USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=33 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 :FLIP amide:sc= -1.73! C(o=-9.4!,f=-7.8!) USER MOD Set 1.2: A 95 HIS : no HD1:sc= -6.05! C(o=-7.8!,f=-13!) USER MOD Set 2.1: A 83 TYR OH : rot 180:sc= 0.413 USER MOD Set 2.2: A 101 TYR OH : rot 148:sc= 0.465 USER MOD Set 3.1: A 78 ASN : amide:sc= -0.148 X(o=-0.15,f=0) USER MOD Set 3.2: A 82 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 45 THR OG1 : rot -85:sc= 0.275 USER MOD Set 4.2: A 84 GLN : amide:sc= -0.319 K(o=-0.044,f=-1.4) 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= 0 X(o=0,f=0) USER MOD Single : A 14 LYS NZ :NH3+ -168:sc=-0.00651 (180deg=-0.133) USER MOD Single : A 21 THR OG1 : rot 26:sc= 0.592 USER MOD Single : A 22 SER OG : rot -19:sc= 0.61 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 110:sc= -0.518 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 140:sc= 0 USER MOD Single : A 53 GLN : amide:sc= -0.133 X(o=-0.13,f=-0.17) USER MOD Single : A 58 HIS : no HD1:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 HIS :FLIP no HE2:sc= -0.483 F(o=-1.6!,f=-0.48) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 160:sc= 0 USER MOD Single : A 73 CYS SG : rot -119:sc= -1.47 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot -176:sc= -2.3! USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 138:sc= -1.63! (180deg=-3.73!) USER MOD Single : A 100 THR OG1 : rot 44:sc= 0.166 USER MOD Single : A 108 ASN : amide:sc= -0.0869 K(o=-0.087,f=-1.5!) USER MOD Single : A 109 SER OG : rot 33:sc= 0.751 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 180:sc=-0.000507 USER MOD Single : A 119 CYS SG : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc= 0.0207 X(o=0.021,f=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 23.724 3.254 7.890 1.00 0.00 N ATOM 2 CA GLY A 1 22.627 3.873 8.610 1.00 0.00 C ATOM 3 C GLY A 1 22.838 5.359 8.822 1.00 0.00 C ATOM 4 O GLY A 1 22.190 6.183 8.177 1.00 0.00 O ATOM 0 H1 GLY A 1 23.532 2.239 7.771 1.00 0.00 H new ATOM 0 H2 GLY A 1 23.822 3.700 6.956 1.00 0.00 H new ATOM 0 H3 GLY A 1 24.606 3.379 8.427 1.00 0.00 H new ATOM 0 HA2 GLY A 1 21.700 3.716 8.059 1.00 0.00 H new ATOM 0 HA3 GLY A 1 22.509 3.384 9.577 1.00 0.00 H new ATOM 8 N SER A 2 23.744 5.702 9.732 1.00 0.00 N ATOM 9 CA SER A 2 24.035 7.099 10.032 1.00 0.00 C ATOM 10 C SER A 2 22.789 7.815 10.545 1.00 0.00 C ATOM 11 O SER A 2 22.512 8.952 10.164 1.00 0.00 O ATOM 12 CB SER A 2 24.568 7.810 8.786 1.00 0.00 C ATOM 13 OG SER A 2 25.376 8.920 9.139 1.00 0.00 O ATOM 0 H SER A 2 24.289 5.032 10.274 1.00 0.00 H new ATOM 0 HA SER A 2 24.796 7.127 10.811 1.00 0.00 H new ATOM 0 HB2 SER A 2 25.148 7.110 8.184 1.00 0.00 H new ATOM 0 HB3 SER A 2 23.734 8.145 8.170 1.00 0.00 H new ATOM 0 HG SER A 2 25.706 9.356 8.326 1.00 0.00 H new ATOM 19 N SER A 3 22.041 7.140 11.412 1.00 0.00 N ATOM 20 CA SER A 3 20.822 7.708 11.975 1.00 0.00 C ATOM 21 C SER A 3 21.122 8.470 13.262 1.00 0.00 C ATOM 22 O SER A 3 21.843 7.983 14.132 1.00 0.00 O ATOM 23 CB SER A 3 19.799 6.604 12.249 1.00 0.00 C ATOM 24 OG SER A 3 18.569 7.149 12.697 1.00 0.00 O ATOM 0 H SER A 3 22.258 6.199 11.740 1.00 0.00 H new ATOM 0 HA SER A 3 20.406 8.406 11.248 1.00 0.00 H new ATOM 0 HB2 SER A 3 19.634 6.023 11.342 1.00 0.00 H new ATOM 0 HB3 SER A 3 20.192 5.918 13.000 1.00 0.00 H new ATOM 0 HG SER A 3 17.931 6.424 12.864 1.00 0.00 H new ATOM 30 N GLY A 4 20.563 9.671 13.376 1.00 0.00 N ATOM 31 CA GLY A 4 20.783 10.483 14.559 1.00 0.00 C ATOM 32 C GLY A 4 19.630 10.400 15.540 1.00 0.00 C ATOM 33 O GLY A 4 19.118 9.316 15.816 1.00 0.00 O ATOM 0 H GLY A 4 19.962 10.096 12.670 1.00 0.00 H new ATOM 0 HA2 GLY A 4 21.700 10.161 15.052 1.00 0.00 H new ATOM 0 HA3 GLY A 4 20.929 11.521 14.262 1.00 0.00 H new ATOM 37 N SER A 5 19.222 11.549 16.069 1.00 0.00 N ATOM 38 CA SER A 5 18.127 11.602 17.030 1.00 0.00 C ATOM 39 C SER A 5 16.778 11.585 16.317 1.00 0.00 C ATOM 40 O SER A 5 16.562 12.322 15.355 1.00 0.00 O ATOM 41 CB SER A 5 18.241 12.857 17.898 1.00 0.00 C ATOM 42 OG SER A 5 17.442 12.746 19.063 1.00 0.00 O ATOM 0 H SER A 5 19.633 12.456 15.848 1.00 0.00 H new ATOM 0 HA SER A 5 18.194 10.721 17.668 1.00 0.00 H new ATOM 0 HB2 SER A 5 19.282 13.014 18.181 1.00 0.00 H new ATOM 0 HB3 SER A 5 17.932 13.730 17.323 1.00 0.00 H new ATOM 0 HG SER A 5 17.534 13.560 19.601 1.00 0.00 H new ATOM 48 N SER A 6 15.873 10.738 16.797 1.00 0.00 N ATOM 49 CA SER A 6 14.546 10.621 16.204 1.00 0.00 C ATOM 50 C SER A 6 13.473 11.108 17.173 1.00 0.00 C ATOM 51 O SER A 6 13.733 11.297 18.361 1.00 0.00 O ATOM 52 CB SER A 6 14.268 9.170 15.806 1.00 0.00 C ATOM 53 OG SER A 6 15.253 8.691 14.907 1.00 0.00 O ATOM 0 H SER A 6 16.034 10.123 17.595 1.00 0.00 H new ATOM 0 HA SER A 6 14.517 11.247 15.312 1.00 0.00 H new ATOM 0 HB2 SER A 6 14.248 8.542 16.697 1.00 0.00 H new ATOM 0 HB3 SER A 6 13.283 9.098 15.344 1.00 0.00 H new ATOM 0 HG SER A 6 15.054 7.761 14.669 1.00 0.00 H new ATOM 59 N GLY A 7 12.264 11.310 16.656 1.00 0.00 N ATOM 60 CA GLY A 7 11.170 11.774 17.488 1.00 0.00 C ATOM 61 C GLY A 7 10.770 13.203 17.177 1.00 0.00 C ATOM 62 O GLY A 7 11.548 14.133 17.390 1.00 0.00 O ATOM 0 H GLY A 7 12.024 11.160 15.676 1.00 0.00 H new ATOM 0 HA2 GLY A 7 10.309 11.120 17.348 1.00 0.00 H new ATOM 0 HA3 GLY A 7 11.459 11.701 18.536 1.00 0.00 H new ATOM 66 N HIS A 8 9.554 13.378 16.670 1.00 0.00 N ATOM 67 CA HIS A 8 9.052 14.704 16.327 1.00 0.00 C ATOM 68 C HIS A 8 7.718 14.976 17.016 1.00 0.00 C ATOM 69 O HIS A 8 6.953 14.052 17.296 1.00 0.00 O ATOM 70 CB HIS A 8 8.893 14.837 14.813 1.00 0.00 C ATOM 71 CG HIS A 8 10.194 14.986 14.084 1.00 0.00 C ATOM 72 ND1 HIS A 8 10.791 13.954 13.391 1.00 0.00 N ATOM 73 CD2 HIS A 8 11.011 16.055 13.943 1.00 0.00 C ATOM 74 CE1 HIS A 8 11.920 14.382 12.856 1.00 0.00 C ATOM 75 NE2 HIS A 8 12.077 15.654 13.176 1.00 0.00 N ATOM 0 H HIS A 8 8.898 12.619 16.488 1.00 0.00 H new ATOM 0 HA HIS A 8 9.777 15.440 16.675 1.00 0.00 H new ATOM 0 HB2 HIS A 8 8.371 13.959 14.432 1.00 0.00 H new ATOM 0 HB3 HIS A 8 8.264 15.700 14.597 1.00 0.00 H new ATOM 0 HD2 HIS A 8 10.854 17.040 14.357 1.00 0.00 H new ATOM 0 HE1 HIS A 8 12.599 13.792 12.258 1.00 0.00 H new ATOM 0 HE2 HIS A 8 12.862 16.243 12.898 1.00 0.00 H new ATOM 83 N PHE A 9 7.446 16.247 17.289 1.00 0.00 N ATOM 84 CA PHE A 9 6.206 16.640 17.947 1.00 0.00 C ATOM 85 C PHE A 9 4.996 16.063 17.217 1.00 0.00 C ATOM 86 O PHE A 9 4.754 16.347 16.044 1.00 0.00 O ATOM 87 CB PHE A 9 6.097 18.165 18.010 1.00 0.00 C ATOM 88 CG PHE A 9 7.150 18.806 18.869 1.00 0.00 C ATOM 89 CD1 PHE A 9 7.115 18.671 20.247 1.00 0.00 C ATOM 90 CD2 PHE A 9 8.174 19.543 18.298 1.00 0.00 C ATOM 91 CE1 PHE A 9 8.082 19.259 21.041 1.00 0.00 C ATOM 92 CE2 PHE A 9 9.145 20.133 19.086 1.00 0.00 C ATOM 93 CZ PHE A 9 9.098 19.991 20.459 1.00 0.00 C ATOM 0 H PHE A 9 8.068 17.023 17.065 1.00 0.00 H new ATOM 0 HA PHE A 9 6.221 16.242 18.961 1.00 0.00 H new ATOM 0 HB2 PHE A 9 6.168 18.568 17.000 1.00 0.00 H new ATOM 0 HB3 PHE A 9 5.113 18.436 18.393 1.00 0.00 H new ATOM 0 HD1 PHE A 9 6.322 18.099 20.707 1.00 0.00 H new ATOM 0 HD2 PHE A 9 8.215 19.658 17.225 1.00 0.00 H new ATOM 0 HE1 PHE A 9 8.043 19.146 22.114 1.00 0.00 H new ATOM 0 HE2 PHE A 9 9.939 20.704 18.628 1.00 0.00 H new ATOM 0 HZ PHE A 9 9.855 20.452 21.077 1.00 0.00 H new ATOM 103 N PRO A 10 4.219 15.232 17.926 1.00 0.00 N ATOM 104 CA PRO A 10 3.022 14.597 17.367 1.00 0.00 C ATOM 105 C PRO A 10 1.897 15.596 17.120 1.00 0.00 C ATOM 106 O PRO A 10 1.140 15.931 18.031 1.00 0.00 O ATOM 107 CB PRO A 10 2.616 13.591 18.447 1.00 0.00 C ATOM 108 CG PRO A 10 3.173 14.148 19.712 1.00 0.00 C ATOM 109 CD PRO A 10 4.447 14.849 19.330 1.00 0.00 C ATOM 0 HA PRO A 10 3.218 14.144 16.395 1.00 0.00 H new ATOM 0 HB2 PRO A 10 1.532 13.487 18.504 1.00 0.00 H new ATOM 0 HB3 PRO A 10 3.021 12.601 18.238 1.00 0.00 H new ATOM 0 HG2 PRO A 10 2.471 14.840 20.176 1.00 0.00 H new ATOM 0 HG3 PRO A 10 3.365 13.356 20.436 1.00 0.00 H new ATOM 0 HD2 PRO A 10 4.630 15.720 19.959 1.00 0.00 H new ATOM 0 HD3 PRO A 10 5.312 14.194 19.432 1.00 0.00 H new ATOM 117 N ALA A 11 1.793 16.069 15.882 1.00 0.00 N ATOM 118 CA ALA A 11 0.759 17.028 15.515 1.00 0.00 C ATOM 119 C ALA A 11 -0.501 16.319 15.031 1.00 0.00 C ATOM 120 O ALA A 11 -0.516 15.727 13.952 1.00 0.00 O ATOM 121 CB ALA A 11 1.276 17.979 14.446 1.00 0.00 C ATOM 0 H ALA A 11 2.413 15.803 15.117 1.00 0.00 H new ATOM 0 HA ALA A 11 0.501 17.604 16.404 1.00 0.00 H new ATOM 0 HB1 ALA A 11 0.493 18.690 14.182 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.142 18.519 14.828 1.00 0.00 H new ATOM 0 HB3 ALA A 11 1.564 17.411 13.562 1.00 0.00 H new ATOM 127 N ARG A 12 -1.557 16.382 15.836 1.00 0.00 N ATOM 128 CA ARG A 12 -2.821 15.744 15.490 1.00 0.00 C ATOM 129 C ARG A 12 -3.975 16.739 15.579 1.00 0.00 C ATOM 130 O ARG A 12 -5.094 16.376 15.940 1.00 0.00 O ATOM 131 CB ARG A 12 -3.087 14.555 16.416 1.00 0.00 C ATOM 132 CG ARG A 12 -3.883 13.439 15.760 1.00 0.00 C ATOM 133 CD ARG A 12 -4.501 12.513 16.796 1.00 0.00 C ATOM 134 NE ARG A 12 -5.681 13.103 17.424 1.00 0.00 N ATOM 135 CZ ARG A 12 -6.650 12.389 17.985 1.00 0.00 C ATOM 136 NH1 ARG A 12 -6.580 11.065 17.997 1.00 0.00 N ATOM 137 NH2 ARG A 12 -7.692 12.999 18.536 1.00 0.00 N ATOM 0 H ARG A 12 -1.562 16.869 16.732 1.00 0.00 H new ATOM 0 HA ARG A 12 -2.750 15.387 14.462 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -2.134 14.155 16.763 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -3.625 14.905 17.297 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -4.669 13.868 15.139 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -3.232 12.866 15.100 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -4.776 11.571 16.322 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -3.761 12.281 17.562 1.00 0.00 H new ATOM 0 HE ARG A 12 -5.765 14.119 17.432 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -5.781 10.593 17.575 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -7.326 10.519 18.429 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -7.749 14.017 18.529 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -8.436 12.449 18.967 1.00 0.00 H new ATOM 151 N VAL A 13 -3.693 17.995 15.247 1.00 0.00 N ATOM 152 CA VAL A 13 -4.706 19.042 15.288 1.00 0.00 C ATOM 153 C VAL A 13 -5.135 19.447 13.882 1.00 0.00 C ATOM 154 O VAL A 13 -4.331 19.446 12.950 1.00 0.00 O ATOM 155 CB VAL A 13 -4.196 20.288 16.035 1.00 0.00 C ATOM 156 CG1 VAL A 13 -5.253 21.381 16.036 1.00 0.00 C ATOM 157 CG2 VAL A 13 -3.789 19.927 17.456 1.00 0.00 C ATOM 0 H VAL A 13 -2.771 18.312 14.947 1.00 0.00 H new ATOM 0 HA VAL A 13 -5.563 18.632 15.823 1.00 0.00 H new ATOM 0 HB VAL A 13 -3.317 20.668 15.514 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -4.874 22.253 16.569 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -5.491 21.658 15.009 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -6.153 21.016 16.531 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -3.431 20.819 17.970 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -4.649 19.522 17.989 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -2.995 19.181 17.429 1.00 0.00 H new ATOM 167 N LYS A 14 -6.410 19.793 13.735 1.00 0.00 N ATOM 168 CA LYS A 14 -6.948 20.202 12.443 1.00 0.00 C ATOM 169 C LYS A 14 -6.146 21.363 11.863 1.00 0.00 C ATOM 170 O LYS A 14 -6.300 22.509 12.285 1.00 0.00 O ATOM 171 CB LYS A 14 -8.418 20.604 12.584 1.00 0.00 C ATOM 172 CG LYS A 14 -8.665 21.636 13.671 1.00 0.00 C ATOM 173 CD LYS A 14 -10.087 21.559 14.200 1.00 0.00 C ATOM 174 CE LYS A 14 -10.260 22.395 15.459 1.00 0.00 C ATOM 175 NZ LYS A 14 -9.576 21.781 16.631 1.00 0.00 N ATOM 0 H LYS A 14 -7.090 19.798 14.495 1.00 0.00 H new ATOM 0 HA LYS A 14 -6.873 19.355 11.761 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -8.771 21.000 11.632 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -9.010 19.714 12.798 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -7.962 21.479 14.489 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -8.476 22.634 13.276 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -10.780 21.906 13.434 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -10.341 20.521 14.414 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -9.861 23.395 15.289 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -11.322 22.508 15.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -9.881 22.261 17.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -9.822 20.772 16.