 4.539 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -3.856 12.565 5.784 1.00 0.00 H new ATOM 1539 N ILE A 106 -2.671 10.225 0.953 1.00 0.00 N ATOM 1540 CA ILE A 106 -2.642 10.320 -0.501 1.00 0.00 C ATOM 1541 C ILE A 106 -3.953 9.836 -1.110 1.00 0.00 C ATOM 1542 O ILE A 106 -4.682 9.037 -0.522 1.00 0.00 O ATOM 1543 CB ILE A 106 -1.479 9.504 -1.096 1.00 0.00 C ATOM 1544 CG1 ILE A 106 -1.418 8.118 -0.450 1.00 0.00 C ATOM 1545 CG2 ILE A 106 -0.162 10.241 -0.906 1.00 0.00 C ATOM 1546 CD1 ILE A 106 -0.430 7.185 -1.114 1.00 0.00 C ATOM 0 H ILE A 106 -2.394 9.315 1.322 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.498 11.372 -0.745 1.00 0.00 H new ATOM 0 HB ILE A 106 -1.652 9.380 -2.165 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -1.152 8.227 0.601 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -2.410 7.667 -0.483 1.00 0.00 H new ATOM 0 HG21 ILE A 106 0.650 9.651 -1.332 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -0.210 11.207 -1.408 1.00 0.00 H new ATOM 0 HG23 ILE A 106 0.020 10.393 0.158 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -0.440 6.222 -0.604 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.707 7.045 -2.159 1.00 0.00 H new ATOM 0 HD13 ILE A 106 0.570 7.615 -1.058 1.00 0.00 H new ATOM 1558 N PRO A 107 -4.261 10.328 -2.319 1.00 0.00 N ATOM 1559 CA PRO A 107 -5.485 9.957 -3.036 1.00 0.00 C ATOM 1560 C PRO A 107 -5.456 8.513 -3.524 1.00 0.00 C ATOM 1561 O PRO A 107 -6.381 8.055 -4.193 1.00 0.00 O ATOM 1562 CB PRO A 107 -5.506 10.923 -4.224 1.00 0.00 C ATOM 1563 CG PRO A 107 -4.078 11.289 -4.440 1.00 0.00 C ATOM 1564 CD PRO A 107 -3.439 11.285 -3.079 1.00 0.00 C ATOM 0 HA PRO A 107 -6.367 10.023 -2.399 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -5.932 10.452 -5.110 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -6.112 11.803 -4.008 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -3.588 10.576 -5.103 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -3.993 12.270 -4.908 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.396 10.971 -3.126 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -3.453 12.276 -2.625 1.00 0.00 H new ATOM 1572 N ASN A 108 -4.387 7.800 -3.184 1.00 0.00 N ATOM 1573 CA ASN A 108 -4.238 6.406 -3.588 1.00 0.00 C ATOM 1574 C ASN A 108 -4.485 5.469 -2.410 1.00 0.00 C ATOM 1575 O ASN A 108 -4.662 4.264 -2.588 1.00 0.00 O ATOM 1576 CB ASN A 108 -2.839 6.167 -4.160 1.00 0.00 C ATOM 1577 CG ASN A 108 -2.350 7.331 -4.999 1.00 0.00 C ATOM 1578 OD1 ASN A 108 -1.321 7.937 -4.700 1.00 0.00 O ATOM 1579 ND2 ASN A 108 -3.088 7.650 -6.056 1.00 0.00 N ATOM 0 H ASN A 108 -3.612 8.164 -2.630 1.00 0.00 H new ATOM 0 HA ASN A 108 -4.980 6.195 -4.358 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -2.140 5.994 -3.342 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -2.848 5.263 -4.769 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -2.809 8.425 -6.658 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -3.934 7.120 -6.266 1.00 0.00 H new ATOM 1586 N SER A 109 -4.496 6.031 -1.205 1.00 0.00 N ATOM 1587 CA SER A 