USER MOD reduce.3.24.130724 H: found=0, std=0, add=882, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 880 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 52 THR OG1 : rot -57:sc= 1.35 USER MOD Set 1.2: A 67 ASN :FLIP amide:sc= 0.915 F(o=-0.18,f=2.3) USER MOD Set 2.1: A 50 THR OG1 : rot 51:sc= 0.967 USER MOD Set 2.2: A 69 THR OG1 : rot 139:sc= 1.54 USER MOD Set 3.1: A 8 LYS NZ :NH3+ -118:sc= 0.024 (180deg=0) USER MOD Set 3.2: A 13 SER OG : rot -169:sc= 0.0205 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 14 SER OG : rot 53:sc= -0.731! USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 168:sc= 0.407 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 19:sc= -0.689! USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 ASN : amide:sc= -0.0661 X(o=-0.066,f=-0.031) USER MOD Single : A 49 GLN : amide:sc= -0.167 X(o=-0.17,f=-0.16) USER MOD Single : A 56 SER OG : rot 170:sc= -0.155 USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= -0.105 USER MOD Single : A 80 ASN : amide:sc= -0.926 K(o=-0.93,f=-2.7!) USER MOD Single : A 82 LYS NZ :NH3+ 160:sc= -0.0618 (180deg=-0.341) USER MOD Single : A 86 MET CE :methyl -156:sc= -0.0577 (180deg=-0.722) USER MOD Single : A 87 TYR OH : rot -110:sc= -0.432 USER MOD Single : A 88 THR OG1 : rot 180:sc= -0.154 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= -2.09! C(o=-2.1!,f=-12!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot -95:sc= 0.748 USER MOD Single : A 104 GLN : amide:sc= -0.349 K(o=-0.35,f=-2.3!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 THR OG1 : rot -169:sc= 0.467 USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.654 5.321 15.344 1.00 0.00 N ATOM 2 CA GLY A 1 6.992 4.710 14.072 1.00 0.00 C ATOM 3 C GLY A 1 7.501 5.719 13.061 1.00 0.00 C ATOM 4 O GLY A 1 8.593 5.563 12.514 1.00 0.00 O ATOM 0 H1 GLY A 1 6.312 4.590 16.000 1.00 0.00 H new ATOM 0 H2 GLY A 1 7.498 5.778 15.745 1.00 0.00 H new ATOM 0 H3 GLY A 1 5.910 6.033 15.200 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.751 3.944 14.231 1.00 0.00 H new ATOM 0 HA3 GLY A 1 6.113 4.208 13.669 1.00 0.00 H new ATOM 8 N SER A 2 6.708 6.755 12.811 1.00 0.00 N ATOM 9 CA SER A 2 7.082 7.791 11.855 1.00 0.00 C ATOM 10 C SER A 2 7.542 9.055 12.575 1.00 0.00 C ATOM 11 O SER A 2 7.320 9.214 13.775 1.00 0.00 O ATOM 12 CB SER A 2 5.903 8.115 10.935 1.00 0.00 C ATOM 13 OG SER A 2 4.818 8.657 11.668 1.00 0.00 O ATOM 0 H SER A 2 5.802 6.900 13.257 1.00 0.00 H new ATOM 0 HA SER A 2 7.910 7.414 11.254 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.219 8.824 10.170 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.581 7.211 10.419 1.00 0.00 H new ATOM 0 HG SER A 2 4.078 8.857 11.057 1.00 0.00 H new ATOM 19 N SER A 3 8.184 9.951 11.833 1.00 0.00 N ATOM 20 CA SER A 3 8.680 11.199 12.400 1.00 0.00 C ATOM 21 C SER A 3 9.230 12.112 11.308 1.00 0.00 C ATOM 22 O SER A 3 9.278 11.738 10.137 1.00 0.00 O ATOM 23 CB SER A 3 9.767 10.916 13.439 1.00 0.00 C ATOM 24 OG SER A 3 10.948 10.433 12.822 1.00 0.00 O ATOM 0 H SER A 3 8.373 9.836 10.837 1.00 0.00 H new ATOM 0 HA SER A 3 7.846 11.705 12.886 1.00 0.00 H new ATOM 0 HB2 SER A 3 9.990 11.827 13.995 1.00 0.00 H new ATOM 0 HB3 SER A 3 9.404 10.184 14.160 1.00 0.00 H new ATOM 0 HG SER A 3 11.628 10.261 13.507 1.00 0.00 H new ATOM 30 N GLY A 4 9.644 13.312 11.701 1.00 0.00 N ATOM 31 CA GLY A 4 10.184 14.261 10.745 1.00 0.00 C ATOM 32 C GLY A 4 10.036 15.697 11.205 1.00 0.00 C ATOM 33 O GLY A 4 9.097 16.388 10.810 1.00 0.00 O ATOM 0 H GLY A 4 9.615 13.644 12.665 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.239 14.043 10.578 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.678 14.136 9.788 1.00 0.00 H new ATOM 37 N SER A 5 10.963 16.147 12.044 1.00 0.00 N ATOM 38 CA SER A 5 10.928 17.510 12.563 1.00 0.00 C ATOM 39 C SER A 5 12.251 18.224 12.306 1.00 0.00 C ATOM 40 O SER A 5 12.767 18.929 13.173 1.00 0.00 O ATOM 41 CB SER A 5 10.624 17.499 14.063 1.00 0.00 C ATOM 42 OG SER A 5 11.634 16.812 14.782 1.00 0.00 O ATOM 0 H SER A 5 11.748 15.588 12.379 1.00 0.00 H new ATOM 0 HA SER A 5 10.137 18.050 12.043 1.00 0.00 H new ATOM 0 HB2 SER A 5 10.545 18.523 14.429 1.00 0.00 H new ATOM 0 HB3 SER A 5 9.660 17.022 14.239 1.00 0.00 H new ATOM 0 HG SER A 5 11.418 16.820 15.738 1.00 0.00 H new ATOM 48 N SER A 6 12.795 18.035 11.107 1.00 0.00 N ATOM 49 CA SER A 6 14.060 18.658 10.736 1.00 0.00 C ATOM 50 C SER A 6 13.860 20.131 10.392 1.00 0.00 C ATOM 51 O SER A 6 14.515 21.006 10.956 1.00 0.00 O ATOM 52 CB SER A 6 14.683 17.925 9.546 1.00 0.00 C ATOM 53 OG SER A 6 15.902 18.532 9.155 1.00 0.00 O ATOM 0 H SER A 6 12.380 17.456 10.377 1.00 0.00 H new ATOM 0 HA SER A 6 14.734 18.591 11.590 1.00 0.00 H new ATOM 0 HB2 SER A 6 14.860 16.882 9.809 1.00 0.00 H new ATOM 0 HB3 SER A 6 13.986 17.928 8.708 1.00 0.00 H new ATOM 0 HG SER A 6 16.281 18.044 8.394 1.00 0.00 H new ATOM 59 N GLY A 7 12.950 20.397 9.460 1.00 0.00 N ATOM 60 CA GLY A 7 12.679 21.764 9.056 1.00 0.00 C ATOM 61 C GLY A 7 11.720 21.844 7.885 1.00 0.00 C ATOM 62 O GLY A 7 11.571 20.884 7.128 1.00 0.00 O ATOM 0 H GLY A 7 12.396 19.690 8.977 1.00 0.00 H new ATOM 0 HA2 GLY A 7 12.263 22.313 9.900 1.00 0.00 H new ATOM 0 HA3 GLY A 7 13.616 22.253 8.788 1.00 0.00 H new ATOM 66 N LYS A 8 11.067 22.991 7.734 1.00 0.00 N ATOM 67 CA LYS A 8 10.117 23.193 6.647 1.00 0.00 C ATOM 68 C LYS A 8 9.676 24.652 6.574 1.00 0.00 C ATOM 69 O LYS A 8 9.505 25.325 7.590 1.00 0.00 O ATOM 70 CB LYS A 8 8.896 22.290 6.834 1.00 0.00 C ATOM 71 CG LYS A 8 8.161 22.523 8.143 1.00 0.00 C ATOM 72 CD LYS A 8 6.789 21.870 8.136 1.00 0.00 C ATOM 73 CE LYS A 8 5.980 22.261 9.364 1.00 0.00 C ATOM 74 NZ LYS A 8 4.515 22.166 9.115 1.00 0.00 N ATOM 0 H LYS A 8 11.178 23.795 8.351 1.00 0.00 H new ATOM 0 HA LYS A 8 10.613 22.934 5.712 1.00 0.00 H new ATOM 0 HB2 LYS A 8 8.206 22.451 6.006 1.00 0.00 H new ATOM 0 HB3 LYS A 8 9.214 21.249 6.786 1.00 0.00 H new ATOM 0 HG2 LYS A 8 8.751 22.124 8.968 1.00 0.00 H new ATOM 0 HG3 LYS A 8 8.054 23.594 8.316 1.00 0.00 H new ATOM 0 HD2 LYS A 8 6.250 22.163 7.235 1.00 0.00 H new ATOM 0 HD3 LYS A 8 6.901 20.786 8.102 1.00 0.00 H new ATOM 0 HE2 LYS A 8 6.250 21.613 10.198 1.00 0.00 H new ATOM 0 HE3 LYS A 8 6.233 23.280 9.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 4.083 23.106 9.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 4.349 21.815 8.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 4.088 21.510 9.800 1.00 0.00 H new ATOM 88 N PRO A 9 9.486 25.153 5.344 1.00 0.00 N ATOM 89 CA PRO A 9 9.061 26.536 5.110 1.00 0.00 C ATOM 90 C PRO A 9 7.618 26.779 5.539 1.00 0.00 C ATOM 91 O PRO A 9 7.038 25.985 6.277 1.00 0.00 O ATOM 92 CB PRO A 9 9.203 26.699 3.595 1.00 0.00 C ATOM 93 CG PRO A 9 9.074 25.318 3.051 1.00 0.00 C ATOM 94 CD PRO A 9 9.671 24.407 4.088 1.00 0.00 C ATOM 0 HA PRO A 9 9.653 27.247 5.686 1.00 0.00 H new ATOM 0 HB2 PRO A 9 8.432 27.356 3.194 1.00 0.00 H new ATOM 0 HB3 PRO A 9 10.165 27.139 3.333 1.00 0.00 H new ATOM 0 HG2 PRO A 9 8.029 25.067 2.866 1.00 0.00 H new ATOM 0 HG3 PRO A 9 9.598 25.223 2.100 1.00 0.00 H new ATOM 0 HD2 PRO A 9 9.164 23.442 4.115 1.00 0.00 H new ATOM 0 HD3 PRO A 9 10.724 24.208 3.890 1.00 0.00 H new ATOM 102 N ALA A 10 7.045 27.883 5.070 1.00 0.00 N ATOM 103 CA ALA A 10 5.669 28.229 5.403 1.00 0.00 C ATOM 104 C ALA A 10 4.694 27.642 4.389 1.00 0.00 C ATOM 105 O ALA A 10 3.991 28.376 3.692 1.00 0.00 O ATOM 106 CB ALA A 10 5.508 29.740 5.479 1.00 0.00 C ATOM 0 H ALA A 10 7.512 28.552 4.459 1.00 0.00 H new ATOM 0 HA ALA A 10 5.439 27.800 6.379 1.00 0.00 H new ATOM 0 HB1 ALA A 10 4.475 29.984 5.728 1.00 0.00 H new ATOM 0 HB2 ALA A 10 6.171 30.138 6.247 1.00 0.00 H new ATOM 0 HB3 ALA A 10 5.763 30.182 4.516 1.00 0.00 H new ATOM 112 N ILE A 11 4.656 26.316 4.309 1.00 0.00 N ATOM 113 CA ILE A 11 3.767 25.631 3.380 1.00 0.00 C ATOM 114 C ILE A 11 2.772 24.746 4.122 1.00 0.00 C ATOM 115 O ILE A 11 3.046 24.238 5.209 1.00 0.00 O ATOM 116 CB ILE A 11 4.556 24.769 2.377 1.00 0.00 C ATOM 117 CG1 ILE A 11 5.446 23.770 3.120 1.00 0.00 C ATOM 118 CG2 ILE A 11 5.392 25.652 1.462 1.00 0.00 C ATOM 119 CD1 ILE A 11 6.149 22.791 2.206 1.00 0.00 C ATOM 0 H ILE A 11 5.231 25.695 4.877 1.00 0.00 H new ATOM 0 HA ILE A 11 3.225 26.404 2.834 1.00 0.00 H new ATOM 0 HB ILE A 11 3.848 24.211 1.764 1.00 0.00 H new ATOM 0 HG12 ILE A 11 6.192 24.318 3.695 1.00 0.00 H new ATOM 0 HG13 ILE A 11 4.838 23.215 3.834 1.00 0.00 H new ATOM 0 HG21 ILE A 11 5.944 25.028 0.759 1.00 0.00 H new ATOM 0 HG22 ILE A 11 4.738 26.328 0.911 1.00 0.00 H new ATOM 0 HG23 ILE A 11 6.094 26.233 2.060 1.00 0.00 H new ATOM 0 HD11 ILE A 11 6.762 22.114 2.801 1.00 0.00 H new ATOM 0 HD12 ILE A 11 5.408 22.216 1.650 1.00 0.00 H new ATOM 0 HD13 ILE A 11 6.784 23.337 1.508 1.00 0.00 H new ATOM 131 N PRO A 12 1.588 24.554 3.521 1.00 0.00 N ATOM 132 CA PRO A 12 0.528 23.727 4.106 1.00 0.00 C ATOM 133 C PRO A 12 0.882 22.243 4.102 1.00 0.00 C ATOM 134 O PRO A 12 0.738 21.564 3.086 1.00 0.00 O ATOM 135 CB PRO A 12 -0.673 23.993 3.196 1.00 0.00 C ATOM 136 CG PRO A 12 -0.077 24.396 1.891 1.00 0.00 C ATOM 137 CD PRO A 12 1.193 25.128 2.224 1.00 0.00 C ATOM 0 HA PRO A 12 0.349 23.974 5.153 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -1.294 23.104 3.090 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -1.310 24.780 3.600 1.00 0.00 H new ATOM 0 HG2 PRO A 12 0.127 23.524 1.269 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -0.760 25.035 1.331 1.00 0.00 H new ATOM 0 HD2 PRO A 12 1.959 24.970 1.465 1.00 0.00 H new ATOM 0 HD3 PRO A 12 1.030 26.204 2.293 1.00 0.00 H new ATOM 145 N SER A 13 1.345 21.747 5.245 1.00 0.00 N ATOM 146 CA SER A 13 1.722 20.344 5.372 1.00 0.00 C ATOM 147 C SER A 13 0.486 19.454 5.449 1.00 0.00 C ATOM 148 O SER A 13 0.358 18.483 4.703 1.00 0.00 O ATOM 149 CB SER A 13 2.592 20.138 6.614 1.00 0.00 C ATOM 150 OG SER A 13 3.951 20.427 6.338 1.00 0.00 O ATOM 0 H SER A 13 1.468 22.296 6.096 1.00 0.00 H new ATOM 0 HA SER A 13 2.294 20.065 4.487 1.00 0.00 H new ATOM 0 HB2 SER A 13 2.237 20.779 7.421 1.00 0.00 H new ATOM 0 HB3 SER A 13 2.499 19.109 6.960 1.00 0.00 H new ATOM 0 HG SER A 13 4.508 20.125 7.086 1.00 0.00 H new ATOM 156 N SER A 14 -0.423 19.792 6.358 1.00 0.00 N ATOM 157 CA SER A 14 -1.649 19.022 6.538 1.00 0.00 C ATOM 158 C SER A 14 -2.857 19.946 6.657 1.00 0.00 C ATOM 159 O SER A 14 -3.704 19.768 7.532 1.00 0.00 O ATOM 160 CB SER A 14 -1.543 18.138 7.782 1.00 0.00 C ATOM 161 OG SER A 14 -2.409 17.020 7.688 1.00 0.00 O ATOM 0 H SER A 14 -0.334 20.594 6.982 1.00 0.00 H new ATOM 0 HA SER A 14 -1.783 18.388 5.662 1.00 0.00 H new ATOM 0 HB2 SER A 14 -0.515 17.797 7.903 1.00 0.00 H new ATOM 0 HB3 SER A 14 -1.792 18.721 8.669 1.00 0.00 H new ATOM 0 HG SER A 14 -2.240 16.545 6.848 1.00 0.00 H new ATOM 167 N SER A 15 -2.930 20.933 5.770 1.00 0.00 N ATOM 168 CA SER A 15 -4.033 21.887 5.776 1.00 0.00 C ATOM 169 C SER A 15 -4.907 21.716 4.538 1.00 0.00 C ATOM 170 O SER A 15 -6.008 21.170 4.612 1.00 0.00 O ATOM 171 CB SER A 15 -3.496 23.318 5.842 1.00 0.00 C ATOM 172 OG SER A 15 -3.092 23.652 7.158 1.00 0.00 O ATOM 0 H SER A 15 -2.238 21.093 5.038 1.00 0.00 H new ATOM 0 HA SER A 15 -4.643 21.694 6.658 1.00 0.00 H new ATOM 0 HB2 SER A 15 -2.651 23.424 5.161 1.00 0.00 H new ATOM 0 HB3 SER A 15 -4.265 24.014 5.507 1.00 0.00 H new ATOM 0 HG SER A 15 -2.751 24.571 7.172 1.00 0.00 H new ATOM 178 N VAL A 16 -4.408 22.186 3.399 1.00 0.00 N ATOM 179 CA VAL A 16 -5.142 22.085 2.144 1.00 0.00 C ATOM 180 C VAL A 16 -4.879 20.749 1.459 1.00 0.00 C ATOM 181 O VAL A 16 -5.081 20.606 0.253 1.00 0.00 O ATOM 182 CB VAL A 16 -4.765 23.226 1.180 1.00 0.00 C ATOM 183 CG1 VAL A 16 -5.058 24.578 1.812 1.00 0.00 C ATOM 184 CG2 VAL A 16 -3.302 23.122 0.778 1.00 0.00 C ATOM 0 H VAL A 16 -3.498 22.640 3.320 1.00 0.00 H new ATOM 0 HA VAL A 16 -6.201 22.162 2.390 1.00 0.00 H new ATOM 0 HB VAL A 16 -5.373 23.133 0.280 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -4.785 25.372 1.116 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -6.121 24.648 2.044 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -4.478 24.684 2.729 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -3.053 23.936 0.097 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -2.675 23.188 1.667 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -3.128 22.167 0.281 1.00 0.00 H new ATOM 194 N LEU A 17 -4.427 19.771 2.237 1.00 0.00 N ATOM 195 CA LEU A 17 -4.136 18.444 1.706 1.00 0.00 C ATOM 196 C LEU A 17 -5.321 17.505 1.908 1.00 0.00 C ATOM 197 O LEU A 17 -6.134 17.678 2.817 1.00 0.00 O ATOM 198 CB LEU A 17 -2.891 17.865 2.381 1.00 0.00 C ATOM 199 CG LEU A 17 -1.558 18.510 1.997 1.00 0.00 C ATOM 200 CD1 LEU A 17 -1.416 18.580 0.485 1.00 0.00 C ATOM 201 CD2 LEU A 17 -1.441 19.897 2.612 1.00 0.00 C ATOM 0 H LEU A 17 -4.254 19.872 3.237 1.00 0.00 H new ATOM 0 HA LEU A 17 -3.950 18.540 0.636 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -3.015 17.949 3.461 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -2.838 16.801 2.149 1.00 0.00 H new ATOM 0 HG LEU A 17 -0.750 17.892 2.388 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.462 19.042 0.230 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -1.455 17.573 0.069 