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -8.546 21.880 16.523 1.00 0.00 H new ATOM 189 N VAL A 15 -5.291 21.058 10.892 1.00 0.00 N ATOM 190 CA VAL A 15 -4.467 22.076 10.252 1.00 0.00 C ATOM 191 C VAL A 15 -4.374 21.843 8.748 1.00 0.00 C ATOM 192 O VAL A 15 -3.805 20.848 8.300 1.00 0.00 O ATOM 193 CB VAL A 15 -3.046 22.103 10.845 1.00 0.00 C ATOM 194 CG1 VAL A 15 -2.181 23.120 10.115 1.00 0.00 C ATOM 195 CG2 VAL A 15 -3.097 22.406 12.335 1.00 0.00 C ATOM 0 H VAL A 15 -5.151 20.114 10.532 1.00 0.00 H new ATOM 0 HA VAL A 15 -4.949 23.036 10.439 1.00 0.00 H new ATOM 0 HB VAL A 15 -2.597 21.119 10.712 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -1.181 23.125 10.548 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -2.118 22.854 9.060 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -2.623 24.111 10.213 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -2.084 22.421 12.738 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -3.565 23.378 12.493 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -3.678 21.636 12.843 1.00 0.00 H new ATOM 205 N GLU A 16 -4.936 22.766 7.975 1.00 0.00 N ATOM 206 CA GLU A 16 -4.916 22.660 6.521 1.00 0.00 C ATOM 207 C GLU A 16 -3.611 22.032 6.039 1.00 0.00 C ATOM 208 O GLU A 16 -2.544 22.236 6.619 1.00 0.00 O ATOM 209 CB GLU A 16 -5.097 24.039 5.884 1.00 0.00 C ATOM 210 CG GLU A 16 -3.889 24.947 6.043 1.00 0.00 C ATOM 211 CD GLU A 16 -4.101 26.315 5.424 1.00 0.00 C ATOM 212 OE1 GLU A 16 -4.830 26.403 4.415 1.00 0.00 O ATOM 213 OE2 GLU A 16 -3.538 27.297 5.951 1.00 0.00 O ATOM 0 H GLU A 16 -5.411 23.596 8.331 1.00 0.00 H new ATOM 0 HA GLU A 16 -5.742 22.017 6.218 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -5.310 23.914 4.822 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -5.966 24.524 6.328 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -3.664 25.063 7.103 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.021 24.475 5.583 1.00 0.00 H new ATOM 220 N PRO A 17 -3.696 21.250 4.953 1.00 0.00 N ATOM 221 CA PRO A 17 -2.533 20.577 4.369 1.00 0.00 C ATOM 222 C PRO A 17 -1.568 21.555 3.709 1.00 0.00 C ATOM 223 O PRO A 17 -1.983 22.569 3.148 1.00 0.00 O ATOM 224 CB PRO A 17 -3.150 19.646 3.322 1.00 0.00 C ATOM 225 CG PRO A 17 -4.445 20.289 2.960 1.00 0.00 C ATOM 226 CD PRO A 17 -4.936 20.963 4.211 1.00 0.00 C ATOM 0 HA PRO A 17 -1.941 20.059 5.124 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -2.502 19.544 2.452 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -3.304 18.645 3.724 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -4.311 21.011 2.155 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -5.163 19.549 2.608 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -5.490 21.875 3.986 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -5.604 20.317 4.780 1.00 0.00 H new ATOM 234 N ALA A 18 -0.277 21.245 3.778 1.00 0.00 N ATOM 235 CA ALA A 18 0.746 22.096 3.185 1.00 0.00 C ATOM 236 C ALA A 18 1.557 21.334 2.142 1.00 0.00 C ATOM 237 O ALA A 18 2.647 21.757 1.758 1.00 0.00 O ATOM 238 CB ALA A 18 1.663 22.651 4.265 1.00 0.00 C ATOM 0 H ALA A 18 0.085 20.410 4.239 1.00 0.00 H new ATOM 0 HA ALA A 18 0.247 22.926 2.685 1.00 0.00 H new ATOM 0 HB1 ALA A 18 2.422 23.285 3.807 1.00 0.00 H new ATOM 0 HB2 ALA A 18 1.078 23.239 4.972 1.00 0.00 H new ATOM 0 HB3 ALA A 18 2.147 21.827 4.790 1.00 0.00 H new ATOM 244 N VAL A 19 1.017 20.208 1.686 1.00 0.00 N ATOM 245 CA VAL A 19 1.690 19.387 0.687 1.00 0.00 C ATOM 246 C VAL A 19 0.706 18.884 -0.364 1.00 0.00 C ATOM 247 O VAL A 19 -0.404 18.463 -0.039 1.00 0.00 O ATOM 248 CB VAL A 19 2.394 18.180 1.334 1.00 0.00 C ATOM 249 CG1 VAL A 19 1.427 17.409 2.220 1.00 0.00 C ATOM 250 CG2 VAL A 19 2.987 17.274 0.265 1.00 0.00 C ATOM 0 H VAL A 19 0.115 19.844 1.993 1.00 0.00 H new ATOM 0 HA VAL A 19 2.437 20.020 0.208 1.00 0.00 H new ATOM 0 HB VAL A 19 3.207 18.548 1.959 1.00 0.00 H new ATOM 0 HG11 VAL A 19 1.943 16.560 2.668 1.00 0.00 H new ATOM 0 HG12 VAL A 19 1.054 18.064 3.007 1.00 0.00 H new ATOM 0 HG13 VAL A 19 0.591 17.050 1.620 1.00 0.00 H new ATOM 0 HG21 VAL A 19 3.481 16.426 0.740 1.00 0.00 H new ATOM 0 HG22 VAL A 19 2.192 16.912 -0.387 1.00 0.00 H new ATOM 0 HG23 VAL A 19 3.714 17.834 -0.324 1.00 0.00 H new ATOM 260 N ASP A 20 1.121 18.931 -1.625 1.00 0.00 N ATOM 261 CA ASP A 20 0.278 18.478 -2.725 1.00 0.00 C ATOM 262 C ASP A 20 -0.158 17.031 -2.517 1.00 0.00 C ATOM 263 O ASP A 20 -1.315 16.759 -2.196 1.00 0.00 O ATOM 264 CB ASP A 20 1.021 18.614 -4.055 1.00 0.00 C ATOM 265 CG ASP A 20 0.266 17.980 -5.207 1.00 0.00 C ATOM 266 OD1 ASP A 20 -0.927 18.304 -5.385 1.00 0.00 O ATOM 267 OD2 ASP A 20 0.869 17.161 -5.932 1.00 0.00 O ATOM 0 H ASP A 20 2.036 19.278 -1.911 1.00 0.00 H new ATOM 0 HA ASP A 20 -0.612 19.106 -2.749 1.00 0.00 H new ATOM 0 HB2 ASP A 20 1.186 19.670 -4.270 1.00 0.00 H new ATOM 0 HB3 ASP A 20 2.003 18.149 -3.968 1.00 0.00 H new ATOM 272 N THR A 21 0.777 16.104 -2.701 1.00 0.00 N ATOM 273 CA THR A 21 0.490 14.685 -2.536 1.00 0.00 C ATOM 274 C THR A 21 -0.784 14.292 -3.274 1.00 0.00 C ATOM 275 O THR A 21 -1.641 13.598 -2.727 1.00 0.00 O ATOM 276 CB THR A 21 0.345 14.311 -1.049 1.00 0.00 C ATOM 277 OG1 THR A 21 -0.585 15.194 -0.410 1.00 0.00 O ATOM 278 CG2 THR A 21 1.688 14.382 -0.339 1.00 0.00 C ATOM 0 H THR A 21 1.740 16.311 -2.965 1.00 0.00 H new ATOM 0 HA THR A 21 1.334 14.140 -2.960 1.00 0.00 H new ATOM 0 HB THR A 21 -0.026 13.288 -0.990 1.00 0.00 H new ATOM 0 HG1 THR A 21 -1.209 15.550 -1.077 1.00 0.00 H new ATOM 0 HG21 THR A 21 1.560 14.114 0.710 1.00 0.00 H new ATOM 0 HG22 THR A 21 2.385 13.688 -0.809 1.00 0.00 H new ATOM 0 HG23 THR A 21 2.083 15.395 -0.408 1.00 0.00 H new ATOM 286 N SER A 22 -0.903 14.740 -4.520 1.00 0.00 N ATOM 287 CA SER A 22 -2.076 14.438 -5.332 1.00 0.00 C ATOM 288 C SER A 22 -1.679 13.686 -6.599 1.00 0.00 C ATOM 289 O SER A 22 -2.535 13.253 -7.371 1.00 0.00 O ATOM 290 CB SER A 22 -2.814 15.726 -5.700 1.00 0.00 C ATOM 291 OG SER A 22 -3.898 15.461 -6.573 1.00 0.00 O ATOM 0 H SER A 22 -0.202 15.313 -4.989 1.00 0.00 H new ATOM 0 HA SER A 22 -2.740 13.803 -4.745 1.00 0.00 H new ATOM 0 HB2 SER A 22 -3.182 16.209 -4.795 1.00 0.00 H new ATOM 0 HB3 SER A 22 -2.122 16.422 -6.175 1.00 0.00 H new ATOM 0 HG SER A 22 -3.773 14.585 -6.994 1.00 0.00 H new ATOM 297 N ARG A 23 -0.375 13.535 -6.807 1.00 0.00 N ATOM 298 CA ARG A 23 0.136 12.837 -7.980 1.00 0.00 C ATOM 299 C ARG A 23 1.154 11.773 -7.579 1.00 0.00 C ATOM 300 O ARG A 23 2.039 11.422 -8.360 1.00 0.00 O ATOM 301 CB ARG A 23 0.776 13.830 -8.952 1.00 0.00 C ATOM 302 CG ARG A 23 -0.183 14.900 -9.450 1.00 0.00 C ATOM 303 CD ARG A 23 0.564 16.104 -10.002 1.00 0.00 C ATOM 304 NE ARG A 23 -0.340 17.076 -10.610 1.00 0.00 N ATOM 305 CZ ARG A 23 -1.024 17.979 -9.916 1.00 0.00 C ATOM 306 NH1 ARG A 23 -0.906 18.033 -8.596 1.00 0.00 N ATOM 307 NH2 ARG A 23 -1.827 18.831 -10.541 1.00 0.00 N ATOM 0 H ARG A 23 0.347 13.887 -6.178 1.00 0.00 H new ATOM 0 HA ARG A 23 -0.703 12.345 -8.473 1.00 0.00 H new ATOM 0 HB2 ARG A 23 1.622 14.312 -8.461 1.00 0.00 H new ATOM 0 HB3 ARG A 23 1.173 13.283 -9.807 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -0.825 14.482 -10.225 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -0.833 15.216 -8.634 1.00 0.00 H new ATOM 0 HD2 ARG A 23 1.124 16.583 -9.199 1.00 0.00 H new ATOM 0 HD3 ARG A 23 1.291 15.771 -10.743 1.00 0.00 H new ATOM 0 HE ARG A 23 -0.453 17.061 -11.624 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -0.289 17.381 -8.112 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -1.432 18.727 -8.065 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -1.920 18.793 -11.556 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -2.351 19.524 -10.006 1.00 0.00 H new ATOM 321 N ILE A 24 1.022 11.266 -6.358 1.00 0.00 N ATOM 322 CA ILE A 24 1.930 10.243 -5.855 1.00 0.00 C ATOM 323 C ILE A 24 1.593 8.875 -6.438 1.00 0.00 C ATOM 324 O ILE A 24 0.463 8.400 -6.325 1.00 0.00 O ATOM 325 CB ILE A 24 1.886 10.158 -4.318 1.00 0.00 C ATOM 326 CG1 ILE A 24 2.457 11.436 -3.698 1.00 0.00 C ATOM 327 CG2 ILE A 24 2.654 8.938 -3.832 1.00 0.00 C ATOM 328 CD1 ILE A 24 2.614 11.360 -2.196 1.00 0.00 C ATOM 0 H ILE A 24 0.296 11.547 -5.699 1.00 0.00 H new ATOM 0 HA ILE A 24 2.934 10.531 -6.166 1.00 0.00 H new ATOM 0 HB ILE A 24 0.847 10.057 -4.004 1.00 0.00 H new ATOM 0 HG12 ILE A 24 3.428 11.646 -4.147 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.804 12.273 -3.945 1.00 0.00 H new ATOM 0 HG21 ILE A 24 2.613 8.892 -2.744 1.00 0.00 H new ATOM 0 HG22 ILE A 24 2.207 8.036 -4.250 1.00 0.00 H new ATOM 0 HG23 ILE A 24 3.693 9.010 -4.154 1.00 0.00 H new ATOM 0 HD11 ILE A 24 3.023 12.300 -1.825 1.00 0.00 H new ATOM 0 HD12 ILE A 24 1.642 11.181 -1.737 1.00 0.00 H new ATOM 0 HD13 ILE A 24 3.290 10.544 -1.942 1.00 0.00 H new ATOM 340 N LYS A 25 2.583 8.244 -7.061 1.00 0.00 N ATOM 341 CA LYS A 25 2.395 6.928 -7.660 1.00 0.00 C ATOM 342 C LYS A 25 3.212 5.872 -6.922 1.00 0.00 C ATOM 343 O LYS A 25 4.344 6.126 -6.509 1.00 0.00 O ATOM 344 CB LYS A 25 2.793 6.955 -9.137 1.00 0.00 C ATOM 345 CG LYS A 25 1.824 7.731 -10.014 1.00 0.00 C ATOM 346 CD LYS A 25 2.511 8.280 -11.253 1.00 0.00 C ATOM 347 CE LYS A 25 1.503 8.669 -12.323 1.00 0.00 C ATOM 348 NZ LYS A 25 0.737 9.889 -11.947 1.00 0.00 N ATOM 0 H LYS A 25 3.524 8.623 -7.164 1.00 0.00 H new ATOM 0 HA LYS A 25 1.340 6.668 -7.579 1.00 0.00 H new ATOM 0 HB2 LYS A 25 3.786 7.395 -9.229 1.00 0.00 H new ATOM 0 HB3 LYS A 25 2.863 5.931 -9.505 1.00 0.00 H new ATOM 0 HG2 LYS A 25 1.001 7.082 -10.311 1.00 0.00 H new ATOM 0 HG3 LYS A 25 1.392 8.552 -9.442 1.00 0.00 H new ATOM 0 HD2 LYS A 25 3.110 9.150 -10.983 1.00 0.00 H new ATOM 0 HD3 LYS A 25 3.196 7.532 -11.652 1.00 0.00 H new ATOM 0 HE2 LYS A 25 2.023 8.843 -13.265 1.00 0.00 H new ATOM 0 HE3 LYS A 25 0.812 7.843 -12.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 0.061 10.121 -12.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 0.221 9.715 -11.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 1.394 10.684 -11.814 1.00 0.00 H new ATOM 362 N VAL A 26 2.632 4.687 -6.761 1.00 0.00 N ATOM 363 CA VAL A 26 3.308 3.592 -6.075 1.00 0.00 C ATOM 364 C VAL A 26 3.322 2.332 -6.933 1.00 0.00 C ATOM 365 O VAL A 26 2.273 1.833 -7.339 1.00 0.00 O ATOM 366 CB VAL A 26 2.636 3.274 -4.726 1.00 0.00 C ATOM 367 CG1 VAL A 26 2.713 4.475 -3.795 1.00 0.00 C ATOM 368 CG2 VAL A 26 1.192 2.846 -4.939 1.00 0.00 C ATOM 0 H VAL A 26 1.696 4.461 -7.096 1.00 0.00 H new ATOM 0 HA VAL A 26 4.333 3.917 -5.894 1.00 0.00 H new ATOM 0 HB VAL A 26 3.171 2.447 -4.259 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.233 4.232 -2.847 1.00 0.00 H new ATOM 0 HG12 VAL A 26 3.757 4.732 -3.618 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.204 5.323 -4.252 1.00 0.00 H new ATOM 0 HG21 VAL A 26 0.732 2.625 -3.976 1.00 0.00 H new ATOM 0 HG22 VAL A 26 0.642 3.651 -5.428 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.165 1.955 -5.567 1.00 0.00 H new ATOM 378 N PHE A 27 4.519 1.821 -7.204 1.00 0.00 N ATOM 379 CA PHE A 27 4.670 0.618 -8.015 1.00 0.00 C ATOM 380 C PHE A 27 5.495 -0.433 -7.279 1.00 0.00 C ATOM 381 O PHE A 27 6.521 -0.122 -6.675 1.00 0.00 O ATOM 382 CB PHE A 27 5.332 0.958 -9.352 1.00 0.00 C ATOM 383 CG PHE A 27 6.500 1.893 -9.221 1.00 0.00 C ATOM 384 CD1 PHE A 27 7.768 1.405 -8.949 1.00 0.00 C ATOM 385 CD2 PHE A 27 6.331 3.260 -9.372 1.00 0.00 C ATOM 386 CE1 PHE A 27 8.844 2.264 -8.828 1.00 0.00 C ATOM 387 CE2 PHE A 27 7.403 4.123 -9.252 1.00 0.00 C ATOM 388 CZ PHE A 27 8.662 3.624 -8.981 1.00 0.00 C ATOM 0 H PHE A 27 5.398 2.221 -6.874 1.00 0.00 H new ATOM 0 HA PHE A 27 3.677 0.209 -8.203 1.00 0.00 H new ATOM 0 HB2 PHE A 27 5.666 0.036 -9.828 1.00 0.00 H new ATOM 0 HB3 PHE A 27 4.590 1.407 -10.012 1.00 0.00 H new ATOM 0 HD1 PHE A 27 7.917 0.342 -8.830 1.00 0.00 H new ATOM 0 HD2 PHE A 27 5.349 3.656 -9.586 1.00 0.00 H new ATOM 0 HE1 PHE A 27 9.827 1.871 -8.614 1.00 0.00 H new ATOM 0 HE2 PHE A 27 7.257 5.187 -9.370 1.00 0.00 H new ATOM 0 HZ PHE A 27 9.502 4.296 -8.889 1.00 0.00 H new ATOM 398 N GLY A 28 5.038 -1.681 -7.333 1.00 0.00 N ATOM 399 CA GLY A 28 5.745 -2.759 -6.667 1.00 0.00 C ATOM 400 C GLY A 28 4.808 -3.827 -6.139 1.00 0.00 C ATOM 401 O GLY A 28 3.600 -3.620 -6.020 1.00 0.00 O ATOM 0 H GLY A 28 4.191 -1.964 -7.826 1.00 0.00 H new ATOM 0 HA2 GLY A 28 6.451 -3.211 -7.364 1.00 0.00 H new ATOM 0 HA3 GLY A 28 6.328 -2.351 -5.841 1.00 0.00 H new ATOM 405 N PRO A 29 5.367 -5.002 -5.812 1.00 0.00 N ATOM 406 CA PRO A 29 4.591 -6.130 -5.289 1.00 0.00 C ATOM 407 C PRO A 29 4.073 -5.873 -3.878 1.00 0.00 C ATOM 408 O PRO A 29 2.985 -6.317 -3.515 1.00 0.00 O ATOM 409 CB PRO A 29 5.597 -7.283 -5.288 1.00 0.00 C ATOM 410 CG PRO A 29 6.929 -6.623 -5.190 1.00 0.00 C ATOM 411 CD PRO A 29 6.800 -5.319 -5.928 1.00 0.00 C ATOM 0 HA PRO A 29 3.701 -6.324 -5.887 1.00 0.00 H new ATOM 0 HB2 PRO A 29 5.426 -7.957 -4.448 1.00 0.00 H new ATOM 0 HB3 PRO A 29 5.517 -7.879 -6.197 1.00 0.00 H new ATOM 0 HG2 PRO A 29 7.206 -6.457 -4.149 1.00 0.00 H new ATOM 0 HG3 PRO A 29 7.707 -7.246 -5.632 1.00 0.00 H new ATOM 0 HD2 PRO A 29 7.421 -4.542 -5.482 1.00 0.00 H new ATOM 0 HD3 PRO A 29 7.107 -5.414 -6.969 1.00 0.00 H new ATOM 419 N GLY A 30 4.861 -5.152 -3.086 1.00 0.00 N ATOM 420 CA GLY A 30 4.464 -4.848 -1.723 1.00 0.00 C ATOM 421 C GLY A 30 3.154 -4.089 -1.656 1.00 0.00 C ATOM 422 O GLY A 30 2.453 -4.136 -0.645 1.00 0.00 O ATOM 0 H GLY A 30 5.766 -4.773 -3.363 1.00 0.00 H new ATOM 0 HA2 GLY A 30 4.372 -5.776 -1.159 1.00 0.00 H new ATOM 0 HA3 GLY A 30 5.246 -4.260 -1.243 1.00 0.00 H new ATOM 426 N ILE A 31 2.824 -3.387 -2.735 1.00 0.00 N ATOM 427 CA ILE A 31 1.589 -2.614 -2.793 1.00 0.00 C ATOM 428 C ILE A 31 0.588 -3.249 -3.751 1.00 0.00 C ATOM 429 O ILE A 31 -0.621 -3.058 -3.618 1.00 0.00 O ATOM 430 CB ILE A 31 1.854 -1.162 -3.234 1.00 0.00 C ATOM 431 CG1 ILE A 31 0.596 -0.312 -3.048 1.00 0.00 C ATOM 432 CG2 ILE A 31 2.315 -1.125 -4.684 1.00 0.00 C ATOM 433 CD1 ILE A 31 0.373 0.131 -1.619 1.00 0.00 C ATOM 0 H ILE A 31 3.394 -3.337 -3.580 1.00 0.00 H new ATOM 0 HA ILE A 31 1.172 -2.609 -1.786 1.00 0.00 H new ATOM 0 HB ILE A 31 2.646 -0.747 -2.610 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.665 0.569 -3.687 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.271 -0.882 -3.383 1.00 0.00 H new ATOM 0 HG21 ILE A 31 2.498 -0.092 -4.981 1.00 0.00 H new ATOM 0 HG22 ILE A 31 3.234 -1.701 -4.788 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.543 -1.555 -5.322 