USER MOD reduce.3.24.130724 H: found=0, std=0, add=772, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 766 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 82 SER OG : rot 180:sc= -0.0957 USER MOD Set 1.2: A 89 HIS : no HD1:sc= -0.368 K(o=-0.27,f=-0.87) USER MOD Set 1.3: A 93 SER OG : rot -167:sc= 0.192 USER MOD Single : A 1 GLY N :NH3+ -101:sc= 0.0405 (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 59:sc= 0.701 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 23:sc= 0.435 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot -100:sc= -0.22 USER MOD Single : A 27 SER OG : rot 150:sc= -0.789 USER MOD Single : A 29 CYS SG : rot 180:sc= -0.0111 USER MOD Single : A 32 ASN : amide:sc= 0.994 K(o=0.99,f=-4.5!) USER MOD Single : A 34 LYS NZ :NH3+ -157:sc= -0.03 (180deg=-0.343) USER MOD Single : A 39 ASN : amide:sc= -0.137 K(o=-0.14,f=-1.1!) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl -165:sc= -3.82 (180deg=-4.63!) USER MOD Single : A 44 SER OG : rot 0:sc= 0.234 USER MOD Single : A 46 HIS : no HD1:sc= -3.28! C(o=-3.3!,f=-6.2!) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot -78:sc= 0.21 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= -0.561 USER MOD Single : A 62 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -0.501 K(o=-0.5,f=-2.5!) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HD1:sc= -1.09 X(o=-1.1,f=-0.74) USER MOD Single : A 68 CYS SG : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -0.0214 X(o=-0.021,f=0) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 HIS : no HD1:sc= -8.75! C(o=-8.8!,f=-10!) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 165:sc= -1.02 USER MOD Single : A 88 GLN : amide:sc= -0.207 X(o=-0.21,f=-0.071) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 4.515 18.580 30.835 1.00 0.00 N ATOM 2 CA GLY A 1 4.154 18.534 29.430 1.00 0.00 C ATOM 3 C GLY A 1 3.450 17.245 29.054 1.00 0.00 C ATOM 4 O GLY A 1 3.672 16.205 29.672 1.00 0.00 O ATOM 0 H1 GLY A 1 3.827 19.165 31.351 1.00 0.00 H new ATOM 0 H2 GLY A 1 4.513 17.616 31.226 1.00 0.00 H new ATOM 0 H3 GLY A 1 5.464 18.992 30.936 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.507 19.379 29.197 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.053 18.644 28.823 1.00 0.00 H new ATOM 8 N SER A 2 2.595 17.315 28.038 1.00 0.00 N ATOM 9 CA SER A 2 1.851 16.146 27.584 1.00 0.00 C ATOM 10 C SER A 2 1.754 16.122 26.062 1.00 0.00 C ATOM 11 O SER A 2 1.433 17.130 25.433 1.00 0.00 O ATOM 12 CB SER A 2 0.449 16.138 28.196 1.00 0.00 C ATOM 13 OG SER A 2 -0.152 14.861 28.078 1.00 0.00 O ATOM 0 H SER A 2 2.401 18.168 27.514 1.00 0.00 H new ATOM 0 HA SER A 2 2.387 15.255 27.911 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.506 16.421 29.247 1.00 0.00 H new ATOM 0 HB3 SER A 2 -0.172 16.883 27.699 1.00 0.00 H new ATOM 0 HG SER A 2 -1.046 14.882 28.478 1.00 0.00 H new ATOM 19 N SER A 3 2.033 14.962 25.476 1.00 0.00 N ATOM 20 CA SER A 3 1.981 14.805 24.027 1.00 0.00 C ATOM 21 C SER A 3 1.603 13.377 23.648 1.00 0.00 C ATOM 22 O SER A 3 1.399 12.526 24.513 1.00 0.00 O ATOM 23 CB SER A 3 3.331 15.169 23.405 1.00 0.00 C ATOM 24 OG SER A 3 4.385 14.440 24.010 1.00 0.00 O ATOM 0 H SER A 3 2.297 14.117 25.982 1.00 0.00 H new ATOM 0 HA SER A 3 1.217 15.479 23.641 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.309 14.962 22.335 1.00 0.00 H new ATOM 0 HB3 SER A 3 3.511 16.238 23.520 1.00 0.00 H new ATOM 0 HG SER A 3 5.236 14.689 23.594 1.00 0.00 H new ATOM 30 N GLY A 4 1.511 13.121 22.346 1.00 0.00 N ATOM 31 CA GLY A 4 1.157 11.795 21.874 1.00 0.00 C ATOM 32 C GLY A 4 1.361 11.638 20.380 1.00 0.00 C ATOM 33 O GLY A 4 0.437 11.846 19.595 1.00 0.00 O ATOM 0 H GLY A 4 1.675 13.808 21.610 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.758 11.053 22.400 1.00 0.00 H new ATOM 0 HA3 GLY A 4 0.114 11.592 22.119 1.00 0.00 H new ATOM 37 N SER A 5 2.576 11.270 19.986 1.00 0.00 N ATOM 38 CA SER A 5 2.901 11.091 18.576 1.00 0.00 C ATOM 39 C SER A 5 2.172 9.879 18.001 1.00 0.00 C ATOM 40 O SER A 5 1.486 9.979 16.984 1.00 0.00 O ATOM 41 CB SER A 5 4.411 10.925 18.396 1.00 0.00 C ATOM 42 OG SER A 5 4.813 11.303 17.090 1.00 0.00 O ATOM 0 H SER A 5 3.352 11.090 20.624 1.00 0.00 H new ATOM 0 HA SER A 5 2.574 11.980 18.037 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.937 11.533 19.132 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.691 9.888 18.580 1.00 0.00 H new ATOM 0 HG SER A 5 5.782 11.190 17.000 1.00 0.00 H new ATOM 48 N SER A 6 2.328 8.735 18.659 1.00 0.00 N ATOM 49 CA SER A 6 1.689 7.503 18.213 1.00 0.00 C ATOM 50 C SER A 6 1.647 7.435 16.689 1.00 0.00 C ATOM 51 O SER A 6 0.620 7.099 16.100 1.00 0.00 O ATOM 52 CB SER A 6 0.272 7.405 18.779 1.00 0.00 C ATOM 53 OG SER A 6 -0.614 8.270 18.089 1.00 0.00 O ATOM 0 H SER A 6 2.892 8.636 19.503 1.00 0.00 H new ATOM 0 HA SER A 6 2.278 6.663 18.581 1.00 0.00 H new ATOM 0 HB2 SER A 6 -0.084 6.378 18.701 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.282 7.660 19.839 1.00 0.00 H new ATOM 0 HG SER A 6 -0.630 8.031 17.139 1.00 0.00 H new ATOM 59 N GLY A 7 2.772 7.755 16.057 1.00 0.00 N ATOM 60 CA GLY A 7 2.843 7.725 14.608 1.00 0.00 C ATOM 61 C GLY A 7 2.511 9.065 13.982 1.00 0.00 C ATOM 62 O GLY A 7 3.211 10.053 14.207 1.00 0.00 O ATOM 0 H GLY A 7 3.635 8.034 16.523 1.00 0.00 H new ATOM 0 HA2 GLY A 7 3.845 7.424 14.303 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.154 6.970 14.229 1.00 0.00 H new ATOM 66 N ARG A 8 1.442 9.100 13.194 1.00 0.00 N ATOM 67 CA ARG A 8 1.020 