109 -4.719 5.246 0.003 1.00 0.00 C ATOM 1588 C SER A 109 -6.123 5.479 0.552 1.00 0.00 C ATOM 1589 O SER A 109 -6.787 6.466 0.231 1.00 0.00 O ATOM 1590 CB SER A 109 -3.678 5.601 1.067 1.00 0.00 C ATOM 1591 OG SER A 109 -2.549 4.749 0.980 1.00 0.00 O ATOM 0 H SER A 109 -4.353 7.027 -1.040 1.00 0.00 H new ATOM 0 HA SER A 109 -4.619 4.192 -0.256 1.00 0.00 H new ATOM 0 HB2 SER A 109 -3.365 6.638 0.943 1.00 0.00 H new ATOM 0 HB3 SER A 109 -4.124 5.519 2.058 1.00 0.00 H new ATOM 0 HG SER A 109 -2.585 4.243 0.141 1.00 0.00 H new ATOM 1597 N PRO A 110 -6.589 4.549 1.399 1.00 0.00 N ATOM 1598 CA PRO A 110 -5.808 3.371 1.787 1.00 0.00 C ATOM 1599 C PRO A 110 -5.642 2.382 0.638 1.00 0.00 C ATOM 1600 O PRO A 110 -6.321 2.482 -0.384 1.00 0.00 O ATOM 1601 CB PRO A 110 -6.640 2.749 2.912 1.00 0.00 C ATOM 1602 CG PRO A 110 -8.033 3.206 2.649 1.00 0.00 C ATOM 1603 CD PRO A 110 -7.912 4.577 2.043 1.00 0.00 C ATOM 0 HA PRO A 110 -4.793 3.634 2.084 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -6.571 1.661 2.900 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -6.293 3.080 3.891 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -8.546 2.524 1.971 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -8.614 3.237 3.571 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -8.706 4.769 1.322 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -7.974 5.358 2.801 1.00 0.00 H new ATOM 1611 N PHE A 111 -4.735 1.426 0.813 1.00 0.00 N ATOM 1612 CA PHE A 111 -4.479 0.419 -0.210 1.00 0.00 C ATOM 1613 C PHE A 111 -5.010 -0.944 0.224 1.00 0.00 C ATOM 1614 O PHE A 111 -5.345 -1.150 1.391 1.00 0.00 O ATOM 1615 CB PHE A 111 -2.980 0.326 -0.502 1.00 0.00 C ATOM 1616 CG PHE A 111 -2.473 1.424 -1.392 1.00 0.00 C ATOM 1617 CD1 PHE A 111 -2.812 1.457 -2.735 1.00 0.00 C ATOM 1618 CD2 PHE A 111 -1.658 2.424 -0.886 1.00 0.00 C ATOM 1619 CE1 PHE A 111 -2.348 2.467 -3.557 1.00 0.00 C ATOM 1620 CE2 PHE A 111 -1.191 3.436 -1.703 1.00 0.00 C ATOM 1621 CZ PHE A 111 -1.535 3.457 -3.041 1.00 0.00 C ATOM 0 H PHE A 111 -4.165 1.328 1.653 1.00 0.00 H new ATOM 0 HA PHE A 111 -5.000 0.720 -1.119 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -2.432 0.351 0.440 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -2.768 -0.636 -0.969 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -3.446 0.685 -3.144 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -1.385 2.412 0.159 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -2.621 2.482 -4.602 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -0.557 4.210 -1.296 1.00 0.00 H new ATOM 0 HZ PHE A 111 -1.169 4.246 -3.682 1.00 0.00 H new ATOM 1631 N LYS A 112 -5.083 -1.873 -0.723 1.00 0.00 N ATOM 1632 CA LYS A 112 -5.572 -3.218 -0.440 1.00 0.00 C ATOM 1633 C LYS A 112 -4.636 -4.271 -1.025 1.00 0.00 C ATOM 1634 O LYS A 112 -4.582 -4.463 -2.239 1.00 0.00 O ATOM 1635 CB LYS A 112 -6.981 -3.400 -1.009 1.00 0.00 C ATOM 1636 CG LYS A 112 -8.083 -3.009 -0.041 1.00 0.00 C ATOM 1637 CD LYS A 112 -9.376 -2.682 -0.770 1.00 0.00 C ATOM 1638 CE LYS A 112 -10.427 -2.128 0.180 1.00 0.00 C ATOM 1639 