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -2.229 19.175 0.070 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -0.487 20.341 2.329 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -2.255 20.525 2.251 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -1.497 19.819 3.698 1.00 0.00 H new ATOM 213 N PRO A 18 -5.422 16.485 1.043 1.00 0.00 N ATOM 214 CA PRO A 18 -6.502 15.496 1.108 1.00 0.00 C ATOM 215 C PRO A 18 -6.380 14.582 2.323 1.00 0.00 C ATOM 216 O PRO A 18 -5.437 13.798 2.430 1.00 0.00 O ATOM 217 CB PRO A 18 -6.327 14.694 -0.184 1.00 0.00 C ATOM 218 CG PRO A 18 -4.886 14.844 -0.530 1.00 0.00 C ATOM 219 CD PRO A 18 -4.488 16.217 -0.064 1.00 0.00 C ATOM 0 HA PRO A 18 -7.480 15.967 1.204 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -6.592 13.647 -0.039 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -6.967 15.078 -0.978 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -4.286 14.077 -0.041 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -4.729 14.736 -1.603 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -3.451 16.243 0.270 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -4.585 16.955 -0.860 1.00 0.00 H new ATOM 227 N SER A 19 -7.340 14.689 3.236 1.00 0.00 N ATOM 228 CA SER A 19 -7.337 13.874 4.446 1.00 0.00 C ATOM 229 C SER A 19 -6.970 12.428 4.126 1.00 0.00 C ATOM 230 O SER A 19 -7.140 11.968 2.997 1.00 0.00 O ATOM 231 CB SER A 19 -8.708 13.926 5.124 1.00 0.00 C ATOM 232 OG SER A 19 -8.686 13.253 6.370 1.00 0.00 O ATOM 0 H SER A 19 -8.129 15.331 3.161 1.00 0.00 H new ATOM 0 HA SER A 19 -6.587 14.279 5.126 1.00 0.00 H new ATOM 0 HB2 SER A 19 -9.004 14.964 5.273 1.00 0.00 H new ATOM 0 HB3 SER A 19 -9.456 13.471 4.475 1.00 0.00 H new ATOM 0 HG SER A 19 -9.573 13.302 6.784 1.00 0.00 H new ATOM 238 N ALA A 20 -6.466 11.717 5.129 1.00 0.00 N ATOM 239 CA ALA A 20 -6.077 10.323 4.957 1.00 0.00 C ATOM 240 C ALA A 20 -7.299 9.412 4.914 1.00 0.00 C ATOM 241 O ALA A 20 -8.320 9.674 5.550 1.00 0.00 O ATOM 242 CB ALA A 20 -5.137 9.895 6.074 1.00 0.00 C ATOM 0 H ALA A 20 -6.318 12.083 6.069 1.00 0.00 H new ATOM 0 HA ALA A 20 -5.556 10.233 4.004 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -4.855 8.852 5.932 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -4.243 10.518 6.056 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -5.639 10.008 7.035 1.00 0.00 H new ATOM 248 N PRO A 21 -7.196 8.317 4.147 1.00 0.00 N ATOM 249 CA PRO A 21 -8.284 7.345 4.003 1.00 0.00 C ATOM 250 C PRO A 21 -8.521 6.547 5.280 1.00 0.00 C ATOM 251 O PRO A 21 -7.640 6.447 6.133 1.00 0.00 O ATOM 252 CB PRO A 21 -7.793 6.426 2.881 1.00 0.00 C ATOM 253 CG PRO A 21 -6.308 6.534 2.926 1.00 0.00 C ATOM 254 CD PRO A 21 -6.008 7.942 3.361 1.00 0.00 C ATOM 0 HA PRO A 21 -9.237 7.829 3.790 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -8.120 5.398 3.039 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -8.184 6.739 1.913 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -5.885 5.811 3.624 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -5.872 6.326 1.949 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -5.098 7.993 3.959 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -5.865 8.605 2.507 1.00 0.00 H new ATOM 262 N ARG A 22 -9.717 5.981 5.405 1.00 0.00 N ATOM 263 CA ARG A 22 -10.070 5.192 6.579 1.00 0.00 C ATOM 264 C ARG A 22 -9.135 3.997 6.732 1.00 0.00 C ATOM 265 O ARG A 22 -8.383 3.663 5.816 1.00 0.00 O ATOM 266 CB ARG A 22 -11.519 4.711 6.480 1.00 0.00 C ATOM 267 CG ARG A 22 -11.721 3.589 5.474 1.00 0.00 C ATOM 268 CD ARG A 22 -12.908 2.715 5.846 1.00 0.00 C ATOM 269 NE ARG A 22 -14.166 3.255 5.338 1.00 0.00 N ATOM 270 CZ ARG A 22 -15.244 2.514 5.108 1.00 0.00 C ATOM 271 NH1 ARG A 22 -15.218 1.209 5.340 1.00 0.00 N ATOM 272 NH2 ARG A 22 -16.352 3.079 4.645 1.00 0.00 N ATOM 0 H ARG A 22 -10.458 6.054 4.708 1.00 0.00 H new ATOM 0 HA ARG A 22 -9.965 5.828 7.458 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -11.848 4.371 7.462 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -12.154 5.553 6.205 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -11.876 4.012 4.482 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -10.820 2.978 5.423 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -12.758 1.711 5.449 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -12.965 2.623 6.931 1.00 0.00 H new ATOM 0 HE ARG A 22 -14.220 4.256 5.149 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -14.368 0.771 5.696 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -16.048 0.643 5.162 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -16.376 4.083 4.466 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -17.180 2.509 4.469 1.00 0.00 H new ATOM 286 N ASP A 23 -9.188 3.356 7.894 1.00 0.00 N ATOM 287 CA ASP A 23 -8.346 2.197 8.168 1.00 0.00 C ATOM 288 C ASP A 23 -8.350 1.232 6.986 1.00 0.00 C ATOM 289 O ASP A 23 -9.310 0.488 6.782 1.00 0.00 O ATOM 290 CB ASP A 23 -8.824 1.479 9.430 1.00 0.00 C ATOM 291 CG ASP A 23 -8.418 2.204 10.698 1.00 0.00 C ATOM 292 OD1 ASP A 23 -7.264 2.024 11.140 1.00 0.00 O ATOM 293 OD2 ASP A 23 -9.254 2.952 11.248 1.00 0.00 O ATOM 0 H ASP A 23 -9.805 3.619 8.662 1.00 0.00 H new ATOM 0 HA ASP A 23 -7.326 2.548 8.324 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -9.909 1.384 9.401 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -8.416 0.468 9.446 1.00 0.00 H new ATOM 298 N VAL A 24 -7.271 1.250 6.210 1.00 0.00 N ATOM 299 CA VAL A 24 -7.150 0.376 5.049 1.00 0.00 C ATOM 300 C VAL A 24 -7.326 -1.086 5.440 1.00 0.00 C ATOM 301 O VAL A 24 -6.532 -1.636 6.204 1.00 0.00 O ATOM 302 CB VAL A 24 -5.786 0.551 4.355 1.00 0.00 C ATOM 303 CG1 VAL A 24 -5.697 -0.336 3.122 1.00 0.00 C ATOM 304 CG2 VAL A 24 -5.557 2.010 3.991 1.00 0.00 C ATOM 0 H VAL A 24 -6.468 1.860 6.364 1.00 0.00 H new ATOM 0 HA VAL A 24 -7.941 0.660 4.355 1.00 0.00 H new ATOM 0 HB VAL A 24 -5.002 0.247 5.049 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -4.727 -0.199 2.645 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -5.813 -1.379 3.415 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -6.487 -0.066 2.422 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -4.589 2.115 3.502 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -6.344 2.344 3.315 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -5.574 2.618 4.896 1.00 0.00 H new ATOM 314 N VAL A 25 -8.372 -1.713 4.912 1.00 0.00 N ATOM 315 CA VAL A 25 -8.652 -3.114 5.205 1.00 0.00 C ATOM 316 C VAL A 25 -8.560 -3.968 3.946 1.00 0.00 C ATOM 317 O VAL A 25 -8.985 -3.568 2.862 1.00 0.00 O ATOM 318 CB VAL A 25 -10.050 -3.289 5.829 1.00 0.00 C ATOM 319 CG1 VAL A 25 -10.076 -2.733 7.244 1.00 0.00 C ATOM 320 CG2 VAL A 25 -11.106 -2.618 4.964 1.00 0.00 C ATOM 0 H VAL A 25 -9.040 -1.273 4.279 1.00 0.00 H new ATOM 0 HA VAL A 25 -7.899 -3.444 5.920 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.277 -4.354 5.879 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.071 -2.865 7.669 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -9.347 -3.263 7.857 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -9.829 -1.672 7.222 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -12.087 -2.751 5.419 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -10.886 -1.554 4.881 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -11.103 -3.068 3.971 1.00 0.00 H new ATOM 330 N PRO A 26 -7.990 -5.174 4.089 1.00 0.00 N ATOM 331 CA PRO A 26 -7.829 -6.111 2.973 1.00 0.00 C ATOM 332 C PRO A 26 -9.160 -6.687 2.503 1.00 0.00 C ATOM 333 O PRO A 26 -9.523 -7.809 2.858 1.00 0.00 O ATOM 334 CB PRO A 26 -6.947 -7.215 3.561 1.00 0.00 C ATOM 335 CG PRO A 26 -7.201 -7.161 5.028 1.00 0.00 C ATOM 336 CD PRO A 26 -7.460 -5.716 5.351 1.00 0.00 C ATOM 0 HA PRO A 26 -7.402 -5.628 2.094 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -7.207 -8.190 3.150 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -5.895 -7.044 3.335 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -8.056 -7.781 5.299 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -6.344 -7.538 5.586 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -8.175 -5.609 6.166 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -6.548 -5.203 5.657 1.00 0.00 H new ATOM 344 N VAL A 27 -9.885 -5.912 1.702 1.00 0.00 N ATOM 345 CA VAL A 27 -11.176 -6.347 1.182 1.00 0.00 C ATOM 346 C VAL A 27 -11.075 -7.727 0.544 1.00 0.00 C ATOM 347 O VAL A 27 -12.036 -8.499 0.551 1.00 0.00 O ATOM 348 CB VAL A 27 -11.726 -5.352 0.142 1.00 0.00 C ATOM 349 CG1 VAL A 27 -10.906 -5.410 -1.138 1.00 0.00 C ATOM 350 CG2 VAL A 27 -13.193 -5.635 -0.142 1.00 0.00 C ATOM 0 H VAL A 27 -9.600 -4.980 1.399 1.00 0.00 H new ATOM 0 HA VAL A 27 -11.860 -6.391 2.030 1.00 0.00 H new ATOM 0 HB VAL A 27 -11.647 -4.345 0.551 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.309 -4.701 -1.861 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -9.869 -5.154 -0.918 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.951 -6.417 -1.554 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -13.565 -4.923 -0.879 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -13.300 -6.648 -0.530 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -13.767 -5.537 0.779 1.00 0.00 H new ATOM 360 N LEU A 28 -9.906 -8.034 -0.008 1.00 0.00 N ATOM 361 CA LEU A 28 -9.678 -9.324 -0.650 1.00 0.00 C ATOM 362 C LEU A 28 -8.217 -9.744 -0.526 1.00 0.00 C ATOM 363 O LEU A 28 -7.335 -8.909 -0.326 1.00 0.00 O ATOM 364 CB LEU A 28 -10.078 -9.259 -2.126 1.00 0.00 C ATOM 365 CG LEU A 28 -10.581 -10.564 -2.743 1.00 0.00 C ATOM 366 CD1 LEU A 28 -12.037 -10.802 -2.374 1.00 0.00 C ATOM 367 CD2 LEU A 28 -10.409 -10.540 -4.255 1.00 0.00 C ATOM 0 H LEU A 28 -9.101 -7.407 -0.024 1.00 0.00 H new ATOM 0 HA LEU A 28 -10.295 -10.067 -0.145 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -10.856 -8.504 -2.238 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -9.217 -8.917 -2.700 1.00 0.00 H new ATOM 0 HG LEU A 28 -9.987 -11.386 -2.343 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -12.378 -11.735 -2.822 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -12.132 -10.864 -1.290 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -12.646 -9.978 -2.745 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -10.772 -11.477 -4.677 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -10.977 -9.709 -4.673 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -9.354 -10.417 -4.499 1.00 0.00 H new ATOM 379 N VAL A 29 -7.968 -11.044 -0.647 1.00 0.00 N ATOM 380 CA VAL A 29 -6.613 -11.575 -0.552 1.00 0.00 C ATOM 381 C VAL A 29 -6.450 -12.821 -1.414 1.00 0.00 C ATOM 382 O VAL A 29 -7.137 -13.822 -1.214 1.00 0.00 O ATOM 383 CB VAL A 29 -6.247 -11.919 0.904 1.00 0.00 C ATOM 384 CG1 VAL A 29 -4.843 -12.501 0.978 1.00 0.00 C ATOM 385 CG2 VAL A 29 -6.371 -10.689 1.790 1.00 0.00 C ATOM 0 H VAL A 29 -8.687 -11.749 -0.811 1.00 0.00 H new ATOM 0 HA VAL A 29 -5.941 -10.797 -0.914 1.00 0.00 H new ATOM 0 HB VAL A 29 -6.946 -12.672 1.268 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -4.602 -12.738 2.014 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -4.793 -13.409 0.377 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -4.127 -11.773 0.596 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -6.109 -10.951 2.815 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -5.697 -9.912 1.430 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -7.397 -10.321 1.761 1.00 0.00 H new ATOM 395 N SER A 30 -5.534 -12.753 -2.375 1.00 0.00 N ATOM 396 CA SER A 30 -5.281 -13.875 -3.271 1.00 0.00 C ATOM 397 C SER A 30 -3.903 -14.477 -3.013 1.00 0.00 C ATOM 398 O SER A 30 -3.054 -13.859 -2.370 1.00 0.00 O ATOM 399 CB SER A 30 -5.389 -13.425 -4.729 1.00 0.00 C ATOM 400 OG SER A 30 -5.395 -14.538 -5.607 1.00 0.00 O ATOM 0 H SER A 30 -4.955 -11.932 -2.553 1.00 0.00 H new ATOM 0 HA SER A 30 -6.034 -14.639 -3.077 1.00 0.00 H new ATOM 0 HB2 SER A 30 -6.301 -12.844 -4.867 1.00 0.00 H new ATOM 0 HB3 SER A 30 -4.553 -12.769 -4.973 1.00 0.00 H new ATOM 0 HG SER A 30 -5.658 -14.245 -6.505 1.00 0.00 H new ATOM 406 N SER A 31 -3.688 -15.687 -3.519 1.00 0.00 N ATOM 407 CA SER A 31 -2.415 -16.376 -3.341 1.00 0.00 C ATOM 408 C SER A 31 -1.321 -15.720 -4.178 1.00 0.00 C ATOM 409 O SER A 31 -0.132 -15.888 -3.907 1.00 0.00 O ATOM 410 CB SER A 31 -2.551 -17.851 -3.725 1.00 0.00 C ATOM 411 OG SER A 31 -2.661 -18.005 -5.129 1.00 0.00 O ATOM 0 H SER A 31 -4.379 -16.211 -4.056 1.00 0.00 H new ATOM 0 HA SER A 31 -2.136 -16.306 -2.290 1.00 0.00 H new ATOM 0 HB2 SER A 31 -1.686 -18.406 -3.362 1.00 0.00 H new ATOM 0 HB3 SER A 31 -3.429 -18.277 -3.240 1.00 0.00 H new ATOM 0 HG SER A 31 -2.745 -18.956 -5.348 1.00 0.00 H new ATOM 417 N ARG A 32 -1.733 -14.971 -5.197 1.00 0.00 N ATOM 418 CA ARG A 32 -0.789 -14.291 -6.075 1.00 0.00 C ATOM 419 C ARG A 32 -0.879 -12.777 -5.901 1.00 0.00 C ATOM 420 O ARG A 32 0.138 -12.086 -5.843 1.00 0.00 O ATOM 421 CB ARG A 32 -1.056 -14.665 -7.534 1.00 0.00 C ATOM 422 CG ARG A 32 0.125 -14.405 -8.455 1.00 0.00 C ATOM 423 CD ARG A 32 -0.320 -14.244 -9.900 1.00 0.00 C ATOM 424 NE ARG A 32 0.741 -13.700 -10.743 1.00 0.00 N ATOM 425 CZ ARG A 32 1.725 -14.433 -11.250 1.00 0.00 C ATOM 426 NH1 ARG A 32 1.783 -15.734 -11.002 1.00 0.00 N ATOM 427 NH2 ARG A 32 2.655 -13.865 -12.008 1.00 0.00 N ATOM 0 H ARG A 32 -2.714 -14.820 -5.434 1.00 0.00 H new ATOM 0 HA ARG A 32 0.217 -14.611 -5.804 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -1.322 -15.721 -7.587 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -1.917 -14.101 -7.893 1.00 0.00 H new ATOM 0 HG2 ARG A 32 0.648 -13.505 -8.132 1.00 0.00 H new ATOM 0 HG3 ARG A 32 0.834 -15.230 -8.381 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -0.634 -15.211 -10.292 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -1.188 -13.586 -9.941 1.00 0.00 H new ATOM 0 HE ARG A 32 0.725 -12.702 -10.954 1.00 0.00 H new ATOM 0 HH11 ARG A 32 1.070 -16.175 -10.420 1.00 0.00 H new ATOM 0 HH12 ARG A 32 2.540 -16.294 -11.393 1.00 0.00 H new ATOM 0 HH21 ARG A 32 2.614 -12.864 -12.201 1.00 0.00 H new ATOM 0 HH22 ARG A 32 3.411 -14.429 -12.397 1.00 0.00 H new ATOM 441 N PHE A 33 -2.104 -12.269 -5.820 1.00 0.00 N ATOM 442 CA PHE A 33 -2.329 -10.837 -5.655 1.00 0.00 C ATOM 443 C PHE A 33 -3.080 -10.550 -4.359 1.00 0.00 C ATOM 444 O PHE A 33 -3.434 -11.467 -3.617 1.00 0.00 O ATOM 445 CB PHE A 33 -3.113 -10.282 -6.846 1.00 0.00 C ATOM 446 CG PHE A 33 -4.544 -10.736 -6.886 1.00 0.00 C ATOM 447 CD1 PHE A 33 -5.512 -10.085 -6.137 1.00 0.00 C ATOM 448 CD2 PHE A 33 -4.922 -11.812 -7.672 1.00 0.00 C ATOM 449 CE1 PHE A 33 -6.829 -10.502 -6.171 1.00 0.00 C ATOM 450 CE2 PHE A 33 -6.238 -12.233 -7.710 1.00 0.00 C ATOM 451 CZ PHE A 33 -7.193 -11.576 -6.959 1.00 0.00 C ATOM 0 H PHE A 33 -2.956 -12.827 -5.866 1.00 0.00 H new ATOM 0 HA PHE A 33 -1.357 -10.345 -5.607 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -3.087 -9.193 -6.812 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -2.618 -10.584 -7.769 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -5.234 -9.243 -5.520 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -4.179 -12.328 -8.262 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -7.574 -9.988 -5.581 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -6.519 -13.074 -8.326 1.00 0.00 H new ATOM 0 HZ PHE A 33 -8.222 -11.902 -6.988 1.00 0.00 H new ATOM 461 N VAL A 34 -3.319 -9.270 -4.091 1.00 0.00 N ATOM 462 CA VAL A 34 -4.028 -8.861 -2.885 1.00 0.00 C ATOM 463 C VAL A 34 -4.703 -7.507 -3.077 1.00 0.00 C ATOM 464 O VAL A 34 -4.042 -6.468 -3.086 1.00 0.00 O ATOM 465 CB VAL A 34 -3.078 -8.782 -1.675 1.00 0.00 C ATOM 466 CG1 VAL A 34 -3.794 -8.184 -0.473 1.00 0.00 C ATOM 467 CG2 VAL A 34 -2.522 -10.158 -1.345 1.00 0.00 C ATOM 0 H VAL A 34 -3.032 -8.499 -4.693 1.00 0.00 H new ATOM 0 HA VAL A 34 -4.788 -9.618 -2.692 1.00 0.00 H new ATOM 0 HB VAL A 34 -2.243 -8.130 -1.931 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -3.108 -8.136 0.372 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -4.139 -7.180 -0.718 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -4.649 -8.808 -0.211 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -1.853 -10.084 -0.488 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -3.343 -10.835 -1.107 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -1.971 -10.543 -2.203 1.00 0.00 H new ATOM 477 N ARG A 35 -6.023 -7.526 -3.230 1.00 0.00 N ATOM 478 CA ARG A 35 -6.788 -6.300 -3.423 1.00 0.00 C ATOM 479 C ARG A 35 -7.051 -5.609 -2.088 1.00 0.00 C ATOM 480 O ARG A 35 -7.209 -6.264 -1.057 1.00 0.00 O ATOM 481 CB ARG A 35 -8.113 -6.605 -4.122 1.00 0.00 C ATOM 482 CG ARG A 35 -8.856 -5.364 -4.588 1.00 0.00 C ATOM 483 CD ARG A 35 -10.335 -5.646 -4.803 1.00 0.00 C ATOM 484 NE ARG A 35 -10.571 -6.441 -6.005 1.00 0.00 N ATOM 485 CZ ARG A 35 -10.483 -5.953 -7.238 1.00 0.00 C ATOM 486 NH1 ARG A 35 -10.166 -4.680 -7.429 1.00 0.00 N ATOM 487 NH2 ARG A 35 -10.713 -6.739 -8.282 1.00 0.00 N ATOM 0 H ARG A 35 -6.585 -8.377 -3.224 1.00 0.00 H new ATOM 0 HA ARG A 35 -6.201 -5.629 -4.051 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -7.921 -7.247 -4.982 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -8.752 -7.167 -3.441 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -8.740 -4.571 -3.850 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -8.415 -5.002 -5.517 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -10.733 -6.173 -3.936 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -10.876 -4.703 -4.880 1.00 0.00 H new ATOM 0 HE ARG A 35 -10.817 -7.424 -5.892 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -9.989 -4.073 -6.629 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -10.099 -4.308 -8.376 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -10.958 -7.719 -8.139 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -10.645 -6.363 -9.228 1.00 0.00 H new ATOM 501 N LEU A 36 -7.098 -4.281 -2.115 1.00 0.00 N ATOM 502 CA LEU A 36 -7.343 -3.500 -0.907 1.00 0.00 C ATOM 503 C LEU A 36 -8.435 -2.462 -1.142 1.00 0.00 C ATOM 504 O LEU A 36 -8.583 -1.940 -2.247 1.00 0.00 O ATOM 505 CB LEU A 36 -6.055 -2.809 -0.454 1.00 0.00 C ATOM 506 CG LEU A 36 -4.811 -3.694 -0.372 1.00 0.00 C ATOM 507 CD1 LEU A 36 -3.557 -2.878 -0.643 1.00 0.00 C ATOM 508 CD2 LEU A 36 -4.726 -4.370 0.988 1.00 0.00 C ATOM 0 H LEU A 36 -6.970 -3.723 -2.959 1.00 0.00 H new ATOM 0 HA LEU A 36 -7.678 -4.181 -0.125 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -5.847 -1.987 -1.139 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -6.229 -2.369 0.528 1.00 0.00 H new ATOM 0 HG LEU A 36 -4.888 -4.468 -1.136 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -2.682 -3.524 -0.580 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.615 -2.442 -1.640 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.474 -2.082 0.097 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -3.834 -4.996 1.028 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -4.672 -3.611 1.769 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.610 -4.988 1.143 1.00 0.00 H new ATOM 520 N SER A 37 -9.198 -2.165 -0.094 1.00 0.00 N ATOM 521 CA SER A 37 -10.278 -1.191 -0.187 1.00 0.00 C ATOM 522 C SER A 37 -10.157 -0.140 0.913 1.00 0.00 C ATOM 523 O SER A 37 -9.989 -0.470 2.087 1.00 0.00 O ATOM 524 CB SER A 37 -11.635 -1.891 -0.091 1.00 0.00 C ATOM 525 OG SER A 37 -11.938 -2.236 1.249 1.00 0.00 O ATOM 0 H SER A 37 -9.087 -2.585 0.829 1.00 0.00 H new ATOM 0 HA SER A 37 -10.202 -0.692 -1.153 1.00 0.00 H new ATOM 0 HB2 SER A 37 -12.413 -1.238 -0.486 1.00 0.00 H new ATOM 0 HB3 SER A 37 -11.629 -2.789 -0.708 1.00 0.00 H new ATOM 0 HG SER A 37 -11.381 -1.707 1.857 1.00 0.00 H new ATOM 531 N TRP A 38 -10.244 1.127 0.524 1.00 0.00 N ATOM 532 CA TRP A 38 -10.144 2.227 1.475 1.00 0.00 C ATOM 533 C TRP A 38 -11.147 3.327 1.144 1.00 0.00 C ATOM 534 O TRP A 38 -11.776 3.307 0.086 1.00 0.00 O ATOM 535 CB TRP A 38 -8.725 2.799 1.479 1.00 0.00 C ATOM 536 CG TRP A 38 -8.271 3.270 0.130 1.00 0.00 C ATOM 537 CD1 TRP A 38 -8.469 4.506 -0.415 1.00 0.00 C ATOM 538 CD2 TRP A 38 -7.545 2.511 -0.843 1.00 0.00 C ATOM 539 NE1 TRP A 38 -7.910 4.562 -1.669 1.00 0.00 N ATOM 540 CE2 TRP A 38 -7.336 3.351 -1.954 1.00 0.00 C ATOM 541 CE3 TRP A 38 -7.050 1.205 -0.883 1.00 0.00 C ATOM 542 CZ2 TRP A 38 -6.654 2.925 -3.091 1.00 0.00 C ATOM 543 CZ3 TRP A 38 -6.374 0.783 -2.012 1.00 0.00 C ATOM 544 CH2 TRP A 38 -6.180 1.641 -3.103 1.00 0.00 C ATOM 0 H TRP A 38 -10.384 1.418 -0.444 1.00 0.00 H new ATOM 0 HA TRP A 38 -10.374 1.838 2.467 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -8.678 3.631 2.181 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -8.035 2.037 1.841 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -8.989 5.320 0.068 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -7.921 5.373 -2.287 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -7.193 0.537 -0.046 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -6.504 3.584 -3.933 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -5.989 -0.225 -2.054 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -5.646 1.282 -3.970 1.00 0.00 H new ATOM 555 N ARG A 39 -11.291 4.284 2.054 1.00 0.00 N ATOM 556 CA ARG A 39 -12.220 5.391 1.857 1.00 0.00 C ATOM 557 C ARG A 39 -11.491 6.624 1.330 1.00 0.00 C ATOM 558 O ARG A 39 -10.369 6.932 1.732 1.00 0.00 O ATOM 559 CB ARG A 39 -12.930 5.728 3.170 1.00 0.00 C ATOM 560 CG ARG A 39 -13.867 6.921 3.066 1.00 0.00 C ATOM 561 CD ARG A 39 -14.134 7.539 4.430 1.00 0.00 C ATOM 562 NE ARG A 39 -14.888 6.640 5.300 1.00 0.00 N ATOM 563 CZ ARG A 39 -16.212 6.528 5.271 1.00 0.00 C ATOM 564 NH1 ARG A 39 -16.923 7.254 4.420 1.00 0.00 N ATOM 565 NH2 ARG A 39 -16.826 5.688 6.094 1.00 0.00 N ATOM 0 H ARG A 39 -10.777 4.316 2.934 1.00 0.00 H new ATOM 0 HA ARG A 39 -12.961 5.084 1.119 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -13.498 4.858 3.500 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -12.182 5.930 3.937 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -13.432 7.670 2.404 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -14.809 6.607 2.617 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -13.186 7.793 4.905 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -14.687 8.470 4.304 1.00 0.00 H new ATOM 0 HE ARG A 39 -14.370 6.067 5.966 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -16.454 7.900 3.785 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -17.939 7.166 4.400 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -16.282 5.127 6.750 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -17.842 5.603 6.071 1.00 0.00 H new ATOM 579 N PRO A 40 -12.143 7.348 0.408 1.00 0.00 N ATOM 580 CA PRO A 40 -11.577 8.558 -0.195 1.00 0.00 C ATOM 581 C PRO A 40 -11.495 9.715 0.796 1.00 0.00 C ATOM 582 O PRO A 40 -12.122 9.702 1.855 1.00 0.00 O ATOM 583 CB PRO A 40 -12.559 8.887 -1.321 1.00 0.00 C ATOM 584 CG PRO A 40 -13.848 8.278 -0.889 1.00 0.00 C ATOM 585 CD PRO A 40 -13.483 7.039 -0.118 1.00 0.00 C ATOM 0 HA PRO A 40 -10.554 8.403 -0.536 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -12.657 9.964 -1.459 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -12.224 8.473 -2.272 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -14.418 8.970 -0.269 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -14.471 8.033 -1.749 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -14.194 6.841 0.684 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -13.470 6.157 -0.758 1.00 0.00 H new ATOM 593 N PRO A 41 -10.704 10.740 0.446 1.00 0.00 N ATOM 594 CA PRO A 41 -10.523 11.924 1.291 1.00 0.00 C ATOM 595 C PRO A 41 -11.779 12.787 1.357 1.00 0.00 C ATOM 596 O PRO A 41 -12.564 12.829 0.411 1.00 0.00 O ATOM 597 CB PRO A 41 -9.388 12.683 0.599 1.00 0.00 C ATOM 598 CG PRO A 41 -9.456 12.251 -0.825 1.00 0.00 C ATOM 599 CD PRO A 41 -9.927 10.823 -0.802 1.00 0.00 C ATOM 0 HA PRO A 41 -10.307 11.657 2.326 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -9.518 13.761 0.692 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -8.422 12.439 1.041 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -10.143 12.880 -1.391 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -8.481 12.333 -1.305 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -10.539 10.588 -1.673 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -9.091 10.124 -0.802 1.00 0.00 H new ATOM 607 N ALA A 42 -11.961 13.474 2.480 1.00 0.00 N ATOM 608 CA ALA A 42 -13.119 14.338 2.668 1.00 0.00 C ATOM 609 C ALA A 42 -12.896 15.703 2.026 1.00 0.00 C ATOM 610 O ALA A 42 -13.804 16.267 1.416 1.00 0.00 O ATOM 611 CB ALA A 42 -13.427 14.493 4.150 1.00 0.00 C ATOM 0 H ALA A 42 -11.321 13.449 3.274 1.00 0.00 H new ATOM 0 HA ALA A 42 -13.973 13.871 2.178 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -14.294 15.141 4.276 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -13.639 13.515 4.582 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -12.568 14.934 4.656 1.00 0.00 H new ATOM 617 N GLU A 43 -11.683 16.228 2.169 1.00 0.00 N ATOM 618 CA GLU A 43 -11.343 17.528 1.604 1.00 0.00 C ATOM 619 C GLU A 43 -10.116 17.425 0.702 1.00 0.00 C ATOM 620 O GLU A 43 -8.983 17.566 1.160 1.00 0.00 O ATOM 621 CB GLU A 43 -11.086 18.543 2.720 1.00 0.00 C ATOM 622 CG GLU A 43 -12.348 18.994 3.435 1.00 0.00 C ATOM 623 CD GLU A 43 -12.128 20.235 4.278 1.00 0.00 C ATOM 624 OE1 GLU A 43 -11.269 20.192 5.184 1.00 0.00 O ATOM 625 OE2 GLU A 43 -12.815 21.249 4.034 1.00 0.00 O ATOM 0 H GLU A 43 -10.920 15.773 2.671 1.00 0.00 H new ATOM 0 HA GLU A 43 -12.187 17.866 1.003 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -10.403 18.105 3.448 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -10.586 19.415 2.298 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -13.127 19.193 2.699 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -12.709 18.186 4.071 1.00 0.00 H new ATOM 632 N ALA A 44 -10.353 17.179 -0.583 1.00 0.00 N ATOM 633 CA ALA A 44 -9.268 17.059 -1.549 1.00 0.00 C ATOM 634 C ALA A 44 -8.584 18.402 -1.777 1.00 0.00 C ATOM 635 O ALA A 44 -7.364 18.472 -1.930 1.00 0.00 O ATOM 636 CB ALA A 44 -9.793 16.503 -2.865 1.00 0.00 C ATOM 0 H ALA A 44 -11.286 17.059 -0.978 1.00 0.00 H new ATOM 0 HA ALA A 44 -8.529 16.369 -1.143 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -8.972 16.419 -3.577 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -10.229 15.519 -2.696 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -10.554 17.173 -3.266 1.00 0.00 H new ATOM 642 N LYS A 45 -9.376 19.469 -1.798 1.00 0.00 N ATOM 643 CA LYS A 45 -8.848 20.812 -2.006 1.00 0.00 C ATOM 644 C LYS A 45 -8.159 20.921 -3.363 1.00 0.00 C ATOM 645 O LYS A 45 -7.076 21.494 -3.476 1.00 0.00 O ATOM 646 CB LYS A 45 -7.862 21.172 -0.892 1.00 0.00 C ATOM 647 CG LYS A 45 -8.463 21.092 0.501 1.00 0.00 C ATOM 648 CD LYS A 45 -9.097 22.411 0.911 1.00 0.00 C ATOM 649 CE LYS A 45 -10.167 22.209 1.974 1.00 0.00 C ATOM 650 NZ LYS A 45 -10.596 23.499 2.581 1.00 0.00 N ATOM 0 H LYS A 45 -10.388 19.429 -1.673 1.00 0.00 H new ATOM 0 HA LYS A 45 -9.683 21.512 -1.984 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -7.004 20.502 -0.947 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -7.489 22.182 -1.060 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -9.213 20.302 0.530 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -7.688 20.821 1.218 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -8.328 23.083 1.291 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -9.537 22.892 0.037 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -11.030 21.711 1.531 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -9.785 21.550 2.