10.328 12.532 1.00 0.00 C ATOM 68 C ARG A 8 2.228 11.139 12.071 1.00 0.00 C ATOM 69 O ARG A 8 2.269 12.359 12.234 1.00 0.00 O ATOM 70 CB ARG A 8 0.156 11.169 13.473 1.00 0.00 C ATOM 71 CG ARG A 8 -0.611 12.276 12.768 1.00 0.00 C ATOM 72 CD ARG A 8 -1.432 13.097 13.751 1.00 0.00 C ATOM 73 NE ARG A 8 -1.668 14.455 13.267 1.00 0.00 N ATOM 74 CZ ARG A 8 -2.025 15.464 14.054 1.00 0.00 C ATOM 75 NH1 ARG A 8 -2.185 15.269 15.356 1.00 0.00 N ATOM 76 NH2 ARG A 8 -2.221 16.671 13.539 1.00 0.00 N ATOM 0 H ARG A 8 0.852 8.291 12.998 1.00 0.00 H new ATOM 0 HA ARG A 8 0.431 10.056 11.656 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -0.552 10.516 13.984 1.00 0.00 H new ATOM 0 HB3 ARG A 8 0.792 11.611 14.240 1.00 0.00 H new ATOM 0 HG2 ARG A 8 0.088 12.927 12.243 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -1.269 11.842 12.015 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -2.388 12.603 13.926 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -0.915 13.139 14.709 1.00 0.00 H new ATOM 0 HE ARG A 8 -1.552 14.639 12.270 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -2.034 14.343 15.755 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -2.459 16.045 15.958 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -2.098 16.825 12.538 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -2.495 17.445 14.144 1.00 0.00 H new ATOM 90 N VAL A 9 3.211 10.453 11.496 1.00 0.00 N ATOM 91 CA VAL A 9 4.419 11.109 11.011 1.00 0.00 C ATOM 92 C VAL A 9 4.909 10.472 9.716 1.00 0.00 C ATOM 93 O VAL A 9 4.942 9.248 9.587 1.00 0.00 O ATOM 94 CB VAL A 9 5.547 11.051 12.058 1.00 0.00 C ATOM 95 CG1 VAL A 9 6.028 9.621 12.246 1.00 0.00 C ATOM 96 CG2 VAL A 9 6.698 11.960 11.651 1.00 0.00 C ATOM 0 H VAL A 9 3.194 9.443 11.355 1.00 0.00 H new ATOM 0 HA VAL A 9 4.160 12.151 10.824 1.00 0.00 H new ATOM 0 HB VAL A 9 5.153 11.405 13.011 1.00 0.00 H new ATOM 0 HG11 VAL A 9 6.825 9.600 12.989 1.00 0.00 H new ATOM 0 HG12 VAL A 9 5.199 9.000 12.585 1.00 0.00 H new ATOM 0 HG13 VAL A 9 6.405 9.237 11.298 1.00 0.00 H new ATOM 0 HG21 VAL A 9 7.486 11.907 12.402 1.00 0.00 H new ATOM 0 HG22 VAL A 9 7.092 11.638 10.687 1.00 0.00 H new ATOM 0 HG23 VAL A 9 6.340 12.987 11.572 1.00 0.00 H new ATOM 106 N LYS A 10 5.289 11.310 8.757 1.00 0.00 N ATOM 107 CA LYS A 10 5.779 10.829 7.471 1.00 0.00 C ATOM 108 C LYS A 10 7.133 11.448 7.139 1.00 0.00 C ATOM 109 O LYS A 10 7.320 12.658 7.266 1.00 0.00 O ATOM 110 CB LYS A 10 4.773 11.155 6.364 1.00 0.00 C ATOM 111 CG LYS A 10 5.175 10.621 5.000 1.00 0.00 C ATOM 112 CD LYS A 10 3.977 10.504 4.072 1.00 0.00 C ATOM 113 CE LYS A 10 4.323 9.727 2.811 1.00 0.00 C ATOM 114 NZ LYS A 10 3.246 9.823 1.788 1.00 0.00 N ATOM 0 H LYS A 10 5.267 12.326 8.846 1.00 0.00 H new ATOM 0 HA LYS A 10 5.899 9.748 7.538 1.00 0.00 H new ATOM 0 HB2 LYS A 10 3.801 10.742 6.635 1.00 0.00 H new ATOM 0 HB3 LYS A 10 4.653 12.237 6.301 1.00 0.00 H new ATOM 0 HG2 LYS A 10 5.919 11.282 4.554 1.00 0.00 H new ATOM 0 HG3 LYS A 10 5.645 9.644 5.115 1.00 0.00 H new ATOM 0 HD2 LYS A 10 3.159 10.008 4.593 1.00 0.00 H new ATOM 0 HD3 LYS A 10 3.626 11.500 3.802 1.00 0.00 H new ATOM 0 HE2 LYS A 10 5.255 10.108 2.394 1.00 0.00 H new ATOM 0 HE3 LYS A 10 4.491 8.680 3.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 3.520 9.280 0.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 2.362 9.436 2.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 3.103 10.820 1.527 1.00 0.00 H new ATOM 128 N GLU A 11 8.073 10.611 6.713 1.00 0.00 N ATOM 129 CA GLU A 11 9.410 11.077 6.363 1.00 0.00 C ATOM 130 C GLU A 11 9.512 11.361 4.867 1.00 0.00 C ATOM 131 O GLU A 11 9.723 12.502 4.454 1.00 0.00 O ATOM 132 CB GLU A 11 10.459 10.040 6.769 1.00 0.00 C ATOM 133 CG GLU A 11 10.632 9.906 8.273 1.00 0.00 C ATOM 134 CD GLU A 11 10.743 11.249 8.969 1.00 0.00 C ATOM 135 OE1 GLU A 11 11.639 12.037 8.600 1.00 0.00 O ATOM 136 OE2 GLU A 11 9.935 11.511 9.884 1.00 0.00 O ATOM 0 H GLU A 11 7.934 9.607 6.602 1.00 0.00 H new ATOM 0 HA GLU A 11 9.598 12.004 6.905 1.00 0.00 H new ATOM 0 HB2 GLU A 11 10.178 9.071 6.356 1.00 0.00 H new ATOM 0 HB3 GLU A 11 11.417 10.311 6.324 1.00 0.00 H new ATOM 0 HG2 GLU A 11 9.786 9.356 8.685 1.00 0.00 H new ATOM 0 HG3 GLU A 11 11.526 9.318 8.481 1.00 0.00 H new ATOM 143 N SER A 12 9.362 10.316 4.060 1.00 0.00 N ATOM 144 CA SER A 12 9.442 10.451 2.610 1.00 0.00 C ATOM 145 C SER A 12 8.371 11.408 2.094 1.00 0.00 C ATOM 146 O SER A 12 7.278 11.493 2.654 1.00 0.00 O ATOM 147 CB SER A 12 9.287 9.084 1.940 1.00 0.00 C ATOM 148 OG SER A 12 7.938 8.650 1.974 1.00 0.00 O ATOM 0 H SER A 12 9.184 9.366 4.386 1.00 0.00 H new ATOM 0 HA SER A 12 10.421 10.860 2.361 1.00 0.00 H new ATOM 0 HB2 SER A 12 9.628 9.141 0.906 1.00 0.00 H new ATOM 0 HB3 SER A 12 9.920 8.354 2.445 1.00 0.00 H new ATOM 0 HG SER A 12 7.865 7.775 1.538 1.00 0.00 H new ATOM 154 N ILE A 13 8.694 12.125 1.023 1.00 0.00 N ATOM 155 CA ILE A 13 7.761 13.074 0.430 1.00 0.00 C ATOM 156 C ILE A 13 7.784 12.990 -1.092 1.00 0.00 C ATOM 157 O ILE A 13 8.833 13.143 -1.718 1.00 0.00 O ATOM 158 CB ILE A 13 8.079 14.519 0.858 1.00 0.00 C ATOM 159 CG1 ILE A 13 8.230 14.602 2.379 1.00 0.00 C ATOM 160 CG2 ILE A 13 6.992 15.467 0.375 1.00 0.00 C ATOM 161 CD1 ILE A 13 6.918 14.799 3.106 1.00 0.00 C ATOM 0 H ILE A 13 9.595 12.066 0.548 1.00 0.00 H new ATOM 0 HA ILE A 13 6.768 12.807 0.791 1.00 0.00 H new ATOM 0 HB ILE A 13 9.022 14.818 0.401 1.00 0.00 H new ATOM 0 HG12 ILE A 13 8.702 13.688 2.740 1.00 0.00 H new ATOM 0 HG13 ILE A 13 8.900 15.426 2.625 