NZ LYS A 112 -11.038 -3.198 1.017 1.00 0.00 N ATOM 0 H LYS A 112 -4.810 -1.719 -1.694 1.00 0.00 H new ATOM 0 HA LYS A 112 -5.604 -3.347 0.642 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -7.077 -2.803 -1.916 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -7.115 -4.443 -1.297 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.257 -3.824 0.662 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.766 -2.146 0.544 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -9.177 -1.955 -1.558 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -9.759 -3.580 -1.254 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -9.973 -1.377 0.826 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -11.206 -1.626 -0.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -11.749 -2.780 1.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -11.494 -3.902 0.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -10.299 -3.660 1.584 1.00 0.00 H new ATOM 1653 N VAL A 113 -3.900 -4.951 -0.152 1.00 0.00 N ATOM 1654 CA VAL A 113 -2.967 -5.987 -0.581 1.00 0.00 C ATOM 1655 C VAL A 113 -3.527 -7.378 -0.306 1.00 0.00 C ATOM 1656 O VAL A 113 -3.476 -7.867 0.822 1.00 0.00 O ATOM 1657 CB VAL A 113 -1.606 -5.844 0.125 1.00 0.00 C ATOM 1658 CG1 VAL A 113 -0.649 -6.934 -0.334 1.00 0.00 C ATOM 1659 CG2 VAL A 113 -1.017 -4.465 -0.128 1.00 0.00 C ATOM 0 H VAL A 113 -3.931 -4.803 0.857 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.825 -5.861 -1.654 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.759 -5.957 1.198 1.00 0.00 H new ATOM 0 HG11 VAL A 113 0.307 -6.817 0.176 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -1.069 -7.911 -0.096 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.498 -6.856 -1.411 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -0.055 -4.382 0.378 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -0.877 -4.320 -1.199 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -1.696 -3.703 0.255 1.00 0.00 H new ATOM 1669 N ALA A 114 -4.061 -8.011 -1.346 1.00 0.00 N ATOM 1670 CA ALA A 114 -4.628 -9.348 -1.217 1.00 0.00 C ATOM 1671 C ALA A 114 -3.556 -10.418 -1.392 1.00 0.00 C ATOM 1672 O ALA A 114 -3.253 -10.830 -2.512 1.00 0.00 O ATOM 1673 CB ALA A 114 -5.745 -9.546 -2.231 1.00 0.00 C ATOM 0 H ALA A 114 -4.113 -7.620 -2.286 1.00 0.00 H new ATOM 0 HA ALA A 114 -5.041 -9.446 -0.213 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -6.160 -10.548 -2.124 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -6.529 -8.808 -2.058 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -5.348 -9.423 -3.239 1.00 0.00 H new ATOM 1679 N VAL A 115 -2.984 -10.864 -0.279 1.00 0.00 N ATOM 1680 CA VAL A 115 -1.945 -11.887 -0.309 1.00 0.00 C ATOM 1681 C VAL A 115 -2.530 -13.253 -0.649 1.00 0.00 C ATOM 1682 O VAL A 115 -3.702 -13.523 -0.384 1.00 0.00 O ATOM 1683 CB VAL A 115 -1.207 -11.977 1.039 1.00 0.00 C ATOM 1684 CG1 VAL A 115 -0.232 -13.146 1.038 1.00 0.00 C ATOM 1685 CG2 VAL A 115 -0.486 -10.672 1.340 1.00 0.00 C ATOM 0 H VAL A 115 -3.222 -10.533 0.656 1.00 0.00 H new ATOM 0 HA VAL A 115 -1.235 -11.596 -1.083 1.00 0.00 H new ATOM 0 HB VAL A 115 -1.943 -12.149 1.825 1.00 0.00 H new ATOM 0 HG11 VAL A 115 0.280 -13.193 1.999 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.778 -14.075 0.871 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.501 -13.008 0.243 1.00 0.00 H new ATOM 0 HG21 VAL A 115 0.030 -10.754 2.297 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.239 -10.467 0.553 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -1.210 -9.859 1.387 1.00 0.00 H new ATOM 1695 N THR A 116 -1.705 -14.115 -1.236 1.00 0.00 N ATOM 1696 CA THR A 116 -2.139 -15.454 -1.613 1.00 0.00 C ATOM 1697 C THR A 116 -1.079 -16.493 -1.267 1.00 0.00 C ATOM 1698 O THR A 116 0.118 -16.210 -1.313 1.00 0.00 O ATOM 1699 CB THR A 116 -2.455 -15.539 -3.118 1.00 0.00 C ATOM 1700 OG1 THR A 116 -2.905 -16.858 -3.450 1.00 0.00 O ATOM 1701 CG2 THR A 116 -1.229 -15.192 -3.949 1.00 0.00 C ATOM 0 H THR A 116 -0.732 -13.909 -1.461 1.00 0.00 H new ATOM 0 HA THR A 116 -3.047 -15.664 -1.047 1.00 0.00 H new ATOM 0 HB THR A 116 -3.242 -14.819 -3.343 1.00 0.00 H new ATOM 0 HG1 THR A 116 -3.106 -16.904 -4.408 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.477 -15.259 -5.008 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.906 -14.177 -3.715 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.424 -15.891 -3.720 1.00 0.00 H new ATOM 1709 N GLU A 117 -1.526 -17.697 -0.923 1.00 0.00 N ATOM 1710 CA GLU A 117 -0.614 -18.778 -0.571 1.00 0.00 C ATOM 1711 C GLU A 117 0.378 -19.043 -1.699 1.00 0.00 C ATOM 1712 O GLU A 117 0.012 -19.556 -2.755 1.00 0.00 O ATOM 1713 CB GLU A 117 -1.398 -20.054 -0.256 1.00 0.00 C ATOM 1714 CG GLU A 117 -1.992 -20.075 1.142 1.00 0.00 C ATOM 1715 CD GLU A 117 -2.411 -21.466 1.577 1.00 0.00 C ATOM 1716 OE1 GLU A 117 -2.876 -22.242 0.717 1.00 0.00 O ATOM 1717 OE2 GLU A 117 -2.274 -21.778 2.779 1.00 0.00 O ATOM 0 H GLU A 117 -2.514 -17.948 -0.881 1.00 0.00 H new ATOM 0 HA GLU A 117 -0.057 -18.474 0.315 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -2.201 -20.166 -0.984 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -0.739 -20.914 -0.374 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -1.261 -19.682 1.849 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -2.857 -19.412 1.175 1.00 0.00 H new ATOM 1724 N GLY A 118 1.638 -18.687 -1.467 1.00 0.00 N ATOM 1725 CA GLY A 118 2.665 -18.892 -2.472 1.00 0.00 C ATOM 1726 C GLY A 118 3.829 -19.712 -1.953 1.00 0.00 C ATOM 1727 O GLY A 118 3.823 -20.940 -2.045 1.00 0.00 O ATOM 0 H GLY A 118 1.966 -18.260 -0.601 1.00 0.00 H new ATOM 0 HA2 GLY A 118 2.228 -19.393 -3.336 1.00 0.00 H new ATOM 0 HA3 GLY A 118 3.031 -17.924 -2.816 1.00 0.00 H new ATOM 1731 N CYS A 119 4.832 -19.032 -1.407 1.00 0.00 N ATOM 1732 CA CYS A 119 6.011 -19.705 -0.873 1.00 0.00 C ATOM 1733 C CYS A 119 6.064 -19.584 0.646 1.00 0.00 C ATOM 1734 O CYS A 119 5.520 -18.642 1.222 1.00 0.00 O ATOM 1735 CB CYS A 119 7.281 -19.119 -1.489 1.00 0.00 C ATOM 1736 SG CYS A 119 8.793 -20.010 -1.053 1.00 0.00 S ATOM 0 H CYS A 119 4.852 -18.016 -1.323 1.00 0.00 H new ATOM 0 HA