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -11.325 23.319 3.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -9.778 23.962 3.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -10.985 24.118 1.841 1.00 0.00 H new ATOM 664 N GLY A 46 -8.796 20.368 -4.391 1.00 0.00 N ATOM 665 CA GLY A 46 -8.230 20.416 -5.726 1.00 0.00 C ATOM 666 C GLY A 46 -8.727 19.288 -6.607 1.00 0.00 C ATOM 667 O GLY A 46 -9.920 19.192 -6.891 1.00 0.00 O ATOM 0 H GLY A 46 -9.693 19.888 -4.323 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -8.479 21.371 -6.189 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -7.143 20.368 -5.658 1.00 0.00 H new ATOM 671 N ASN A 47 -7.809 18.431 -7.043 1.00 0.00 N ATOM 672 CA ASN A 47 -8.161 17.304 -7.900 1.00 0.00 C ATOM 673 C ASN A 47 -7.119 16.195 -7.794 1.00 0.00 C ATOM 674 O ASN A 47 -5.953 16.390 -8.140 1.00 0.00 O ATOM 675 CB ASN A 47 -8.289 17.763 -9.354 1.00 0.00 C ATOM 676 CG ASN A 47 -7.235 18.785 -9.733 1.00 0.00 C ATOM 677 OD1 ASN A 47 -7.424 19.987 -9.545 1.00 0.00 O ATOM 678 ND2 ASN A 47 -6.117 18.310 -10.270 1.00 0.00 N ATOM 0 H ASN A 47 -6.816 18.495 -6.817 1.00 0.00 H new ATOM 0 HA ASN A 47 -9.120 16.910 -7.565 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -8.207 16.899 -10.013 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -9.279 18.191 -9.511 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -5.372 18.950 -10.545 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -6.004 17.306 -10.407 1.00 0.00 H new ATOM 685 N ILE A 48 -7.547 15.032 -7.316 1.00 0.00 N ATOM 686 CA ILE A 48 -6.652 13.891 -7.167 1.00 0.00 C ATOM 687 C ILE A 48 -6.436 13.184 -8.500 1.00 0.00 C ATOM 688 O ILE A 48 -7.360 13.060 -9.304 1.00 0.00 O ATOM 689 CB ILE A 48 -7.197 12.878 -6.143 1.00 0.00 C ATOM 690 CG1 ILE A 48 -7.303 13.524 -4.760 1.00 0.00 C ATOM 691 CG2 ILE A 48 -6.305 11.646 -6.091 1.00 0.00 C ATOM 692 CD1 ILE A 48 -8.005 12.655 -3.740 1.00 0.00 C ATOM 0 H ILE A 48 -8.508 14.855 -7.025 1.00 0.00 H new ATOM 0 HA ILE A 48 -5.700 14.282 -6.808 1.00 0.00 H new ATOM 0 HB ILE A 48 -8.194 12.568 -6.456 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -6.301 13.757 -4.399 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -7.838 14.470 -4.849 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -6.703 10.939 -5.363 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -6.276 11.176 -7.074 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -5.297 11.939 -5.799 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -8.044 13.176 -2.783 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -9.019 12.443 -4.079 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -7.459 11.719 -3.622 1.00 0.00 H new ATOM 704 N GLN A 49 -5.211 12.720 -8.727 1.00 0.00 N ATOM 705 CA GLN A 49 -4.875 12.024 -9.963 1.00 0.00 C ATOM 706 C GLN A 49 -4.908 10.512 -9.762 1.00 0.00 C ATOM 707 O GLN A 49 -5.522 9.784 -10.543 1.00 0.00 O ATOM 708 CB GLN A 49 -3.492 12.455 -10.456 1.00 0.00 C ATOM 709 CG GLN A 49 -3.460 13.866 -11.020 1.00 0.00 C ATOM 710 CD GLN A 49 -4.348 14.027 -12.239 1.00 0.00 C ATOM 711 OE1 GLN A 49 -3.986 13.618 -13.343 1.00 0.00 O ATOM 712 NE2 GLN A 49 -5.517 14.625 -12.045 1.00 0.00 N ATOM 0 H GLN A 49 -4.435 12.814 -8.071 1.00 0.00 H new ATOM 0 HA GLN A 49 -5.619 12.289 -10.714 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -2.784 12.386 -9.631 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -3.156 11.758 -11.224 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -3.776 14.569 -10.249 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -2.435 14.124 -11.285 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -5.776 14.948 -11.113 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -6.156 14.761 -12.828 1.00 0.00 H new ATOM 721 N THR A 50 -4.243 10.045 -8.710 1.00 0.00 N ATOM 722 CA THR A 50 -4.195 8.620 -8.407 1.00 0.00 C ATOM 723 C THR A 50 -3.750 8.378 -6.970 1.00 0.00 C ATOM 724 O THR A 50 -3.366 9.310 -6.263 1.00 0.00 O ATOM 725 CB THR A 50 -3.241 7.875 -9.360 1.00 0.00 C ATOM 726 OG1 THR A 50 -3.356 6.462 -9.163 1.00 0.00 O ATOM 727 CG2 THR A 50 -1.801 8.308 -9.131 1.00 0.00 C ATOM 0 H THR A 50 -3.730 10.633 -8.053 1.00 0.00 H new ATOM 0 HA THR A 50 -5.206 8.234 -8.541 1.00 0.00 H new ATOM 0 HB THR A 50 -3.520 8.122 -10.384 1.00 0.00 H new ATOM 0 HG1 THR A 50 -4.300 6.203 -9.198 1.00 0.00 H new ATOM 0 HG21 THR A 50 -1.146 7.769 -9.815 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.710 9.379 -9.310 1.00 0.00 H new ATOM 0 HG23 THR A 50 -1.514 8.087 -8.103 1.00 0.00 H new ATOM 735 N PHE A 51 -3.803 7.121 -6.542 1.00 0.00 N ATOM 736 CA PHE A 51 -3.405 6.756 -5.188 1.00 0.00 C ATOM 737 C PHE A 51 -2.165 5.869 -5.205 1.00 0.00 C ATOM 738 O PHE A 51 -2.110 4.871 -5.925 1.00 0.00 O ATOM 739 CB PHE A 51 -4.551 6.036 -4.473 1.00 0.00 C ATOM 740 CG PHE A 51 -5.659 6.954 -4.041 1.00 0.00 C ATOM 741 CD1 PHE A 51 -6.610 7.390 -4.950 1.00 0.00 C ATOM 742 CD2 PHE A 51 -5.749 7.381 -2.726 1.00 0.00 C ATOM 743 CE1 PHE A 51 -7.630 8.235 -4.554 1.00 0.00 C ATOM 744 CE2 PHE A 51 -6.767 8.225 -2.325 1.00 0.00 C ATOM 745 CZ PHE A 51 -7.709 8.652 -3.240 1.00 0.00 C ATOM 0 H PHE A 51 -4.118 6.338 -7.114 1.00 0.00 H new ATOM 0 HA PHE A 51 -3.167 7.672 -4.648 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -4.960 5.273 -5.136 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -4.156 5.520 -3.598 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -6.554 7.066 -5.979 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -5.015 7.050 -2.006 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -8.365 8.569 -5.272 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -6.826 8.550 -1.297 1.00 0.00 H new ATOM 0 HZ PHE A 51 -8.506 9.311 -2.928 1.00 0.00 H new ATOM 755 N THR A 52 -1.167 6.240 -4.408 1.00 0.00 N ATOM 756 CA THR A 52 0.074 5.480 -4.332 1.00 0.00 C ATOM 757 C THR A 52 -0.024 4.369 -3.293 1.00 0.00 C ATOM 758 O THR A 52 -0.315 4.623 -2.124 1.00 0.00 O ATOM 759 CB THR A 52 1.269 6.388 -3.985 1.00 0.00 C ATOM 760 OG1 THR A 52 1.391 7.430 -4.960 1.00 0.00 O ATOM 761 CG2 THR A 52 2.560 5.586 -3.928 1.00 0.00 C ATOM 0 H THR A 52 -1.195 7.063 -3.806 1.00 0.00 H new ATOM 0 HA THR A 52 0.235 5.040 -5.316 1.00 0.00 H new ATOM 0 HB THR A 52 1.090 6.828 -3.004 1.00 0.00 H new ATOM 0 HG1 THR A 52 1.483 7.034 -5.852 1.00 0.00 H new ATOM 0 HG21 THR A 52 3.389 6.249 -3.681 1.00 0.00 H new ATOM 0 HG22 THR A 52 2.474 4.812 -3.165 1.00 0.00 H new ATOM 0 HG23 THR A 52 2.743 5.121 -4.897 1.00 0.00 H new ATOM 769 N VAL A 53 0.222 3.136 -3.726 1.00 0.00 N ATOM 770 CA VAL A 53 0.164 1.986 -2.832 1.00 0.00 C ATOM 771 C VAL A 53 1.524 1.308 -2.720 1.00 0.00 C ATOM 772 O VAL A 53 1.989 0.664 -3.661 1.00 0.00 O ATOM 773 CB VAL A 53 -0.874 0.954 -3.312 1.00 0.00 C ATOM 774 CG1 VAL A 53 -0.861 -0.274 -2.415 1.00 0.00 C ATOM 775 CG2 VAL A 53 -2.262 1.577 -3.358 1.00 0.00 C ATOM 0 H VAL A 53 0.463 2.908 -4.691 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.133 2.361 -1.853 1.00 0.00 H new ATOM 0 HB VAL A 53 -0.608 0.639 -4.321 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.601 -0.992 -2.770 1.00 0.00 H new ATOM 0 HG12 VAL A 53 0.128 -0.731 -2.438 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -1.101 0.019 -1.393 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -2.983 0.834 -3.699 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -2.539 1.921 -2.362 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -2.259 2.422 -4.046 1.00 0.00 H new ATOM 785 N PHE A 54 2.159 1.455 -1.562 1.00 0.00 N ATOM 786 CA PHE A 54 3.468 0.857 -1.325 1.00 0.00 C ATOM 787 C PHE A 54 3.333 -0.616 -0.952 1.00 0.00 C ATOM 788 O PHE A 54 2.347 -1.025 -0.339 1.00 0.00 O ATOM 789 CB PHE A 54 4.204 1.610 -0.215 1.00 0.00 C ATOM 790 CG PHE A 54 4.431 3.062 -0.525 1.00 0.00 C ATOM 791 CD1 PHE A 54 5.495 3.456 -1.321 1.00 0.00 C ATOM 792 CD2 PHE A 54 3.581 4.033 -0.021 1.00 0.00 C ATOM 793 CE1 PHE A 54 5.707 4.791 -1.608 1.00 0.00 C ATOM 794 CE2 PHE A 54 3.788 5.370 -0.305 1.00 0.00 C ATOM 795 CZ PHE A 54 4.853 5.750 -1.099 1.00 0.00 C ATOM 0 H PHE A 54 1.788 1.983 -0.772 1.00 0.00 H new ATOM 0 HA PHE A 54 4.045 0.929 -2.247 1.00 0.00 H new ATOM 0 HB2 PHE A 54 3.632 1.529 0.709 1.00 0.00 H new ATOM 0 HB3 PHE A 54 5.166 1.130 -0.037 1.00 0.00 H new ATOM 0 HD1 PHE A 54 6.166 2.711 -1.722 1.00 0.00 H new ATOM 0 HD2 PHE A 54 2.747 3.742 0.601 1.00 0.00 H new ATOM 0 HE1 PHE A 54 6.540 5.084 -2.230 1.00 0.00 H new ATOM 0 HE2 PHE A 54 3.118 6.117 0.094 1.00 0.00 H new ATOM 0 HZ PHE A 54 5.017 6.794 -1.321 1.00 0.00 H new ATOM 805 N PHE A 55 4.331 -1.409 -1.328 1.00 0.00 N ATOM 806 CA PHE A 55 4.324 -2.838 -1.035 1.00 0.00 C ATOM 807 C PHE A 55 5.734 -3.416 -1.113 1.00 0.00 C ATOM 808 O PHE A 55 6.436 -3.235 -2.108 1.00 0.00 O ATOM 809 CB PHE A 55 3.403 -3.576 -2.009 1.00 0.00 C ATOM 810 CG PHE A 55 3.720 -3.308 -3.452 1.00 0.00 C ATOM 811 CD1 PHE A 55 3.443 -2.075 -4.020 1.00 0.00 C ATOM 812 CD2 PHE A 55 4.297 -4.290 -4.242 1.00 0.00 C ATOM 813 CE1 PHE A 55 3.733 -1.827 -5.348 1.00 0.00 C ATOM 814 CE2 PHE A 55 4.590 -4.048 -5.571 1.00 0.00 C ATOM 815 CZ PHE A 55 4.308 -2.814 -6.124 1.00 0.00 C ATOM 0 H PHE A 55 5.155 -1.087 -1.836 1.00 0.00 H new ATOM 0 HA PHE A 55 3.950 -2.973 -0.020 1.00 0.00 H new ATOM 0 HB2 PHE A 55 3.474 -4.648 -1.823 1.00 0.00 H new ATOM 0 HB3 PHE A 55 2.371 -3.286 -1.812 1.00 0.00 H new ATOM 0 HD1 PHE A 55 2.995 -1.299 -3.418 1.00 0.00 H new ATOM 0 HD2 PHE A 55 4.520 -5.256 -3.814 1.00 0.00 H new ATOM 0 HE1 PHE A 55 3.510 -0.862 -5.779 1.00 0.00 H new ATOM 0 HE2 PHE A 55 5.039 -4.822 -6.176 1.00 0.00 H new ATOM 0 HZ PHE A 55 4.537 -2.621 -7.162 1.00 0.00 H new ATOM 825 N SER A 56 6.142 -4.111 -0.056 1.00 0.00 N ATOM 826 CA SER A 56 7.469 -4.713 -0.002 1.00 0.00 C ATOM 827 C SER A 56 7.440 -6.024 0.776 1.00 0.00 C ATOM 828 O SER A 56 6.447 -6.351 1.426 1.00 0.00 O ATOM 829 CB SER A 56 8.464 -3.746 0.642 1.00 0.00 C ATOM 830 OG SER A 56 8.182 -3.565 2.019 1.00 0.00 O ATOM 0 H SER A 56 5.572 -4.271 0.775 1.00 0.00 H new ATOM 0 HA SER A 56 7.787 -4.924 -1.023 1.00 0.00 H new ATOM 0 HB2 SER A 56 9.477 -4.129 0.523 1.00 0.00 H new ATOM 0 HB3 SER A 56 8.424 -2.784 0.130 1.00 0.00 H new ATOM 0 HG SER A 56 8.918 -3.076 2.442 1.00 0.00 H new ATOM 836 N ARG A 57 8.537 -6.771 0.706 1.00 0.00 N ATOM 837 CA ARG A 57 8.638 -8.048 1.403 1.00 0.00 C ATOM 838 C ARG A 57 9.192 -7.856 2.812 1.00 0.00 C ATOM 839 O ARG A 57 10.104 -7.059 3.026 1.00 0.00 O ATOM 840 CB ARG A 57 9.531 -9.011 0.619 1.00 0.00 C ATOM 841 CG ARG A 57 9.823 -10.308 1.357 1.00 0.00 C ATOM 842 CD ARG A 57 10.039 -11.462 0.391 1.00 0.00 C ATOM 843 NE ARG A 57 10.678 -12.605 1.038 1.00 0.00 N ATOM 844 CZ ARG A 57 11.028 -13.713 0.394 1.00 0.00 C ATOM 845 NH1 ARG A 57 10.803 -13.826 -0.908 1.00 0.00 N ATOM 846 NH2 ARG A 57 11.606 -14.710 1.053 1.00 0.00 N ATOM 0 H ARG A 57 9.368 -6.514 0.174 1.00 0.00 H new ATOM 0 HA ARG A 57 7.637 -8.472 1.480 1.00 0.00 H new ATOM 0 HB2 ARG A 57 9.053 -9.244 -0.332 1.00 0.00 H new ATOM 0 HB3 ARG A 57 10.473 -8.514 0.389 1.00 0.00 H new ATOM 0 HG2 ARG A 57 10.709 -10.182 1.979 1.00 0.00 H new ATOM 0 HG3 ARG A 57 8.995 -10.542 2.026 1.00 0.00 H new ATOM 0 HD2 ARG A 57 9.080 -11.771 -0.025 1.00 0.00 H new ATOM 0 HD3 ARG A 57 10.655 -11.126 -0.443 1.00 0.00 H new ATOM 0 HE ARG A 57 10.866 -12.549 2.039 1.00 0.00 H new ATOM 0 HH11 ARG A 57 10.360 -13.061 -1.417 1.00 0.00 H new ATOM 0 HH12 ARG A 57 11.073 -14.678 -1.400 1.00 0.00 H new ATOM 0 HH21 ARG A 57 11.782 -14.626 2.054 1.00 0.00 H new ATOM 0 HH22 ARG A 57 11.875 -15.561 0.558 1.00 0.00 H new ATOM 860 N GLU A 58 8.632 -8.592 3.767 1.00 0.00 N ATOM 861 CA GLU A 58 9.070 -8.501 5.155 1.00 0.00 C ATOM 862 C GLU A 58 10.584 -8.660 5.260 1.00 0.00 C ATOM 863 O GLU A 58 11.169 -9.550 4.645 1.00 0.00 O ATOM 864 CB GLU A 58 8.374 -9.567 6.003 1.00 0.00 C ATOM 865 CG GLU A 58 8.844 -9.598 7.448 1.00 0.00 C ATOM 866 CD GLU A 58 8.260 -8.469 8.275 1.00 0.00 C ATOM 867 OE1 GLU A 58 