1.00 0.00 H new ATOM 0 HG21 ILE A 13 7.232 16.484 0.686 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.929 15.425 -0.712 1.00 0.00 H new ATOM 0 HG23 ILE A 13 6.035 15.172 0.805 1.00 0.00 H new ATOM 0 HD11 ILE A 13 7.101 14.849 4.179 1.00 0.00 H new ATOM 0 HD12 ILE A 13 6.454 15.727 2.773 1.00 0.00 H new ATOM 0 HD13 ILE A 13 6.253 13.963 2.890 1.00 0.00 H new ATOM 173 N THR A 14 6.618 12.747 -1.684 1.00 0.00 N ATOM 174 CA THR A 14 6.504 12.644 -3.133 1.00 0.00 C ATOM 175 C THR A 14 7.662 11.845 -3.720 1.00 0.00 C ATOM 176 O THR A 14 8.126 12.128 -4.825 1.00 0.00 O ATOM 177 CB THR A 14 6.466 14.034 -3.795 1.00 0.00 C ATOM 178 OG1 THR A 14 7.583 14.816 -3.355 1.00 0.00 O ATOM 179 CG2 THR A 14 5.171 14.758 -3.459 1.00 0.00 C ATOM 0 H THR A 14 5.740 12.618 -1.182 1.00 0.00 H new ATOM 0 HA THR A 14 5.567 12.127 -3.340 1.00 0.00 H new ATOM 0 HB THR A 14 6.519 13.900 -4.875 1.00 0.00 H new ATOM 0 HG1 THR A 14 8.299 14.221 -3.050 1.00 0.00 H new ATOM 0 HG21 THR A 14 5.167 15.737 -3.938 1.00 0.00 H new ATOM 0 HG22 THR A 14 4.324 14.174 -3.819 1.00 0.00 H new ATOM 0 HG23 THR A 14 5.093 14.882 -2.379 1.00 0.00 H new ATOM 187 N ARG A 15 8.124 10.846 -2.975 1.00 0.00 N ATOM 188 CA ARG A 15 9.228 10.007 -3.423 1.00 0.00 C ATOM 189 C ARG A 15 8.732 8.619 -3.817 1.00 0.00 C ATOM 190 O ARG A 15 8.612 7.727 -2.977 1.00 0.00 O ATOM 191 CB ARG A 15 10.285 9.888 -2.322 1.00 0.00 C ATOM 192 CG ARG A 15 11.239 11.070 -2.264 1.00 0.00 C ATOM 193 CD ARG A 15 12.590 10.667 -1.695 1.00 0.00 C ATOM 194 NE ARG A 15 12.549 10.514 -0.243 1.00 0.00 N ATOM 195 CZ ARG A 15 13.624 10.589 0.534 1.00 0.00 C ATOM 196 NH1 ARG A 15 14.817 10.814 0.002 1.00 0.00 N ATOM 197 NH2 ARG A 15 13.506 10.440 1.848 1.00 0.00 N ATOM 0 H ARG A 15 7.751 10.598 -2.059 1.00 0.00 H new ATOM 0 HA ARG A 15 9.675 10.476 -4.299 1.00 0.00 H new ATOM 0 HB2 ARG A 15 9.785 9.788 -1.359 1.00 0.00 H new ATOM 0 HB3 ARG A 15 10.860 8.975 -2.479 1.00 0.00 H new ATOM 0 HG2 ARG A 15 11.372 11.481 -3.265 1.00 0.00 H new ATOM 0 HG3 ARG A 15 10.805 11.859 -1.650 1.00 0.00 H new ATOM 0 HD2 ARG A 15 12.909 9.729 -2.149 1.00 0.00 H new ATOM 0 HD3 ARG A 15 13.334 11.419 -1.959 1.00 0.00 H new ATOM 0 HE ARG A 15 11.646 10.340 0.198 1.00 0.00 H new ATOM 0 HH11 ARG A 15 14.912 10.930 -1.007 1.00 0.00 H new ATOM 0 HH12 ARG A 15 15.640 10.871 0.602 1.00 0.00 H new ATOM 0 HH21 ARG A 15 12.590 10.268 2.261 1.00 0.00 H new ATOM 0 HH22 ARG A 15 14.332 10.498 2.444 1.00 0.00 H new ATOM 211 N THR A 16 8.442 8.444 -5.103 1.00 0.00 N ATOM 212 CA THR A 16 7.956 7.166 -5.610 1.00 0.00 C ATOM 213 C THR A 16 8.914 6.585 -6.643 1.00 0.00 C ATOM 214 O THR A 16 9.817 7.271 -7.122 1.00 0.00 O ATOM 215 CB THR A 16 6.559 7.307 -6.243 1.00 0.00 C ATOM 216 OG1 THR A 16 6.616 8.201 -7.360 1.00 0.00 O ATOM 217 CG2 THR A 16 5.553 7.823 -5.224 1.00 0.00 C ATOM 0 H THR A 16 8.535 9.171 -5.812 1.00 0.00 H new ATOM 0 HA THR A 16 7.893 6.491 -4.757 1.00 0.00 H new ATOM 0 HB THR A 16 6.236 6.323 -6.582 1.00 0.00 H new ATOM 0 HG1 THR A 16 5.724 8.284 -7.758 1.00 0.00 H new ATOM 0 HG21 THR A 16 4.574 7.915 -5.694 1.00 0.00 H new ATOM 0 HG22 THR A 16 5.491 7.126 -4.389 1.00 0.00 H new ATOM 0 HG23 THR A 16 5.873 8.799 -4.859 1.00 0.00 H new ATOM 225 N SER A 17 8.710 5.316 -6.985 1.00 0.00 N ATOM 226 CA SER A 17 9.558 4.642 -7.960 1.00 0.00 C ATOM 227 C SER A 17 8.755 4.243 -9.195 1.00 0.00 C ATOM 228 O SER A 17 7.541 4.441 -9.249 1.00 0.00 O ATOM 229 CB SER A 17 10.204 3.403 -7.336 1.00 0.00 C ATOM 230 OG SER A 17 11.216 3.766 -6.413 1.00 0.00 O ATOM 0 H SER A 17 7.965 4.735 -6.601 1.00 0.00 H new ATOM 0 HA SER A 17 10.341 5.337 -8.265 1.00 0.00 H new ATOM 0 HB2 SER A 17 9.443 2.808 -6.831 1.00 0.00 H new ATOM 0 HB3 SER A 17 10.630 2.777 -8.120 1.00 0.00 H new ATOM 0 HG SER A 17 11.612 2.957 -6.027 1.00 0.00 H new ATOM 236 N ARG A 18 9.442 3.681 -10.184 1.00 0.00 N ATOM 237 CA ARG A 18 8.794 3.255 -11.418 1.00 0.00 C ATOM 238 C ARG A 18 8.485 1.761 -11.384 1.00 0.00 C ATOM 239 O ARG A 18 9.225 0.978 -10.788 1.00 0.00 O ATOM 240 CB ARG A 18 9.682 3.575 -12.622 1.00 0.00 C ATOM 241 CG ARG A 18 11.023 2.861 -12.597 1.00 0.00 C ATOM 242 CD ARG A 18 11.634 2.775 -13.987 1.00 0.00 C ATOM 243 NE ARG A 18 10.991 1.752 -14.806 1.00 0.00 N ATOM 244 CZ ARG A 18 11.068 0.450 -14.551 1.00 0.00 C ATOM 245 NH1 ARG A 18 11.757 0.016 -13.505 1.00 0.00 N ATOM 246 NH2 ARG A 18 10.455 -0.420 -15.343 1.00 0.00 N ATOM 0 H ARG A 18 10.447 3.510 -10.155 1.00 0.00 H new ATOM 0 HA ARG A 18 7.855 3.800 -11.512 1.00 0.00 H new ATOM 0 HB2 ARG A 18 9.153 3.304 -13.535 1.00 0.00 H new ATOM 0 HB3 ARG A 18 9.853 4.651 -12.660 1.00 0.00 H new ATOM 0 HG2 ARG A 18 11.705 3.389 -11.930 1.00 0.00 H new ATOM 0 HG3 ARG A 18 10.895 1.857 -12.192 1.00 0.00 H new ATOM 0 HD2 ARG A 18 11.547 3.742 -14.481 1.00 0.00 H new ATOM 0 HD3 ARG A 18 12.698 2.555 -13.902 1.00 0.00 H new ATOM 0 HE ARG A 18 10.453 2.053 -15.619 1.00 0.00 H new ATOM 0 HH11 ARG A 18 12.230 0.682 -12.894 1.00 0.00 H new ATOM 0 HH12 ARG A 18 11.815 -0.984 -13.311 1.00 0.00 H new ATOM 0 HH21 ARG A 18 9.924 -0.090 -16.149 1.00 0.00 H new ATOM 0 HH22 ARG A 18 10.515 -1.419 -15.146 1.00 0.00 H new ATOM 260 N ALA A 19 7.388 1.373 -12.026 1.00 0.00 N ATOM 261 CA ALA A 19 6.983 -0.026 -12.069 1.00 0.00 C ATOM 262 C ALA A 19 5.770 -0.219 -12.973 1.00 0.00 C ATOM 263 O ALA A 19 4.882 0.630 -13.050 1.00 0.00 O ATOM 264 CB ALA A 19 6.684 -0.533 -10.666 1.00 0.00 C ATOM 0 H ALA A 19 6.764 2.008 -12.523 1.00 0.00 H new ATOM 0 HA ALA A 19 7.808 -0.604 -12.484 1.00 0.00 H new ATOM 0 HB1 ALA A 19 6.383 -1.579 -10.714 1.00 0.00 H new ATOM 0 HB2 ALA A 19 7.577 -0.440 -10.048 1.00 0.00 H new ATOM 0 HB3 ALA A 19 5.878 0.057 -10.230 1.00 0.00 H new ATOM 270 N PRO A 20 5.730 -1.360 -13.676 1.00 0.00 N ATOM 271 CA PRO A 20 4.631 -1.690 -14.588 1.00 0.00 C ATOM 272 C PRO A 20 3.332 -1.986 -13.847 1.00 0.00 C ATOM 273 O PRO A 20 2.310 -2.291 -14.462 1.00 0.00 O ATOM 274 CB PRO A 20 5.133 -2.944 -15.309 1.00 0.00 C ATOM 275 CG PRO A 20 6.106 -3.560 -14.365 1.00 0.00 C ATOM 276 CD PRO A 20 6.755 -2.417 -13.634 1.00 0.00 C ATOM 0 HA PRO A 20 4.394 -0.863 -15.257 1.00 0.00 H new ATOM 0 HB2 PRO A 20 4.313 -3.626 -15.534 1.00 0.00 H new ATOM 0 HB3 PRO A 20 5.607 -2.692 -16.258 1.00 0.00 H new ATOM 0 HG2 PRO A 20 5.603 -4.232 -13.670 1.00 0.00 H new ATOM 0 HG3 PRO A 20 6.848 -4.152 -14.901 1.00 0.00 H new ATOM 0 HD2 PRO A 20 7.011 -2.688 -12.610 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.678 -2.101 -14.120 1.00 0.00 H new ATOM 284 N SER A 21 3.378 -1.895 -12.521 1.00 0.00 N ATOM 285 CA SER A 21 2.205 -2.156 -11.696 1.00 0.00 C ATOM 286 C SER A 21 1.132 -1.096 -11.925 1.00 0.00 C ATOM 287 O SER A 21 1.264 0.044 -11.479 1.00 0.00 O ATOM 288 CB SER A 21 2.594 -2.193 -10.217 1.00 0.00 C ATOM 289 OG SER A 21 3.519 -3.234 -9.958 1.00 0.00 O ATOM 0 H SER A 21 4.215 -1.642 -11.996 1.00 0.00 H new ATOM 0 HA SER A 21 1.799 -3.126 -11.982 1.00 0.00 H new ATOM 0 HB2 SER A 21 3.029 -1.236 -9.928 1.00 0.00 H new ATOM 0 HB3 SER A 21 1.702 -2.335 -9.607 1.00 0.00 H new ATOM 0 HG SER A 21 3.753 -3.235 -9.006 1.00 0.00 H new ATOM 295 N VAL A 22 0.069 -1.480 -12.624 1.00 0.00 N ATOM 296 CA VAL A 22 -1.028 -0.565 -12.913 1.00 0.00 C ATOM 297 C VAL A 22 -2.274 -0.930 -12.114 1.00 0.00 C ATOM 298 O VAL A 22 -2.357 -2.013 -11.534 1.00 0.00 O ATOM 299 CB VAL A 22 -1.377 -0.561 -14.413 1.00 0.00 C ATOM 300 CG1 VAL A 22 -0.488 0.417 -15.166 1.00 0.00 C ATOM 301 CG2 VAL A 22 -1.251 -1.963 -14.992 1.00 0.00 C ATOM 0 H VAL A 22 -0.056 -2.420 -13.001 1.00 0.00 H new ATOM 0 HA VAL A 22 -0.693 0.431 -12.623 1.00 0.00 H new ATOM 0 HB VAL A 22 -2.411 -0.236 -14.527 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -0.749 0.406 -16.224 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -0.632 1.421 -14.767 1.00 0.00 H new ATOM 0 HG13 VAL A 22 0.556 0.126 -15.047 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -1.501 -1.942 -16.053 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -0.228 -2.318 -14.867 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -1.934 -2.634 -14.471 1.00 0.00 H new ATOM 311 N ALA A 23 -3.242 -0.020 -12.089 1.00 0.00 N ATOM 312 CA ALA A 23 -4.486 -0.248 -11.363 1.00 0.00 C ATOM 313 C ALA A 23 -5.655 0.457 -12.042 1.00 0.00 C ATOM 314 O ALA A 23 -5.461 1.318 -12.901 1.00 0.00 O ATOM 315 CB ALA A 23 -4.349 0.221 -9.922 1.00 0.00 C ATOM 0 H ALA A 23 -3.189 0.882 -12.563 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.690 -1.319 -11.367 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -5.285 0.045 -9.392 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -3.546 -0.332 -9.434 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -4.118 1.286 -9.906 1.00 0.00 H new ATOM 321 N THR A 24 -6.871 0.087 -11.652 1.00 0.00 N ATOM 322 CA THR A 24 -8.071 0.682 -12.225 1.00 0.00 C ATOM 323 C THR A 24 -9.001 1.202 -11.134 1.00 0.00 C ATOM 324 O THR A 24 -8.721 1.057 -9.944 1.00 0.00 O ATOM 325 CB THR A 24 -8.838 -0.328 -13.099 1.00 0.00 C ATOM 326 OG1 THR A 24 -10.007 0.288 -13.651 1.00 0.00 O ATOM 327 CG2 THR A 24 -9.239 -1.551 -12.287 1.00 0.00 C ATOM 0 H THR A 24 -7.050 -0.622 -10.941 1.00 0.00 H new ATOM 0 HA THR A 24 -7.744 1.514 -12.848 1.00 0.00 H new ATOM 0 HB THR A 24 -8.180 -0.647 -13.908 1.00 0.00 H new ATOM 0 HG1 THR A 24 -10.793 0.027 -13.127 1.00 0.00 H new ATOM 0 HG21 THR A 24 -9.779 -2.250 -12.925 1.00 0.00 H new ATOM 0 HG22 THR A 24 -8.345 -2.035 -11.893 1.00 0.00 H new ATOM 0 HG23 THR A 24 -9.880 -1.245 -11.460 1.00 0.00 H new ATOM 335 N VAL A 25 -10.111 1.806 -11.547 1.00 0.00 N ATOM 336 CA VAL A 25 -11.084 2.346 -10.605 1.00 0.00 C ATOM 337 C VAL A 25 -12.463 1.736 -10.830 1.00 0.00 C ATOM 338 O VAL A 25 -12.938 1.651 -11.962 1.00 0.00 O ATOM 339 CB VAL A 25 -11.186 3.878 -10.720 1.00 0.00 C ATOM 340 CG1 VAL A 25 -11.520 4.286 -12.147 1.00 0.00 C ATOM 341 CG2 VAL A 25 -12.224 4.417 -9.747 1.00 0.00 C ATOM 0 H VAL A 25 -10.359 1.934 -12.528 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.735 2.088 -9.605 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.219 4.309 -10.461 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.588 5.372 -12.208 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -10.738 3.933 -12.819 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -12.474 3.846 -12.437 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -12.283 5.501 -9.842 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -13.196 3.980 -9.973 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -11.937 4.157 -8.728 1.00 0.00 H new ATOM 351 N GLY A 26 -13.102 1.315 -9.743 1.00 0.00 N ATOM 352 CA GLY A 26 -14.422 0.719 -9.843 1.00 0.00 C ATOM 353 C GLY A 26 -14.368 -0.788 -10.001 1.00 0.00 C ATOM 354 O GLY A 26 -15.217 -1.380 -10.666 1.00 0.00 O ATOM 0 H GLY A 26 -12.730 1.376 -8.795 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -14.998 0.967 -8.951 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -14.949 1.152 -10.693 1.00 0.00 H new ATOM 358 N SER A 27 -13.365 -1.409 -9.388 1.00 0.00 N