CYS A 119 5.945 -20.762 -1.133 1.00 0.00 H new ATOM 0 HB2 CYS A 119 7.176 -19.113 -2.574 1.00 0.00 H new ATOM 0 HB3 CYS A 119 7.380 -18.081 -1.172 1.00 0.00 H new ATOM 0 HG CYS A 119 9.812 -19.440 -1.624 1.00 0.00 H new ATOM 1742 N GLN A 120 6.722 -20.544 1.288 1.00 0.00 N ATOM 1743 CA GLN A 120 6.845 -20.545 2.741 1.00 0.00 C ATOM 1744 C GLN A 120 8.265 -20.902 3.168 1.00 0.00 C ATOM 1745 O GLN A 120 8.984 -21.622 2.475 1.00 0.00 O ATOM 1746 CB GLN A 120 5.851 -21.532 3.357 1.00 0.00 C ATOM 1747 CG GLN A 120 6.135 -22.982 3.002 1.00 0.00 C ATOM 1748 CD GLN A 120 5.329 -23.956 3.839 1.00 0.00 C ATOM 1749 OE1 GLN A 120 4.244 -23.629 4.320 1.00 0.00 O ATOM 1750 NE2 GLN A 120 5.856 -25.162 4.016 1.00 0.00 N ATOM 0 H GLN A 120 7.178 -21.330 0.825 1.00 0.00 H new ATOM 0 HA GLN A 120 6.620 -19.541 3.100 1.00 0.00 H new ATOM 0 HB2 GLN A 120 5.867 -21.422 4.441 1.00 0.00 H new ATOM 0 HB3 GLN A 120 4.845 -21.276 3.026 1.00 0.00 H new ATOM 0 HG2 GLN A 120 5.912 -23.144 1.947 1.00 0.00 H new ATOM 0 HG3 GLN A 120 7.197 -23.184 3.138 1.00 0.00 H new ATOM 0 HE21 GLN A 120 6.758 -25.390 3.599 1.00 0.00 H new ATOM 0 HE22 GLN A 120 5.358 -25.860 4.569 1.00 0.00 H new ATOM 1759 N PRO A 121 8.680 -20.388 4.335 1.00 0.00 N ATOM 1760 CA PRO A 121 10.017 -20.640 4.880 1.00 0.00 C ATOM 1761 C PRO A 121 10.193 -22.083 5.341 1.00 0.00 C ATOM 1762 O PRO A 121 9.242 -22.864 5.344 1.00 0.00 O ATOM 1763 CB PRO A 121 10.099 -19.684 6.073 1.00 0.00 C ATOM 1764 CG PRO A 121 8.683 -19.462 6.479 1.00 0.00 C ATOM 1765 CD PRO A 121 7.875 -19.522 5.213 1.00 0.00 C ATOM 0 HA PRO A 121 10.797 -20.483 4.135 1.00 0.00 H new ATOM 0 HB2 PRO A 121 10.681 -20.116 6.887 1.00 0.00 H new ATOM 0 HB3 PRO A 121 10.583 -18.747 5.797 1.00 0.00 H new ATOM 0 HG2 PRO A 121 8.356 -20.224 7.187 1.00 0.00 H new ATOM 0 HG3 PRO A 121 8.565 -18.497 6.972 1.00 0.00 H new ATOM 0 HD2 PRO A 121 6.883 -19.939 5.389 1.00 0.00 H new ATOM 0 HD3 PRO A 121 7.733 -18.532 4.780 1.00 0.00 H new ATOM 1773 N SER A 122 11.416 -22.430 5.729 1.00 0.00 N ATOM 1774 CA SER A 122 11.717 -23.781 6.189 1.00 0.00 C ATOM 1775 C SER A 122 12.276 -23.759 7.609 1.00 0.00 C ATOM 1776 O SER A 122 11.703 -24.351 8.523 1.00 0.00 O ATOM 1777 CB SER A 122 12.716 -24.453 5.245 1.00 0.00 C ATOM 1778 OG SER A 122 12.087 -24.860 4.043 1.00 0.00 O ATOM 0 H SER A 122 12.214 -21.795 5.734 1.00 0.00 H new ATOM 0 HA SER A 122 10.789 -24.353 6.191 1.00 0.00 H new ATOM 0 HB2 SER A 122 13.528 -23.762 5.018 1.00 0.00 H new ATOM 0 HB3 SER A 122 13.161 -25.318 5.737 1.00 0.00 H new ATOM 0 HG SER A 122 12.747 -25.285 3.456 1.00 0.00 H new ATOM 1784 N SER A 123 13.401 -23.072 7.784 1.00 0.00 N ATOM 1785 CA SER A 123 14.041 -22.976 9.091 1.00 0.00 C ATOM 1786 C SER A 123 13.354 -21.924 9.956 1.00 0.00 C ATOM 1787 O SER A 123 12.766 -20.972 9.446 1.00 0.00 O ATOM 1788 CB SER A 123 15.524 -22.634 8.932 1.00 0.00 C ATOM 1789 OG SER A 123 15.697 -21.477 8.131 1.00 0.00 O ATOM 0 H SER A 123 13.887 -22.574 7.038 1.00 0.00 H new ATOM 0 HA SER A 123 13.950 -23.943 9.585 1.00 0.00 H new ATOM 0 HB2 SER A 123 15.970 -22.471 