7.188 -7.951 7.898 1.00 0.00 O ATOM 868 OE2 GLU A 58 8.874 -8.104 9.299 1.00 0.00 O ATOM 0 H GLU A 58 7.875 -9.257 3.605 1.00 0.00 H new ATOM 0 HA GLU A 58 8.799 -7.514 5.531 1.00 0.00 H new ATOM 0 HB2 GLU A 58 7.299 -9.390 5.983 1.00 0.00 H new ATOM 0 HB3 GLU A 58 8.544 -10.545 5.553 1.00 0.00 H new ATOM 0 HG2 GLU A 58 8.567 -10.552 7.896 1.00 0.00 H new ATOM 0 HG3 GLU A 58 9.932 -9.537 7.474 1.00 0.00 H new ATOM 875 N GLY A 59 11.212 -7.789 6.044 1.00 0.00 N ATOM 876 CA GLY A 59 12.652 -7.849 6.215 1.00 0.00 C ATOM 877 C GLY A 59 13.379 -6.823 5.369 1.00 0.00 C ATOM 878 O GLY A 59 14.294 -6.151 5.846 1.00 0.00 O ATOM 0 H GLY A 59 10.749 -7.043 6.564 1.00 0.00 H new ATOM 0 HA2 GLY A 59 12.897 -7.689 7.265 1.00 0.00 H new ATOM 0 HA3 GLY A 59 13.005 -8.847 5.954 1.00 0.00 H new ATOM 882 N ASP A 60 12.975 -6.704 4.109 1.00 0.00 N ATOM 883 CA ASP A 60 13.595 -5.753 3.194 1.00 0.00 C ATOM 884 C ASP A 60 13.725 -4.379 3.843 1.00 0.00 C ATOM 885 O ASP A 60 13.217 -4.150 4.940 1.00 0.00 O ATOM 886 CB ASP A 60 12.779 -5.647 1.905 1.00 0.00 C ATOM 887 CG ASP A 60 13.631 -5.270 0.709 1.00 0.00 C ATOM 888 OD1 ASP A 60 14.815 -5.666 0.676 1.00 0.00 O ATOM 889 OD2 ASP A 60 13.115 -4.578 -0.194 1.00 0.00 O ATOM 0 H ASP A 60 12.221 -7.254 3.698 1.00 0.00 H new ATOM 0 HA ASP A 60 14.594 -6.117 2.954 1.00 0.00 H new ATOM 0 HB2 ASP A 60 12.287 -6.600 1.711 1.00 0.00 H new ATOM 0 HB3 ASP A 60 11.993 -4.903 2.036 1.00 0.00 H new ATOM 894 N ASN A 61 14.410 -3.469 3.159 1.00 0.00 N ATOM 895 CA ASN A 61 14.609 -2.118 3.670 1.00 0.00 C ATOM 896 C ASN A 61 13.890 -1.094 2.795 1.00 0.00 C ATOM 897 O ASN A 61 13.293 -0.143 3.299 1.00 0.00 O ATOM 898 CB ASN A 61 16.101 -1.789 3.737 1.00 0.00 C ATOM 899 CG ASN A 61 16.896 -2.855 4.467 1.00 0.00 C ATOM 900 OD1 ASN A 61 16.677 -3.104 5.653 1.00 0.00 O ATOM 901 ND2 ASN A 61 17.823 -3.490 3.761 1.00 0.00 N ATOM 0 H ASN A 61 14.837 -3.643 2.249 1.00 0.00 H new ATOM 0 HA ASN A 61 14.189 -2.071 4.675 1.00 0.00 H new ATOM 0 HB2 ASN A 61 16.491 -1.677 2.725 1.00 0.00 H new ATOM 0 HB3 ASN A 61 16.237 -0.831 4.239 1.00 0.00 H new ATOM 0 HD21 ASN A 61 18.388 -4.217 4.199 1.00 0.00 H new ATOM 0 HD22 ASN A 61 17.970 -3.251 2.780 1.00 0.00 H new ATOM 908 N ARG A 62 13.952 -1.298 1.484 1.00 0.00 N ATOM 909 CA ARG A 62 13.308 -0.393 0.539 1.00 0.00 C ATOM 910 C ARG A 62 11.862 -0.810 0.286 1.00 0.00 C ATOM 911 O ARG A 62 11.448 -1.905 0.663 1.00 0.00 O ATOM 912 CB ARG A 62 14.081 -0.366 -0.781 1.00 0.00 C ATOM 913 CG ARG A 62 15.277 0.571 -0.768 1.00 0.00 C ATOM 914 CD ARG A 62 14.851 2.021 -0.934 1.00 0.00 C ATOM 915 NE ARG A 62 15.967 2.879 -1.322 1.00 0.00 N ATOM 916 CZ ARG A 62 16.414 2.986 -2.568 1.00 0.00 C ATOM 917 NH1 ARG A 62 15.841 2.292 -3.542 1.00 0.00 N ATOM 918 NH2 ARG A 62 17.435 3.788 -2.842 1.00 0.00 N ATOM 0 H ARG A 62 14.441 -2.082 1.051 1.00 0.00 H new ATOM 0 HA ARG A 62 13.309 0.607 0.973 1.00 0.00 H new ATOM 0 HB2 ARG A 62 14.423 -1.375 -1.012 1.00 0.00 H new ATOM 0 HB3 ARG A 62 13.405 -0.067 -1.582 1.00 0.00 H new ATOM 0 HG2 ARG A 62 15.821 0.456 0.170 1.00 0.00 H new ATOM 0 HG3 ARG A 62 15.963 0.298 -1.570 1.00 0.00 H new ATOM 0 HD2 ARG A 62 14.066 2.084 -1.688 1.00 0.00 H new ATOM 0 HD3 ARG A 62 14.424 2.383 0.001 1.00 0.00 H new ATOM 0 HE ARG A 62 16.429 3.427 -0.596 1.00 0.00 H new ATOM 0 HH11 ARG A 62 15.056 1.675 -3.335 1.00 0.00 H new ATOM 0 HH12 ARG A 62 16.186 2.375 -4.498 1.00 0.00 H new ATOM 0 HH21 ARG A 62 17.878 4.323 -2.095 1.00 0.00 H new ATOM 0 HH22 ARG A 62 17.777 3.869 -3.799 1.00 0.00 H new ATOM 932 N GLU A 63 11.101 0.072 -0.354 1.00 0.00 N ATOM 933 CA GLU A 63 9.701 -0.205 -0.655 1.00 0.00 C ATOM 934 C GLU A 63 9.372 0.164 -2.099 1.00 0.00 C ATOM 935 O GLU A 63 9.918 1.123 -2.645 1.00 0.00 O ATOM 936 CB GLU A 63 8.788 0.567 0.301 1.00 0.00 C ATOM 937 CG GLU A 63 8.515 -0.165 1.604 1.00 0.00 C ATOM 938 CD GLU A 63 9.641 -0.010 2.608 1.00 0.00 C ATOM 939 OE1 GLU A 63 10.323 1.037 2.577 1.00 0.00 O ATOM 940 OE2 GLU A 63 9.842 -0.934 3.423 1.00 0.00 O ATOM 0 H GLU A 63 11.430 0.983 -0.674 1.00 0.00 H new ATOM 0 HA GLU A 63 9.532 -1.274 -0.523 1.00 0.00 H new ATOM 0 HB2 GLU A 63 9.243 1.532 0.524 1.00 0.00 H new ATOM 0 HB3 GLU A 63 7.840 0.769 -0.198 1.00 0.00 H new ATOM 0 HG2 GLU A 63 7.590 0.211 2.041 1.00 0.00 H new ATOM 0 HG3 GLU A 63 8.362 -1.224 1.396 1.00 0.00 H new ATOM 947 N ARG A 64 8.476 -0.604 -2.710 1.00 0.00 N ATOM 948 CA ARG A 64 8.075 -0.360 -4.090 1.00 0.00 C ATOM 949 C ARG A 64 6.919 0.634 -4.153 1.00 0.00 C ATOM 950 O ARG A 64 6.321 0.971 -3.131 1.00 0.00 O ATOM 951 CB ARG A 64 7.672 -1.671 -4.766 1.00 0.00 C ATOM 952 CG ARG A 64 8.799 -2.689 -4.843 1.00 0.00 C ATOM 953 CD ARG A 64 8.625 -3.625 -6.028 1.00 0.00 C ATOM 954 NE ARG A 64 9.467 -4.812 -5.916 1.00 0.00 N ATOM 955 CZ ARG A 64 9.297 -5.749 -4.990 1.00 0.00 C ATOM 956 NH1 ARG A 64 8.321 -5.636 -4.099 1.00 0.00 N ATOM 957 NH2 ARG A 64 10.105 -6.801 -4.952 1.00 0.00 N ATOM 0 H ARG A 64 8.014 -1.400 -2.271 1.00 0.00 H new ATOM 0 HA ARG A 64 8.927 0.066 -4.619 1.00 0.00 H new ATOM 0 HB2 ARG A 64 6.835 -2.108 -4.221 1.00 0.00 H new ATOM 0 HB3 ARG A 64 7.318 -1.456 -5.774 1.00 0.00 H new ATOM 0 HG2 ARG A 64 9.754 -2.170 -4.925 1.00 0.00 H new ATOM 0 HG3 ARG A 64 8.830 -3.270 -3.921 1.00 0.00 H new ATOM 0 HD2 ARG A 64 7.580 -3.927 -6.101 1.00 0.00 H new ATOM 0 HD3 ARG A 64 8.868 -3.094 -6.948 1.00 0.00 H new ATOM 0 HE ARG A 64 10.228 -4.928 -6.586 1.00 0.00 H new ATOM 0 HH11 ARG A 64 7.699 -4.828 -4.124 1.00 0.00 H new ATOM 0 HH12 ARG A 64 8.193 -6.357 -3.389 1.00 0.00 H new ATOM 0 HH21 ARG A 64 10.858 -6.891 -5.634 1.00 0.00 H new ATOM 0 HH22 ARG A 64 9.973 -7.520 -4.240 1.00 0.00 H new ATOM 971 N ALA A 65 6.610 1.099 -5.359 1.00 0.00 N ATOM 972 CA ALA A 65 5.525 2.053 -5.555 1.00 0.00 C ATOM 973 C ALA A 65 4.655 1.657 -6.743 1.00 0.00 C ATOM 974 O ALA A 65 5.146 1.105 -7.729 1.00 0.00 O ATOM 975 CB ALA A 65 6.083 3.455 -5.750 1.00 0.00 C ATOM 0 H ALA A 65 7.096 0.831 -6.215 1.00 0.00 H new ATOM 0 HA ALA A 65 4.900 2.044 -4.662 1.00 0.00 H new ATOM 0 HB1 ALA A 65 5.262 4.157 -5.895 1.00 0.00 H new ATOM 0 HB2 ALA A 65 6.656 3.744 -4.869 1.00 0.00 H new ATOM 0 HB3 ALA A 65 6.732 3.470 -6.626 1.00 0.00 H new ATOM 981 N LEU A 66 3.361 1.942 -6.644 1.00 0.00 N ATOM 982 CA LEU A 66 2.422 1.616 -7.712 1.00 0.00 C ATOM 983 C LEU A 66 1.310 2.656 -7.795 1.00 0.00 C ATOM 984 O LEU A 66 0.415 2.691 -6.951 1.00 0.00 O ATOM 985 CB LEU A 66 1.822 0.228 -7.483 1.00 0.00 C ATOM 986 CG LEU A 66 0.705 -0.187 -8.442 1.00 0.00 C ATOM 987 CD1 LEU A 66 1.251 -0.369 -9.849 1.00 0.00 C ATOM 988 CD2 LEU A 66 0.034 -1.465 -7.958 1.00 0.00 C ATOM 0 H LEU A 66 2.938 2.398 -5.835 1.00 0.00 H new ATOM 0 HA LEU A 66 2.967 1.618 -8.656 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.623 -0.508 -7.550 1.00 0.00 H new ATOM 0 HB3 LEU A 66 1.434 0.185 -6.465 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.043 0.606 -8.464 1.00 0.00 H new ATOM 0 HD11 LEU A 66 0.442 -0.664 -10.518 1.00 0.00 H new ATOM 0 HD12 LEU A 66 1.684 0.569 -10.195 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.019 -1.143 -9.844 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.758 -1.745 -8.652 1.00 0.00 H new ATOM 0 HD22 LEU A 66 0.771 -2.266 -7.906 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -0.392 -1.300 -6.969 1.00 0.00 H new ATOM 1000 N ASN A 67 1.372 3.501 -8.819 1.00 0.00 N ATOM 1001 CA ASN A 67 0.368 4.541 -9.014 1.00 0.00 C ATOM 1002 C ASN A 67 -0.568 4.185 -10.164 1.00 0.00 C ATOM 1003 O ASN A 67 -0.219 4.339 -11.335 1.00 0.00 O ATOM 1004 CB ASN A 67 1.044 5.886 -9.289 1.00 0.00 C ATOM 1005 CG ASN A 67 2.342 6.049 -8.521 1.00 0.00 C ATOM 1006 OD1 ASN A 67 2.262 6.667 -7.348 1.00 0.00 O flip ATOM 1007 ND2 ASN A 67 3.403 5.623 -8.977 1.00 0.00 N flip ATOM 0 H ASN A 67 2.107 3.486 -9.526 1.00 0.00 H new ATOM 0 HA ASN A 67 -0.221 4.618 -8.100 1.00 0.00 H new ATOM 0 HB2 ASN A 67 1.243 5.978 -10.357 1.00 0.00 H new ATOM 0 HB3 ASN A 67 0.363 6.693 -9.021 1.00 0.00 H new ATOM 0 HD21 ASN A 67 3.417 5.154 -9.883 1.00 0.00 H new ATOM 0 HD22 ASN A 67 4.268 5.739 -8.449 1.00 0.00 H new ATOM 1014 N THR A 68 -1.761 3.708 -9.823 1.00 0.00 N ATOM 1015 CA THR A 68 -2.749 3.330 -10.826 1.00 0.00 C ATOM 1016 C THR A 68 -4.104 3.052 -10.186 1.00 0.00 C ATOM 1017 O THR A 68 -4.294 2.029 -9.527 1.00 0.00 O ATOM 1018 CB THR A 68 -2.300 2.084 -11.614 1.00 0.00 C ATOM 1019 OG1 THR A 68 -3.429 1.473 -12.248 1.00 0.00 O ATOM 1020 CG2 THR A 68 -1.622 1.079 -10.695 1.00 0.00 C ATOM 0 H THR A 68 -2.067 3.574 -8.859 1.00 0.00 H new ATOM 0 HA THR A 68 -2.841 4.172 -11.512 1.00 0.00 H new ATOM 0 HB THR A 68 -1.584 2.399 -12.373 1.00 0.00 H new ATOM 0 HG1 THR A 68 -3.135 0.683 -12.748 1.00 0.00 H new ATOM 0 HG21 THR A 68 -1.314 0.208 -11.273 1.00 0.00 H new ATOM 0 HG22 THR A 68 -0.747 1.538 -10.236 1.00 0.00 H new ATOM 0 HG23 THR A 68 -2.319 0.770 -9.917 1.00 0.00 H new ATOM 1028 N THR A 69 -5.046 3.969 -10.385 1.00 0.00 N ATOM 1029 CA THR A 69 -6.385 3.822 -9.827 1.00 0.00 C ATOM 1030 C THR A 69 -7.421 4.530 -10.692 1.00 0.00 C ATOM 1031 O THR A 69 -7.191 5.642 -11.167 1.00 0.00 O ATOM 1032 CB THR A 69 -6.460 4.382 -8.394 1.00 0.00 C ATOM 1033 OG1 THR A 69 -5.527 5.457 -8.238 1.00 0.00 O ATOM 1034 CG2 THR A 69 -6.164 3.295 -7.372 1.00 0.00 C ATOM 0 H THR A 69 -4.906 4.821 -10.928 1.00 0.00 H new ATOM 0 HA THR A 69 -6.603 2.754 -9.804 1.00 0.00 H new ATOM 0 HB THR A 69 -7.471 4.752 -8.225 1.00 0.00 H new ATOM 0 HG1 THR A 69 -5.941 6.176 -7.717 1.00 0.00 H new ATOM 0 HG21 THR A 69 -6.223 3.714 -6.368 1.00 0.00 H new ATOM 0 HG22 THR A 69 -6.894 2.492 -7.473 1.00 0.00 H new ATOM 0 HG23 THR A 69 -5.163 2.899 -7.542 1.00 0.00 H new ATOM 1042 N GLN A 70 -8.562 3.879 -10.892 1.00 0.00 N ATOM 1043 CA GLN A 70 -9.634 4.447 -11.700 1.00 0.00 C ATOM 1044 C GLN A 70 -10.130 5.759 -11.102 1.00 0.00 C ATOM 1045 O GLN A 70 -10.045 5.991 -9.896 1.00 0.00 O ATOM 1046 CB GLN A 70 -10.794 3.456 -11.817 1.00 0.00 C ATOM 1047 CG GLN A 70 -10.582 2.396 -12.886 1.00 0.00 C ATOM 1048 CD GLN A 70 -11.587 1.264 -12.792 1.00 0.00 C ATOM 1049 OE1 GLN A 70 -12.453 1.258 -11.917 1.00 0.00 O ATOM 1050 NE2 GLN A 70 -11.477 0.298 -13.697 1.00 0.00 N ATOM 0 H GLN A 70 -8.768 2.958 -10.506 1.00 0.00 H new ATOM 0 HA GLN A 70 -9.236 4.649 -12.695 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -10.941 2.966 -10.855 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -11.709 4.005 -12.038 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -10.653 2.859 -13.870 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -9.574 1.991 -12.796 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -10.744 0.343 -14.405 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -12.126 -0.489 -13.684 1.00 0.00 H new ATOM 1059 N PRO A 71 -10.661 6.640 -11.963 1.00 0.00 N ATOM 1060 CA PRO A 71 -11.181 7.944 -11.543 1.00 0.00 C ATOM 1061 C PRO A 71 -12.463 7.821 -10.727 1.00 0.00 C ATOM 1062 O PRO A 71 -13.565 7.927 -11.264 1.00 0.00 O ATOM 1063 CB PRO A 71 -11.456 8.660 -12.867 1.00 0.00 C ATOM 1064 CG PRO A 71 -11.679 7.564 -13.851 1.00 0.00 C ATOM 1065 CD PRO A 71 -10.794 6.430 -13.415 1.00 0.00 C ATOM 0 HA PRO A 71 -10.482 8.472 -10.895 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -12.329 9.309 -12.792 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -10.615 9.289 -13.159 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -12.725 7.259 -13.865 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -11.428 7.889 -14.861 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -11.240 5.462 -13.642 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -9.826 6.460 -13.916 1.00 0.00 H new ATOM 1073 N GLY A 72 -12.312 7.596 -9.425 1.00 0.00 N ATOM 1074 CA GLY A 72 -13.467 7.463 -8.556 1.00 0.00 C ATOM 1075 C GLY A 72 -13.377 6.247 -7.655 1.00 0.00 C ATOM 1076 O GLY A 72 -13.924 6.242 -6.553 1.00 0.00 O ATOM 0 H GLY A 72 -11.411 7.503 -8.957 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -13.562 8.359 -7.943 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -14.369 7.395 -9.164 1.00 0.00 H new ATOM 1080 N SER A 73 -12.686 5.214 -8.125 1.00 0.00 N ATOM 1081 CA SER A 73 -12.531 3.984 -7.356 1.00 0.00 C ATOM 1082 C SER A 73 -11.374 4.103 -6.369 1.00 0.00 C ATOM 1083 O SER A 73 -10.277 4.533 -6.729 1.00 0.00 O ATOM 1084 CB SER A 73 -12.297 2.798 -8.293 1.00 0.00 C ATOM 1085 OG SER A 73 -12.714 1.584 -7.693 1.00 0.00 O ATOM 0 H SER A 73 -12.224 5.204 -9.034 1.00 0.00 H new ATOM 0 HA SER A 73 -13.450 3.818 -6.794 1.00 0.00 H new ATOM 0 HB2 SER A 73 -12.842 2.953 -9.224 1.00 0.00 H new ATOM 0 HB3 SER A 73 -11.239 2.736 -8.549 1.00 0.00 H new ATOM 0 HG SER A 73 -12.556 0.841 -8.313 1.00 0.00 H new ATOM 1091 N LEU A 74 -11.627 3.720 -5.123 1.00 0.00 N ATOM 1092 CA LEU A 74 -10.607 3.783 -4.081 1.00 0.00 C ATOM 1093 C LEU A 74 -10.049 2.395 -3.781 1.00 0.00 C ATOM 1094 O LEU A 74 -9.540 2.144 -2.689 1.00 0.00 O ATOM 1095 CB LEU A 74 -11.188 4.397 -2.807 1.00 0.00 C ATOM 1096 CG LEU A 74 -11.510 5.891 -2.869 1.00 0.00 C ATOM 1097 CD1 LEU A 74 -10.290 6.681 -3.317 1.00 0.00 C ATOM 1098 CD2 LEU A 74 -12.685 6.146 -3.802 1.00 0.00 C ATOM 0 H LEU A 74 -12.529 3.363 -4.809 1.00 0.00 H new ATOM 0 HA LEU A 74 -9.793 4.412 -4.442 