ATOM 359 CA SER A 27 -13.199 -2.856 -9.468 1.00 0.00 C ATOM 360 C SER A 27 -12.502 -3.393 -8.222 1.00 0.00 C ATOM 361 O SER A 27 -11.744 -2.678 -7.565 1.00 0.00 O ATOM 362 CB SER A 27 -12.398 -3.231 -10.716 1.00 0.00 C ATOM 363 OG SER A 27 -11.009 -3.036 -10.508 1.00 0.00 O ATOM 0 H SER A 27 -12.655 -0.933 -8.831 1.00 0.00 H new ATOM 0 HA SER A 27 -14.189 -3.307 -9.532 1.00 0.00 H new ATOM 0 HB2 SER A 27 -12.588 -4.273 -10.974 1.00 0.00 H new ATOM 0 HB3 SER A 27 -12.731 -2.628 -11.561 1.00 0.00 H new ATOM 0 HG SER A 27 -10.504 -3.678 -11.049 1.00 0.00 H new ATOM 369 N ILE A 28 -12.765 -4.655 -7.902 1.00 0.00 N ATOM 370 CA ILE A 28 -12.163 -5.289 -6.736 1.00 0.00 C ATOM 371 C ILE A 28 -10.723 -5.706 -7.018 1.00 0.00 C ATOM 372 O ILE A 28 -10.477 -6.732 -7.654 1.00 0.00 O ATOM 373 CB ILE A 28 -12.965 -6.525 -6.289 1.00 0.00 C ATOM 374 CG1 ILE A 28 -14.375 -6.116 -5.858 1.00 0.00 C ATOM 375 CG2 ILE A 28 -12.246 -7.243 -5.157 1.00 0.00 C ATOM 376 CD1 ILE A 28 -15.286 -7.291 -5.579 1.00 0.00 C ATOM 0 H ILE A 28 -13.391 -5.259 -8.434 1.00 0.00 H new ATOM 0 HA ILE A 28 -12.175 -4.550 -5.935 1.00 0.00 H new ATOM 0 HB ILE A 28 -13.048 -7.211 -7.132 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -14.308 -5.498 -4.963 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -14.820 -5.499 -6.638 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -12.826 -8.114 -4.852 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -11.261 -7.563 -5.497 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -12.135 -6.567 -4.309 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -16.268 -6.926 -5.279 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -15.384 -7.898 -6.479 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -14.863 -7.897 -4.778 1.00 0.00 H new ATOM 388 N CYS A 29 -9.777 -4.905 -6.542 1.00 0.00 N ATOM 389 CA CYS A 29 -8.361 -5.191 -6.742 1.00 0.00 C ATOM 390 C CYS A 29 -7.834 -6.120 -5.653 1.00 0.00 C ATOM 391 O CYS A 29 -8.195 -5.989 -4.483 1.00 0.00 O ATOM 392 CB CYS A 29 -7.553 -3.892 -6.755 1.00 0.00 C ATOM 393 SG CYS A 29 -5.779 -4.128 -7.007 1.00 0.00 S ATOM 0 H CYS A 29 -9.965 -4.052 -6.015 1.00 0.00 H new ATOM 0 HA CYS A 29 -8.250 -5.689 -7.705 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -7.938 -3.245 -7.543 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -7.709 -3.371 -5.811 1.00 0.00 H new ATOM 0 HG CYS A 29 -5.183 -2.973 -7.005 1.00 0.00 H new ATOM 399 N ASP A 30 -6.981 -7.060 -6.046 1.00 0.00 N ATOM 400 CA ASP A 30 -6.406 -8.012 -5.104 1.00 0.00 C ATOM 401 C ASP A 30 -4.960 -7.648 -4.778 1.00 0.00 C ATOM 402 O ASP A 30 -4.062 -7.829 -5.601 1.00 0.00 O ATOM 403 CB ASP A 30 -6.471 -9.430 -5.674 1.00 0.00 C ATOM 404 CG ASP A 30 -6.222 -9.464 -7.169 1.00 0.00 C ATOM 405 OD1 ASP A 30 -7.054 -8.917 -7.923 1.00 0.00 O ATOM 406 OD2 ASP A 30 -5.194 -10.038 -7.586 1.00 0.00 O ATOM 0 H ASP A 30 -6.673 -7.183 -7.011 1.00 0.00 H new ATOM 0 HA ASP A 30 -6.989 -7.972 -4.184 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -5.733 -10.055 -5.171 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -7.450 -9.859 -5.462 1.00 0.00 H new ATOM 411 N LEU A 31 -4.743 -7.133 -3.573 1.00 0.00 N ATOM 412 CA LEU A 31 -3.407 -6.742 -3.137 1.00 0.00 C ATOM 413 C LEU A 31 -2.770 -7.835 -2.285 1.00 0.00 C ATOM 414 O LEU A 31 -3.092 -7.984 -1.107 1.00 0.00 O ATOM 415 CB LEU A 31 -3.469 -5.434 -2.347 1.00 0.00 C ATOM 416 CG LEU A 31 -2.131 -4.736 -2.099 1.00 0.00 C ATOM 417 CD1 LEU A 31 -1.725 -3.915 -3.313 1.00 0.00 C ATOM 418 CD2 LEU A 31 -2.211 -3.855 -0.860 1.00 0.00 C ATOM 0 H LEU A 31 -5.475 -6.976 -2.880 1.00 0.00 H new ATOM 0 HA LEU A 31 -2.791 -6.594 -4.024 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -4.124 -4.743 -2.878 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -3.934 -5.637 -1.383 1.00 0.00 H new ATOM 0 HG LEU A 31 -1.371 -5.498 -1.930 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -0.771 -3.425 -3.119 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -1.627 -4.570 -4.179 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -2.486 -3.160 -3.513 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -1.250 -3.366 -0.699 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -2.984 -3.099 -1.000 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -2.456 -4.468 0.007 1.00 0.00 H new ATOM 430 N ASN A 32 -1.862 -8.596 -2.889 1.00 0.00 N ATOM 431 CA ASN A 32 -1.179 -9.675 -2.185 1.00 0.00 C ATOM 432 C ASN A 32 0.040 -9.147 -1.433 1.00 0.00 C ATOM 433 O ASN A 32 0.868 -8.430 -1.996 1.00 0.00 O ATOM 434 CB ASN A 32 -0.751 -10.765 -3.170 1.00 0.00 C ATOM 435 CG ASN A 32 -0.060 -10.198 -4.395 1.00 0.00 C ATOM 436 OD1 ASN A 32 -0.607 -9.340 -5.089 1.00 0.00 O ATOM 437 ND2 ASN A 32 1.148 -10.676 -4.667 1.00 0.00 N ATOM 0 H ASN A 32 -1.583 -8.485 -3.864 1.00 0.00 H new ATOM 0 HA ASN A 32 -1.875 -10.101 -1.462 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -0.080 -11.462 -2.668 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -1.627 -11.334 -3.481 1.00 0.00 H new ATOM 0 HD21 ASN A 32 1.661 -10.333 -5.479 1.00 0.00 H new ATOM 0 HD22 ASN A 32 1.563 -11.387 -4.064 1.00 0.00 H new ATOM 444 N LEU A 33 0.143 -9.507 -0.159 1.00 0.00 N ATOM 445 CA LEU A 33 1.260 -9.071 0.672 1.00 0.00 C ATOM 446 C LEU A 33 1.834 -10.238 1.469 1.00 0.00 C ATOM 447 O LEU A 33 1.123 -10.893 2.231 1.00 0.00 O ATOM 448 CB LEU A 33 0.812 -7.960 1.623 1.00 0.00 C ATOM 449 CG LEU A 33 -0.056 -6.861 1.009 1.00 0.00 C ATOM 450 CD1 LEU A 33 -0.958 -6.241 2.065 1.00 