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.536 0.729 -1.561 1.00 0.00 H new ATOM 0 HD12 ILE A 31 0.272 -0.745 -0.978 1.00 0.00 H new ATOM 0 HD13 ILE A 31 1.222 0.728 -1.287 1.00 0.00 H new ATOM 445 N GLU A 32 1.099 -4.007 -4.716 1.00 0.00 N ATOM 446 CA GLU A 32 0.248 -4.672 -5.696 1.00 0.00 C ATOM 447 C GLU A 32 -0.258 -6.009 -5.160 1.00 0.00 C ATOM 448 O GLU A 32 -1.453 -6.295 -5.204 1.00 0.00 O ATOM 449 CB GLU A 32 1.013 -4.892 -7.003 1.00 0.00 C ATOM 450 CG GLU A 32 1.336 -3.604 -7.743 1.00 0.00 C ATOM 451 CD GLU A 32 0.226 -3.178 -8.684 1.00 0.00 C ATOM 452 OE1 GLU A 32 -0.834 -2.738 -8.192 1.00 0.00 O ATOM 453 OE2 GLU A 32 0.418 -3.286 -9.914 1.00 0.00 O ATOM 0 H GLU A 32 2.097 -4.176 -4.840 1.00 0.00 H new ATOM 0 HA GLU A 32 -0.611 -4.029 -5.889 1.00 0.00 H new ATOM 0 HB2 GLU A 32 1.942 -5.419 -6.786 1.00 0.00 H new ATOM 0 HB3 GLU A 32 0.424 -5.538 -7.655 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.519 -2.810 -7.019 1.00 0.00 H new ATOM 0 HG3 GLU A 32 2.257 -3.736 -8.310 1.00 0.00 H new ATOM 460 N GLY A 33 0.663 -6.824 -4.654 1.00 0.00 N ATOM 461 CA GLY A 33 0.292 -8.120 -4.117 1.00 0.00 C ATOM 462 C GLY A 33 0.707 -9.263 -5.022 1.00 0.00 C ATOM 463 O GLY A 33 -0.048 -10.214 -5.220 1.00 0.00 O ATOM 0 H GLY A 33 1.659 -6.610 -4.607 1.00 0.00 H new ATOM 0 HA2 GLY A 33 0.753 -8.250 -3.138 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -0.787 -8.152 -3.967 1.00 0.00 H new ATOM 467 N LYS A 34 1.912 -9.169 -5.576 1.00 0.00 N ATOM 468 CA LYS A 34 2.428 -10.203 -6.466 1.00 0.00 C ATOM 469 C LYS A 34 3.221 -11.246 -5.686 1.00 0.00 C ATOM 470 O LYS A 34 2.775 -12.382 -5.519 1.00 0.00 O ATOM 471 CB LYS A 34 3.312 -9.578 -7.547 1.00 0.00 C ATOM 472 CG LYS A 34 2.741 -8.300 -8.136 1.00 0.00 C ATOM 473 CD LYS A 34 1.393 -8.542 -8.794 1.00 0.00 C ATOM 474 CE LYS A 34 1.548 -8.934 -10.255 1.00 0.00 C ATOM 475 NZ LYS A 34 0.419 -9.784 -10.724 1.00 0.00 N ATOM 0 H LYS A 34 2.549 -8.387 -5.424 1.00 0.00 H new ATOM 0 HA LYS A 34 1.580 -10.697 -6.939 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.294 -9.366 -7.124 1.00 0.00 H new ATOM 0 HB3 LYS A 34 3.460 -10.303 -8.348 1.00 0.00 H new ATOM 0 HG2 LYS A 34 2.634 -7.552 -7.350 1.00 0.00 H new ATOM 0 HG3 LYS A 34 3.437 -7.894 -8.870 1.00 0.00 H new ATOM 0 HD2 LYS A 34 0.862 -9.330 -8.259 1.00 0.00 H new ATOM 0 HD3 LYS A 34 0.784 -7.641 -8.721 1.00 0.00 H new ATOM 0 HE2 LYS A 34 1.605 -8.035 -10.868 1.00 0.00 H new ATOM 0 HE3 LYS A 34 2.487 -9.471 -10.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 0.562 -10.030 -11.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 0.380 -10.654 -10.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -0.475 -9.262 -10.620 1.00 0.00 H new ATOM 489 N ASP A 35 4.397 -10.854 -5.209 1.00 0.00 N ATOM 490 CA ASP A 35 5.251 -11.754 -4.444 1.00 0.00 C ATOM 491 C ASP A 35 5.229 -11.396 -2.961 1.00 0.00 C ATOM 492 O ASP A 35 6.252 -11.467 -2.279 1.00 0.00 O ATOM 493 CB ASP A 35 6.685 -11.704 -4.972 1.00 0.00 C ATOM 494 CG ASP A 35 6.742 -11.596 -6.484 1.00 0.00 C ATOM 495 OD1 ASP A 35 5.968 -12.307 -7.158 1.00 0.00 O ATOM 496 OD2 ASP A 35 7.561 -10.801 -6.992 1.00 0.00 O ATOM 0 H ASP A 35 4.781 -9.918 -5.339 1.00 0.00 H new ATOM 0 HA ASP A 35 4.865 -12.767 -4.560 1.00 0.00 H new ATOM 0 HB2 ASP A 35 7.202 -10.852 -4.530 1.00 0.00 H new ATOM 0 HB3 ASP A 35 7.218 -12.600 -4.654 1.00 0.00 H new ATOM 501 N VAL A 36 4.057 -11.010 -2.468 1.00 0.00 N ATOM 502 CA VAL A 36 3.902 -10.640 -1.066 1.00 0.00 C ATOM 503 C VAL A 36 3.444 -11.830 -0.231 1.00 0.00 C ATOM 504 O VAL A 36 2.923 -11.665 0.872 1.00 0.00 O ATOM 505 CB VAL A 36 2.891 -9.490 -0.898 1.00 0.00 C ATOM 506 CG1 VAL A 36 2.924 -8.953 0.525 1.00 0.00 C ATOM 507 CG2 VAL A 36 3.173 -8.382 -1.901 1.00 0.00 C ATOM 0 H VAL A 36 3.201 -10.945 -3.018 1.00 0.00 H new ATOM 0 HA VAL A 36 4.880 -10.309 -0.716 1.00 0.00 H new ATOM 0 HB VAL A 36 1.891 -9.878 -1.091 1.00 0.00 H new ATOM 0 HG11 VAL A 36 2.203 -8.141 0.624 1.00 0.00 H new ATOM 0 HG12 VAL A 36 2.669 -9.752 1.221 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.923 -8.580 0.750 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.449 -7.578 -1.768 1.00 0.00 H new ATOM 0 HG22 VAL A 36 4.179 -7.995 -1.742 1.00 0.00 H new ATOM 0 HG23 VAL A 36 3.093 -8.778 -2.913 1.00 0.00 H new ATOM 517 N PHE A 37 3.644 -13.031 -0.764 1.00 0.00 N ATOM 518 CA PHE A 37 3.252 -14.251 -0.068 1.00 0.00 C ATOM 519 C PHE A 37 3.568 -14.153 1.422 1.00 0.00 C ATOM 520 O PHE A 37 4.407 -13.355 1.838 1.00 0.00 O ATOM 521 CB PHE A 37 3.966 -15.461 -0.673 1.00 0.00 C ATOM 522 CG PHE A 37 4.164 -15.359 -2.159 1.00 0.00 C ATOM 523 CD1 PHE A 37 3.114 -15.604 -3.030 1.00 0.00 C ATOM 524 CD2 PHE A 37 5.400 -15.018 -2.684 1.00 0.00 C ATOM 525 CE1 PHE A 37 3.293 -15.510 -4.397 1.00 0.00 C ATOM 526 CE2 PHE A 37 5.584 -14.923 -4.051 1.00 0.00 C ATOM 527 CZ PHE A 37 4.530 -15.170 -4.908 1.00 0.00 C ATOM 0 H PHE A 37 4.075 -13.185 -1.675 1.00 0.00 H new ATOM 0 HA PHE A 37 2.176 -14.376 -0.186 1.00 0.00 H new ATOM 0 HB2 PHE A 37 4.937 -15.578 -0.192 1.00 0.00 H new ATOM 0 HB3 PHE A 37 3.391 -16.360 -0.452 1.00 0.00 H new ATOM 0 HD1 PHE A 37 2.145 -15.871 -2.636 1.00 0.00 H new ATOM 0 HD2 PHE A 37 6.228 -14.824 -2.019 1.00 0.00 H new ATOM 0 HE1 PHE A 37 2.466 -15.702 -5.065 1.00 0.00 H new ATOM 0 HE2 PHE A 37 6.552 -14.656 -4.448 1.00 0.00 H new ATOM 0 HZ PHE A 37 4.673 -15.097 -5.976 1.00 0.00 H new ATOM 537 N ARG A 38 2.888 -14.970 2.220 1.00 0.00 N ATOM 538 CA ARG A 38 3.094 -14.975 3.663 1.00 0.00 C ATOM 539 C ARG A 38 4.545 -15.305 4.004 1.00 0.00 C ATOM 540 O ARG A 38 5.147 -16.193 3.401 1.00 0.00 O ATOM 541 CB ARG A 38 2.160 -15.986 4.330 1.00 0.00 C ATOM 542 CG ARG A 38 1.935 -15.723 5.810 1.00 0.00 C ATOM 543 CD ARG A 38 1.155 -16.853 6.464 1.00 0.00 C ATOM 544 NE ARG A 38 1.456 -16.972 7.888 1.00 0.00 N ATOM 545 CZ ARG A 38 0.604 -17.465 8.780 1.00 0.00 C ATOM 546 NH1 ARG A 38 -0.595 -17.882 8.397 1.00 0.00 N ATOM 547 NH2 ARG A 38 0.950 -17.541 10.059 1.00 0.00 N ATOM 0 H ARG A 38 2.190 -15.637 1.891 1.00 0.00 H new ATOM 0 HA ARG A 38 2.867 -13.978 4.040 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.198 -15.973 3.817 1.00 0.00 H new ATOM 0 HB3 ARG A 38 2.574 -16.987 4.206 1.00 0.00 H new ATOM 0 HG2 ARG A 38 2.896 -15.606 6.310 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.394 -14.785 5.936 1.00 0.00 H new ATOM 0 HD2 ARG A 38 0.087 -16.680 6.332 1.00 0.00 H new ATOM 0 HD3 ARG A 38 1.390 -17.793 5.964 1.00 0.00 H new ATOM 0 HE ARG A 38 2.370 -16.660 8.215 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -0.865 -17.825 7.415 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -1.247 -18.260 9.084 1.00 0.00 H new ATOM 0 HH21 ARG A 38 1.871 -17.221 10.358 1.00 0.00 H new ATOM 0 HH22 ARG A 38 0.295 -17.920 10.743 1.00 0.00 H new ATOM 561 N GLU A 39 5.098 -14.584 4.974 1.00 0.00 N ATOM 562 CA GLU A 39 6.478 -14.800 5.393 1.00 0.00 C ATOM 563 C GLU A 39 7.446 -14.507 4.250 1.00 0.00 C ATOM 564 O GLU A 39 8.464 -15.181 4.097 1.00 0.00 O ATOM 565 CB GLU A 39 6.667 -16.238 5.880 1.00 0.00 C ATOM 566 CG GLU A 39 5.885 -16.560 7.143 1.00 0.00 C ATOM 567 CD GLU A 39 5.568 -18.038 7.271 1.00 0.00 C ATOM 568 OE1 GLU A 39 6.436 -18.790 7.761 1.00 0.00 O ATOM 569 OE2 GLU A 39 4.453 -18.442 6.881 1.00 0.00 O ATOM 0 H GLU A 39 4.612 -13.846 5.484 1.00 0.00 H new ATOM 0 HA GLU A 39 6.693 -14.115 6.213 1.00 0.00 H new ATOM 0 HB2 GLU A 39 6.362 -16.924 5.089 1.00 0.00 H new ATOM 0 HB3 GLU A 39 7.727 -16.414 6.064 1.00 0.00 H new ATOM 0 HG2 GLU A 39 6.458 -16.238 8.013 1.00 0.00 H new ATOM 0 HG3 GLU A 39 4.955 -15.991 7.145 1.00 0.00 H new ATOM 576 N ALA A 40 7.120 -13.496 3.451 1.00 0.00 N ATOM 577 CA ALA A 40 7.960 -13.113 2.323 1.00 0.00 C ATOM 578 C ALA A 40 8.394 -11.655 2.433 1.00 0.00 C ATOM 579 O ALA A 40 7.635 -10.803 2.897 1.00 0.00 O ATOM 580 CB ALA A 40 7.225 -13.350 1.012 1.00 0.00 C ATOM 0 H ALA A 40 6.281 -12.928 3.564 1.00 0.00 H new ATOM 0 HA ALA A 40 8.856 -13.734 2.341 1.00 0.00 H new ATOM 0 HB1 ALA A 40 7.865 -13.059 0.179 1.00 0.00 H new ATOM 0 HB2 ALA A 40 6.971 -14.406 0.923 1.00 0.00 H new ATOM 0 HB3 ALA A 40 6.312 -12.754 0.994 1.00 0.00 H new ATOM 586 N THR A 41 9.620 -11.373 2.003 1.00 0.00 N ATOM 587 CA THR A 41 10.155 -10.018 2.054 1.00 0.00 C ATOM 588 C THR A 41 9.775 -9.229 0.807 1.00 0.00 C ATOM 589 O THR A 41 10.411 -9.357 -0.240 1.00 0.00 O ATOM 590 CB THR A 41 11.689 -10.025 2.196 1.00 0.00 C ATOM 591 OG1 THR A 41 12.077 -10.882 3.276 1.00 0.00 O ATOM 592 CG2 THR A 41 12.216 -8.619 2.443 1.00 0.00 C ATOM 0 H THR A 41 10.261 -12.065 1.615 1.00 0.00 H new ATOM 0 HA THR A 41 9.718 -9.539 2.930 1.00 0.00 H new ATOM 0 HB THR A 41 12.116 -10.398 1.265 1.00 0.00 H new ATOM 0 HG1 THR A 41 13.054 -10.882 3.359 1.00 0.00 H new ATOM 0 HG21 THR A 41 13.301 -8.649 2.540 1.00 0.00 H new ATOM 0 HG22 THR A 41 11.944 -7.976 1.606 1.00 0.00 H new ATOM 0 HG23 THR A 41 11.781 -8.223 3.361 1.00 0.00 H new ATOM 600 N THR A 42 8.734 -8.411 0.923 1.00 0.00 N ATOM 601 CA THR A 42 8.269 -7.601 -0.195 1.00 0.00 C ATOM 602 C THR A 42 8.365 -6.114 0.125 1.00 0.00 C ATOM 603 O THR A 42 8.247 -5.709 1.282 1.00 0.00 O ATOM 604 CB THR A 42 6.813 -7.941 -0.569 1.00 0.00 C ATOM 605 OG1 THR A 42 6.399 -7.155 -1.691 1.00 0.00 O ATOM 606 CG2 THR A 42 5.880 -7.689 0.606 1.00 0.00 C ATOM 0 H THR A 42 8.196 -8.292 1.782 1.00 0.00 H new ATOM 0 HA THR A 42 8.917 -7.830 -1.041 1.00 0.00 H new ATOM 0 HB THR A 42 6.765 -8.998 -0.830 1.00 0.00 H new ATOM 0 HG1 THR A 42 6.305 -7.732 -2.478 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.858 -7.936 0.319 1.00 0.00 H new ATOM 0 HG22 THR A 42 6.180 -8.311 1.449 1.00 0.00 H new ATOM 0 HG23 THR A 42 5.932 -6.639 0.893 1.00 0.00 H new ATOM 614 N ASP A 43 8.578 -5.304 -0.906 1.00 0.00 N ATOM 615 CA ASP A 43 8.688 -3.860 -0.734 1.00 0.00 C ATOM 616 C ASP A 43 8.218 -3.126 -1.986 1.00 0.00 C ATOM 617 O ASP A 43 8.319 -3.646 -3.098 1.00 0.00 O ATOM 618 CB ASP A 43 10.132 -3.471 -0.412 1.00 0.00 C ATOM 619 CG ASP A 43 11.112 -3.966 -1.458 1.00 0.00 C ATOM 620 OD1 ASP A 43 11.351 -5.190 -1.515 1.00 0.00 O ATOM 621 OD2 ASP A 43 11.638 -3.128 -2.219 1.00 0.00 O ATOM 0 H ASP A 43 8.678 -5.623 -1.870 1.00 0.00 H new ATOM 0 HA ASP A 43 8.047 -3.569 0.098 1.00 0.00 H new ATOM 0 HB2 ASP A 43 10.204 -2.386 -0.335 1.00 0.00 H new ATOM 0 HB3 ASP A 43 10.407 -3.879 0.561 1.00 0.00 H new ATOM 626 N PHE A 44 7.704 -1.915 -1.799 1.00 0.00 N ATOM 627 CA PHE A 44 7.217 -1.110 -2.913 1.00 0.00 C ATOM 628 C PHE A 44 8.033 0.171 -3.057 1.00 0.00 C ATOM 629 O PHE A 44 8.903 0.463 -2.235 1.00 0.00 O ATOM 630 CB PHE A 44 5.739 -0.767 -2.714 1.00 0.00 C ATOM 631 CG PHE A 44 5.456 -0.067 -1.415 1.00 0.00 C ATOM 632 CD1 PHE A 44 5.186 -0.793 -0.266 1.00 0.00 C ATOM 633 CD2 PHE A 44 5.461 1.317 -1.343 1.00 0.00 C ATOM 634 CE1 PHE A 44 4.925 -0.151 0.930 1.00 0.00 C ATOM 635 CE2 PHE A 44 5.201 1.964 -0.150 1.00 0.00 C ATOM 636 CZ PHE A 44 4.933 1.229 0.988 1.00 0.00 C ATOM 0 H PHE A 44 7.614 -1.469 -0.886 1.00 0.00 H new ATOM 0 HA PHE A 44 7.328 -1.694 -3.826 1.00 0.00 H new ATOM 0 HB2 PHE A 44 5.407 -0.135 -3.538 1.00 0.00 H new ATOM 0 HB3 PHE A 44 5.152 -1.684 -2.759 1.00 0.00 H new ATOM 0 HD1 PHE A 44 5.179 -1.872 -0.305 1.00 0.00 H new ATOM 0 HD2 PHE A 44 5.671 1.897 -2.230 1.00 0.00 H new ATOM 0 HE1 PHE A 44 4.715 -0.728 1.818 1.00 0.00 H new ATOM 0 HE2 PHE A 44 5.207 3.043 -0.108 1.00 0.00 H new ATOM 0 HZ PHE A 44 4.730 1.732 1.922 1.00 0.00 H new ATOM 646 N THR A 45 7.748 0.932 -4.108 1.00 0.00 N ATOM 647 CA THR A 45 8.455 2.181 -4.362 1.00 0.00 C ATOM 648 C THR A 45 7.481 3.342 -4.524 1.00 0.00 C ATOM 649 O THR A 45 6.523 3.259 -5.292 1.00 0.00 O ATOM 650 CB THR A 45 9.333 2.082 -5.625 1.00 0.00 C ATOM 651 OG1 THR A 45 10.148 0.907 -5.564 1.00 0.00 O ATOM 652 CG2 THR A 45 10.217 3.312 -5.766 1.00 0.00 C ATOM 0 H THR A 45 7.032 0.705 -4.798 1.00 0.00 H new ATOM 0 HA THR A 45 9.093 2.364 -3.497 1.00 0.00 H new ATOM 0 HB THR A 45 8.677 2.023 -6.494 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.962 1.100 -5.054 1.00 0.00 H new ATOM 0 HG21 THR A 45 10.828 3.220 -6.664 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.593 4.202 -5.841 1.00 0.00 H new ATOM 0 HG23 THR A 45 10.865 3.396 -4.894 1.00 0.00 H new ATOM 660 N VAL A 46 7.733 4.425 -3.795 1.00 0.00 N ATOM 661 CA VAL A 46 6.879 5.605 -3.859 1.00 0.00 C ATOM 662 C VAL A 46 7.574 6.748 -4.591 1.00 0.00 C ATOM 663 O VAL A 46 8.551 7.312 -4.097 1.00 0.00 O ATOM 664 CB VAL A 46 6.474 6.082 -2.452 1.00 0.00 C ATOM 665 CG1 VAL A 46 5.711 7.395 -2.532 1.00 0.00 C ATOM 666 CG2 VAL A 46 5.647 5.017 -1.747 1.00 0.00 C ATOM 0 H VAL A 46 8.522 4.509 -3.153 1.00 0.00 H new ATOM 0 HA VAL A 46 5.983 5.317 -4.409 1.00 0.00 H new ATOM 0 HB VAL A 46 7.380 6.251 -1.870 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.433 7.716 -1.528 1.00 0.00 H new ATOM 0 HG12 VAL A 46 6.341 8.154 -2.995 1.00 0.00 H new ATOM 0 HG13 VAL A 46 4.811 7.257 -3.131 1.00 0.00 H new ATOM 0 HG21 VAL A 46 5.369 5.370 -0.754 1.00 0.00 H new ATOM 0 HG22 VAL A 46 4.746 4.814 -2.325 1.00 0.00 H new ATOM 0 HG23 VAL A 46 6.233 4.102 -1.656 1.00 0.00 H new ATOM 676 N ASP A 47 7.064 7.085 -5.770 1.00 0.00 N ATOM 677 CA ASP A 47 7.634 8.163 -6.570 1.00 0.00 C ATOM 678 C ASP A 47 7.012 9.505 -6.197 1.00 0.00 C ATOM 679 O ASP A 47 5.793 9.670 -6.246 1.00 0.00 O ATOM 680 CB ASP A 47 7.426 7.886 -8.060 1.00 0.00 C ATOM 681 CG ASP A 47 8.533 8.468 -8.917 1.00 0.00 C ATOM 682 OD1 ASP A 47 9.577 7.800 -9.071 1.00 