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -12.101 3.859 -2.552 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -10.482 4.231 -1.993 1.00 0.00 H new ATOM 0 HG LEU A 74 -11.787 6.225 -1.869 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -10.537 7.742 -3.355 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -9.475 6.524 -2.610 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -9.982 6.344 -4.307 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -12.900 7.214 -3.833 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -12.437 5.796 -4.804 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -13.562 5.610 -3.438 1.00 0.00 H new ATOM 1110 N GLN A 75 -10.147 1.499 -4.758 1.00 0.00 N ATOM 1111 CA GLN A 75 -9.650 0.138 -4.599 1.00 0.00 C ATOM 1112 C GLN A 75 -8.690 -0.227 -5.726 1.00 0.00 C ATOM 1113 O GLN A 75 -8.962 0.038 -6.898 1.00 0.00 O ATOM 1114 CB GLN A 75 -10.816 -0.852 -4.565 1.00 0.00 C ATOM 1115 CG GLN A 75 -11.886 -0.497 -3.546 1.00 0.00 C ATOM 1116 CD GLN A 75 -13.246 -1.060 -3.908 1.00 0.00 C ATOM 1117 OE1 GLN A 75 -14.238 -0.332 -3.961 1.00 0.00 O ATOM 1118 NE2 GLN A 75 -13.301 -2.362 -4.160 1.00 0.00 N ATOM 0 H GLN A 75 -10.566 1.691 -5.668 1.00 0.00 H new ATOM 0 HA GLN A 75 -9.109 0.084 -3.655 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -11.270 -0.900 -5.555 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -10.430 -1.847 -4.343 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -11.590 -0.874 -2.567 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -11.957 0.587 -3.462 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -12.455 -2.928 -4.105 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -14.190 -2.796 -4.409 1.00 0.00 H new ATOM 1127 N LEU A 76 -7.566 -0.836 -5.365 1.00 0.00 N ATOM 1128 CA LEU A 76 -6.564 -1.238 -6.346 1.00 0.00 C ATOM 1129 C LEU A 76 -6.033 -2.635 -6.042 1.00 0.00 C ATOM 1130 O LEU A 76 -5.807 -2.987 -4.883 1.00 0.00 O ATOM 1131 CB LEU A 76 -5.410 -0.234 -6.366 1.00 0.00 C ATOM 1132 CG LEU A 76 -4.184 -0.637 -7.187 1.00 0.00 C ATOM 1133 CD1 LEU A 76 -4.583 -0.961 -8.618 1.00 0.00 C ATOM 1134 CD2 LEU A 76 -3.138 0.468 -7.160 1.00 0.00 C ATOM 0 H LEU A 76 -7.326 -1.062 -4.400 1.00 0.00 H new ATOM 0 HA LEU A 76 -7.039 -1.256 -7.327 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -5.786 0.713 -6.752 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -5.092 -0.056 -5.339 1.00 0.00 H new ATOM 0 HG LEU A 76 -3.750 -1.532 -6.741 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -3.698 -1.246 -9.187 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -5.296 -1.786 -8.619 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -5.042 -0.084 -9.075 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -2.273 0.164 -7.749 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -3.561 1.380 -7.581 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -2.830 0.652 -6.131 1.00 0.00 H new ATOM 1146 N THR A 77 -5.833 -3.428 -7.090 1.00 0.00 N ATOM 1147 CA THR A 77 -5.328 -4.786 -6.935 1.00 0.00 C ATOM 1148 C THR A 77 -3.829 -4.849 -7.204 1.00 0.00 C ATOM 1149 O THR A 77 -3.374 -4.560 -8.311 1.00 0.00 O ATOM 1150 CB THR A 77 -6.049 -5.766 -7.881 1.00 0.00 C ATOM 1151 OG1 THR A 77 -7.467 -5.615 -7.752 1.00 0.00 O ATOM 1152 CG2 THR A 77 -5.656 -7.203 -7.574 1.00 0.00 C ATOM 0 H THR A 77 -6.013 -3.153 -8.055 1.00 0.00 H new ATOM 0 HA THR A 77 -5.522 -5.079 -5.903 1.00 0.00 H new ATOM 0 HB THR A 77 -5.751 -5.536 -8.904 1.00 0.00 H new ATOM 0 HG1 THR A 77 -7.919 -6.239 -8.357 1.00 0.00 H new ATOM 0 HG21 THR A 77 -6.178 -7.876 -8.254 1.00 0.00 H new ATOM 0 HG22 THR A 77 -4.580 -7.321 -7.701 1.00 0.00 H new ATOM 0 HG23 THR A 77 -5.929 -7.443 -6.546 1.00 0.00 H new ATOM 1160 N VAL A 78 -3.064 -5.229 -6.185 1.00 0.00 N ATOM 1161 CA VAL A 78 -1.616 -5.331 -6.313 1.00 0.00 C ATOM 1162 C VAL A 78 -1.180 -6.783 -6.478 1.00 0.00 C ATOM 1163 O VAL A 78 -0.998 -7.503 -5.497 1.00 0.00 O ATOM 1164 CB VAL A 78 -0.900 -4.728 -5.089 1.00 0.00 C ATOM 1165 CG1 VAL A 78 0.606 -4.896 -5.214 1.00 0.00 C ATOM 1166 CG2 VAL A 78 -1.270 -3.261 -4.926 1.00 0.00 C ATOM 0 H VAL A 78 -3.424 -5.471 -5.262 1.00 0.00 H new ATOM 0 HA VAL A 78 -1.337 -4.767 -7.203 1.00 0.00 H new ATOM 0 HB VAL A 78 -1.227 -5.263 -4.198 1.00 0.00 H new ATOM 0 HG11 VAL A 78 1.094 -4.464 -4.340 1.00 0.00 H new ATOM 0 HG12 VAL A 78 0.850 -5.956 -5.279 1.00 0.00 H new ATOM 0 HG13 VAL A 78 0.955 -4.388 -6.113 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -0.756 -2.850 -4.057 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -0.972 -2.709 -5.818 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -2.347 -3.171 -4.786 1.00 0.00 H new ATOM 1176 N GLY A 79 -1.013 -7.207 -7.727 1.00 0.00 N ATOM 1177 CA GLY A 79 -0.599 -8.571 -7.999 1.00 0.00 C ATOM 1178 C GLY A 79 0.905 -8.705 -8.132 1.00 0.00 C ATOM 1179 O GLY A 79 1.651 -7.805 -7.748 1.00 0.00 O ATOM 0 H GLY A 79 -1.157 -6.630 -8.556 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.949 -9.220 -7.197 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -1.074 -8.915 -8.918 1.00 0.00 H new ATOM 1183 N ASN A 80 1.351 -9.832 -8.676 1.00 0.00 N ATOM 1184 CA ASN A 80 2.777 -10.082 -8.856 1.00 0.00 C ATOM 1185 C ASN A 80 3.464 -10.308 -7.513 1.00 0.00 C ATOM 1186 O ASN A 80 4.516 -9.730 -7.236 1.00 0.00 O ATOM 1187 CB ASN A 80 3.433 -8.908 -9.586 1.00 0.00 C ATOM 1188 CG ASN A 80 2.566 -8.366 -10.706 1.00 0.00 C ATOM 1189 OD1 ASN A 80 1.653 -9.041 -11.182 1.00 0.00 O ATOM 1190 ND2 ASN A 80 2.848 -7.140 -11.132 1.00 0.00 N ATOM 0 H ASN A 80 0.746 -10.587 -9.000 1.00 0.00 H new ATOM 0 HA ASN A 80 2.889 -10.984 -9.457 1.00 0.00 H new ATOM 0 HB2 ASN A 80 3.641 -8.110 -8.873 1.00 0.00 H new ATOM 0 HB3 ASN A 80 4.392 -9.228 -9.995 1.00 0.00 H new ATOM 0 HD21 ASN A 80 2.298 -6.722 -11.883 1.00 0.00 H new ATOM 0 HD22 ASN A 80 3.614 -6.617 -10.708 1.00 0.00 H new ATOM 1197 N LEU A 81 2.862 -11.152 -6.682 1.00 0.00 N ATOM 1198 CA LEU A 81 3.415 -11.455 -5.366 1.00 0.00 C ATOM 1199 C LEU A 81 3.652 -12.954 -5.208 1.00 0.00 C ATOM 1200 O LEU A 81 3.366 -13.738 -6.113 1.00 0.00 O ATOM 1201 CB LEU A 81 2.475 -10.957 -4.268 1.00 0.00 C ATOM 1202 CG LEU A 81 1.999 -9.510 -4.397 1.00 0.00 C ATOM 1203 CD1 LEU A 81 0.678 -9.315 -3.670 1.00 0.00 C ATOM 1204 CD2 LEU A 81 3.052 -8.553 -3.857 1.00 0.00 C ATOM 0 H LEU A 81 1.991 -11.639 -6.896 1.00 0.00 H new ATOM 0 HA LEU A 81 4.373 -10.942 -5.275 1.00 0.00 H new ATOM 0 HB2 LEU A 81 1.599 -11.606 -4.245 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.979 -11.068 -3.308 1.00 0.00 H new ATOM 0 HG LEU A 81 1.844 -9.292 -5.454 1.00 0.00 H new ATOM 0 HD11 LEU A 81 0.355 -8.279 -3.773 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.075 -9.974 -4.101 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.806 -9.552 -2.614 1.00 0.00 H new ATOM 0 HD21 LEU A 81 2.697 -7.527 -3.957 1.00 0.00 H new ATOM 0 HD22 LEU A 81 3.238 -8.772 -2.806 1.00 0.00 H new ATOM 0 HD23 LEU A 81 3.977 -8.673 -4.422 1.00 0.00 H new ATOM 1216 N LYS A 82 4.175 -13.346 -4.051 1.00 0.00 N ATOM 1217 CA LYS A 82 4.448 -14.751 -3.771 1.00 0.00 C ATOM 1218 C LYS A 82 3.638 -15.233 -2.572 1.00 0.00 C ATOM 1219 O LYS A 82 3.501 -14.538 -1.565 1.00 0.00 O ATOM 1220 CB LYS A 82 5.941 -14.959 -3.510 1.00 0.00 C ATOM 1221 CG LYS A 82 6.279 -16.346 -2.989 1.00 0.00 C ATOM 1222 CD LYS A 82 7.702 -16.410 -2.458 1.00 0.00 C ATOM 1223 CE LYS A 82 8.216 -17.841 -2.417 1.00 0.00 C ATOM 1224 NZ LYS A 82 8.428 -18.394 -3.783 1.00 0.00 N ATOM 0 H LYS A 82 4.418 -12.710 -3.292 1.00 0.00 H new ATOM 0 HA LYS A 82 4.154 -15.334 -4.644 1.00 0.00 H new ATOM 0 HB2 LYS A 82 6.491 -14.783 -4.434 1.00 0.00 H new ATOM 0 HB3 LYS A 82 6.283 -14.216 -2.789 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.581 -16.618 -2.197 1.00 0.00 H new ATOM 0 HG3 LYS A 82 6.155 -17.076 -3.788 1.00 0.00 H new ATOM 0 HD2 LYS A 82 8.354 -15.806 -3.088 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.738 -15.980 -1.457 1.00 0.00 H new ATOM 0 HE2 LYS A 82 9.154 -17.874 -1.862 1.00 0.00 H new ATOM 0 HE3 LYS A 82 7.505 -18.467 -1.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 9.076 -19.206 -3.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 7.517 -18.702 -4.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 8.840 -17.660 -4.394 1.00 0.00 H new ATOM 1238 N PRO A 83 3.090 -16.453 -2.679 1.00 0.00 N ATOM 1239 CA PRO A 83 2.287 -17.056 -1.611 1.00 0.00 C ATOM 1240 C PRO A 83 3.127 -17.433 -0.396 1.00 0.00 C ATOM 1241 O PRO A 83 4.333 -17.652 -0.508 1.00 0.00 O ATOM 1242 CB PRO A 83 1.706 -18.310 -2.269 1.00 0.00 C ATOM 1243 CG PRO A 83 2.669 -18.648 -3.355 1.00 0.00 C ATOM 1244 CD PRO A 83 3.212 -17.337 -3.850 1.00 0.00 C ATOM 0 HA PRO A 83 1.532 -16.368 -1.231 1.00 0.00 H new ATOM 0 HB2 PRO A 83 1.614 -19.127 -1.553 1.00 0.00 H new ATOM 0 HB3 PRO A 83 0.709 -18.122 -2.668 1.00 0.00 H new ATOM 0 HG2 PRO A 83 3.470 -19.286 -2.982 1.00 0.00 H new ATOM 0 HG3 PRO A 83 2.175 -19.194 -4.159 1.00 0.00 H new ATOM 0 HD2 PRO A 83 4.247 -17.429 -4.178 1.00 0.00 H new ATOM 0 HD3 PRO A 83 2.641 -16.960 -4.699 1.00 0.00 H new ATOM 1252 N GLU A 84 2.482 -17.508 0.764 1.00 0.00 N ATOM 1253 CA GLU A 84 3.172 -17.858 2.000 1.00 0.00 C ATOM 1254 C GLU A 84 4.273 -16.848 2.314 1.00 0.00 C ATOM 1255 O GLU A 84 5.418 -17.221 2.565 1.00 0.00 O ATOM 1256 CB GLU A 84 3.769 -19.263 1.896 1.00 0.00 C ATOM 1257 CG GLU A 84 2.737 -20.373 2.008 1.00 0.00 C ATOM 1258 CD GLU A 84 3.332 -21.675 2.508 1.00 0.00 C ATOM 1259 OE1 GLU A 84 4.347 -22.123 1.936 1.00 0.00 O ATOM 1260 OE2 GLU A 84 2.781 -22.245 3.473 1.00 0.00 O ATOM 0 H GLU A 84 1.483 -17.331 0.874 1.00 0.00 H new ATOM 0 HA GLU A 84 2.443 -17.839 2.811 1.00 0.00 H new ATOM 0 HB2 GLU A 84 4.290 -19.358 0.943 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.514 -19.391 2.681 1.00 0.00 H new ATOM 0 HG2 GLU A 84 1.942 -20.058 2.684 1.00 0.00 H new ATOM 0 HG3 GLU A 84 2.279 -20.538 1.033 1.00 0.00 H new ATOM 1267 N ALA A 85 3.915 -15.569 2.298 1.00 0.00 N ATOM 1268 CA ALA A 85 4.870 -14.505 2.582 1.00 0.00 C ATOM 1269 C ALA A 85 4.159 -13.235 3.037 1.00 0.00 C ATOM 1270 O ALA A 85 3.161 -12.826 2.445 1.00 0.00 O ATOM 1271 CB ALA A 85 5.726 -14.222 1.356 1.00 0.00 C ATOM 0 H ALA A 85 2.970 -15.244 2.091 1.00 0.00 H new ATOM 0 HA ALA A 85 5.516 -14.839 3.394 1.00 0.00 H new ATOM 0 HB1 ALA A 85 6.434 -13.425 1.583 1.00 0.00 H new ATOM 0 HB2 ALA A 85 6.271 -15.124 1.077 1.00 0.00 H new ATOM 0 HB3 ALA A 85 5.086 -13.914 0.529 1.00 0.00 H new ATOM 1277 N MET A 86 4.679 -12.618 4.093 1.00 0.00 N ATOM 1278 CA MET A 86 4.092 -11.394 4.627 1.00 0.00 C ATOM 1279 C MET A 86 4.389 -10.207 3.716 1.00 0.00 C ATOM 1280 O MET A 86 5.514 -10.040 3.244 1.00 0.00 O ATOM 1281 CB MET A 86 4.627 -11.118 6.034 1.00 0.00 C ATOM 1282 CG MET A 86 4.020 -9.886 6.684 1.00 0.00 C ATOM 1283 SD MET A 86 4.099 -9.940 8.485 1.00 0.00 S ATOM 1284 CE MET A 86 2.475 -10.586 8.876 1.00 0.00 C ATOM 0 H MET A 86 5.504 -12.945 4.595 1.00 0.00 H new ATOM 0 HA MET A 86 3.012 -11.530 4.677 1.00 0.00 H new ATOM 0 HB2 MET A 86 4.431 -11.985 6.665 1.00 0.00 H new ATOM 0 HB3 MET A 86 5.709 -10.997 5.985 1.00 0.00 H new ATOM 0 HG2 MET A 86 4.542 -8.998 6.328 1.00 0.00 H new ATOM 0 HG3 MET A 86 2.980 -9.791 6.373 1.00 0.00 H new ATOM 0 HE1 MET A 86 2.200 -10.291 9.889 1.00 0.00 H new ATOM 0 HE2 MET A 86 1.745 -10.187 8.171 1.00 0.00 H new ATOM 0 HE3 MET A 86 2.490 -11.674 8.806 1.00 0.00 H new ATOM 1294 N TYR A 87 3.374 -9.385 3.474 1.00 0.00 N ATOM 1295 CA TYR A 87 3.525 -8.214 2.618 1.00 0.00 C ATOM 1296 C TYR A 87 2.761 -7.022 3.184 1.00 0.00 C ATOM 1297 O TYR A 87 1.545 -7.079 3.369 1.00 0.00 O ATOM 1298 CB TYR A 87 3.033 -8.525 1.203 1.00 0.00 C ATOM 1299 CG TYR A 87 3.912 -9.504 0.457 1.00 0.00 C ATOM 1300 CD1 TYR A 87 5.288 -9.325 0.395 1.00 0.00 C ATOM 1301 CD2 TYR A 87 3.365 -10.609 -0.184 1.00 0.00 C ATOM 1302 CE1 TYR A 87 6.094 -10.216 -0.286 1.00 0.00 C ATOM 1303 CE2 TYR A 87 4.163 -11.506 -0.866 1.00 0.00 C ATOM 1304 CZ TYR A 87 5.527 -11.306 -0.915 1.00 0.00 C ATOM 1305 OH TYR A 87 6.327 -12.197 -1.593 1.00 0.00 O ATOM 0 H TYR A 87 2.437 -9.508 3.859 1.00 0.00 H new ATOM 0 HA TYR A 87 4.584 -7.957 2.580 1.00 0.00 H new ATOM 0 HB2 TYR A 87 2.022 -8.928 1.259 1.00 0.00 H new ATOM 0 HB3 TYR A 87 2.975 -7.596 0.635 1.00 0.00 H new ATOM 0 HD1 TYR A 87 5.735 -8.474 0.888 1.00 0.00 H new ATOM 0 HD2 TYR A 87 2.298 -10.769 -0.148 1.00 0.00 H new ATOM 0 HE1 TYR A 87 7.162 -10.061 -0.326 1.00 0.00 H new ATOM 0 HE2 TYR A 87 3.722 -12.360 -1.359 1.00 0.00 H new ATOM 0 HH TYR A 87 6.168 -12.112 -2.556 1.00 0.00 H new ATOM 1315 N THR A 88 3.484 -5.940 3.458 1.00 0.00 N ATOM 1316 CA THR A 88 2.876 -4.733 4.004 1.00 0.00 C ATOM 1317 C THR A 88 2.373 -3.820 2.892 1.00 0.00 C ATOM 1318 O THR A 88 3.087 -3.549 1.927 1.00 0.00 O ATOM 1319 CB THR A 88 3.870 -3.952 4.884 1.00 0.00 C ATOM 1320 OG1 THR A 88 4.461 -4.827 5.851 1.00 0.00 O ATOM 1321 CG2 THR A 88 3.176 -2.799 5.593 1.00 0.00 C ATOM 0 H THR A 88 4.491 -5.875 3.311 1.00 0.00 H new ATOM 0 HA THR A 88 2.033 -5.053 4.617 1.00 0.00 H new ATOM 0 HB THR A 88 4.649 -3.545 4.239 1.00 0.00 H new ATOM 0 HG1 THR A 88 5.093 -4.323 6.405 1.00 0.00 H new ATOM 0 HG21 THR A 88 3.898 -2.263 6.208 1.00 0.00 H new ATOM 0 HG22 THR A 88 2.753 -2.119 4.854 1.00 0.00 H new ATOM 0 HG23 THR A 88 2.378 -3.188 6.226 1.00 0.00 H new ATOM 1329 N PHE A 89 1.139 -3.347 3.034 1.00 0.00 N ATOM 1330 CA PHE A 89 0.540 -2.463 2.041 1.00 0.00 C ATOM 1331 C PHE A 89 0.156 -1.125 2.665 1.00 0.00 C ATOM 1332 O PHE A 89 -0.243 -1.061 3.828 1.00 0.00 O ATOM 1333 CB PHE A 89 -0.694 -3.122 1.420 1.00 0.00 C ATOM 1334 CG PHE A 89 -0.386 -4.385 0.668 1.00 0.00 C ATOM 1335 CD1 PHE A 89 -0.004 -5.533 1.343 1.00 0.00 C ATOM 1336 CD2 PHE A 89 -0.478 -4.424 -0.714 1.00 0.00 C ATOM 1337 CE1 PHE A 89 0.282 -6.696 0.653 1.00 0.00 C ATOM 1338 CE2 PHE A 89 -0.194 -5.584 -1.409 1.00 0.00 C ATOM 1339 CZ PHE A 89 0.185 -6.722 -0.724 1.00 0.00 C ATOM 0 H PHE A 89 0.534 -3.561 3.827 1.00 0.00 H new ATOM 0 HA PHE A 89 1.278 -2.281 1.260 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -1.413 -3.345 2.209 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.172 -2.414 0.744 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.071 -5.519 2.420 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -0.775 -3.537 -1.254 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.581 -7.584 1.191 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -0.268 -5.601 -2.486 1.00 0.00 H new ATOM 0 HZ PHE A 89 0.405 -7.631 -1.265 1.00 0.00 H new ATOM 1349 N ARG A 90 0.281 -0.057 1.883 1.00 0.00 N ATOM 1350 CA ARG A 90 -0.051 1.281 2.358 1.00 0.00 C ATOM 1351 C ARG A 90 -0.889 2.031 1.327 1.00 0.00 C ATOM 1352 O ARG A 90 -0.994 1.615 0.174 1.00 0.00 O ATOM 1353 CB ARG A 90 1.225 2.067 2.663 1.00 0.00 C ATOM 1354 CG ARG A 90 2.096 1.424 3.730 1.00 0.00 C ATOM 1355 CD ARG A 90 3.092 2.417 4.309 1.00 0.00 C ATOM 1356 NE ARG A 90 4.028 2.905 3.299 1.00 0.00 N ATOM 1357 CZ ARG A 90 4.702 4.044 3.411 1.00 0.00 C ATOM 1358 NH1 ARG A 90 4.544 4.809 4.483 1.00 0.00 N ATOM 1359 NH2 ARG A 90 5.535 4.421 2.450 1.00 0.00 N ATOM 0 H ARG A 90 0.610 -0.093 0.918 1.00 0.00 H new ATOM 0 HA ARG A 90 -0.636 1.181 3.272 1.00 0.00 H new ATOM 0 HB2 ARG A 90 1.805 2.171 1.746 1.00 0.00 H new ATOM 0 HB3 ARG A 90 0.954 3.073 2.985 1.00 0.00 H new ATOM 0 HG2 ARG A 90 1.466 1.032 4.528 1.00 0.00 H new ATOM 0 HG3 ARG A 90 2.632 0.577 3.302 1.00 0.00 H new ATOM 0 HD2 ARG A 90 2.554 3.260 4.742 1.00 0.00 H new ATOM 0 HD3 ARG A 90 3.647 1.944 5.119 1.00 0.00 H new ATOM 0 HE ARG A 90 4.172 2.340 2.462 1.00 0.00 H new ATOM 0 HH11 ARG A 90 3.904 4.523 5.224 1.00 0.00 H new ATOM 0 HH12 ARG A 90 5.063 5.683 4.567 1.00 0.00 H new ATOM 0 HH21 ARG A 90 5.659 3.836 1.624 1.00 0.00 H new ATOM 0 HH22 ARG A 90 6.052 5.296 2.537 1.00 0.00 H new ATOM 1373 N VAL A 91 -1.486 3.141 1.752 1.00 0.00 N ATOM 1374 CA VAL A 91 -2.315 3.950 0.867 1.00 0.00 C ATOM 1375 C VAL A 91 -2.121 5.437 1.140 1.00 0.00 C ATOM 1376 O VAL A 91 -2.193 5.884 2.285 1.00 0.00 O ATOM 1377 CB VAL A 91 -3.807 3.601 1.021 1.00 0.00 C ATOM 1378 CG1 VAL A 91 -4.657 4.475 0.111 1.00 0.00 C ATOM 1379 CG2 VAL A 91 -4.042 2.127 0.729 1.00 0.00 C ATOM 0 H VAL A 91 -1.411 3.500 2.704 1.00 0.00 H new ATOM 0 HA VAL A 91 -2.001 3.727 -0.153 1.00 0.00 H new ATOM 0 HB VAL A 91 -4.103 3.796 2.052 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -5.708 4.214 0.234 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -4.511 5.523 0.372 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -4.362 4.315 -0.926 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.102 1.898 0.843 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -3.730 1.904 -0.291 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -3.463 1.521 1.426 1.00 0.00 H new ATOM 1389 N VAL A 92 -1.875 6.201 0.080 1.00 0.00 N ATOM 1390 CA VAL A 92 -1.672 7.639 0.205 1.00 0.00 C ATOM 1391 C VAL A 92 -2.355 8.391 -0.932 1.00 0.00 C ATOM 1392 O VAL A 92 -2.356 7.939 -2.076 1.00 0.00 O ATOM 1393 CB VAL A 92 -0.174 7.996 0.215 1.00 0.00 C ATOM 1394 CG1 VAL A 92 0.016 9.500 0.338 1.00 0.00 C ATOM 1395 CG2 VAL A 92 0.540 7.266 1.342 1.00 0.00 C ATOM 0 H VAL A 92 -1.812 5.848 -0.875 1.00 0.00 H new ATOM 0 HA VAL A 92 -2.116 7.940 1.154 1.00 0.00 H new ATOM 0 HB VAL A 92 0.264 7.675 -0.730 1.00 0.00 H new ATOM 0 HG11 VAL A 92 1.081 9.733 0.343 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -0.460 9.997 -0.507 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -0.436 9.849 1.266 1.00 0.00 H new ATOM 0 HG21 VAL A 92 1.598 7.530 1.334 1.00 0.00 H new ATOM 0 HG22 VAL A 92 0.101 7.554 2.297 1.00 0.00 H new ATOM 0 HG23 VAL A 92 0.434 6.190 1.203 1.00 0.00 H new ATOM 1405 N ALA A 93 -2.935 9.542 -0.608 1.00 0.00 N ATOM 1406 CA ALA A 93 -3.620 10.359 -1.602 1.00 0.00 C ATOM 1407 C ALA A 93 -2.695 11.435 -2.160 1.00 0.00 C ATOM 1408 O ALA A 93 -2.069 12.180 -1.406 1.00 0.00 O ATOM 1409 CB ALA A 93 -4.866 10.991 -0.999 1.00 0.00 C ATOM 0 H ALA A 93 -2.944 9.930 0.335 1.00 0.00 H new ATOM 0 HA ALA A 93 -3.918 9.711 -2.426 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -5.367 11.598 -1.753 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -5.542 10.208 -0.656 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -4.583 11.621 -0.156 1.00 0.00 H new ATOM 1415 N TYR A 94 -2.614 11.511 -3.484 1.00 0.00 N ATOM 1416 CA TYR A 94 -1.762 12.494 -4.142 1.00 0.00 C ATOM 1417 C TYR A 94 -2.591 13.446 -4.998 1.00 0.00 C ATOM 1418 O TYR A 94 -3.233 13.032 -5.963 1.00 0.00 O ATOM 1419 CB TYR A 94 -0.713 11.794 -5.008 1.00 0.00 C ATOM 1420 CG TYR A 94 0.556 11.450 -4.261 1.00 0.00 C ATOM 1421 CD1 TYR A 94 0.647 10.286 -3.507 1.00 0.00 C ATOM 1422 CD2 TYR A 94 1.663 12.288 -4.309 1.00 0.00 C ATOM 1423 CE1 TYR A 94 1.805 9.967 -2.823 1.00 0.00 C ATOM 1424 CE2 TYR A 94 2.824 11.977 -3.629 1.00 0.00 C ATOM 1425 CZ TYR A 94 2.890 10.816 -2.888 1.00 0.00 C ATOM 1426 OH TYR A 94 4.045 10.503 -2.208 1.00 0.00 O ATOM 0 H TYR A 94 -3.128 10.904 -4.122 1.00 0.00 H new ATOM 0 HA TYR A 94 -1.257 13.074 -3.370 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -1.143 10.880 -5.417 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -0.465 12.436 -5.853 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -0.201 9.620 -3.455 1.00 0.00 H new ATOM 0 HD2 TYR A 94 1.615 13.198 -4.888 1.00 0.00 H new ATOM 0 HE1 TYR A 94 1.860 9.059 -2.241 1.00 0.00 H new ATOM 0 HE2 TYR A 94 3.676 12.639 -3.677 1.00 0.00 H new ATOM 0 HH TYR A 94 4.713 11.204 -2.359 1.00 0.00 H new ATOM 1436 N ASN A 95 -2.572 14.726 -4.638 1.00 0.00 N ATOM 1437 CA ASN A 95 -3.322 15.738 -5.372 1.00 0.00 C ATOM 1438 C ASN A 95 -2.386 16.800 -5.943 1.00 0.00 C ATOM 1439 O ASN A 95 -1.177 16.759 -5.722 1.00 0.00 O ATOM 1440 CB ASN A 95 -4.360 16.395 -4.461 1.00 0.00 C ATOM 1441 CG ASN A 95 -3.731 17.334 -3.450 1.00 0.00 C ATOM 1442 OD1 ASN A 95 -2.512 17.353 -3.279 1.00 0.00 O ATOM 1443 ND2 ASN A 95 -4.563 18.118 -2.774 1.00 0.00 N ATOM 0 H ASN A 95 -2.045 15.086 -3.842 1.00 0.00 H new ATOM 0 HA ASN A 95 -3.834 15.246 -6.199 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -5.076 16.948 -5.070 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -4.919 15.621 -3.935 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -4.198 18.770 -2.080 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -5.567 18.068 -2.949 1.00 0.00 H new ATOM 1450 N GLU A 96 -2.956 17.749 -6.678 1.00 0.00 N ATOM 1451 CA GLU A 96 -2.173 18.822 -7.281 1.00 0.00 C ATOM 1452 C GLU A 96 -1.066 19.283 -6.337 1.00 0.00 C ATOM 1453 O GLU A 96 0.085 19.443 -6.745 1.00 0.00 O ATOM 1454 CB GLU A 96 -3.076 20.003 -7.642 1.00 0.00 C ATOM 1455 CG GLU A 96 -2.326 21.183 -8.236 1.00 0.00 C ATOM 1456 CD GLU A 96 -3.204 22.045 -9.122 1.00 0.00 C ATOM 1457 OE1 GLU A 96 -4.208 21.523 -9.650 1.00 0.00 O ATOM 1458 OE2 GLU A 96 -2.888 23.242 -9.288 1.00 0.00 O ATOM 0 H GLU A 96 -3.957 17.797 -6.871 1.00 0.00 H new ATOM 0 HA GLU A 96 -1.714 18.435 -8.191 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -3.831 19.668 -8.353 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -3.604 20.332 -6.747 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -1.919 21.793 -7.430 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -1.479 20.816 -8.816 1.00 0.00 H new ATOM 1465 N TRP A 97 -1.423 19.495 -5.076 1.00 0.00 N ATOM 1466 CA TRP A 97 -0.460 19.939 -4.074 1.00 0.00 C ATOM 1467 C TRP A 97 0.621 18.887 -3.854 1.00 0.00 C ATOM 1468 O TRP A 97 1.791 19.113 -4.159 1.00 0.00 O ATOM 1469 CB TRP A 97 -1.171 20.242 -2.754 1.00 0.00 C ATOM 1470 CG TRP A 97 -1.914 21.543 -2.764 1.00 0.00 C ATOM 1471 CD1 TRP A 97 -3.226 21.740 -2.440 1.00 0.00 C ATOM 1472 CD2 TRP A 97 -1.389 22.827 -3.117 1.00 0.00 C ATOM 1473 NE1 TRP A 97 -3.549 23.069 -2.571 1.00 0.00 N ATOM 1474 CE2 TRP A 97 -2.439 23.757 -2.984 1.00 0.00 C ATOM 1475 CE3 TRP A 97 -0.135 23.283 -3.531 1.00 0.00 C ATOM 1476 CZ2 TRP A 97 -2.270 25.113 -3.252 1.00 0.00 C ATOM 1477 CZ3 TRP A 97 0.031 24.629 -3.796 1.00 0.00 C ATOM 1478 CH2 TRP A 97 -1.031 25.531 -3.656 1.00 0.00 C ATOM 0 H TRP A 97 -2.371 19.367 -4.723 1.00 0.00 H new ATOM 0 HA TRP A 97 0.015 20.849 -4.440 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -1.869 19.435 -2.532 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -0.436 20.258 -1.949 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -3.909 20.965 -2.127 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -4.466 23.477 -2.390 1.00 0.00 H new ATOM 0 HE3 TRP A 97 0.690 22.595 -3.642 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -3.088 25.810 -3.145 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 0.996 24.992 -4.117 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -0.869 26.577 -3.871 1.00 0.00 H new ATOM 1489 N GLY A 98 0.221 17.736 -3.323 1.00 0.00 N ATOM 1490 CA GLY A 98 1.169 16.666 -3.072 1.00 0.00 C ATOM 1491 C GLY A 98 0.616 15.608 -2.138 1.00 0.00 C ATOM 1492 O GLY A 98 -0.596 15.463 -1.979 1.00 0.00 O ATOM 0 H GLY A 98 -0.742 17.525 -3.062 1.00 0.00 H new ATOM 0 HA2 GLY A 98 1.447 16.202 -4.018 1.00 0.00 H new ATOM 0 HA3 GLY A 98 2.079 17.085 -2.643 1.00 0.00 H new ATOM 1496 N PRO A 99 1.518 14.846 -1.501 1.00 0.00 N ATOM 1497 CA PRO A 99 1.136 13.782 -0.567 1.00 0.00 C ATOM 1498 C PRO A 99 0.542 14.331 0.725 1.00 0.00 C ATOM 1499 O PRO A 99 1.264 14.816 1.595 1.00 0.00 O ATOM 1500 CB PRO A 99 2.460 13.066 -0.285 1.00 0.00 C ATOM 1501 CG PRO A 99 3.508 14.095 -0.536 1.00 0.00 C ATOM 1502 CD PRO A 99 2.979 14.964 -1.643 1.00 0.00 C ATOM 0 HA PRO A 99 0.364 13.133 -0.981 1.00 0.00 H new ATOM 0 HB2 PRO A 99 2.502 12.701 0.741 1.00 0.00 H new ATOM 0 HB3 PRO A 99 2.589 12.202 -0.937 1.00 0.00 H new ATOM 0 HG2 PRO A 99 3.702 14.682 0.362 1.00 0.00 H new ATOM 0 HG3 PRO A 99 4.451 13.630 -0.822 1.00 0.00 H new ATOM 0 HD2 PRO A 99 3.311 15.997 -1.537 1.00 0.00 H new ATOM 0 HD3 PRO A 99 3.317 14.620 -2.620 1.00 0.00 H new ATOM 1510 N GLY A 100 -0.780 14.251 0.844 1.00 0.00 N ATOM 1511 CA GLY A 100 -1.449 14.743 2.034 1.00 0.00 C ATOM 1512 C GLY A 100 -1.143 13.906 3.260 1.00 0.00 C ATOM 1513 O GLY A 100 0.021 13.659 3.576 1.00 0.00 O ATOM 0 H GLY A 100 -1.399 13.854 0.137 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -1.146 15.774 2.217 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -2.526 14.752 1.864 1.00 0.00 H new ATOM 1517 N GLU A 101 -2.189 13.469 3.954 1.00 0.00 N ATOM 1518 CA GLU A 101 -2.025 12.657 5.153 1.00 0.00 C ATOM 1519 C GLU A 101 -1.755 11.199 4.791 1.00 0.00 C ATOM 1520 O GLU A 101 -2.340 10.664 3.849 1.00 0.00 O ATOM 1521 CB GLU A 101 -3.272 12.752 6.035 1.00 0.00 C ATOM 1522 CG GLU A 101 -3.300 13.988 6.918 1.00 0.00 C ATOM 1523 CD GLU A 101 -3.907 15.190 6.221 1.00 0.00 C ATOM 1524 OE1 GLU A 101 -3.165 15.899 5.510 1.00 0.00 O ATOM 1525 OE2 GLU A 101 -5.123 15.421 6.387 1.00 0.00 O ATOM 0 H GLU A 101 -3.159 13.664 3.706 1.00 0.00 H new ATOM 0 HA GLU A 101 -1.167 13.041 5.706 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -4.157 12.750 5.399 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -3.330 11.864 6.665 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -3.869 13.771 7.822 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -2.284 14.229 7.231 1.00 0.00 H new ATOM 1532 N SER A 102 -0.865 10.563 5.545 1.00 0.00 N ATOM 1533 CA SER A 102 -0.514 9.169 5.301 1.00 0.00 C ATOM 1534 C SER A 102 -1.333 8.239 6.191 1.00 0.00 C ATOM 1535 O SER A 102 -1.481 8.479 7.389 1.00 0.00 O ATOM 1536 CB SER A 102 0.979 8.946 5.549 1.00 0.00 C ATOM 1537 OG SER A 102 1.402 7.698 5.030 1.00 0.00 O ATOM 0 H SER A 102 -0.374 10.991 6.330 1.00 0.00 H new ATOM 0 HA SER A 102 -0.740 8.940 4.260 1.00 0.00 H new ATOM 0 HB2 SER A 102 1.552 9.749 5.085 1.00 0.00 H new ATOM 0 HB3 SER A 102 1.183 8.986 6.619 1.00 0.00 H new ATOM 0 HG SER A 102 2.360 7.581 5.200 1.00 0.00 H new ATOM 1543 N SER A 103 -1.863 7.175 5.594 1.00 0.00 N ATOM 1544 CA SER A 103 -2.671 6.210 6.330 1.00 0.00 C ATOM 1545 C SER A 103 -1.785 5.228 7.092 1.00 0.00 C ATOM 1546 O SER A 103 -0.575 5.169 6.872 1.00 0.00 O ATOM 1547 CB SER A 103 -3.590 5.448 5.374 1.00 0.00 C ATOM 1548 OG SER A 103 -2.880 4.439 4.678 1.00 0.00 O ATOM 0 H SER A 103 -1.747 6.960 4.604 1.00 0.00 H new ATOM 0 HA SER A 103 -3.280 6.757 7.050 1.00 0.00 H new ATOM 0 HB2 SER A 103 -4.410 4.999 5.934 1.00 0.00 H new ATOM 0 HB3 SER A 103 -4.034 6.142 4.661 1.00 0.00 H new ATOM 0 HG SER