0.00 C ATOM 451 CD2 LEU A 33 0.814 -5.797 0.356 1.00 0.00 C ATOM 0 H LEU A 33 -0.534 -10.100 0.322 1.00 0.00 H new ATOM 0 HA LEU A 33 2.040 -8.685 0.015 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.260 -8.414 2.446 1.00 0.00 H new ATOM 0 HB3 LEU A 33 1.700 -7.497 2.052 1.00 0.00 H new ATOM 0 HG LEU A 33 -0.686 -7.309 0.240 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -1.568 -5.461 1.610 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -1.606 -7.009 2.486 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -0.347 -5.808 2.857 1.00 0.00 H new ATOM 0 HD21 LEU A 33 0.180 -5.023 -0.076 1.00 0.00 H new ATOM 0 HD22 LEU A 33 1.470 -5.353 1.105 1.00 0.00 H new ATOM 0 HD23 LEU A 33 1.417 -6.252 -0.430 1.00 0.00 H new ATOM 463 N LYS A 34 3.126 -10.492 1.290 1.00 0.00 N ATOM 464 CA LYS A 34 3.798 -11.577 1.994 1.00 0.00 C ATOM 465 C LYS A 34 4.068 -11.198 3.447 1.00 0.00 C ATOM 466 O LYS A 34 5.134 -10.676 3.774 1.00 0.00 O ATOM 467 CB LYS A 34 5.113 -11.930 1.295 1.00 0.00 C ATOM 468 CG LYS A 34 4.936 -12.365 -0.149 1.00 0.00 C ATOM 469 CD LYS A 34 4.373 -13.773 -0.242 1.00 0.00 C ATOM 470 CE LYS A 34 5.479 -14.817 -0.239 1.00 0.00 C ATOM 471 NZ LYS A 34 6.288 -14.773 -1.488 1.00 0.00 N ATOM 0 H LYS A 34 3.729 -9.960 0.662 1.00 0.00 H new ATOM 0 HA LYS A 34 3.142 -12.447 1.980 1.00 0.00 H new ATOM 0 HB2 LYS A 34 5.775 -11.065 1.327 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.606 -12.729 1.849 1.00 0.00 H new ATOM 0 HG2 LYS A 34 4.269 -11.671 -0.660 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.896 -12.321 -0.663 1.00 0.00 H new ATOM 0 HD2 LYS A 34 3.699 -13.953 0.596 1.00 0.00 H new ATOM 0 HD3 LYS A 34 3.782 -13.870 -1.153 1.00 0.00 H new ATOM 0 HE2 LYS A 34 6.129 -14.654 0.621 1.00 0.00 H new ATOM 0 HE3 LYS A 34 5.042 -15.809 -0.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 6.749 -15.694 -1.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 5.668 -14.563 -2.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 7.013 -14.032 -1.406 1.00 0.00 H new ATOM 485 N ILE A 35 3.097 -11.465 4.314 1.00 0.00 N ATOM 486 CA ILE A 35 3.232 -11.154 5.731 1.00 0.00 C ATOM 487 C ILE A 35 3.581 -12.400 6.537 1.00 0.00 C ATOM 488 O ILE A 35 3.045 -13.485 6.312 1.00 0.00 O ATOM 489 CB ILE A 35 1.940 -10.535 6.297 1.00 0.00 C ATOM 490 CG1 ILE A 35 1.607 -9.234 5.564 1.00 0.00 C ATOM 491 CG2 ILE A 35 2.083 -10.285 7.791 1.00 0.00 C ATOM 492 CD1 ILE A 35 0.149 -8.844 5.657 1.00 0.00 C ATOM 0 H ILE A 35 2.208 -11.896 4.059 1.00 0.00 H new ATOM 0 HA ILE A 35 4.041 -10.429 5.819 1.00 0.00 H new ATOM 0 HB ILE A 35 1.121 -11.237 6.142 1.00 0.00 H new ATOM 0 HG12 ILE A 35 2.217 -8.429 5.974 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.881 -9.338 4.514 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.162 -9.847 8.176 1.00 0.00 H new ATOM 0 HG22 ILE A 35 2.278 -11.229 8.301 1.00 0.00 H new ATOM 0 HG23 ILE A 35 2.912 -9.600 7.968 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -0.014 -7.913 5.115 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.467 -9.630 5.220 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.125 -8.708 6.703 1.00 0.00 H new ATOM 504 N PRO A 36 4.501 -12.244 7.500 1.00 0.00 N ATOM 505 CA PRO A 36 4.941 -13.345 8.361 1.00 0.00 C ATOM 506 C PRO A 36 3.855 -13.790 9.335 1.00 0.00 C ATOM 507 O PRO A 36 2.683 -13.452 9.168 1.00 0.00 O ATOM 508 CB PRO A 36 6.129 -12.749 9.121 1.00 0.00 C ATOM 509 CG PRO A 36 5.880 -11.281 9.121 1.00 0.00 C ATOM 510 CD PRO A 36 5.182 -10.979 7.824 1.00 0.00 C ATOM 0 HA PRO A 36 5.189 -14.237 7.786 1.00 0.00 H new ATOM 0 HB2 PRO A 36 6.186 -13.141 10.137 1.00 0.00 H new ATOM 0 HB3 PRO A 36 7.073 -12.990 8.632 1.00 0.00 H new ATOM 0 HG2 PRO A 36 5.265 -10.990 9.972 1.00 0.00 H new ATOM 0 HG3 PRO A 36 6.815 -10.727 9.199 1.00 0.00 H new ATOM 0 HD2 PRO A 36 4.474 -10.157 7.931 1.00 0.00 H new ATOM 0 HD3 PRO A 36 5.888 -10.692 7.045 1.00 0.00 H new ATOM 518 N GLU A 37 4.252 -14.549 10.352 1.00 0.00 N ATOM 519 CA GLU A 37 3.310 -15.039 11.351 1.00 0.00 C ATOM 520 C GLU A 37 2.388 -13.919 11.826 1.00 0.00 C ATOM 521 O GLU A 37 1.302 -14.174 12.346 1.00 0.00 O ATOM 522 CB GLU A 37 4.062 -15.635 12.543 1.00 0.00 C ATOM 523 CG GLU A 37 4.448 -17.092 12.352 1.00 0.00 C ATOM 524 CD GLU A 37 3.267 -17.964 11.976 1.00 0.00 C ATOM 525 OE1 GLU A 37 2.407 -18.208 12.847 1.00 0.00 O ATOM 526 OE2 GLU A 37 3.203 -18.403 10.808 1.00 0.00 O ATOM 0 H GLU A 37 5.218 -14.837 10.505 1.00 0.00 H new ATOM 0 HA GLU A 37 2.701 -15.816 10.889 1.00 0.00 H new ATOM 0 HB2 GLU A 37 4.964 -15.050 12.723 1.00 0.00 H new ATOM 0 HB3 GLU A 37 3.441 -15.546 13.435 1.00 0.00 H new ATOM 0 HG2 GLU A 37 5.209 -17.163 11.575 1.00 0.00 H new ATOM 0 HG3 GLU A 37 4.895 -17.469 13.272 1.00 0.00 H new ATOM 533 N ILE A 38 2.830 -12.680 11.643 1.00 0.00 N ATOM 534 CA ILE A 38 2.045 -11.521 12.051 1.00 0.00 C ATOM 535 C ILE A 38 0.555 -11.765 11.841 1.00 0.00 C ATOM 536 O ILE A 38 0.118 -12.088 10.737 1.00 0.00 O ATOM 537 CB ILE A 38 2.462 -10.257 11.276 1.00 0.00 C ATOM 538 CG1 ILE A 38 3.834 -9.771 11.748 1.00 0.00 C ATOM 539 CG2 ILE A 38 1.419 -9.163 11.447 1.00 0.00 C ATOM 540 CD1 ILE A 38 4.449 -8.726 10.844 1.00 0.00 C ATOM 0 H ILE A 38 3.727 -12.452 11.215 1.00 0.00 H new ATOM 0 HA ILE A 38 2.239 -11.366 13.112 1.00 0.00 H new ATOM 0 HB ILE A 38 2.531 -10.505 10.217 1.00 0.00 H new ATOM 0 HG12 ILE A 38 3.739 -9.360 12.753 1.00 0.00 H new ATOM 0 HG13 ILE A 38 4.509 -10.624 11.815 1.00 0.00 H new ATOM 0 HG21 ILE A 38 1.728 -8.276 10.894 1.00 0.00 H new ATOM 0 HG22 ILE A 38 0.459 -9.512 11.066 1.00 0.00 H new ATOM 0 HG23 ILE A 38 1.321 -8.915 12.504 1.00 0.00 H new ATOM 0 HD11 ILE A 38 5.420 -8.428 11.240 1.00 0.00 H new ATOM 0 HD12 ILE A 38 4.577 -9.140 9.844 1.00 0.00 H new ATOM 0 HD13 ILE A 38 3.794 -7.856 10.796 1.00 0.00 H new ATOM 552 N ASN A 39 -0.222 -11.606 12.908 1.00 0.00 N ATOM 553 CA ASN A 39 -1.665 -11.808 12.840 1.00 0.00 C ATOM 554 C ASN A 39 -2.338 -10.670 12.078 1.00 0.00 C ATOM 555 O ASN A 39 -1.853 -9.539 12.076 1.00 0.00 O ATOM 556 CB ASN A 39 -2.253 -11.912 14.248 1.00 0.00 C ATOM 557 CG ASN A 39 -3.496 -12.779 14.293 1.00 0.00 C ATOM 558 OD1 ASN A 39 -3.598 -13.775 13.576 1.00 0.00 O ATOM 559 ND2 ASN A 39 -4.449 -12.403 15.138 1.00 0.00 N ATOM 0 H ASN A 39 0.123 -11.338 13.830 1.00 0.00 H new ATOM 0 HA ASN A 39 -1.852 -12.740 12.306 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -1.502 -12.323 14.923 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -2.496 -10.914 14.612 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -5.309 -12.947 15.212 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -4.321 -11.570 15.713 1.00 0.00 H new ATOM 566 N SER A 40 -3.458 -10.979 11.433 1.00 0.00 N ATOM 567 CA SER A 40 -4.197 -9.983 10.665 1.00 0.00 C ATOM 568 C SER A 40 -4.783 -8.915 11.582 1.00 0.00 C ATOM 569 O SER A 40 -4.949 -7.762 11.184 1.00 0.00 O ATOM 570 CB SER A 40 -5.314 -10.653 9.863 1.00 0.00 C ATOM 571 OG SER A 40 -6.322 -11.161 10.720 1.00 0.00 O ATOM 0 H SER A 40 -3.874 -11.910 11.427 1.00 0.00 H new ATOM 0 HA SER A 40 -3.503 -9.503 9.976 1.00 0.00 H new ATOM 0 HB2 SER A 40 -5.750 -9.934 9.170 1.00 0.00 H new ATOM 0 HB3 SER A 40 -4.900 -11.463 9.263 1.00 0.00 H new ATOM 0 HG SER A 40 -7.025 -11.583 10.184 1.00 0.00 H new ATOM 577 N SER A 41 -5.097 -9.308 12.813 1.00 0.00 N ATOM 578 CA SER A 41 -5.669 -8.386 13.787 1.00 0.00 C ATOM 579 C SER A 41 -4.633 -7.361 14.239 1.00 0.00 C ATOM 580 O SER A 41 -4.969 -6.218 14.548 1.00 0.00 O ATOM 581 CB SER A 41 -6.202 -9.156 14.997 1.00 0.00 C ATOM 582 OG SER A 41 -6.715 -8.272 15.979 1.00 0.00 O ATOM 0 H SER A 41 -4.965 -10.258 13.159 1.00 0.00 H new ATOM 0 HA SER A 41 -6.494 -7.857 13.309 1.00 0.00 H new ATOM 0 HB2 SER A 41 -6.985 -9.844 14.678 1.00 0.00 H new ATOM 0 HB3 SER A 41 -5.403 -9.760 15.428 1.00 0.00 H new ATOM 0 HG SER A 41 -7.051 -8.789 16.741 1.00 0.00 H new ATOM 588 N ASP A 42 -3.373 -7.779 14.274 1.00 0.00 N ATOM 589 CA ASP A 42 -2.286 -6.898 14.687 1.00 0.00 C ATOM 590 C ASP A 42 -1.968 -5.881 13.596 1.00 0.00 C ATOM 591 O ASP A 42 -1.373 -4.837 13.862 1.00 0.00 O ATOM 592 CB ASP A 42 -1.037 -7.716 15.020 1.00 0.00 C ATOM 593 CG ASP A 42 -1.214 -8.562 16.266 1.00 0.00 C ATOM 594 OD1 ASP A 42 -2.196 -9.331 16.326 1.00 0.00 O ATOM 595 OD2 ASP A 42 -0.371 -8.454 17.181 1.00 0.00 O ATOM 0 H ASP A 42 -3.078 -8.722 14.021 1.00 0.00 H new ATOM 0 HA ASP A 42 -2.606 -6.359 15.579 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -0.794 -8.363 14.177 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -0.191 -7.042 15.159 1.00 0.00 H new ATOM 600 N MET A 43 -2.366 -6.194 12.368 1.00 0.00 N ATOM 601 CA MET A 43 -2.123 -5.306 11.236 1.00 0.00 C ATOM 602 C MET A 43 -3.352 -4.453 10.940 1.00 0.00 C ATOM 603 O MET A 43 -4.423 -4.673 11.506 1.00 0.00 O ATOM 604 CB MET A 43 -1.740 -6.118 9.997 1.00 0.00 C ATOM 605 CG MET A 43 -0.410 -6.842 10.131 1.00 0.00 C ATOM 606 SD MET A 43 -0.026 -7.860 8.694 1.00 0.00 S ATOM 607 CE MET A 43 -1.278 -9.134 8.837 1.00 0.00 C ATOM 0 H MET A 43 -2.858 -7.055 12.131 1.00 0.00 H new ATOM 0 HA MET A 43 -1.298 -4.643 11.497 1.00 0.00 H new ATOM 0 HB2 MET A 43 -2.523 -6.849 9.795 1.00 0.00 H new ATOM 0 HB3 MET A 43 -1.696 -5.452 9.135 1.00 0.00 H new ATOM 0 HG2 MET A 43 0.385 -6.110 10.276 1.00 0.00 H new ATOM 0 HG3 MET A 43 -0.431 -7.470 11.021 1.00 0.00 H new ATOM 0 HE1 MET A 43 -1.018 -9.974 8.193 1.00 0.00 H new ATOM 0 HE2 MET A 43 -1.335 -9.474 9.871 1.00 0.00 H new ATOM 0 HE3 MET A 43 -2.244 -8.730 8.534 1.00 0.00 H new ATOM 617 N SER A 44 -3.190 -3.478 10.051 1.00 0.00 N ATOM 618 CA SER A 44 -4.286 -2.589 9.684 1.00 0.00 C ATOM 619 C SER A 44 -4.069 -2.007 8.290 1.00 0.00 C ATOM 620 O SER A 44 -2.998 -1.484 7.984 1.00 0.00 O ATOM 621 CB SER A 44 -4.419 -1.459 10.706 1.00 0.00 C ATOM 622 OG SER A 44 -4.746 -1.967 11.988 1.00 0.00 O ATOM 0 H SER A 44 -2.311 -3.284 9.572 1.00 0.00 H new ATOM 0 HA SER A 44 -5.207 -3.172 9.677 1.00 0.00 H new ATOM 0 HB2 SER A 44 -3.484 -0.901 10.760 1.00 0.00 H new ATOM 0 HB3 SER A 44 -5.189 -0.759 10.381 1.00 0.00 H new ATOM 0 HG SER A 44 -4.818 -2.943 11.944 1.00 0.00 H new ATOM 628 N ALA A 45 -5.095 -2.102 7.450 1.00 0.00 N ATOM 629 CA ALA A 45 -5.018 -1.583 6.090 1.00 0.00 C ATOM 630 C ALA A 45 -6.076 -0.512 5.851 1.00 0.00 C ATOM 631 O ALA A 45 -7.260 -0.722 6.119 1.00 0.00 O ATOM 632 CB ALA A 45 -5.173 -2.715 5.084 1.00 0.00 C ATOM 0 H ALA A 45 -5.988 -2.533 7.687 1.00 0.00 H new ATOM 0 HA ALA A 45 -4.038 -1.125 5.957 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -5.114 -2.313 4.072 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -4.377 -3.445 5.232 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -6.140 -3.198 5.226 1.00 0.00 H new ATOM 638 N HIS A 46 -5.643 0.639 5.345 1.00 0.00 N ATOM 639 CA HIS A 46 -6.554 1.744 5.070 1.00 0.00 C ATOM 640 C HIS A 46 -6.078 2.554 3.868 1.00 0.00 C ATOM 641 O HIS A 46 -4.916 2.954 3.796 1.00 0.00 O ATOM 642 CB HIS A 46 -6.674 2.651 6.295 1.00 0.00 C ATOM 643 CG HIS A 46 -7.293 