0.00 O ATOM 683 OD2 ASP A 47 8.355 9.590 -9.434 1.00 0.00 O ATOM 0 H ASP A 47 6.257 6.627 -6.193 1.00 0.00 H new ATOM 0 HA ASP A 47 8.703 8.209 -6.363 1.00 0.00 H new ATOM 0 HB2 ASP A 47 7.373 6.810 -8.222 1.00 0.00 H new ATOM 0 HB3 ASP A 47 6.469 8.304 -8.374 1.00 0.00 H new ATOM 688 N SER A 48 7.857 10.460 -5.823 1.00 0.00 N ATOM 689 CA SER A 48 7.390 11.786 -5.437 1.00 0.00 C ATOM 690 C SER A 48 8.199 12.873 -6.138 1.00 0.00 C ATOM 691 O SER A 48 9.430 12.861 -6.111 1.00 0.00 O ATOM 692 CB SER A 48 7.485 11.962 -3.920 1.00 0.00 C ATOM 693 OG SER A 48 6.802 10.922 -3.242 1.00 0.00 O ATOM 0 H SER A 48 8.869 10.340 -5.779 1.00 0.00 H new ATOM 0 HA SER A 48 6.348 11.880 -5.742 1.00 0.00 H new ATOM 0 HB2 SER A 48 8.532 11.972 -3.617 1.00 0.00 H new ATOM 0 HB3 SER A 48 7.062 12.925 -3.635 1.00 0.00 H new ATOM 0 HG SER A 48 6.879 11.057 -2.274 1.00 0.00 H new ATOM 699 N ARG A 49 7.498 13.812 -6.765 1.00 0.00 N ATOM 700 CA ARG A 49 8.150 14.906 -7.475 1.00 0.00 C ATOM 701 C ARG A 49 7.961 16.225 -6.732 1.00 0.00 C ATOM 702 O ARG A 49 8.893 16.776 -6.147 1.00 0.00 O ATOM 703 CB ARG A 49 7.595 15.023 -8.895 1.00 0.00 C ATOM 704 CG ARG A 49 8.448 14.325 -9.942 1.00 0.00 C ATOM 705 CD ARG A 49 7.658 14.055 -11.214 1.00 0.00 C ATOM 706 NE ARG A 49 8.458 13.356 -12.216 1.00 0.00 N ATOM 707 CZ ARG A 49 8.210 13.406 -13.520 1.00 0.00 C ATOM 708 NH1 ARG A 49 7.190 14.120 -13.977 1.00 0.00 N ATOM 709 NH2 ARG A 49 8.983 12.743 -14.370 1.00 0.00 N ATOM 0 H ARG A 49 6.479 13.837 -6.796 1.00 0.00 H new ATOM 0 HA ARG A 49 9.217 14.688 -7.527 1.00 0.00 H new ATOM 0 HB2 ARG A 49 6.590 14.603 -8.919 1.00 0.00 H new ATOM 0 HB3 ARG A 49 7.506 16.078 -9.155 1.00 0.00 H new ATOM 0 HG2 ARG A 49 9.316 14.941 -10.175 1.00 0.00 H new ATOM 0 HG3 ARG A 49 8.824 13.384 -9.539 1.00 0.00 H new ATOM 0 HD2 ARG A 49 6.777 13.460 -10.974 1.00 0.00 H new ATOM 0 HD3 ARG A 49 7.303 14.999 -11.628 1.00 0.00 H new ATOM 0 HE ARG A 49 9.251 12.799 -11.897 1.00 0.00 H new ATOM 0 HH11 ARG A 49 6.594 14.632 -13.327 1.00 0.00 H new ATOM 0 HH12 ARG A 49 7.002 14.157 -14.979 1.00 0.00 H new ATOM 0 HH21 ARG A 49 9.769 12.194 -14.023 1.00 0.00 H new ATOM 0 HH22 ARG A 49 8.791 12.782 -15.371 1.00 0.00 H new ATOM 723 N PRO A 50 6.724 16.745 -6.756 1.00 0.00 N ATOM 724 CA PRO A 50 6.383 18.006 -6.091 1.00 0.00 C ATOM 725 C PRO A 50 6.409 17.884 -4.571 1.00 0.00 C ATOM 726 O PRO A 50 5.868 18.733 -3.861 1.00 0.00 O ATOM 727 CB PRO A 50 4.961 18.292 -6.580 1.00 0.00 C ATOM 728 CG PRO A 50 4.405 16.955 -6.929 1.00 0.00 C ATOM 729 CD PRO A 50 5.565 16.143 -7.434 1.00 0.00 C ATOM 0 HA PRO A 50 7.096 18.797 -6.326 1.00 0.00 H new ATOM 0 HB2 PRO A 50 4.367 18.778 -5.807 1.00 0.00 H new ATOM 0 HB3 PRO A 50 4.965 18.957 -7.444 1.00 0.00 H new ATOM 0 HG2 PRO A 50 3.948 16.483 -6.059 1.00 0.00 H new ATOM 0 HG3 PRO A 50 3.629 17.042 -7.689 1.00 0.00 H new ATOM 0 HD2 PRO A 50 5.456 15.088 -7.183 1.00 0.00 H new ATOM 0 HD3 PRO A 50 5.657 16.205 -8.518 1.00 0.00 H new ATOM 737 N LEU A 51 7.040 16.825 -4.077 1.00 0.00 N ATOM 738 CA LEU A 51 7.136 16.592 -2.640 1.00 0.00 C ATOM 739 C LEU A 51 8.594 16.513 -2.198 1.00 0.00 C ATOM 740 O LEU A 51 8.982 17.103 -1.189 1.00 0.00 O ATOM 741 CB LEU A 51 6.406 15.303 -2.262 1.00 0.00 C ATOM 742 CG LEU A 51 5.090 15.037 -2.994 1.00 0.00 C ATOM 743 CD1 LEU A 51 4.426 13.778 -2.459 1.00 0.00 C ATOM 744 CD2 LEU A 51 4.156 16.232 -2.862 1.00 0.00 C ATOM 0 H LEU A 51 7.493 16.113 -4.650 1.00 0.00 H new ATOM 0 HA LEU A 51 6.665 17.431 -2.128 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.076 14.463 -2.444 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.205 15.324 -1.191 1.00 0.00 H new ATOM 0 HG LEU A 51 5.309 14.886 -4.051 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.491 13.605 -2.992 1.00 0.00 H new ATOM 0 HD12 LEU A 51 5.090 12.926 -2.605 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.220 13.899 -1.395 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.224 16.026 -3.389 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.944 16.414 -1.808 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.630 17.113 -3.294 1.00 0.00 H new ATOM 756 N THR A 52 9.400 15.781 -2.961 1.00 0.00 N ATOM 757 CA THR A 52 10.815 15.625 -2.650 1.00 0.00 C ATOM 758 C THR A 52 11.663 15.649 -3.916 1.00 0.00 C ATOM 759 O THR A 52 11.184 15.317 -5.000 1.00 0.00 O ATOM 760 CB THR A 52 11.082 14.311 -1.892 1.00 0.00 C ATOM 761 OG1 THR A 52 12.367 14.361 -1.262 1.00 0.00 O ATOM 762 CG2 THR A 52 11.019 13.120 -2.836 1.00 0.00 C ATOM 0 H THR A 52 9.096 15.286 -3.800 1.00 0.00 H new ATOM 0 HA THR A 52 11.093 16.466 -2.014 1.00 0.00 H new ATOM 0 HB THR A 52 10.310 14.192 -1.131 1.00 0.00 H new ATOM 0 HG1 THR A 52 12.311 13.953 -0.373 1.00 0.00 H new ATOM 0 HG21 THR A 52 11.211 12.203 -2.278 1.00 0.00 H new ATOM 0 HG22 THR A 52 10.030 13.068 -3.291 1.00 0.00 H new ATOM 0 HG23 THR A 52 11.771 13.234 -3.616 1.00 0.00 H new ATOM 770 N GLN A 53 12.923 16.045 -3.771 1.00 0.00 N ATOM 771 CA GLN A 53 13.838 16.112 -4.905 1.00 0.00 C ATOM 772 C GLN A 53 15.087 15.277 -4.647 1.00 0.00 C ATOM 773 O GLN A 53 15.612 14.630 -5.553 1.00 0.00 O ATOM 774 CB GLN A 53 14.229 17.563 -5.187 1.00 0.00 C ATOM 775 CG GLN A 53 13.044 18.463 -5.498 1.00 0.00 C ATOM 776 CD GLN A 53 12.458 19.108 -4.257 1.00 0.00 C ATOM 777 OE1 GLN A 53 13.144 19.837 -3.540 1.00 0.00 O ATOM 778 NE2 GLN A 53 11.184 18.841 -3.997 1.00 0.00 N ATOM 0 H GLN A 53 13.334 16.324 -2.880 1.00 0.00 H new ATOM 0 HA GLN A 53 13.326 15.706 -5.777 1.00 0.00 H new ATOM 0 HB2 GLN A 53 14.761 17.962 -4.323 1.00 0.00 H new ATOM 0 HB3 GLN A 53 14.923 17.587 -6.027 1.00 0.00 H new ATOM 0 HG2 GLN A 53 13.357 19.241 -6.194 1.00 0.00 H new ATOM 0 HG3 GLN A 53 12.271 17.880 -5.999 1.00 0.00 H new ATOM 0 HE21 GLN A 53 10.653 18.231 -4.619 1.00 0.00 H new ATOM 0 HE22 GLN A 53 10.736 19.246 -3.175 1.00 0.00 H new ATOM 787 N VAL A 54 15.560 15.296 -3.404 1.00 0.00 N ATOM 788 CA VAL A 54 16.748 14.540 -3.027 1.00 0.00 C ATOM 789 C VAL A 54 16.442 13.566 -1.894 1.00 0.00 C ATOM 790 O VAL A 54 17.241 13.397 -0.974 1.00 0.00 O ATOM 791 CB VAL A 54 17.892 15.474 -2.591 1.00 0.00 C ATOM 792 CG1 VAL A 54 18.240 16.449 -3.705 1.00 0.00 C ATOM 793 CG2 VAL A 54 17.517 16.218 -1.318 1.00 0.00 C ATOM 0 H VAL A 54 15.138 15.827 -2.642 1.00 0.00 H new ATOM 0 HA VAL A 54 17.061 13.981 -3.909 1.00 0.00 H new ATOM 0 HB VAL A 54 18.773 14.867 -2.384 1.00 0.00 H new ATOM 0 HG11 VAL A 54 19.050 17.101 -3.378 1.00 0.00 H new ATOM 0 HG12 VAL A 54 18.555 15.894 -4.589 1.00 0.00 H new ATOM 0 HG13 VAL A 54 17.365 17.052 -3.947 1.00 0.00 H new ATOM 0 HG21 VAL A 54 18.337 16.873 -1.025 1.00 0.00 H new ATOM 0 HG22 VAL A 54 16.622 16.814 -1.495 1.00 0.00 H new ATOM 0 HG23 VAL A 54 17.323 15.500 -0.521 1.00 0.00 H new ATOM 803 N GLY A 55 15.279 12.926 -1.969 1.00 0.00 N ATOM 804 CA GLY A 55 14.888 11.976 -0.944 1.00 0.00 C ATOM 805 C GLY A 55 14.583 12.645 0.381 1.00 0.00 C ATOM 806 O GLY A 55 15.130 13.702 0.691 1.00 0.00 O ATOM 0 H GLY A 55 14.601 13.048 -2.721 1.00 0.00 H new ATOM 0 HA2 GLY A 55 14.010 11.425 -1.280 1.00 0.00 H new ATOM 0 HA3 GLY A 55 15.687 11.248 -0.804 1.00 0.00 H new ATOM 810 N GLY A 56 13.704 12.028 1.165 1.00 0.00 N ATOM 811 CA GLY A 56 13.340 12.587 2.455 1.00 0.00 C ATOM 812 C GLY A 56 13.083 11.518 3.498 1.00 0.00 C ATOM 813 O GLY A 56 13.216 10.326 3.221 1.00 0.00 O ATOM 0 H GLY A 56 13.238 11.152 0.930 1.00 0.00 H new ATOM 0 HA2 GLY A 56 14.138 13.244 2.801 1.00 0.00 H new ATOM 0 HA3 GLY A 56 12.447 13.202 2.342 1.00 0.00 H new ATOM 817 N ASP A 57 12.717 11.944 4.702 1.00 0.00 N ATOM 818 CA ASP A 57 12.442 11.015 5.791 1.00 0.00 C ATOM 819 C ASP A 57 11.142 11.379 6.501 1.00 0.00 C ATOM 820 O ASP A 57 11.062 11.344 7.729 1.00 0.00 O ATOM 821 CB ASP A 57 13.599 11.010 6.791 1.00 0.00 C ATOM 822 CG ASP A 57 13.749 12.336 7.510 1.00 0.00 C ATOM 823 OD1 ASP A 57 13.673 13.387 6.839 1.00 0.00 O ATOM 824 OD2 ASP A 57 13.940 12.323 8.743 1.00 0.00 O ATOM 0 H ASP A 57 12.604 12.927 4.948 1.00 0.00 H new ATOM 0 HA ASP A 57 12.336 10.017 5.365 1.00 0.00 H new ATOM 0 HB2 ASP A 57 13.439 10.219 7.524 1.00 0.00 H new ATOM 0 HB3 ASP A 57 14.526 10.777 6.268 1.00 0.00 H new ATOM 829 N HIS A 58 10.125 11.729 5.720 1.00 0.00 N ATOM 830 CA HIS A 58 8.828 12.101 6.274 1.00 0.00 C ATOM 831 C HIS A 58 7.746 11.121 5.829 1.00 0.00 C ATOM 832 O HIS A 58 6.572 11.480 5.733 1.00 0.00 O ATOM 833 CB HIS A 58 8.454 13.520 5.845 1.00 0.00 C ATOM 834 CG HIS A 58 8.936 14.578 6.791 1.00 0.00 C ATOM 835 ND1 HIS A 58 8.084 15.369 7.532 1.00 0.00 N ATOM 836 CD2 HIS A 58 10.190 14.971 7.115 1.00 0.00 C ATOM 837 CE1 HIS A 58 8.793 16.204 8.270 1.00 0.00 C ATOM 838 NE2 HIS A 58 10.074 15.983 8.036 1.00 0.00 N ATOM 0 H HIS A 58 10.174 11.763 4.702 1.00 0.00 H new ATOM 0 HA HIS A 58 8.902 12.066 7.361 1.00 0.00 H new ATOM 0 HB2 HIS A 58 8.868 13.713 4.855 1.00 0.00 H new ATOM 0 HB3 HIS A 58 7.370 13.590 5.756 1.00 0.00 H new ATOM 0 HD2 HIS A 58 11.110 14.564 6.722 1.00 0.00 H new ATOM 0 HE1 HIS A 58 8.393 16.942 8.949 1.00 0.00 H new ATOM 0 HE2 HIS A 58 10.851 16.483 8.469 1.00 0.00 H new ATOM 846 N ILE A 59 8.150 9.885 5.557 1.00 0.00 N ATOM 847 CA ILE A 59 7.215 8.855 5.123 1.00 0.00 C ATOM 848 C ILE A 59 6.904 7.881 6.255 1.00 0.00 C ATOM 849 O ILE A 59 7.754 7.606 7.103 1.00 0.00 O ATOM 850 CB ILE A 59 7.764 8.067 3.919 1.00 0.00 C ATOM 851 CG1 ILE A 59 7.918 8.987 2.707 1.00 0.00 C ATOM 852 CG2 ILE A 59 6.850 6.896 3.591 1.00 0.00 C ATOM 853 CD1 ILE A 59 6.604 9.532 2.192 1.00 0.00 C ATOM 0 H ILE A 59 9.118 9.573 5.629 1.00 0.00 H new ATOM 0 HA ILE A 59 6.299 9.366 4.825 1.00 0.00 H new ATOM 0 HB ILE A 59 8.747 7.673 4.179 1.00 0.00 H new ATOM 0 HG12 ILE A 59 8.568 9.820 2.974 1.00 0.00 H new ATOM 0 HG13 ILE A 59 8.414 8.439 1.906 1.00 0.00 H new ATOM 0 HG21 ILE A 59 7.251 6.349 2.738 1.00 0.00 H new ATOM 0 HG22 ILE A 59 6.788 6.231 4.452 1.00 0.00 H new ATOM 0 HG23 ILE A 59 5.855 7.268 3.348 1.00 0.00 H new ATOM 0 HD11 ILE A 59 6.789 10.176 1.332 1.00 0.00 H new ATOM 0 HD12 ILE A 59 5.959 8.705 1.894 1.00 0.00 H new ATOM 0 HD13 ILE A 59 6.116 10.108 2.978 1.00 0.00 H new ATOM 865 N LYS A 60 5.682 7.360 6.262 1.00 0.00 N ATOM 866 CA LYS A 60 5.258 6.414 7.287 1.00 0.00 C ATOM 867 C LYS A 60 4.092 5.564 6.794 1.00 0.00 C ATOM 868 O LYS A 60 3.146 6.077 6.198 1.00 0.00 O ATOM 869 CB LYS A 60 4.857 7.159 8.563 1.00 0.00 C ATOM 870 CG LYS A 60 4.495 6.239 9.715 1.00 0.00 C ATOM 871 CD LYS A 60 5.730 5.782 10.474 1.00 0.00 C ATOM 872 CE LYS A 60 5.366 4.865 11.632 1.00 0.00 C ATOM 873 NZ LYS A 60 4.783 5.621 12.775 1.00 0.00 N ATOM 0 H LYS A 60 4.967 7.577 5.568 1.00 0.00 H new ATOM 0 HA LYS A 60 6.097 5.754 7.507 1.00 0.00 H new ATOM 0 HB2 LYS A 60 5.679 7.806 8.870 1.00 0.00 H new ATOM 0 HB3 LYS A 60 4.007 7.806 8.344 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.819 6.756 10.396 1.00 0.00 H new ATOM 0 HG3 LYS A 60 3.959 5.370 9.333 1.00 0.00 H new ATOM 0 HD2 LYS A 60 6.404 5.261 9.794 1.00 0.00 H new ATOM 0 HD3 LYS A 60 6.268 6.651 10.852 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.653 4.115 11.291 1.00 0.00 H new ATOM 0 HE3 LYS A 60 6.255 4.331 11.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 4.548 4.961 13.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 5.473 6.320 13.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.920 6.111 12.463 1.00 0.00 H new ATOM 887 N ALA A 61 4.167 4.261 7.048 1.00 0.00 N ATOM 888 CA ALA A 61 3.116 3.341 6.633 1.00 0.00 C ATOM 889 C ALA A 61 2.651 2.476 7.800 1.00 0.00 C ATOM 890 O ALA A 61 3.329 2.380 8.823 1.00 0.00 O ATOM 891 CB ALA A 61 3.602 2.466 5.487 1.00 0.00 C ATOM 0 H ALA A 61 4.945 3.820 7.539 1.00 0.00 H new ATOM 0 HA ALA A 61 2.266 3.931 6.290 1.00 0.00 H new ATOM 0 HB1 ALA A 61 2.806 1.784 5.187 1.00 0.00 H new ATOM 0 HB2 ALA A 61 3.878 3.095 4.641 1.00 0.00 H new ATOM 0 HB3 ALA A 61 4.470 1.891 5.811 1.00 0.00 H new ATOM 897 N HIS A 62 1.490 1.849 7.640 1.00 0.00 N ATOM 898 CA HIS A 62 0.934 0.992 8.682 1.00 0.00 C ATOM 899 C HIS A 62 0.045 -0.091 8.078 1.00 0.00 C ATOM 900 O HIS A 62 -1.037 0.196 7.566 1.00 0.00 O ATOM 901 CB HIS A 62 0.134 1.825 9.684 1.00 0.00 C ATOM 902 CG HIS A 62 -0.637 1.000 10.668 1.00 0.00 C ATOM 903 ND1 HIS A 62 -1.684 0.160 10.491 1.00 0.00 N flip ATOM 904 CD2 HIS A 62 -0.359 0.983 12.018 1.00 0.00 C flip ATOM 905 CE1 HIS A 62 -2.015 -0.344 11.724 1.00 0.00 C flip ATOM 906 NE2 HIS A 62 -1.200 0.168 12.629 1.00 0.00 N flip ATOM 0 H HIS A 62 0.916 1.918 6.800 1.00 0.00 H new ATOM 0 HA HIS A 62 1.762 0.510 9.201 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.816 2.479 10.227 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -0.558 2.467 9.139 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -2.142 -0.058 9.606 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.424 1.548 12.501 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -2.812 -1.045 11.922 1.00 0.00 H new ATOM 914 N ILE A 63 0.510 -1.334 8.140 1.00 0.00 N ATOM 915 CA ILE A 63 -0.243 -2.458 7.599 1.00 0.00 C ATOM 916 C ILE A 63 -1.252 -2.984 8.616 1.00 0.00 C ATOM 917 O ILE A 63 -0.996 -2.978 9.819 1.00 0.00 O ATOM 918 CB ILE A 63 0.689 -3.609 7.175 1.00 0.00 C ATOM 919 CG1 ILE A 63 1.666 -3.132 6.099 1.00 0.00 C ATOM 920 CG2 ILE A 63 -0.125 -4.792 6.673 1.00 0.00 C ATOM 921 CD1 ILE A 63 2.949 -3.933 6.050 1.00 0.00 C ATOM 0 H ILE A 63 1.404 -1.588 8.559 1.00 0.00 H new ATOM 0 HA ILE A 63 -0.773 -2.089 6.721 1.00 0.00 H new ATOM 0 HB ILE A 63 1.263 -3.931 