A 103 -2.587 4.785 3.809 1.00 0.00 H new ATOM 1554 N GLN A 104 -2.397 4.461 7.987 1.00 0.00 N ATOM 1555 CA GLN A 104 -1.664 3.482 8.782 1.00 0.00 C ATOM 1556 C GLN A 104 -1.355 2.235 7.960 1.00 0.00 C ATOM 1557 O GLN A 104 -2.217 1.683 7.277 1.00 0.00 O ATOM 1558 CB GLN A 104 -2.467 3.101 10.027 1.00 0.00 C ATOM 1559 CG GLN A 104 -1.679 2.272 11.029 1.00 0.00 C ATOM 1560 CD GLN A 104 -0.897 3.127 12.006 1.00 0.00 C ATOM 1561 OE1 GLN A 104 -1.190 4.309 12.188 1.00 0.00 O ATOM 1562 NE2 GLN A 104 0.106 2.532 12.642 1.00 0.00 N ATOM 0 H GLN A 104 -3.398 4.498 8.180 1.00 0.00 H new ATOM 0 HA GLN A 104 -0.721 3.934 9.091 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -2.817 4.010 10.516 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -3.352 2.542 9.722 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -2.364 1.629 11.582 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -0.991 1.618 10.493 1.00 0.00 H new ATOM 0 HE21 GLN A 104 0.314 1.550 12.461 1.00 0.00 H new ATOM 0 HE22 GLN A 104 0.668 3.057 13.312 1.00 0.00 H new ATOM 1571 N PRO A 105 -0.095 1.780 8.026 1.00 0.00 N ATOM 1572 CA PRO A 105 0.357 0.593 7.295 1.00 0.00 C ATOM 1573 C PRO A 105 -0.241 -0.695 7.852 1.00 0.00 C ATOM 1574 O PRO A 105 -0.458 -0.818 9.058 1.00 0.00 O ATOM 1575 CB PRO A 105 1.874 0.608 7.496 1.00 0.00 C ATOM 1576 CG PRO A 105 2.080 1.359 8.766 1.00 0.00 C ATOM 1577 CD PRO A 105 0.985 2.388 8.821 1.00 0.00 C ATOM 0 HA PRO A 105 0.051 0.619 6.249 1.00 0.00 H new ATOM 0 HB2 PRO A 105 2.274 -0.403 7.565 1.00 0.00 H new ATOM 0 HB3 PRO A 105 2.379 1.095 6.662 1.00 0.00 H new ATOM 0 HG2 PRO A 105 2.032 0.691 9.626 1.00 0.00 H new ATOM 0 HG3 PRO A 105 3.062 1.832 8.785 1.00 0.00 H new ATOM 0 HD2 PRO A 105 0.669 2.584 9.846 1.00 0.00 H new ATOM 0 HD3 PRO A 105 1.307 3.340 8.400 1.00 0.00 H new ATOM 1585 N ILE A 106 -0.506 -1.650 6.967 1.00 0.00 N ATOM 1586 CA ILE A 106 -1.078 -2.928 7.372 1.00 0.00 C ATOM 1587 C ILE A 106 -0.226 -4.092 6.877 1.00 0.00 C ATOM 1588 O ILE A 106 0.473 -3.981 5.870 1.00 0.00 O ATOM 1589 CB ILE A 106 -2.514 -3.096 6.841 1.00 0.00 C ATOM 1590 CG1 ILE A 106 -2.531 -3.000 5.314 1.00 0.00 C ATOM 1591 CG2 ILE A 106 -3.430 -2.047 7.454 1.00 0.00 C ATOM 1592 CD1 ILE A 106 -3.735 -3.662 4.681 1.00 0.00 C ATOM 0 H ILE A 106 -0.334 -1.563 5.965 1.00 0.00 H new ATOM 0 HA ILE A 106 -1.100 -2.933 8.462 1.00 0.00 H new ATOM 0 HB ILE A 106 -2.879 -4.082 7.128 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -2.509 -1.950 5.024 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -1.625 -3.459 4.919 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -4.442 -2.178 7.070 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -3.437 -2.159 8.538 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -3.069 -1.052 7.194 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -3.681 -3.555 3.598 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -3.747 -4.720 4.941 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -4.646 -3.188 5.048 1.00 0.00 H new ATOM 1604 N LYS A 107 -0.291 -5.211 7.592 1.00 0.00 N ATOM 1605 CA LYS A 107 0.471 -6.399 7.225 1.00 0.00 C ATOM 1606 C LYS A 107 -0.460 -7.557 6.881 1.00 0.00 C ATOM 1607 O LYS A 107 -1.083 -8.149 7.762 1.00 0.00 O ATOM 1608 CB LYS A 107 1.405 -6.803 8.368 1.00 0.00 C ATOM 1609 CG LYS A 107 2.738 -6.076 8.351 1.00 0.00 C ATOM 1610 CD LYS A 107 3.633 -6.524 9.495 1.00 0.00 C ATOM 1611 CE LYS A 107 5.063 -6.042 9.306 1.00 0.00 C ATOM 1612 NZ LYS A 107 5.934 -6.429 10.449 1.00 0.00 N ATOM 0 H LYS A 107 -0.864 -5.320 8.429 1.00 0.00 H new ATOM 0 HA LYS A 107 1.067 -6.161 6.344 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.907 -6.609 9.318 1.00 0.00 H new ATOM 0 HB3 LYS A 107 1.586 -7.877 8.316 1.00 0.00 H new ATOM 0 HG2 LYS A 107 3.241 -6.259 7.401 1.00 0.00 H new ATOM 0 HG3 LYS A 107 2.568 -5.002 8.420 1.00 0.00 H new ATOM 0 HD2 LYS A 107 3.240 -6.141 10.437 1.00 0.00 H new ATOM 0 HD3 LYS A 107 3.621 -7.612 9.563 1.00 0.00 H new ATOM 0 HE2 LYS A 107 5.468 -6.459 8.384 1.00 0.00 H new ATOM 0 HE3 LYS A 107 5.069 -4.958 9.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 6.900 -6.082 10.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 5.563 -6.011 11.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 5.949 -7.465 10.539 1.00 0.00 H new ATOM 1626 N VAL A 108 -0.547 -7.877 5.594 1.00 0.00 N ATOM 1627 CA VAL A 108 -1.400 -8.967 5.133 1.00 0.00 C ATOM 1628 C VAL A 108 -0.569 -10.112 4.565 1.00 0.00 C ATOM 1629 O VAL A 108 0.257 -9.911 3.675 1.00 0.00 O ATOM 1630 CB VAL A 108 -2.394 -8.486 4.059 1.00 0.00 C ATOM 1631 CG1 VAL A 108 -3.315 -9.621 3.639 1.00 0.00 C ATOM 1632 CG2 VAL A 108 -3.196 -7.299 4.570 1.00 0.00 C ATOM 0 H VAL A 108 -0.038 -7.397 4.852 1.00 0.00 H new ATOM 0 HA VAL A 108 -1.957 -9.322 6.000 1.00 0.00 H new ATOM 0 HB VAL A 108 -1.830 -8.164 3.183 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -4.011 -9.263 2.880 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -2.722 -10.439 3.231 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -3.874 -9.975 4.505 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -3.893 -6.972 3.799 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -3.752 -7.592 5.461 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -2.519 -6.482 4.817 1.00 0.00 H new ATOM 1642 N ALA A 109 -0.794 -11.314 5.085 1.00 0.00 N ATOM 1643 CA ALA A 109 -0.068 -12.492 4.627 1.00 0.00 C ATOM 1644 C ALA A 109 -0.850 -13.235 3.549 1.00 0.00 C ATOM 1645 O ALA A 109 -1.979 -13.672 3.776 1.00 0.00 O ATOM 1646 CB ALA A 109 0.228 -13.417 5.799 1.00 0.00 C ATOM 0 H ALA A 109 -1.473 -11.498 5.824 1.00 0.00 H new ATOM 0 HA ALA A 109 0.875 -12.161 4.191 1.00 0.00 H new ATOM 0 HB1 ALA A 109 0.771 -14.293 5.443 1.00 0.00 H new ATOM 0 HB2 ALA A 109 0.834 -12.889 6.535 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -0.708 -13.732 6.259 1.00 0.00 H new ATOM 1652 N THR A 110 -0.244 -13.373 2.374 1.00 0.00 N ATOM 1653 CA THR A 110 -0.884 -14.061 1.260 1.00 0.00 C ATOM 1654 C THR A 110 -1.418 -15.423 1.688 1.00 0.00 C ATOM 1655 O THR A 110 -1.132 -15.893 2.789 1.00 0.00 O ATOM 1656 CB THR A 110 0.091 -14.252 0.083 1.00 0.00 C ATOM 1657 OG1 THR A 110 1.387 -14.611 0.573 1.00 0.00 O ATOM 1658 CG2 THR A 110 0.191 -12.981 -0.748 1.00 0.00 C ATOM 0 H THR A 110 0.690 -13.017 2.169 1.00 0.00 H new ATOM 0 HA THR A 110 -1.714 -13.433 0.937 1.00 0.00 H new ATOM 0 HB THR A 110 -0.291 -15.053 -0.550 1.00 0.00 H new ATOM 0 HG1 THR A 110 2.039 -14.557 -0.157 1.00 0.00 H new ATOM 0 HG21 THR A 110 0.885 -13.140 -1.573 1.00 0.00 H new ATOM 0 HG22 THR A 110 -0.792 -12.727 -1.144 1.00 0.00 H new ATOM 0 HG23 THR A 110 0.552 -12.165 -0.122 1.00 0.00 H new ATOM 1666 N GLN A 111 -2.195 -16.051 0.812 1.00 0.00 N ATOM 1667 CA GLN A 111 -2.769 -17.360 1.101 1.00 0.00 C ATOM 1668 C GLN A 111 -1.796 -18.474 0.732 1.00 0.00 C ATOM 1669 O GLN A 111 -0.988 -18.347 -0.188 1.00 0.00 O ATOM 1670 CB GLN A 111 -4.084 -17.543 0.340 1.00 0.00 C ATOM 1671 CG GLN A 111 -5.120 -16.474 0.651 1.00 0.00 C ATOM 1672 CD GLN A 111 -6.524 -16.892 0.261 1.00 0.00 C ATOM 1673 OE1 GLN A 111 -6.775 -17.278 -0.881 1.00 0.00 O ATOM 1674 NE2 GLN A 111 -7.449 -16.818 1.210 1.00 0.00 N ATOM 0 H GLN A 111 -2.442 -15.675 -0.103 1.00 0.00 H new ATOM 0 HA GLN A 111 -2.966 -17.414 2.172 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -3.879 -17.538 -0.730 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -4.500 -18.521 0.580 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -5.095 -16.248 1.717 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -4.859 -15.556 0.125 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -7.197 -16.492 2.143 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -8.412 -17.087 1.006 1.00 0.00 H new ATOM 1683 N PRO A 112 -1.872 -19.594 1.467 1.00 0.00 N ATOM 1684 CA PRO A 112 -1.005 -20.753 1.236 1.00 0.00 C ATOM 1685 C PRO A 112 -1.331 -21.470 -0.069 1.00 0.00 C ATOM 1686 O PRO A 112 -2.335 -22.176 -0.166 1.00 0.00 O ATOM 1687 CB PRO A 112 -1.299 -21.660 2.433 1.00 0.00 C ATOM 1688 CG PRO A 112 -2.675 -21.285 2.864 1.00 0.00 C ATOM 1689 CD PRO A 112 -2.811 -19.815 2.580 1.00 0.00 C ATOM 0 HA PRO A 112 0.043 -20.467 1.148 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -1.244 -22.713 2.155 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -0.577 -21.504 3.234 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -3.425 -21.859 2.319 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -2.822 -21.493 3.924 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -3.832 -19.552 2.303 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -2.552 -19.212 3.450 1.00 0.00 H new ATOM 1697 N GLU A 113 -0.477 -21.285 -1.071 1.00 0.00 N ATOM 1698 CA GLU A 113 -0.677 -21.916 -2.371 1.00 0.00 C ATOM 1699 C GLU A 113 -0.611 -23.436 -2.254 1.00 0.00 C ATOM 1700 O GLU A 113 -1.582 -24.134 -2.545 1.00 0.00 O ATOM 1701 CB GLU A 113 0.374 -21.423 -3.368 1.00 0.00 C ATOM 1702 CG GLU A 113 0.222 -22.020 -4.757 1.00 0.00 C ATOM 1703 CD GLU A 113 0.425 -23.523 -4.772 1.00 0.00 C ATOM 1704 OE1 GLU A 113 1.535 -23.974 -4.418 1.00 0.00 O ATOM 1705 OE2 GLU A 113 -0.524 -24.247 -5.137 1.00 0.00 O ATOM 0 H GLU A 113 0.359 -20.704 -1.008 1.00 0.00 H new ATOM 0 HA GLU A 113 -1.668 -21.640 -2.732 1.00 0.00 H new ATOM 0 HB2 GLU A 113 0.313 -20.337 -3.440 1.00 0.00 H new ATOM 0 HB3 GLU A 113 1.366 -21.662 -2.985 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -0.771 -21.788 -5.142 1.00 0.00 H new ATOM 0 HG3 GLU A 113 0.942 -21.553 -5.430 1.00 0.00 H new ATOM 1712 N SER A 114 0.542 -23.941 -1.827 1.00 0.00 N ATOM 1713 CA SER A 114 0.738 -25.378 -1.677 1.00 0.00 C ATOM 1714 C SER A 114 -0.218 -25.950 -0.634 1.00 0.00 C ATOM 1715 O SER A 114 -0.114 -25.645 0.554 1.00 0.00 O ATOM 1716 CB SER A 114 2.184 -25.678 -1.278 1.00 0.00 C ATOM 1717 OG SER A 114 2.558 -26.990 -1.665 1.00 0.00 O ATOM 0 H SER A 114 1.354 -23.376 -1.579 1.00 0.00 H new ATOM 0 HA SER A 114 0.528 -25.851 -2.636 1.00 0.00 H new ATOM 0 HB2 SER A 114 2.851 -24.954 -1.745 1.00 0.00 H new ATOM 0 HB3 SER A 114 2.298 -25.567 -0.200 1.00 0.00 H new ATOM 0 HG SER A 114 3.487 -27.157 -1.400 1.00 0.00 H new ATOM 1723 N GLY A 115 -1.151 -26.782 -1.088 1.00 0.00 N ATOM 1724 CA GLY A 115 -2.112 -27.383 -0.183 1.00 0.00 C ATOM 1725 C GLY A 115 -2.955 -26.350 0.539 1.00 0.00 C ATOM 1726 O GLY A 115 -2.630 -25.914 1.643 1.00 0.00 O ATOM 0 H GLY A 115 -1.258 -27.050 -2.066 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -2.765 -28.052 -0.744 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -1.584 -27.993 0.550 1.00 0.00 H new ATOM 1730 N PRO A 116 -4.065 -25.941 -0.093 1.00 0.00 N ATOM 1731 CA PRO A 116 -4.979 -24.946 0.477 1.00 0.00 C ATOM 1732 C PRO A 116 -5.744 -25.485 1.680 1.00 0.00 C ATOM 1733 O PRO A 116 -6.562 -24.781 2.273 1.00 0.00 O ATOM 1734 CB PRO A 116 -5.939 -24.644 -0.677 1.00 0.00 C ATOM 1735 CG PRO A 116 -5.910 -25.869 -1.524 1.00 0.00 C ATOM 1736 CD PRO A 116 -4.514 -26.417 -1.412 1.00 0.00 C ATOM 0 HA PRO A 116 -4.448 -24.069 0.848 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -6.945 -24.439 -0.312 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -5.619 -23.766 -1.239 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -6.644 -26.598 -1.181 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -6.155 -25.633 -2.560 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -4.504 -27.505 -1.471 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -3.872 -26.048 -2.212 1.00 0.00 H new ATOM 1744 N SER A 117 -5.473 -26.736 2.036 1.00 0.00 N ATOM 1745 CA SER A 117 -6.140 -27.371 3.168 1.00 0.00 C ATOM 1746 C SER A 117 -6.401 -26.360 4.281 1.00 0.00 C ATOM 1747 O SER A 117 -7.544 -26.146 4.684 1.00 0.00 O ATOM 1748 CB SER A 117 -5.293 -28.527 3.702 1.00 0.00 C ATOM 1749 OG SER A 117 -6.009 -29.279 4.667 1.00 0.00 O ATOM 0 H SER A 117 -4.796 -27.331 1.558 1.00 0.00 H new ATOM 0 HA SER A 117 -7.098 -27.761 2.823 1.00 0.00 H new ATOM 0 HB2 SER A 117 -4.996 -29.176 2.878 1.00 0.00 H new ATOM 0 HB3 SER A 117 -4.377 -28.137 4.146 1.00 0.00 H new ATOM 0 HG SER A 117 -5.447 -30.013 4.992 1.00 0.00 H new ATOM 1755 N SER A 118 -5.332 -25.741 4.772 1.00 0.00 N ATOM 1756 CA SER A 118 -5.444 -24.756 5.841 1.00 0.00 C ATOM 1757 C SER A 118 -5.649 -23.356 5.270 1.00 0.00 C ATOM 1758 O SER A 118 -5.329 -23.092 4.112 1.00 0.00 O ATOM 1759 CB SER A 118 -4.192 -24.782 6.720 1.00 0.00 C ATOM 1760 OG SER A 118 -3.033 -24.470 5.966 1.00 0.00 O ATOM 0 H SER A 118 -4.379 -25.904 4.447 1.00 0.00 H new ATOM 0 HA SER A 118 -6.312 -25.013 6.449 1.00 0.00 H new ATOM 0 HB2 SER A 118 -4.302 -24.068 7.536 1.00 0.00 H new ATOM 0 HB3 SER A 118 -4.081 -25.768 7.172 1.00 0.00 H new ATOM 0 HG SER A 118 -2.247 -24.492 6.551 1.00 0.00 H new ATOM 1766 N GLY A 119 -6.187 -22.461 6.093 1.00 0.00 N ATOM 1767 CA GLY A 119 -6.427 -21.099 5.654 1.00 0.00 C ATOM 1768 C GLY A 119 -7.619 -20.468 6.346 1.00 0.00 C ATOM 1769 O GLY A 119 -8.669 -20.272 5.733 1.00 0.00 O ATOM 0 H GLY A 119 -6.461 -22.655 7.056 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -5.539 -20.497 5.846 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -6.591 -21.091 4.576 1.00 0.00 H new TER 1773 GLY A 119