9.913 1.00 0.00 H new ATOM 0 HB3 SER A 123 16.048 -23.476 8.479 1.00 0.00 H new ATOM 0 HG SER A 123 16.653 -21.278 8.046 1.00 0.00 H new ATOM 1795 N GLY A 124 13.435 -22.103 11.271 1.00 0.00 N ATOM 1796 CA GLY A 124 12.817 -21.163 12.188 1.00 0.00 C ATOM 1797 C GLY A 124 13.711 -19.976 12.490 1.00 0.00 C ATOM 1798 O GLY A 124 14.561 -19.592 11.688 1.00 0.00 O ATOM 0 H GLY A 124 13.918 -22.883 11.718 1.00 0.00 H new ATOM 0 HA2 GLY A 124 11.878 -20.808 11.762 1.00 0.00 H new ATOM 0 HA3 GLY A 124 12.572 -21.675 13.118 1.00 0.00 H new ATOM 1802 N PRO A 125 13.521 -19.374 13.674 1.00 0.00 N ATOM 1803 CA PRO A 125 14.307 -18.215 14.107 1.00 0.00 C ATOM 1804 C PRO A 125 15.755 -18.578 14.414 1.00 0.00 C ATOM 1805 O PRO A 125 16.028 -19.393 15.296 1.00 0.00 O ATOM 1806 CB PRO A 125 13.590 -17.756 15.380 1.00 0.00 C ATOM 1807 CG PRO A 125 12.910 -18.979 15.893 1.00 0.00 C ATOM 1808 CD PRO A 125 12.525 -19.779 14.680 1.00 0.00 C ATOM 0 HA PRO A 125 14.364 -17.450 13.333 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.295 -17.359 16.110 1.00 0.00 H new ATOM 0 HB3 PRO A 125 12.872 -16.964 15.167 1.00 0.00 H new ATOM 0 HG2 PRO A 125 13.573 -19.550 16.543 1.00 0.00 H new ATOM 0 HG3 PRO A 125 12.032 -18.718 16.483 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.565 -20.850 14.876 1.00 0.00 H new ATOM 0 HD3 PRO A 125 11.510 -19.552 14.354 1.00 0.00 H new ATOM 1816 N SER A 126 16.682 -17.969 13.681 1.00 0.00 N ATOM 1817 CA SER A 126 18.103 -18.231 13.873 1.00 0.00 C ATOM 1818 C SER A 126 18.440 -18.338 15.357 1.00 0.00 C ATOM 1819 O SER A 126 17.682 -17.881 16.212 1.00 0.00 O ATOM 1820 CB SER A 126 18.939 -17.125 13.227 1.00 0.00 C ATOM 1821 OG SER A 126 20.323 -17.340 13.442 1.00 0.00 O ATOM 0 H SER A 126 16.474 -17.290 12.948 1.00 0.00 H new ATOM 0 HA SER A 126 18.340 -19.182 13.395 1.00 0.00 H new ATOM 0 HB2 SER A 126 18.735 -17.089 12.157 1.00 0.00 H new ATOM 0 HB3 SER A 126 18.650 -16.158 13.639 1.00 0.00 H new ATOM 0 HG SER A 126 20.836 -16.620 13.018 1.00 0.00 H new ATOM 1827 N SER A 127 19.584 -18.946 15.655 1.00 0.00 N ATOM 1828 CA SER A 127 20.022 -19.117 17.036 1.00 0.00 C ATOM 1829 C SER A 127 20.758 -17.876 17.530 1.00 0.00 C ATOM 1830 O SER A 127 21.901 -17.625 17.149 1.00 0.00 O ATOM 1831 CB SER A 127 20.928 -20.344 17.157 1.00 0.00 C ATOM 1832 OG SER A 127 21.625 -20.342 18.391 1.00 0.00 O ATOM 0 H SER A 127 20.224 -19.328 14.959 1.00 0.00 H new ATOM 0 HA SER A 127 19.138 -19.264 17.656 1.00 0.00 H new ATOM 0 HB2 SER A 127 20.330 -21.251 17.075 1.00 0.00 H new ATOM 0 HB3 SER A 127 21.641 -20.356 16.333 1.00 0.00 H new ATOM 0 HG SER A 127 22.196 -21.137 18.445 1.00 0.00 H new ATOM 1838 N GLY A 128 20.093 -17.101 18.382 1.00 0.00 N ATOM 1839 CA GLY A 128 20.699 -15.895 18.915 1.00 0.00 C ATOM 1840 C GLY A 128 19.886 -14.653 18.608 1.00 0.00 C ATOM 1841 O GLY A 128 19.793 -13.744 19.433 1.00 0.00 O ATOM 0 H GLY A 128 19.146 -17.287 18.712 1.00 0.00 H new ATOM 0 HA2 GLY A 128 20.810 -15.995 19.995 1.00 0.00 H new ATOM 0 HA3 GLY A 128 21.701 -15.782 18.500 1.00 0.00 H new TER 1845 GLY A 128