8.044 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.177 -3.185 5.126 1.00 0.00 H new ATOM 0 HG13 ILE A 63 1.908 -2.084 6.278 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.548 -5.597 6.377 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.784 -5.143 7.467 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -0.722 -4.485 5.815 1.00 0.00 H new ATOM 0 HD11 ILE A 63 3.594 -3.539 5.264 1.00 0.00 H new ATOM 0 HD12 ILE A 63 3.460 -3.860 7.010 1.00 0.00 H new ATOM 0 HD13 ILE A 63 2.718 -4.977 5.840 1.00 0.00 H new ATOM 933 N ALA A 64 -2.398 -3.441 8.122 1.00 0.00 N ATOM 934 CA ALA A 64 -3.443 -3.974 8.986 1.00 0.00 C ATOM 935 C ALA A 64 -3.984 -5.293 8.444 1.00 0.00 C ATOM 936 O ALA A 64 -4.672 -5.321 7.425 1.00 0.00 O ATOM 937 CB ALA A 64 -4.570 -2.963 9.138 1.00 0.00 C ATOM 0 H ALA A 64 -2.626 -3.453 7.128 1.00 0.00 H new ATOM 0 HA ALA A 64 -3.006 -4.165 9.966 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -5.343 -3.375 9.786 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -4.179 -2.046 9.578 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -4.996 -2.743 8.159 1.00 0.00 H new ATOM 943 N ASN A 65 -3.666 -6.385 9.133 1.00 0.00 N ATOM 944 CA ASN A 65 -4.119 -7.708 8.719 1.00 0.00 C ATOM 945 C ASN A 65 -5.637 -7.822 8.828 1.00 0.00 C ATOM 946 O ASN A 65 -6.284 -7.113 9.600 1.00 0.00 O ATOM 947 CB ASN A 65 -3.453 -8.788 9.573 1.00 0.00 C ATOM 948 CG ASN A 65 -1.993 -8.990 9.214 1.00 0.00 C ATOM 949 OD1 ASN A 65 -1.236 -9.584 10.129 1.00 0.00 O flip ATOM 950 ND2 ASN A 65 -1.553 -8.617 8.127 1.00 0.00 N flip ATOM 0 H ASN A 65 -3.097 -6.379 9.980 1.00 0.00 H new ATOM 0 HA ASN A 65 -3.835 -7.852 7.676 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.531 -8.515 10.625 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.989 -9.729 9.447 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -2.172 -8.165 7.454 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -0.569 -8.760 7.899 1.00 0.00 H new ATOM 957 N PRO A 66 -6.220 -8.736 8.038 1.00 0.00 N ATOM 958 CA PRO A 66 -7.668 -8.965 8.028 1.00 0.00 C ATOM 959 C PRO A 66 -8.160 -9.621 9.314 1.00 0.00 C ATOM 960 O PRO A 66 -9.352 -9.879 9.473 1.00 0.00 O ATOM 961 CB PRO A 66 -7.870 -9.906 6.837 1.00 0.00 C ATOM 962 CG PRO A 66 -6.564 -10.607 6.683 1.00 0.00 C ATOM 963 CD PRO A 66 -5.511 -9.615 7.093 1.00 0.00 C ATOM 0 HA PRO A 66 -8.228 -8.033 7.952 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -8.679 -10.612 7.023 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -8.131 -9.353 5.935 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -6.524 -11.499 7.308 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -6.414 -10.932 5.653 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -4.658 -10.105 7.563 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -5.128 -9.059 6.237 1.00 0.00 H new ATOM 971 N SER A 67 -7.233 -9.886 10.229 1.00 0.00 N ATOM 972 CA SER A 67 -7.572 -10.515 11.501 1.00 0.00 C ATOM 973 C SER A 67 -7.463 -9.514 12.647 1.00 0.00 C ATOM 974 O SER A 67 -8.137 -9.646 13.668 1.00 0.00 O ATOM 975 CB SER A 67 -6.656 -11.711 11.763 1.00 0.00 C ATOM 976 OG SER A 67 -7.190 -12.896 11.198 1.00 0.00 O ATOM 0 H SER A 67 -6.242 -9.675 10.114 1.00 0.00 H new ATOM 0 HA SER A 67 -8.603 -10.864 11.443 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.669 -11.516 11.342 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.524 -11.844 12.837 1.00 0.00 H new ATOM 0 HG SER A 67 -6.585 -13.646 11.378 1.00 0.00 H new ATOM 982 N GLY A 68 -6.606 -8.512 12.471 1.00 0.00 N ATOM 983 CA GLY A 68 -6.423 -7.504 13.498 1.00 0.00 C ATOM 984 C GLY A 68 -4.961 -7.183 13.741 1.00 0.00 C ATOM 985 O GLY A 68 -4.622 -6.072 14.147 1.00 0.00 O ATOM 0 H GLY A 68 -6.036 -8.381 11.636 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -6.948 -6.594 13.208 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -6.875 -7.850 14.427 1.00 0.00 H new ATOM 989 N ALA A 69 -4.094 -8.159 13.493 1.00 0.00 N ATOM 990 CA ALA A 69 -2.661 -7.975 13.687 1.00 0.00 C ATOM 991 C ALA A 69 -2.122 -6.869 12.786 1.00 0.00 C ATOM 992 O ALA A 69 -2.847 -6.327 11.952 1.00 0.00 O ATOM 993 CB ALA A 69 -1.921 -9.279 13.425 1.00 0.00 C ATOM 0 H ALA A 69 -4.359 -9.085 13.157 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.495 -7.677 14.722 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.852 -9.127 13.574 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -2.278 -10.045 14.114 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.103 -9.601 12.400 1.00 0.00 H new ATOM 999 N SER A 70 -0.847 -6.539 12.959 1.00 0.00 N ATOM 1000 CA SER A 70 -0.212 -5.494 12.164 1.00 0.00 C ATOM 1001 C SER A 70 1.201 -5.902 11.759 1.00 0.00 C ATOM 1002 O SER A 70 1.984 -6.376 12.583 1.00 0.00 O ATOM 1003 CB SER A 70 -0.171 -4.181 12.949 1.00 0.00 C ATOM 1004 OG SER A 70 0.420 -4.367 14.223 1.00 0.00 O ATOM 0 H SER A 70 -0.232 -6.980 13.643 1.00 0.00 H new ATOM 0 HA SER A 70 -0.803 -5.350 11.259 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.393 -3.436 12.388 1.00 0.00 H new ATOM 0 HB3 SER A 70 -1.183 -3.792 13.067 1.00 0.00 H new ATOM 0 HG SER A 70 0.436 -3.513 14.704 1.00 0.00 H new ATOM 1010 N THR A 71 1.521 -5.715 10.482 1.00 0.00 N ATOM 1011 CA THR A 71 2.838 -6.064 9.966 1.00 0.00 C ATOM 1012 C THR A 71 3.771 -4.858 9.979 1.00 0.00 C ATOM 1013 O THR A 71 3.576 -3.904 9.227 1.00 0.00 O ATOM 1014 CB THR A 71 2.751 -6.615 8.530 1.00 0.00 C ATOM 1015 OG1 THR A 71 1.846 -7.724 8.486 1.00 0.00 O ATOM 1016 CG2 THR A 71 4.121 -7.051 8.033 1.00 0.00 C ATOM 0 H THR A 71 0.886 -5.324 9.787 1.00 0.00 H new ATOM 0 HA THR A 71 3.239 -6.838 10.621 1.00 0.00 H new ATOM 0 HB THR A 71 2.384 -5.820 7.881 1.00 0.00 H new ATOM 0 HG1 THR A 71 1.546 -7.865 7.564 1.00 0.00 H new ATOM 0 HG21 THR A 71 4.034 -7.436 7.017 1.00 0.00 H new ATOM 0 HG22 THR A 71 4.799 -6.198 8.041 1.00 0.00 H new ATOM 0 HG23 THR A 71 4.513 -7.832 8.685 1.00 0.00 H new ATOM 1024 N GLU A 72 4.784 -4.909 10.837 1.00 0.00 N ATOM 1025 CA GLU A 72 5.747 -3.819 10.947 1.00 0.00 C ATOM 1026 C GLU A 72 6.348 -3.484 9.585 1.00 0.00 C ATOM 1027 O GLU A 72 6.839 -4.365 8.878 1.00 0.00 O ATOM 1028 CB GLU A 72 6.860 -4.189 11.930 1.00 0.00 C ATOM 1029 CG GLU A 72 7.535 -2.985 12.567 1.00 0.00 C ATOM 1030 CD GLU A 72 8.422 -3.365 13.736 1.00 0.00 C ATOM 1031 OE1 GLU A 72 7.899 -3.940 14.715 1.00 0.00 O ATOM 1032 OE2 GLU A 72 9.638 -3.088 13.674 1.00 0.00 O ATOM 0 H GLU A 72 4.960 -5.693 11.466 1.00 0.00 H new ATOM 0 HA GLU A 72 5.221 -2.940 11.319 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.444 -4.820 12.716 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.611 -4.782 11.409 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.132 -2.468 11.816 1.00 0.00 H new ATOM 0 HG3 GLU A 72 6.773 -2.283 12.907 1.00 0.00 H new ATOM 1039 N CYS A 73 6.304 -2.207 9.224 1.00 0.00 N ATOM 1040 CA CYS A 73 6.842 -1.755 7.945 1.00 0.00 C ATOM 1041 C CYS A 73 8.153 -1.000 8.144 1.00 0.00 C ATOM 1042 O CYS A 73 8.349 -0.331 9.159 1.00 0.00 O ATOM 1043 CB CYS A 73 5.828 -0.861 7.229 1.00 0.00 C ATOM 1044 SG CYS A 73 5.440 0.669 8.110 1.00 0.00 S ATOM 0 H CYS A 73 5.902 -1.466 9.798 1.00 0.00 H new ATOM 0 HA CYS A 73 7.039 -2.633 7.330 1.00 0.00 H new ATOM 0 HB2 CYS A 73 6.215 -0.611 6.241 1.00 0.00 H new ATOM 0 HB3 CYS A 73 4.907 -1.424 7.078 1.00 0.00 H new ATOM 0 HG CYS A 73 4.171 0.697 8.393 1.00 0.00 H new ATOM 1050 N PHE A 74 9.048 -1.113 7.168 1.00 0.00 N ATOM 1051 CA PHE A 74 10.342 -0.444 7.236 1.00 0.00 C ATOM 1052 C PHE A 74 10.547 0.467 6.029 1.00 0.00 C ATOM 1053 O PHE A 74 10.762 -0.004 4.912 1.00 0.00 O ATOM 1054 CB PHE A 74 11.470 -1.475 7.310 1.00 0.00 C ATOM 1055 CG PHE A 74 11.156 -2.644 8.199 1.00 0.00 C ATOM 1056 CD1 PHE A 74 10.597 -2.448 9.451 1.00 0.00 C ATOM 1057 CD2 PHE A 74 11.421 -3.938 7.783 1.00 0.00 C ATOM 1058 CE1 PHE A 74 10.308 -3.522 10.272 1.00 0.00 C ATOM 1059 CE2 PHE A 74 11.135 -5.016 8.599 1.00 0.00 C ATOM 1060 CZ PHE A 74 10.576 -4.808 9.845 1.00 0.00 C ATOM 0 H PHE A 74 8.901 -1.662 6.321 1.00 0.00 H new ATOM 0 HA PHE A 74 10.360 0.168 8.138 1.00 0.00 H new ATOM 0 HB2 PHE A 74 11.684 -1.840 6.306 1.00 0.00 H new ATOM 0 HB3 PHE A 74 12.375 -0.986 7.672 1.00 0.00 H new ATOM 0 HD1 PHE A 74 10.384 -1.445 9.790 1.00 0.00 H new ATOM 0 HD2 PHE A 74 11.856 -4.107 6.809 1.00 0.00 H new ATOM 0 HE1 PHE A 74 9.873 -3.356 11.246 1.00 0.00 H new ATOM 0 HE2 PHE A 74 11.348 -6.020 8.263 1.00 0.00 H new ATOM 0 HZ PHE A 74 10.349 -5.649 10.484 1.00 0.00 H new ATOM 1070 N VAL A 75 10.479 1.773 6.262 1.00 0.00 N ATOM 1071 CA VAL A 75 10.658 2.751 5.195 1.00 0.00 C ATOM 1072 C VAL A 75 12.137 3.029 4.947 1.00 0.00 C ATOM 1073 O VAL A 75 12.909 3.227 5.885 1.00 0.00 O ATOM 1074 CB VAL A 75 9.946 4.077 5.524 1.00 0.00 C ATOM 1075 CG1 VAL A 75 8.443 3.866 5.619 1.00 0.00 C ATOM 1076 CG2 VAL A 75 10.492 4.669 6.814 1.00 0.00 C ATOM 0 H VAL A 75 10.301 2.179 7.181 1.00 0.00 H new ATOM 0 HA VAL A 75 10.216 2.323 4.295 1.00 0.00 H new ATOM 0 HB VAL A 75 10.140 4.783 4.717 1.00 0.00 H new ATOM 0 HG11 VAL A 75 7.957 4.813 5.852 1.00 0.00 H new ATOM 0 HG12 VAL A 75 8.068 3.490 4.667 1.00 0.00 H new ATOM 0 HG13 VAL A 75 8.226 3.144 6.406 1.00 0.00 H new ATOM 0 HG21 VAL A 75 9.978 5.605 7.031 1.00 0.00 H new ATOM 0 HG22 VAL A 75 10.331 3.968 7.633 1.00 0.00 H new ATOM 0 HG23 VAL A 75 11.560 4.859 6.704 1.00 0.00 H new ATOM 1086 N THR A 76 12.525 3.043 3.676 1.00 0.00 N ATOM 1087 CA THR A 76 13.911 3.296 3.303 1.00 0.00 C ATOM 1088 C THR A 76 13.997 4.285 2.145 1.00 0.00 C ATOM 1089 O THR A 76 13.608 3.972 1.020 1.00 0.00 O ATOM 1090 CB THR A 76 14.633 1.994 2.906 1.00 0.00 C ATOM 1091 OG1 THR A 76 14.575 1.054 3.984 1.00 0.00 O ATOM 1092 CG2 THR A 76 16.084 2.269 2.543 1.00 0.00 C ATOM 0 H THR A 76 11.899 2.882 2.887 1.00 0.00 H new ATOM 0 HA THR A 76 14.401 3.722 4.178 1.00 0.00 H new ATOM 0 HB THR A 76 14.130 1.577 2.034 1.00 0.00 H new ATOM 0 HG1 THR A 76 15.035 0.229 3.723 1.00 0.00 H new ATOM 0 HG21 THR A 76 16.573 1.335 2.266 1.00 0.00 H new ATOM 0 HG22 THR A 76 16.124 2.962 1.703 1.00 0.00 H new ATOM 0 HG23 THR A 76 16.597 2.707 3.399 1.00 0.00 H new ATOM 1100 N ASP A 77 14.509 5.477 2.429 1.00 0.00 N ATOM 1101 CA ASP A 77 14.648 6.511 1.411 1.00 0.00 C ATOM 1102 C ASP A 77 15.933 6.317 0.611 1.00 0.00 C ATOM 1103 O ASP A 77 17.009 6.138 1.179 1.00 0.00 O ATOM 1104 CB ASP A 77 14.640 7.898 2.057 1.00 0.00 C ATOM 1105 CG ASP A 77 15.710 8.047 3.120 1.00 0.00 C ATOM 1106 OD1 ASP A 77 15.656 7.306 4.124 1.00 0.00 O ATOM 1107 OD2 ASP A 77 16.601 8.905 2.949 1.00 0.00 O ATOM 0 H ASP A 77 14.835 5.751 3.356 1.00 0.00 H new ATOM 0 HA ASP A 77 13.801 6.431 0.730 1.00 0.00 H new ATOM 0 HB2 ASP A 77 14.789 8.655 1.287 1.00 0.00 H new ATOM 0 HB3 ASP A 77 13.662 8.083 2.501 1.00 0.00 H new ATOM 1112 N ASN A 78 15.811 6.352 -0.712 1.00 0.00 N ATOM 1113 CA ASN A 78 16.962 6.178 -1.591 1.00 0.00 C ATOM 1114 C ASN A 78 17.709 7.495 -1.776 1.00 0.00 C ATOM 1115 O ASN A 78 18.503 7.646 -2.704 1.00 0.00 O ATOM 1116 CB ASN A 78 16.515 5.638 -2.951 1.00 0.00 C ATOM 1117 CG ASN A 78 15.850 4.279 -2.843 1.00 0.00 C ATOM 1118 OD1 ASN A 78 16.520 3.257 -2.696 1.00 0.00 O ATOM 1119 ND2 ASN A 78 14.524 4.262 -2.915 1.00 0.00 N ATOM 0 H ASN A 78 14.927 6.499 -1.199 1.00 0.00 H new ATOM 0 HA ASN A 78 17.637 5.459 -1.126 1.00 0.00 H new ATOM 0 HB2 ASN A 78 15.822 6.343 -3.409 1.00 0.00 H new ATOM 0 HB3 ASN A 78 17.379 5.565 -3.612 1.00 0.00 H new ATOM 0 HD21 ASN A 78 14.021 3.377 -2.848 1.00 0.00 H new ATOM 0 HD22 ASN A 78 14.009 5.134 -3.037 1.00 0.00 H new ATOM 1126 N ALA A 79 17.450 8.446 -0.884 1.00 0.00 N ATOM 1127 CA ALA A 79 18.100 9.750 -0.947 1.00 0.00 C ATOM 1128 C ALA A 79 18.192 10.248 -2.385 1.00 0.00 C ATOM 1129 O ALA A 79 19.097 11.008 -2.731 1.00 0.00 O ATOM 1130 CB ALA A 79 19.485 9.680 -0.320 1.00 0.00 C ATOM 0 H ALA A 79 16.795 8.338 -0.110 1.00 0.00 H new ATOM 0 HA ALA A 79 17.494 10.459 -0.383 1.00 0.00 H new ATOM 0 HB1 ALA A 79 19.959 10.660 -0.374 1.00 0.00 H new ATOM 0 HB2 ALA A 79 19.397 9.376 0.723 1.00 0.00 H new ATOM 0 HB3 ALA A 79 20.092 8.953 -0.860 1.00 0.00 H new ATOM 1136 N ASP A 80 17.252 9.816 -3.217 1.00 0.00 N ATOM 1137 CA ASP A 80 17.227 10.219 -4.619 1.00 0.00 C ATOM 1138 C ASP A 80 15.926 10.942 -4.953 1.00 0.00 C ATOM 1139 O ASP A 80 15.904 11.851 -5.782 1.00 0.00 O ATOM 1140 CB ASP A 80 17.396 8.999 -5.526 1.00 0.00 C ATOM 1141 CG ASP A 80 18.850 8.610 -5.707 1.00 0.00 C ATOM 1142 OD1 ASP A 80 19.604 9.399 -6.313 1.00 0.00 O ATOM 1143 OD2 ASP A 80 19.233 7.515 -5.244 1.00 0.00 O ATOM 0 H ASP A 80 16.497 9.187 -2.946 1.00 0.00 H new ATOM 0 HA ASP A 80 18.057 10.905 -4.789 1.00 0.00 H new ATOM 0 HB2 ASP A 80 16.847 8.157 -5.104 1.00 0.00 H new ATOM 0 HB3 ASP A 80 16.955 9.210 -6.500 1.00 0.00 H new ATOM 1148 N GLY A 81 14.842 10.529 -4.304 1.00 0.00 N ATOM 1149 CA GLY A 81 13.551 11.146 -4.548 1.00 0.00 C ATOM 1150 C GLY A 81 12.400 10.180 -4.349 1.00 0.00 C ATOM 1151 O GLY A 81 11.238 10.586 -4.307 1.00 0.00 O ATOM 0 H GLY A 81 14.834 9.778 -3.614 1.00 0.00 H new ATOM 0 HA2 GLY A 81 13.426 11.997 -3.879 1.00 0.00 H new ATOM 0 HA3 GLY A 81 13.524 11.534 -5.566 1.00 0.00 H new ATOM 1155 N THR A 82 12.721 8.895 -4.230 1.00 0.00 N ATOM 1156 CA THR A 82 11.705 7.868 -4.038 1.00 0.00 C ATOM 1157 C THR A 82 11.891 7.153 -2.705 1.00 0.00 C ATOM 1158 O THR A 82 12.962 7.214 -2.101 1.00 0.00 O ATOM 1159 CB THR A 82 11.735 6.829 -5.174 1.00 0.00 C ATOM 1160 OG1 THR A 82 12.990 6.139 -5.173 1.00 0.00 O ATOM 1161 CG2 THR A 82 11.519 7.496 -6.524 1.00 0.00 C ATOM 0 H THR A 82 13.677 8.541 -4.263 1.00 0.00 H new ATOM 0 HA THR A 82 10.739 8.374 -4.044 1.00 0.00 H new ATOM 0 HB THR A 82 10.928 6.116 -5.006 1.00 0.00 H new ATOM 0 HG1 THR A 82 13.001 5.479 -5.897 1.00 0.00 H new ATOM 0 HG21 THR A 82 11.544 6.742 -7.311 1.00 0.00 H new ATOM 0 HG22 THR A 82 10.551 7.996 -6.532 1.00 0.00 H new ATOM 0 HG23 THR A 82 12.307 8.229 -6.698 1.00 0.00 H new ATOM 1169 N TYR A 83 10.842 6.475 -2.252 1.00 0.00 N ATOM 1170 CA TYR A 83 10.890 5.749 -0.988 1.00 0.00 C ATOM 1171 C TYR A 83 10.672 4.255 -1.210 1.00 0.00 C ATOM 1172 O TYR A 83 9.919 3.852 -2.096 1.00 0.00 O ATOM 1173 CB TYR A 83 9.834 6.292 -0.023 1.00 0.00 C ATOM 1174 CG TYR A 83 9.885 7.793 0.148 1.00 0.00 C ATOM 1175 CD1 TYR A 83 9.170 8.633 -0.696 1.00 0.00 C ATOM 1176 CD2 TYR A 83 10.650 8.371 1.154 1.00 0.00 C ATOM 1177 CE1 TYR A 83 9.215 10.006 -0.544 1.00 0.00 C ATOM 1178 CE2 TYR A 83 10.699 9.742 1.315 1.00 0.00 C ATOM 1179 CZ TYR A 83 9.980 10.555 0.463 1.00 0.00 C ATOM 1180 OH TYR A 83 10.027 11.922 0.619 1.00 0.00 O ATOM 0 H TYR A 83 9.949 6.413 -2.741 1.00 0.00 H new ATOM 0 HA TYR A 83 11.879 5.893 -0.552 1.00 0.00 H new ATOM 0 HB2 TYR A 83 8.845 6.009 -0.383 1.00 0.00 H new ATOM 0 HB3 TYR A 83 9.966 5.819 0.950 1.00 0.00 H new ATOM 0 HD1 TYR A 83 8.568 8.206 -1.485 1.00 0.00 H new ATOM 0 HD2 TYR A 83 11.216 7.738 1.821 1.00 0.00 H new ATOM 0 HE1 TYR A 83 8.654 10.645 -1.210 1.00 0.00 H new ATOM 0 HE2 TYR A 83 11.297 10.175 2.103 1.00 0.00 H new ATOM 0 HH TYR A 83 10.610 12.145 1.374 1.00 0.00 H new ATOM 1190 N GLN A 84 11.337 3.440 -0.398 1.00 0.00 N ATOM 1191 CA GLN A 84 11.217 1.991 -0.505 1.00 0.00 C ATOM 1192 C GLN A 84 10.852 1.374 0.842 1.00 0.00 C ATOM 1193 O GLN A 84 11.691 1.274 1.738 1.00 0.00 O ATOM 1194 CB GLN A 84 12.525 1.386 -1.019 1.00 0.00 C ATOM 1195 CG GLN A 84 12.372 -0.030 -1.550 1.00 0.00 C ATOM 1196 CD GLN A 84 12.040 -0.066 -3.029 1.00 0.00 C ATOM 1197 OE1 GLN A 84 12.591 0.701 -3.819 1.00 0.00 O ATOM 1198 NE2 GLN A 84 11.135 -0.959 -3.411 1.00 0.00 N ATOM 0 H GLN A 84 11.964 3.758 0.341 1.00 0.00 H new ATOM 0 HA GLN A 84 10.419 1.769 -1.214 1.00 0.00 H new ATOM 0 HB2 GLN A 84 12.923 2.021 -1.810 1.00 0.00 H new ATOM 0 HB3 GLN A 84 13.257 1.385 -0.212 1.00 0.00 H new ATOM 0 HG2 GLN A 84 13.296 -0.581 -1.375 1.00 0.00 H new ATOM 0 HG3 GLN A 84 11.586 -0.540 -0.993 1.00 0.00 H new ATOM 0 HE21 GLN A 84 10.704 -1.575 -2.722 1.00 0.00 H new ATOM 0 HE22 GLN A 84 10.871 -1.029 -4.394 1.00 0.00 H new ATOM 1207 N VAL A 85 9.596 0.962 0.977 1.00 0.00 N ATOM 1208 CA VAL A 85 9.120 0.354 2.214 1.00 0.00 C ATOM 1209 C VAL A 85 9.051 -1.164 2.089 1.00 0.00 C ATOM 1210 O VAL A 85 8.455 -1.693 1.152 1.00 0.00 O ATOM 1211 CB VAL A 85 7.730 0.890 2.605 1.00 0.00 C ATOM 1212 CG1 VAL A 85 7.256 0.251 3.901 1.00 0.00 C ATOM 1213 CG2 VAL A 85 7.759 2.406 2.727 1.00 0.00 C ATOM 0 H VAL A 85 8.890 1.038 0.245 1.00 0.00 H new ATOM 0 HA VAL A 85 9.835 0.619 2.993 1.00 0.00 H new ATOM 0 HB VAL A 85 7.023 0.625 1.819 1.00 0.00 H new ATOM 0 HG11 VAL A 85 6.272 0.642 4.161 1.00 0.00 H new ATOM 0 HG12 VAL A 85 7.194 -0.830 3.773 1.00 0.00 H new ATOM 0 HG13 VAL A 85 7.961 0.482 4.700 1.00 0.00 H new ATOM 0 HG21 VAL A 85 6.769 2.768 3.004 1.00 0.00 H new ATOM 0 HG22 VAL A 85 8.478 2.696 3.493 1.00 0.00 H new ATOM 0 HG23 VAL A 85 8.051 2.842 1.772 1.00 0.00 H new ATOM 1223 N GLU A 86 9.664 -1.860 3.042 1.00 0.00 N ATOM 1224 CA GLU A 86 9.672 -3.318 3.038 1.00 0.00 C ATOM 1225 C GLU A 86 8.923 -3.869 4.248 1.00 0.00 C ATOM 1226 O GLU A 86 9.070 -3.368 5.363 1.00 0.00 O ATOM 1227 CB GLU A 86 11.109 -3.842 3.031 1.00 0.00 C ATOM 1228 CG GLU A 86 11.204 -5.355 2.922 1.00 0.00 C ATOM 1229 CD GLU A 86 12.459 -5.908 3.568 1.00 0.00 C ATOM 1230 OE1 GLU A 86 13.512 -5.932 2.897 1.00 0.00 O ATOM 1231 OE2 GLU A 86 12.388 -6.318 4.746 1.00 0.00 O ATOM 0 H GLU A 86 10.161 -1.438 3.826 1.00 0.00 H new ATOM 0 HA GLU A 86 9.166 -3.657 2.134 1.00 0.00 H new ATOM 0 HB2 GLU A 86 11.647 -3.391 2.197 1.00 0.00 H new ATOM 0 HB3 GLU A 86 11.609 -3.520 3.944 1.00 0.00 H new ATOM 0 HG2 GLU A 86 10.329 -5.805 3.392 1.00 0.00 H new ATOM 0 HG3 GLU A 86 11.184 -5.642 1.871 1.00 0.00 H new ATOM 1238 N TYR A 87 8.122 -4.903 4.019 1.00 0.00 N ATOM 1239 CA TYR A 87 7.348 -5.522 5.089 1.00 0.00 C ATOM 1240 C TYR A 87 7.101 -6.999 4.799 1.00 0.00 C ATOM 1241 O TYR A 87 7.016 -7.412 3.642 1.00 0.00 O ATOM 1242 CB TYR A 87 6.013 -4.795 5.267 1.00 0.00 C ATOM 1243 CG TYR A 87 4.990 -5.142 4.209 1.00 0.00 C ATOM 1244 CD1 TYR A 87 4.209 -6.286 4.318 1.00 0.00 C ATOM 1245 CD2 TYR A 87 4.803 -4.324 3.102 1.00 0.00 C ATOM 1246 CE1 TYR A 87 3.274 -6.606 3.353 1.00 0.00 C ATOM 1247 CE2 TYR A 87 3.868 -4.635 2.133 1.00 0.00 C ATOM 1248 CZ TYR A 87 3.107 -5.778 2.263 1.00 0.00 C ATOM 1249 OH TYR A 87 2.175 -6.093 1.301 1.00 0.00 O ATOM 0 H TYR A 87 7.991 -5.331 3.102 1.00 0.00 H new ATOM 0 HA TYR A 87 7.923 -5.443 6.012 1.00 0.00 H new ATOM 0 HB2 TYR A 87 5.605 -5.037 6.248 1.00 0.00 H new ATOM 0 HB3 TYR A 87 6.189 -3.719 5.251 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.335 -6.936 5.171 1.00 0.00 H new ATOM 0 HD2 TYR A 87 5.399 -3.429 2.997 1.00 0.00 H new ATOM 0 HE1 TYR A 87 2.677 -7.500 3.452 1.00 0.00 H new ATOM 0 HE2 TYR A 87 3.734 -3.987 1.279 1.00 0.00 H new ATOM 0 HH TYR A 87 2.226 -5.442 0.570 1.00 0.00 H new ATOM 1259 N THR A 88 6.985 -7.792 5.860 1.00 0.00 N ATOM 1260 CA THR A 88 6.749 -9.224 5.722 1.00 0.00 C ATOM 1261 C THR A 88 5.452 -9.635 6.408 1.00 0.00 C ATOM 1262 O THR A 88 5.390 -9.797 7.627 1.00 0.00 O ATOM 1263 CB THR A 88 7.911 -10.045 6.311 1.00 0.00 C ATOM 1264 OG1 THR A 88 9.163 -9.509 5.868 1.00 0.00 O ATOM 1265 CG2 THR A 88 7.805 -11.506 5.901 1.00 0.00 C ATOM 0 H THR A 88 7.051 -7.467 6.824 1.00 0.00 H new ATOM 0 HA THR A 88 6.674 -9.430 4.654 1.00 0.00 H new ATOM 0 HB THR A 88 7.855 -9.985 7.398 1.00 0.00 H new ATOM 0 HG1 THR A 88 9.897 -10.035 6.248 1.00 0.00 H new ATOM 0 HG21 THR A 88 8.637 -12.065 6.329 1.00 0.00 H new ATOM 0 HG22 THR A 88 6.864 -11.919 6.265 1.00 0.00 H new ATOM 0 HG23 THR A 88 7.838 -11.582 4.814 1.00 0.00 H new ATOM 1273 N PRO A 89 4.388 -9.810 5.609 1.00 0.00 N ATOM 1274 CA PRO A 89 3.072 -10.207 6.119 1.00 0.00 C ATOM 1275 C PRO A 89 3.055 -11.646 6.621 1.00 0.00 C ATOM 1276 O PRO A 89 3.333 -12.580 5.868 1.00 0.00 O ATOM 1277 CB PRO A 89 2.159 -10.054 4.900 1.00 0.00 C ATOM 1278 CG PRO A 89 3.065 -10.209 3.727 1.00 0.00 C ATOM 1279 CD PRO A 89 4.389 -9.634 4.147 1.00 0.00 C ATOM 0 HA PRO A 89 2.767 -9.605 6.975 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.374 -10.810 4.896 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.666 -9.082 4.894 1.00 0.00 H new ATOM 0 HG2 PRO A 89 3.166 -11.258 3.448 1.00 0.00 H new ATOM 0 HG3 PRO A 89 2.670 -9.684 2.857 1.00 0.00 H new ATOM 0 HD2 PRO A 89 5.222 -10.159 3.679 1.00 0.00 H new ATOM 0 HD3 PRO A 89 4.478 -8.584 3.869 1.00 0.00 H new ATOM 1287 N PHE A 90 2.726 -11.819 7.897 1.00 0.00 N ATOM 1288 CA PHE A 90 2.673 -13.146 8.500 1.00 0.00 C ATOM 1289 C PHE A 90 1.247 -13.690 8.492 1.00 0.00 C ATOM 1290 O PHE A 90 0.823 -14.359 9.434 1.00 0.00 O ATOM 1291 CB PHE A 90 3.206 -13.100 9.933 1.00 0.00 C ATOM 1292 CG PHE A 90 2.742 -11.899 10.707 1.00 0.00 C ATOM 1293 CD1 PHE A 90 1.496 -11.888 11.313 1.00 0.00 C ATOM 1294 CD2 PHE A 90 3.552 -10.781 10.827 1.00 0.00 C ATOM 1295 CE1 PHE A 90 1.066 -10.784 12.026 1.00 0.00 C ATOM 1296 CE2 PHE A 90 3.128 -9.675 11.540 1.00 0.00 C ATOM 1297 CZ PHE A 90 1.883 -9.676 12.138 1.00 0.00 C ATOM 0 H PHE A 90 2.492 -11.057 8.533 1.00 0.00 H new ATOM 0 HA PHE A 90 3.301 -13.812 7.908 1.00 0.00 H new ATOM 0 HB2 PHE A 90 2.894 -14.003 10.457 1.00 0.00 H new ATOM 0 HB3 PHE A 90 4.296 -13.107 9.907 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.853 -12.752 11.227 1.00 0.00 H new ATOM 0 HD2 PHE A 90 4.525 -10.774 10.358 1.00 0.00 H new ATOM 0 HE1 PHE A 90 0.093 -10.788 12.495 1.00 0.00 H new ATOM 0 HE2 PHE A 90 3.770 -8.811 11.629 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.549 -8.812 12.692 1.00 0.00 H new ATOM 1307 N GLU A 91 0.513 -13.396 7.424 1.00 0.00 N ATOM 1308 CA GLU A 91 -0.865 -13.854 7.295 1.00 0.00 C ATOM 1309 C GLU A 91 -1.349 -13.726 5.853 1.00 0.00 C ATOM 1310 O GLU A 91 -1.238 -12.663 5.241 1.00 0.00 O ATOM 1311 CB GLU A 91 -1.781 -13.055 8.224 1.00 0.00 C ATOM 1312 CG GLU A 91 -1.887 -13.639 9.623 1.00 0.00 C ATOM 1313 CD GLU A 91 -3.113 -13.147 10.368 1.00 0.00 C ATOM 1314 OE1 GLU A 91 -3.192 -11.933 10.647 1.00 0.00 O ATOM 1315 OE2 GLU A 91 -3.994 -13.978 10.673 1.00 0.00 O ATOM 0 H GLU A 91 0.849 -12.843 6.636 1.00 0.00 H new ATOM 0 HA GLU A 91 -0.899 -14.906 7.580 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -1.411 -12.032 8.293 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.777 -13.005 7.784 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -1.918 -14.727 9.557 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -0.993 -13.379 10.190 1.00 0.00 H new ATOM 1322 N LYS A 92 -1.884 -14.817 5.316 1.00 0.00 N ATOM 1323 CA LYS A 92 -2.386 -14.828 3.946 1.00 0.00 C ATOM 1324 C LYS A 92 -3.764 -14.181 3.866 1.00 0.00 C ATOM 1325 O LYS A 92 -4.781 -14.831 4.105 1.00 0.00 O ATOM 1326 CB LYS A 92 -2.453 -16.263 3.418 1.00 0.00 C ATOM 1327 CG LYS A 92 -1.168 -17.047 3.622 1.00 0.00 C ATOM 1328 CD LYS A 92 -1.430 -18.543 3.673 1.00 0.00 C ATOM 1329 CE LYS A 92 -2.056 -18.955 4.996 1.00 0.00 C ATOM 1330 NZ LYS A 92 -3.536 -18.788 4.985 1.00 0.00 N ATOM 0 H LYS A 92 -1.981 -15.705 5.808 1.00 0.00 H new ATOM 0 HA LYS A 92 -1.697 -14.251 3.328 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -3.270 -16.786 3.914 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -2.689 -16.239 2.354 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -0.473 -16.826 2.812 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -0.690 -16.729 4.548 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -2.090 -18.826 2.853 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -0.494 -19.082 3.529 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -1.809 -19.996 5.206 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -1.629 -18.358 5.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -3.981 -19.608 5.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -3.791 -17.921 5.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -3.870 -18.718 4.003 1.00 0.00 H new ATOM 1344 N GLY A 93 -3.791 -12.895 3.527 1.00 0.00 N ATOM 1345 CA GLY A 93 -5.050 -12.182 3.420 1.00 0.00 C ATOM 1346 C GLY A 93 -4.870 -10.756 2.940 1.00 0.00 C ATOM 1347 O GLY A 93 -3.745 -10.301 2.729 1.00 0.00 O ATOM 0 H GLY A 93 -2.963 -12.335 3.325 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -5.707 -12.713 2.732 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -5.544 -12.175 4.392 1.00 0.00 H new ATOM 1351 N LEU A 94 -5.980 -10.047 2.765 1.00 0.00 N ATOM 1352 CA LEU A 94 -5.940 -8.663 2.305 1.00 0.00 C ATOM 1353 C LEU A 94 -5.769 -7.704 3.479 1.00 0.00 C ATOM 1354 O LEU A 94 -6.623 -7.630 4.363 1.00 0.00 O ATOM 1355 CB LEU A 94 -7.217 -8.324 1.535 1.00 0.00 C ATOM 1356 CG LEU A 94 -7.504 -6.836 1.334 1.00 0.00 C ATOM 1357 CD1 LEU A 94 -6.480 -6.217 0.396 1.00 0.00 C ATOM 1358 CD2 LEU A 94 -8.913 -6.632 0.796 1.00 0.00 C ATOM 0 H LEU A 94 -6.919 -10.408 2.935 1.00 0.00 H new ATOM 0 HA LEU A 94 -5.083 -8.551 1.641 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.164 -8.799 0.555 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -8.063 -8.769 2.059 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.430 -6.338 2.301 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.700 -5.158 0.265 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.482 -6.330 0.820 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.522 -6.719 -0.571 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.100 -5.567 0.659 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.015 -7.144 -0.161 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.635 -7.039 1.504 1.00 0.00 H new ATOM 1370 N HIS A 95 -4.662 -6.969 3.479 1.00 0.00 N ATOM 1371 CA HIS A 95 -4.381 -6.011 4.543 1.00 0.00 C ATOM 1372 C HIS A 95 -4.604 -4.581 4.059 1.00 0.00 C ATOM 1373 O HIS A 95 -4.589 -4.312 2.858 1.00 0.00 O ATOM 1374 CB HIS A 95 -2.944 -6.175 5.039 1.00 0.00 C ATOM 1375 CG HIS A 95 -2.404 -7.561 4.862 1.00 0.00 C ATOM 1376 ND1 HIS A 95 -3.100 -8.693 5.229 1.00 0.00 N ATOM 1377 CD2 HIS A 95 -1.228 -7.994 4.351 1.00 0.00 C ATOM 1378 CE1 HIS A 95 -2.375 -9.762 4.954 1.00 0.00 C ATOM 1379 NE2 HIS A 95 -1.234 -9.365 4.419 1.00 0.00 N ATOM 0 H HIS A 95 -3.945 -7.018 2.755 1.00 0.00 H new ATOM 0 HA HIS A 95 -5.067 -6.209 5.367 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -2.302 -5.473 4.507 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -2.900 -5.909 6.095 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -0.433 -7.376 3.962 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -2.665 -10.786 5.136 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -0.480 -9.978 4.107 1.00 0.00 H new ATOM 1387 N VAL A 96 -4.811 -3.668 5.003 1.00 0.00 N ATOM 1388 CA VAL A 96 -5.038 -2.266 4.673 1.00 0.00 C ATOM 1389 C VAL A 96 -3.833 -1.411 5.051 1.00 0.00 C ATOM 1390 O VAL A 96 -3.564 -1.185 6.231 1.00 0.00 O ATOM 1391 CB VAL A 96 -6.287 -1.716 5.387 1.00 0.00 C ATOM 1392 CG1 VAL A 96 -6.480 -0.242 5.066 1.00 0.00 C ATOM 1393 CG2 VAL A 96 -7.519 -2.520 4.999 1.00 0.00 C ATOM 0 H VAL A 96 -4.826 -3.874 6.002 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.193 -2.216 3.595 1.00 0.00 H new ATOM 0 HB VAL A 96 -6.141 -1.813 6.463 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -7.367 0.129 5.579 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.607 0.320 5.398 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -6.604 -0.117 3.990 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -8.392 -2.118 5.512 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.670 -2.457 3.921 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.378 -3.562 5.285 1.00 0.00 H new ATOM 1403 N VAL A 97 -3.110 -0.938 4.041 1.00 0.00 N ATOM 1404 CA VAL A 97 -1.934 -0.106 4.266 1.00 0.00 C ATOM 1405 C VAL A 97 -2.293 1.375 4.231 1.00 0.00 C ATOM 1406 O VAL A 97 -2.790 1.879 3.224 1.00 0.00 O ATOM 1407 CB VAL A 97 -0.841 -0.383 3.217 1.00 0.00 C ATOM 1408 CG1 VAL A 97 0.336 0.561 3.409 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -0.389 -1.834 3.289 1.00 0.00 C ATOM 0 H VAL A 97 -3.318 -1.117 3.059 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.551 -0.361 5.254 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.260 -0.205 2.226 1.00 0.00 H new ATOM 0 HG11 VAL A 97 1.098 0.350 2.659 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.003 1.591 3.302 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.758 0.419 4.404 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.383 -2.012 2.541 1.00 0.00 H new ATOM 0 HG22 VAL A 97 0.012 -2.041 4.281 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.238 -2.490 3.097 1.00 0.00 H new ATOM 1419 N GLU A 98 -2.038 2.067 5.337 1.00 0.00 N ATOM 1420 CA GLU A 98 -2.336 3.491 5.432 1.00 0.00 C ATOM 1421 C GLU A 98 -1.070 4.324 5.254 1.00 0.00 C ATOM 1422 O GLU A 98 -0.170 4.293 6.093 1.00 0.00 O ATOM 1423 CB GLU A 98 -2.984 3.811 6.780 1.00 0.00 C ATOM 1424 CG GLU A 98 -4.482 3.558 6.810 1.00 0.00 C ATOM 1425 CD GLU A 98 -5.012 3.357 8.216 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -4.519 2.444 8.911 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -5.920 4.113 8.623 1.00 0.00 O ATOM 0 H GLU A 98 -1.626 1.665 6.179 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.033 3.744 4.633 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -2.507 3.211 7.555 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -2.795 4.856 7.025 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -4.998 4.400 6.348 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.710 2.677 6.210 1.00 0.00 H new ATOM 1434 N VAL A 99 -1.008 5.068 4.154 1.00 0.00 N ATOM 1435 CA VAL A 99 0.147 5.911 3.865 1.00 0.00 C ATOM 1436 C VAL A 99 -0.164 7.379 4.129 1.00 0.00 C ATOM 1437 O VAL A 99 -1.245 7.867 3.796 1.00 0.00 O ATOM 1438 CB VAL A 99 0.608 5.749 2.404 1.00 0.00 C ATOM 1439 CG1 VAL A 99 1.853 6.583 2.142 1.00 0.00 C ATOM 1440 CG2 VAL A 99 0.860 4.284 2.084 1.00 0.00 C ATOM 0 H VAL A 99 -1.744 5.104 3.448 1.00 0.00 H new ATOM 0 HA VAL A 99 0.949 5.588 4.529 1.00 0.00 H new ATOM 0 HB VAL A 99 -0.185 6.108 1.749 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.164 6.456 1.105 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.633 7.634 2.329 1.00 0.00 H new ATOM 0 HG13 VAL A 99 2.655 6.257 2.804 1.00 0.00 H new ATOM 0 HG21 VAL A 99 1.185 4.189 1.048 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.635 3.895 2.745 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -0.059 3.716 2.230 1.00 0.00 H new ATOM 1450 N THR A 100 0.791 8.083 4.730 1.00 0.00 N ATOM 1451 CA THR A 100 0.619 9.496 5.039 1.00 0.00 C ATOM 1452 C THR A 100 1.919 10.266 4.836 1.00 0.00 C ATOM 1453 O THR A 100 2.939 9.954 5.452 1.00 0.00 O ATOM 1454 CB THR A 100 0.136 9.699 6.488 1.00 0.00 C ATOM 1455 OG1 THR A 100 0.977 8.972 7.391 1.00 0.00 O ATOM 1456 CG2 THR A 100 -1.305 9.241 6.648 1.00 0.00 C ATOM 0 H THR A 100 1.692 7.696 5.012 1.00 0.00 H new ATOM 0 HA THR A 100 -0.137 9.879 4.354 1.00 0.00 H new ATOM 0 HB THR A 100 0.189 10.763 6.720 1.00 0.00 H new ATOM 0 HG1 THR A 100 1.916 9.106 7.144 1.00 0.00 H new ATOM 0 HG21 THR A 100 -1.623 9.394 7.679 1.00 0.00 H new ATOM 0 HG22 THR A 100 -1.946 9.817 5.981 1.00 0.00 H new ATOM 0 HG23 THR A 100 -1.380 8.183 6.399 1.00 0.00 H new ATOM 1464 N TYR A 101 1.877 11.271 3.970 1.00 0.00 N ATOM 1465 CA TYR A 101 3.053 12.085 3.684 1.00 0.00 C ATOM 1466 C TYR A 101 2.933 13.461 4.331 1.00 0.00 C ATOM 1467 O TYR A 101 2.044 14.243 3.993 1.00 0.00 O ATOM 1468 CB TYR A 101 3.242 12.233 2.174 1.00 0.00 C ATOM 1469 CG TYR A 101 4.588 12.801 1.785 1.00 0.00 C ATOM 1470 CD1 TYR A 101 4.982 14.062 2.215 1.00 0.00 C ATOM 1471 CD2 TYR A 101 5.466 12.078 0.987 1.00 0.00 C ATOM 1472 CE1 TYR A 101 6.211 14.586 1.862 1.00 0.00 C ATOM 1473 CE2 TYR A 101 6.697 12.593 0.630 1.00 0.00 C ATOM 1474 CZ TYR A 101 7.065 13.847 1.069 1.00 0.00 C ATOM 1475 OH TYR A 101 8.289 14.364 0.715 1.00 0.00 O ATOM 0 H TYR A 101 1.041 11.542 3.453 1.00 0.00 H new ATOM 0 HA TYR A 101 3.923 11.581 4.104 1.00 0.00 H new ATOM 0 HB2 TYR A 101 3.119 11.257 1.704 1.00 0.00 H new ATOM 0 HB3 TYR A 101 2.457 12.878 1.780 1.00 0.00 H new ATOM 0 HD1 TYR A 101 4.316 14.643 2.836 1.00 0.00 H new ATOM 0 HD2 TYR A 101 5.181 11.096 0.640 1.00 0.00 H new ATOM 0 HE1 TYR A 101 6.501 15.568 2.205 1.00 0.00 H new ATOM 0 HE2 TYR A 101 7.368 12.016 0.010 1.00 0.00 H new ATOM 0 HH TYR A 101 8.939 13.636 0.629 1.00 0.00 H new ATOM 1485 N ASP A 102 3.835 13.751 5.262 1.00 0.00 N ATOM 1486 CA ASP A 102 3.834 15.033 5.956 1.00 0.00 C ATOM 1487 C ASP A 102 2.497 15.274 6.649 1.00 0.00 C ATOM 1488 O ASP A 102 1.917 16.356 6.543 1.00 0.00 O ATOM 1489 CB ASP A 102 4.125 16.169 4.974 1.00 0.00 C ATOM 1490 CG ASP A 102 5.588 16.234 4.581 1.00 0.00 C ATOM 1491 OD1 ASP A 102 6.268 15.188 4.648 1.00 0.00 O ATOM 1492 OD2 ASP A 102 6.053 17.330 4.205 1.00 0.00 O ATOM 0 H ASP A 102 4.577 13.115 5.554 1.00 0.00 H new ATOM 0 HA ASP A 102 4.617 15.009 6.714 1.00 0.00 H new ATOM 0 HB2 ASP A 102 3.517 16.036 4.079 1.00 0.00 H new ATOM 0 HB3 ASP A 102 3.830 17.118 5.422 1.00 0.00 H new ATOM 1497 N ASP A 103 2.012 14.260 7.357 1.00 0.00 N ATOM 1498 CA ASP A 103 0.743 14.362 8.068 1.00 0.00 C ATOM 1499 C ASP A 103 -0.411 14.573 7.093 1.00 0.00 C ATOM 1500 O ASP A 103 -1.401 15.228 7.419 1.00 0.00 O ATOM 1501 CB ASP A 103 0.790 15.509 9.079 1.00 0.00 C ATOM 1502 CG ASP A 103 1.843 15.295 10.148 1.00 0.00 C ATOM 1503 OD1 ASP A 103 2.879 14.667 9.844 1.00 0.00 O ATOM 1504 OD2 ASP A 103 1.632 15.757 11.289 1.00 0.00 O ATOM 0 H ASP A 103 2.478 13.358 7.454 1.00 0.00 H new ATOM 0 HA ASP A 103 0.578 13.426 8.601 1.00 0.00 H new ATOM 0 HB2 ASP A 103 0.993 16.443 8.555 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -0.187 15.614 9.551 1.00 0.00 H new ATOM 1509 N VAL A 104 -0.275 14.016 5.894 1.00 0.00 N ATOM 1510 CA VAL A 104 -1.306 14.144 4.870 1.00 0.00 C ATOM 1511 C VAL A 104 -1.410 12.874 4.034 1.00 0.00 C ATOM 1512 O VAL A 104 -0.460 12.458 3.370 1.00 0.00 O ATOM 1513 CB VAL A 104 -1.027 15.338 3.939 1.00 0.00 C ATOM 1514 CG1 VAL A 104 -2.078 15.417 2.842 1.00 0.00 C ATOM 1515 CG2 VAL A 104 -0.976 16.633 4.734 1.00 0.00 C ATOM 0 H VAL A 104 0.539 13.472 5.607 1.00 0.00 H new ATOM 0 HA VAL A 104 -2.250 14.311 5.389 1.00 0.00 H new ATOM 0 HB VAL A 104 -0.055 15.190 3.468 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -1.864 16.267 2.194 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -2.060 14.499 2.254 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.064 15.542 3.291 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -0.778 17.466 4.060 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -1.931 16.790 5.235 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -0.182 16.572 5.478 1.00 0.00 H new ATOM 1525 N PRO A 105 -2.592 12.240 4.064 1.00 0.00 N ATOM 1526 CA PRO A 105 -2.849 11.008 3.312 1.00 0.00 C ATOM 1527 C PRO A 105 -2.906 11.248 1.807 1.00 0.00 C ATOM 1528 O PRO A 105 -3.211 12.352 1.357 1.00 0.00 O ATOM 1529 CB PRO A 105 -4.215 10.554 3.833 1.00 0.00 C ATOM 1530 CG PRO A 105 -4.873 11.803 4.310 1.00 0.00 C ATOM 1531 CD PRO A 105 -3.769 12.679 4.833 1.00 0.00 C ATOM 0 HA PRO A 105 -2.057 10.272 3.452 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -4.799 10.074 3.047 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -4.110 9.829 4.640 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -5.411 12.295 3.499 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -5.602 11.586 5.091 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -3.983 13.735 4.671 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -3.622 12.544 5.905 1.00 0.00 H new ATOM 1539 N ILE A 106 -2.610 10.207 1.036 1.00 0.00 N ATOM 1540 CA ILE A 106 -2.628 10.305 -0.418 1.00 0.00 C ATOM 1541 C ILE A 106 -3.981 9.881 -0.981 1.00 0.00 C ATOM 1542 O ILE A 106 -4.721 9.110 -0.369 1.00 0.00 O ATOM 1543 CB ILE A 106 -1.525 9.440 -1.055 1.00 0.00 C ATOM 1544 CG1 ILE A 106 -1.503 8.050 -0.414 1.00 0.00 C ATOM 1545 CG2 ILE A 106 -0.171 10.117 -0.911 1.00 0.00 C ATOM 1546 CD1 ILE A 106 -0.577 7.078 -1.111 1.00 0.00 C ATOM 0 H ILE A 106 -2.355 9.287 1.394 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.446 11.351 -0.666 1.00 0.00 H new ATOM 0 HB ILE A 106 -1.741 9.327 -2.117 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -1.200 8.144 0.629 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -2.514 7.642 -0.416 1.00 0.00 H new ATOM 0 HG21 ILE A 106 0.598 9.493 -1.366 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -0.194 11.086 -1.409 1.00 0.00 H new ATOM 0 HG23 ILE A 106 0.055 10.258 0.146 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -0.612 6.114 -0.603 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.893 6.954 -2.147 1.00 0.00 H new ATOM 0 HD13 ILE A 106 0.442 7.464 -1.086 1.00 0.00 H new ATOM 1558 N PRO A 107 -4.312 10.393 -2.175 1.00 0.00 N ATOM 1559 CA PRO A 107 -5.576 10.078 -2.848 1.00 0.00 C ATOM 1560 C PRO A 107 -5.627 8.637 -3.342 1.00 0.00 C ATOM 1561 O PRO A 107 -6.591 8.225 -3.985 1.00 0.00 O ATOM 1562 CB PRO A 107 -5.599 11.050 -4.031 1.00 0.00 C ATOM 1563 CG PRO A 107 -4.166 11.356 -4.298 1.00 0.00 C ATOM 1564 CD PRO A 107 -3.478 11.317 -2.961 1.00 0.00 C ATOM 0 HA PRO A 107 -6.430 10.179 -2.178 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -6.077 10.602 -4.902 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -6.159 11.954 -3.790 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -3.732 10.626 -4.982 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -4.056 12.335 -4.765 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -2.452 10.958 -3.047 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -3.433 12.305 -2.504 1.00 0.00 H new ATOM 1572 N ASN A 108 -4.582 7.874 -3.037 1.00 0.00 N ATOM 1573 CA ASN A 108 -4.508 6.478 -3.451 1.00 0.00 C ATOM 1574 C ASN A 108 -4.800 5.547 -2.278 1.00 0.00 C ATOM 1575 O ASN A 108 -5.204 4.400 -2.468 1.00 0.00 O ATOM 1576 CB ASN A 108 -3.126 6.168 -4.030 1.00 0.00 C ATOM 1577 CG ASN A 108 -2.577 7.313 -4.860 1.00 0.00 C ATOM 1578 OD1 ASN A 108 -1.516 7.860 -4.558 1.00 0.00 O ATOM 1579 ND2 ASN A 108 -3.300 7.681 -5.911 1.00 0.00 N ATOM 0 H ASN A 108 -3.775 8.199 -2.505 1.00 0.00 H new ATOM 0 HA ASN A 108 -5.262 6.313 -4.220 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -2.435 5.949 -3.216 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -3.186 5.272 -4.647 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -2.982 8.446 -6.506 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -4.173 7.199 -6.123 1.00 0.00 H new ATOM 1586 N SER A 109 -4.593 6.049 -1.065 1.00 0.00 N ATOM 1587 CA SER A 109 -4.832 5.262 0.139 1.00 0.00 C ATOM 1588 C SER A 109 -6.256 5.463 0.647 1.00 0.00 C ATOM 1589 O SER A 109 -6.938 6.425 0.295 1.00 0.00 O ATOM 1590 CB SER A 109 -3.831 5.645 1.231 1.00 0.00 C ATOM 1591 OG SER A 109 -2.687 4.810 1.190 1.00 0.00 O ATOM 0 H SER A 109 -4.260 6.997 -0.890 1.00 0.00 H new ATOM 0 HA SER A 109 -4.700 4.210 -0.113 1.00 0.00 H new ATOM 0 HB2 SER A 109 -3.531 6.685 1.105 1.00 0.00 H new ATOM 0 HB3 SER A 109 -4.307 5.567 2.208 1.00 0.00 H new ATOM 0 HG SER A 109 -2.504 4.552 0.263 1.00 0.00 H new ATOM 1597 N PRO A 110 -6.718 4.531 1.494 1.00 0.00 N ATOM 1598 CA PRO A 110 -5.916 3.381 1.920 1.00 0.00 C ATOM 1599 C PRO A 110 -5.691 2.381 0.790 1.00 0.00 C ATOM 1600 O PRO A 110 -6.435 2.360 -0.191 1.00 0.00 O ATOM 1601 CB PRO A 110 -6.761 2.751 3.030 1.00 0.00 C ATOM 1602 CG PRO A 110 -8.159 3.164 2.724 1.00 0.00 C ATOM 1603 CD PRO A 110 -8.060 4.530 2.102 1.00 0.00 C ATOM 0 HA PRO A 110 -4.917 3.677 2.241 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -6.661 1.666 3.035 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -6.450 3.105 4.013 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -8.634 2.458 2.043 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -8.765 3.190 3.629 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -8.839 4.690 1.357 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -8.165 5.319 2.847 1.00 0.00 H new ATOM 1611 N PHE A 111 -4.661 1.554 0.934 1.00 0.00 N ATOM 1612 CA PHE A 111 -4.338 0.552 -0.075 1.00 0.00 C ATOM 1613 C PHE A 111 -4.879 -0.817 0.326 1.00 0.00 C ATOM 1614 O PHE A 111 -5.266 -1.033 1.475 1.00 0.00 O ATOM 1615 CB PHE A 111 -2.824 0.474 -0.280 1.00 0.00 C ATOM 1616 CG PHE A 111 -2.257 1.655 -1.016 1.00 0.00 C ATOM 1617 CD1 PHE A 111 -2.638 1.923 -2.321 1.00 0.00 C ATOM 1618 CD2 PHE A 111 -1.343 2.497 -0.402 1.00 0.00 C ATOM 1619 CE1 PHE A 111 -2.119 3.009 -3.000 1.00 0.00 C ATOM 1620 CE2 PHE A 111 -0.821 3.584 -1.077 1.00 0.00 C ATOM 1621 CZ PHE A 111 -1.208 3.840 -2.378 1.00 0.00 C ATOM 0 H PHE A 111 -4.036 1.558 1.740 1.00 0.00 H new ATOM 0 HA PHE A 111 -4.810 0.850 -1.011 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -2.337 0.394 0.692 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -2.586 -0.436 -0.831 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -3.349 1.276 -2.813 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -1.036 2.301 0.615 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -2.426 3.208 -4.016 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -0.110 4.233 -0.587 1.00 0.00 H new ATOM 0 HZ PHE A 111 -0.799 4.688 -2.908 1.00 0.00 H new ATOM 1631 N LYS A 112 -4.904 -1.739 -0.630 1.00 0.00 N ATOM 1632 CA LYS A 112 -5.397 -3.088 -0.380 1.00 0.00 C ATOM 1633 C LYS A 112 -4.463 -4.130 -0.986 1.00 0.00 C ATOM 1634 O LYS A 112 -4.448 -4.334 -2.200 1.00 0.00 O ATOM 1635 CB LYS A 112 -6.805 -3.254 -0.955 1.00 0.00 C ATOM 1636 CG LYS A 112 -7.908 -2.865 0.013 1.00 0.00 C ATOM 1637 CD LYS A 112 -9.216 -2.592 -0.711 1.00 0.00 C ATOM 1638 CE LYS A 112 -10.223 -1.903 0.198 1.00 0.00 C ATOM 1639 NZ LYS A 112 -11.623 -2.120 -0.262 1.00 0.00 N ATOM 0 H LYS A 112 -4.588 -1.576 -1.586 1.00 0.00 H new ATOM 0 HA LYS A 112 -5.432 -3.240 0.699 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -6.894 -2.648 -1.856 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -6.946 -4.293 -1.254 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.054 -3.664 0.740 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.608 -1.978 0.570 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -9.026 -1.968 -1.584 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -9.635 -3.530 -1.074 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -10.112 -2.280 1.215 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -10.012 -0.834 0.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -12.279 -1.635 0.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -11.736 -1.738 -1.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -11.833 -3.139 -0.268 1.00 0.00 H new ATOM 1653 N VAL A 113 -3.684 -4.789 -0.133 1.00 0.00 N ATOM 1654 CA VAL A 113 -2.748 -5.811 -0.585 1.00 0.00 C ATOM 1655 C VAL A 113 -3.277 -7.210 -0.287 1.00 0.00 C ATOM 1656 O VAL A 113 -3.235 -7.670 0.854 1.00 0.00 O ATOM 1657 CB VAL A 113 -1.369 -5.643 0.079 1.00 0.00 C ATOM 1658 CG1 VAL A 113 -0.426 -6.753 -0.359 1.00 0.00 C ATOM 1659 CG2 VAL A 113 -0.785 -4.277 -0.246 1.00 0.00 C ATOM 0 H VAL A 113 -3.683 -4.633 0.875 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.641 -5.688 -1.663 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.495 -5.712 1.160 1.00 0.00 H new ATOM 0 HG11 VAL A 113 0.543 -6.617 0.121 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -0.842 -7.718 -0.070 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -0.303 -6.720 -1.442 1.00 0.00 H new ATOM 0 HG21 VAL A 113 0.190 -4.175 0.231 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -0.673 -4.177 -1.326 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -1.453 -3.499 0.123 1.00 0.00 H new ATOM 1669 N ALA A 114 -3.773 -7.882 -1.320 1.00 0.00 N ATOM 1670 CA ALA A 114 -4.308 -9.230 -1.169 1.00 0.00 C ATOM 1671 C ALA A 114 -3.196 -10.271 -1.232 1.00 0.00 C ATOM 1672 O ALA A 114 -2.850 -10.762 -2.307 1.00 0.00 O ATOM 1673 CB ALA A 114 -5.353 -9.506 -2.240 1.00 0.00 C ATOM 0 H ALA A 114 -3.816 -7.515 -2.271 1.00 0.00 H new ATOM 0 HA ALA A 114 -4.781 -9.300 -0.189 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.744 -10.516 -2.115 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -6.167 -8.788 -2.147 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -4.897 -9.413 -3.226 1.00 0.00 H new ATOM 1679 N VAL A 115 -2.638 -10.605 -0.072 1.00 0.00 N ATOM 1680 CA VAL A 115 -1.565 -11.589 0.005 1.00 0.00 C ATOM 1681 C VAL A 115 -2.083 -12.991 -0.295 1.00 0.00 C ATOM 1682 O VAL A 115 -3.227 -13.324 0.016 1.00 0.00 O ATOM 1683 CB VAL A 115 -0.900 -11.586 1.394 1.00 0.00 C ATOM 1684 CG1 VAL A 115 0.111 -12.718 1.505 1.00 0.00 C ATOM 1685 CG2 VAL A 115 -0.240 -10.243 1.665 1.00 0.00 C ATOM 0 H VAL A 115 -2.912 -10.208 0.827 1.00 0.00 H new ATOM 0 HA VAL A 115 -0.825 -11.310 -0.745 1.00 0.00 H new ATOM 0 HB VAL A 115 -1.672 -11.745 2.147 1.00 0.00 H new ATOM 0 HG11 VAL A 115 0.571 -12.700 2.493 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -0.394 -13.673 1.357 1.00 0.00 H new ATOM 0 HG13 VAL A 115 0.882 -12.594 0.744 1.00 0.00 H new ATOM 0 HG21 VAL A 115 0.225 -10.258 2.651 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.521 -10.052 0.908 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -0.992 -9.455 1.631 1.00 0.00 H new ATOM 1695 N THR A 116 -1.232 -13.813 -0.903 1.00 0.00 N ATOM 1696 CA THR A 116 -1.603 -15.180 -1.246 1.00 0.00 C ATOM 1697 C THR A 116 -0.464 -16.149 -0.951 1.00 0.00 C ATOM 1698 O THR A 116 0.707 -15.775 -0.994 1.00 0.00 O ATOM 1699 CB THR A 116 -1.993 -15.300 -2.732 1.00 0.00 C ATOM 1700 OG1 THR A 116 -2.381 -16.646 -3.029 1.00 0.00 O ATOM 1701 CG2 THR A 116 -0.835 -14.891 -3.629 1.00 0.00 C ATOM 0 H THR A 116 -0.281 -13.555 -1.168 1.00 0.00 H new ATOM 0 HA THR A 116 -2.464 -15.438 -0.630 1.00 0.00 H new ATOM 0 HB THR A 116 -2.832 -14.631 -2.921 1.00 0.00 H new ATOM 0 HG1 THR A 116 -2.629 -16.714 -3.975 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.133 -14.984 -4.673 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.561 -13.857 -3.420 1.00 0.00 H new ATOM 0 HG23 THR A 116 0.020 -15.539 -3.437 1.00 0.00 H new ATOM 1709 N GLU A 117 -0.816 -17.396 -0.652 1.00 0.00 N ATOM 1710 CA GLU A 117 0.178 -18.418 -0.350 1.00 0.00 C ATOM 1711 C GLU A 117 0.725 -19.041 -1.632 1.00 0.00 C ATOM 1712 O GLU A 117 -0.018 -19.636 -2.412 1.00 0.00 O ATOM 1713 CB GLU A 117 -0.429 -19.505 0.539 1.00 0.00 C ATOM 1714 CG GLU A 117 -1.880 -19.818 0.213 1.00 0.00 C ATOM 1715 CD GLU A 117 -2.377 -21.070 0.910 1.00 0.00 C ATOM 1716 OE1 GLU A 117 -1.554 -21.765 1.540 1.00 0.00 O ATOM 1717 OE2 GLU A 117 -3.591 -21.353 0.824 1.00 0.00 O ATOM 0 H GLU A 117 -1.782 -17.722 -0.613 1.00 0.00 H new ATOM 0 HA GLU A 117 1.001 -17.941 0.182 1.00 0.00 H new ATOM 0 HB2 GLU A 117 0.162 -20.416 0.439 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -0.359 -19.192 1.581 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -2.504 -18.973 0.503 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -1.988 -19.939 -0.865 1.00 0.00 H new ATOM 1724 N GLY A 118 2.030 -18.898 -1.842 1.00 0.00 N ATOM 1725 CA GLY A 118 2.655 -19.451 -3.030 1.00 0.00 C ATOM 1726 C GLY A 118 4.014 -20.057 -2.742 1.00 0.00 C ATOM 1727 O GLY A 118 4.374 -21.089 -3.309 1.00 0.00 O ATOM 0 H GLY A 118 2.665 -18.409 -1.211 1.00 0.00 H new ATOM 0 HA2 GLY A 118 2.004 -20.213 -3.458 1.00 0.00 H new ATOM 0 HA3 GLY A 118 2.762 -18.666 -3.779 1.00 0.00 H new ATOM 1731 N CYS A 119 4.771 -19.414 -1.860 1.00 0.00 N ATOM 1732 CA CYS A 119 6.100 -19.895 -1.500 1.00 0.00 C ATOM 1733 C CYS A 119 6.845 -20.407 -2.728 1.00 0.00 C ATOM 1734 O CYS A 119 7.507 -21.443 -2.676 1.00 0.00 O ATOM 1735 CB CYS A 119 5.998 -21.003 -0.451 1.00 0.00 C ATOM 1736 SG CYS A 119 7.489 -21.213 0.550 1.00 0.00 S ATOM 0 H CYS A 119 4.488 -18.559 -1.381 1.00 0.00 H new ATOM 0 HA CYS A 119 6.660 -19.059 -1.081 1.00 0.00 H new ATOM 0 HB2 CYS A 119 5.158 -20.787 0.209 1.00 0.00 H new ATOM 0 HB3 CYS A 119 5.775 -21.944 -0.953 1.00 0.00 H new ATOM 0 HG CYS A 119 7.304 -22.171 1.409 1.00 0.00 H new ATOM 1742 N GLN A 120 6.730 -19.675 -3.831 1.00 0.00 N ATOM 1743 CA GLN A 120 7.390 -20.057 -5.074 1.00 0.00 C ATOM 1744 C GLN A 120 8.901 -20.145 -4.882 1.00 0.00 C ATOM 1745 O GLN A 120 9.506 -19.357 -4.156 1.00 0.00 O ATOM 1746 CB GLN A 120 7.063 -19.053 -6.181 1.00 0.00 C ATOM 1747 CG GLN A 120 5.629 -19.143 -6.678 1.00 0.00 C ATOM 1748 CD GLN A 120 5.367 -18.243 -7.869 1.00 0.00 C ATOM 1749 OE1 GLN A 120 5.015 -18.712 -8.951 1.00 0.00 O ATOM 1750 NE2 GLN A 120 5.537 -16.940 -7.675 1.00 0.00 N ATOM 0 H GLN A 120 6.186 -18.814 -3.890 1.00 0.00 H new ATOM 0 HA GLN A 120 7.020 -21.040 -5.365 1.00 0.00 H new ATOM 0 HB2 GLN A 120 7.248 -18.044 -5.812 1.00 0.00 H new ATOM 0 HB3 GLN A 120 7.740 -19.215 -7.019 1.00 0.00 H new ATOM 0 HG2 GLN A 120 5.407 -20.175 -6.951 1.00 0.00 H new ATOM 0 HG3 GLN A 120 4.950 -18.875 -5.868 1.00 0.00 H new ATOM 0 HE21 GLN A 120 5.830 -16.594 -6.761 1.00 0.00 H new ATOM 0 HE22 GLN A 120 5.375 -16.285 -8.440 1.00 0.00 H new ATOM 1759 N PRO A 121 9.526 -21.127 -5.549 1.00 0.00 N ATOM 1760 CA PRO A 121 10.974 -21.342 -5.468 1.00 0.00 C ATOM 1761 C PRO A 121 11.763 -20.236 -6.160 1.00 0.00 C ATOM 1762 O PRO A 121 11.806 -20.167 -7.389 1.00 0.00 O ATOM 1763 CB PRO A 121 11.176 -22.676 -6.191 1.00 0.00 C ATOM 1764 CG PRO A 121 10.019 -22.780 -7.124 1.00 0.00 C ATOM 1765 CD PRO A 121 8.868 -22.104 -6.433 1.00 0.00 C ATOM 0 HA PRO A 121 11.329 -21.343 -4.437 1.00 0.00 H new ATOM 0 HB2 PRO A 121 12.123 -22.694 -6.731 1.00 0.00 H new ATOM 0 HB3 PRO A 121 11.194 -23.509 -5.488 1.00 0.00 H new ATOM 0 HG2 PRO A 121 10.241 -22.297 -8.076 1.00 0.00 H new ATOM 0 HG3 PRO A 121 9.786 -23.822 -7.342 1.00 0.00 H new ATOM 0 HD2 PRO A 121 8.202 -21.617 -7.145 1.00 0.00 H new ATOM 0 HD3 PRO A 121 8.265 -22.815 -5.868 1.00 0.00 H new ATOM 1773 N SER A 122 12.387 -19.373 -5.365 1.00 0.00 N ATOM 1774 CA SER A 122 13.173 -18.269 -5.902 1.00 0.00 C ATOM 1775 C SER A 122 14.435 -18.782 -6.588 1.00 0.00 C ATOM 1776 O SER A 122 15.217 -19.526 -5.997 1.00 0.00 O ATOM 1777 CB SER A 122 13.548 -17.292 -4.785 1.00 0.00 C ATOM 1778 OG SER A 122 13.863 -16.014 -5.310 1.00 0.00 O ATOM 0 H SER A 122 12.363 -19.417 -4.346 1.00 0.00 H new ATOM 0 HA SER A 122 12.564 -17.749 -6.642 1.00 0.00 H new ATOM 0 HB2 SER A 122 12.721 -17.205 -4.080 1.00 0.00 H new ATOM 0 HB3 SER A 122 14.401 -17.681 -4.229 1.00 0.00 H new ATOM 0 HG SER A 122 14.097 -15.408 -4.577 1.00 0.00 H new ATOM 1784 N SER A 123 14.625 -18.380 -7.841 1.00 0.00 N ATOM 1785 CA SER A 123 15.789 -18.802 -8.611 1.00 0.00 C ATOM 1786 C SER A 123 16.748 -17.636 -8.830 1.00 0.00 C ATOM 1787 O SER A 123 16.332 -16.535 -9.189 1.00 0.00 O ATOM 1788 CB SER A 123 15.353 -19.379 -9.960 1.00 0.00 C ATOM 1789 OG SER A 123 15.024 -20.752 -9.845 1.00 0.00 O ATOM 0 H SER A 123 13.988 -17.763 -8.344 1.00 0.00 H new ATOM 0 HA SER A 123 16.308 -19.575 -8.044 1.00 0.00 H new ATOM 0 HB2 SER A 123 14.492 -18.826 -10.334 1.00 0.00 H new ATOM 0 HB3 SER A 123 16.154 -19.254 -10.689 1.00 0.00 H new ATOM 0 HG SER A 123 14.747 -21.096 -10.720 1.00 0.00 H new ATOM 1795 N GLY A 124 18.035 -17.886 -8.610 1.00 0.00 N ATOM 1796 CA GLY A 124 19.034 -16.849 -8.787 1.00 0.00 C ATOM 1797 C GLY A 124 20.104 -16.885 -7.714 1.00 0.00 C ATOM 1798 O GLY A 124 21.230 -17.327 -7.946 1.00 0.00 O ATOM 0 H GLY A 124 18.404 -18.789 -8.312 1.00 0.00 H new ATOM 0 HA2 GLY A 124 19.501 -16.962 -9.765 1.00 0.00 H new ATOM 0 HA3 GLY A 124 18.547 -15.874 -8.777 1.00 0.00 H new ATOM 1802 N PRO A 125 19.756 -16.409 -6.510 1.00 0.00 N ATOM 1803 CA PRO A 125 20.683 -16.377 -5.374 1.00 0.00 C ATOM 1804 C PRO A 125 20.996 -17.771 -4.842 1.00 0.00 C ATOM 1805 O PRO A 125 21.724 -17.923 -3.861 1.00 0.00 O ATOM 1806 CB PRO A 125 19.927 -15.561 -4.322 1.00 0.00 C ATOM 1807 CG PRO A 125 18.488 -15.741 -4.665 1.00 0.00 C ATOM 1808 CD PRO A 125 18.432 -15.867 -6.163 1.00 0.00 C ATOM 0 HA PRO A 125 21.649 -15.954 -5.648 1.00 0.00 H new ATOM 0 HB2 PRO A 125 20.142 -15.918 -3.315 1.00 0.00 H new ATOM 0 HB3 PRO A 125 20.213 -14.510 -4.355 1.00 0.00 H new ATOM 0 HG2 PRO A 125 18.080 -16.630 -4.183 1.00 0.00 H new ATOM 0 HG3 PRO A 125 17.896 -14.892 -4.322 1.00 0.00 H new ATOM 0 HD2 PRO A 125 17.630 -16.533 -6.480 1.00 0.00 H new ATOM 0 HD3 PRO A 125 18.254 -14.904 -6.641 1.00 0.00 H new ATOM 1816 N SER A 126 20.441 -18.788 -5.495 1.00 0.00 N ATOM 1817 CA SER A 126 20.659 -20.170 -5.085 1.00 0.00 C ATOM 1818 C SER A 126 22.068 -20.356 -4.530 1.00 0.00 C ATOM 1819 O SER A 126 22.246 -20.701 -3.361 1.00 0.00 O ATOM 1820 CB SER A 126 20.435 -21.116 -6.267 1.00 0.00 C ATOM 1821 OG SER A 126 20.031 -22.399 -5.823 1.00 0.00 O ATOM 0 H SER A 126 19.837 -18.680 -6.310 1.00 0.00 H new ATOM 0 HA SER A 126 19.943 -20.407 -4.298 1.00 0.00 H new ATOM 0 HB2 SER A 126 19.676 -20.701 -6.930 1.00 0.00 H new ATOM 0 HB3 SER A 126 21.353 -21.201 -6.848 1.00 0.00 H new ATOM 0 HG SER A 126 19.893 -22.984 -6.597 1.00 0.00 H new ATOM 1827 N SER A 127 23.066 -20.126 -5.377 1.00 0.00 N ATOM 1828 CA SER A 127 24.460 -20.272 -4.973 1.00 0.00 C ATOM 1829 C SER A 127 24.820 -19.262 -3.888 1.00 0.00 C ATOM 1830 O SER A 127 25.154 -18.114 -4.178 1.00 0.00 O ATOM 1831 CB SER A 127 25.384 -20.092 -6.179 1.00 0.00 C ATOM 1832 OG SER A 127 25.103 -21.051 -7.184 1.00 0.00 O ATOM 0 H SER A 127 22.936 -19.838 -6.347 1.00 0.00 H new ATOM 0 HA SER A 127 24.592 -21.276 -4.569 1.00 0.00 H new ATOM 0 HB2 SER A 127 25.264 -19.088 -6.586 1.00 0.00 H new ATOM 0 HB3 SER A 127 26.423 -20.186 -5.863 1.00 0.00 H new ATOM 0 HG SER A 127 25.706 -20.914 -7.945 1.00 0.00 H new ATOM 1838 N GLY A 128 24.748 -19.699 -2.634 1.00 0.00 N ATOM 1839 CA GLY A 128 25.069 -18.822 -1.523 1.00 0.00 C ATOM 1840 C GLY A 128 25.222 -19.574 -0.216 1.00 0.00 C ATOM 1841 O GLY A 128 25.945 -20.568 -0.145 1.00 0.00 O ATOM 0 H GLY A 128 24.473 -20.645 -2.368 1.00 0.00 H new ATOM 0 HA2 GLY A 128 25.994 -18.288 -1.741 1.00 0.00 H new ATOM 0 HA3 GLY A 128 24.285 -18.072 -1.418 1.00 0.00 H new TER 1845 GLY A 128