1.978 7.481 1.00 0.00 C ATOM 644 ND1 HIS A 46 -6.685 0.945 8.163 1.00 0.00 N ATOM 645 CD2 HIS A 46 -8.474 2.196 8.107 1.00 0.00 C ATOM 646 CE1 HIS A 46 -7.465 0.556 9.155 1.00 0.00 C ATOM 647 NE2 HIS A 46 -8.557 1.300 9.144 1.00 0.00 N ATOM 0 H HIS A 46 -4.667 0.830 5.117 1.00 0.00 H new ATOM 0 HA HIS A 46 -7.534 1.326 4.840 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -5.682 3.011 6.569 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -7.269 3.525 6.032 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -9.213 2.937 7.840 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -7.247 -0.236 9.856 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -9.335 1.221 9.799 1.00 0.00 H new ATOM 655 N VAL A 47 -6.984 2.791 2.924 1.00 0.00 N ATOM 656 CA VAL A 47 -6.657 3.553 1.725 1.00 0.00 C ATOM 657 C VAL A 47 -6.987 5.030 1.905 1.00 0.00 C ATOM 658 O VAL A 47 -8.154 5.409 2.015 1.00 0.00 O ATOM 659 CB VAL A 47 -7.414 3.016 0.495 1.00 0.00 C ATOM 660 CG1 VAL A 47 -7.020 3.789 -0.754 1.00 0.00 C ATOM 661 CG2 VAL A 47 -7.150 1.528 0.316 1.00 0.00 C ATOM 0 H VAL A 47 -7.950 2.466 2.967 1.00 0.00 H new ATOM 0 HA VAL A 47 -5.585 3.440 1.561 1.00 0.00 H new ATOM 0 HB VAL A 47 -8.483 3.156 0.658 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -7.565 3.396 -1.612 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -7.264 4.843 -0.622 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -5.949 3.683 -0.925 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -7.692 1.165 -0.557 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -6.082 1.362 0.175 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -7.487 0.990 1.202 1.00 0.00 H new ATOM 671 N THR A 48 -5.951 5.863 1.935 1.00 0.00 N ATOM 672 CA THR A 48 -6.130 7.299 2.103 1.00 0.00 C ATOM 673 C THR A 48 -6.306 7.993 0.757 1.00 0.00 C ATOM 674 O THR A 48 -5.410 7.969 -0.086 1.00 0.00 O ATOM 675 CB THR A 48 -4.935 7.932 2.841 1.00 0.00 C ATOM 676 OG1 THR A 48 -4.660 7.203 4.042 1.00 0.00 O ATOM 677 CG2 THR A 48 -5.217 9.388 3.179 1.00 0.00 C ATOM 0 H THR A 48 -4.979 5.567 1.845 1.00 0.00 H new ATOM 0 HA THR A 48 -7.031 7.437 2.700 1.00 0.00 H new ATOM 0 HB THR A 48 -4.067 7.890 2.184 1.00 0.00 H new ATOM 0 HG1 THR A 48 -3.898 7.610 4.505 1.00 0.00 H new ATOM 0 HG21 THR A 48 -4.359 9.813 3.700 1.00 0.00 H new ATOM 0 HG22 THR A 48 -5.398 9.946 2.260 1.00 0.00 H new ATOM 0 HG23 THR A 48 -6.097 9.449 3.820 1.00 0.00 H new ATOM 685 N SER A 49 -7.467 8.610 0.562 1.00 0.00 N ATOM 686 CA SER A 49 -7.762 9.308 -0.684 1.00 0.00 C ATOM 687 C SER A 49 -7.016 10.637 -0.752 1.00 0.00 C ATOM 688 O SER A 49 -6.701 11.254 0.266 1.00 0.00 O ATOM 689 CB SER A 49 -9.267 9.547 -0.816 1.00 0.00 C ATOM 690 OG SER A 49 -10.004 8.428 -0.355 1.00 0.00 O ATOM 0 H SER A 49 -8.219 8.641 1.251 1.00 0.00 H new ATOM 0 HA SER A 49 -7.428 8.681 -1.511 1.00 0.00 H new ATOM 0 HB2 SER A 49 -9.549 10.432 -0.246 1.00 0.00 H new ATOM 0 HB3 SER A 49 -9.517 9.746 -1.858 1.00 0.00 H new ATOM 0 HG SER A 49 -9.994 7.726 -1.038 1.00 0.00 H new ATOM 696 N PRO A 50 -6.726 11.090 -1.981 1.00 0.00 N ATOM 697 CA PRO A 50 -6.014 12.350 -2.213 1.00 0.00 C ATOM 698 C PRO A 50 -6.861 13.568 -1.857 1.00 0.00 C ATOM 699 O PRO A 50 -6.410 14.706 -1.981 1.00 0.00 O ATOM 700 CB PRO A 50 -5.723 12.322 -3.715 1.00 0.00 C ATOM 701 CG PRO A 50 -6.779 11.442 -4.289 1.00 0.00 C ATOM 702 CD PRO A 50 -7.072 10.406 -3.239 1.00 0.00 C ATOM 0 HA PRO A 50 -5.121 12.434 -1.594 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -5.765 13.323 -4.145 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -4.727 11.929 -3.918 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -7.674 12.015 -4.532 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -6.438 10.975 -5.213 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -8.118 10.101 -3.256 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -6.475 9.506 -3.385 1.00 0.00 H new ATOM 710 N SER A 51 -8.089 13.320 -1.415 1.00 0.00 N ATOM 711 CA SER A 51 -9.000 14.396 -1.044 1.00 0.00 C ATOM 712 C SER A 51 -8.989 14.622 0.465 1.00 0.00 C ATOM 713 O SER A 51 -9.420 15.667 0.951 1.00 0.00 O ATOM 714 CB SER A 51 -10.421 14.076 -1.513 1.00 0.00 C ATOM 715 OG SER A 51 -11.106 13.283 -0.559 1.00 0.00 O ATOM 0 H SER A 51 -8.476 12.383 -1.305 1.00 0.00 H new ATOM 0 HA SER A 51 -8.661 15.309 -1.533 1.00 0.00 H new ATOM 0 HB2 SER A 51 -10.969 15.003 -1.681 1.00 0.00 H new ATOM 0 HB3 SER A 51 -10.383 13.551 -2.467 1.00 0.00 H new ATOM 0 HG SER A 51 -12.012 13.094 -0.881 1.00 0.00 H new ATOM 721 N GLY A 52 -8.494 13.632 1.201 1.00 0.00 N ATOM 722 CA GLY A 52 -8.436 13.741 2.647 1.00 0.00 C ATOM 723 C GLY A 52 -9.362 12.761 3.340 1.00 0.00 C ATOM 724 O GLY A 52 -9.845 13.025 4.441 1.00 0.00 O ATOM 0 H GLY A 52 -8.132 12.757 0.822 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -7.413 13.567 2.981 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -8.700 14.756 2.943 1.00 0.00 H new ATOM 728 N ARG A 53 -9.611 11.627 2.694 1.00 0.00 N ATOM 729 CA ARG A 53 -10.488 10.605 3.253 1.00 0.00 C ATOM 730 C ARG A 53 -9.705 9.338 3.583 1.00 0.00 C ATOM 731 O ARG A 53 -8.659 9.070 2.991 1.00 0.00 O ATOM 732 CB ARG A 53 -11.617 10.279 2.274 1.00 0.00 C ATOM 733 CG ARG A 53 -12.779 11.257 2.336 1.00 0.00 C ATOM 734 CD ARG A 53 -13.715 11.086 1.150 1.00 0.00 C ATOM 735 NE ARG A 53 -14.374 12.338 0.787 1.00 0.00 N ATOM 736 CZ ARG A 53 -15.056 12.509 -0.340 1.00 0.00 C ATOM 737 NH1 ARG A 53 -15.170 11.513 -1.208 1.00 0.00 N ATOM 738 NH2 ARG A 53 -15.628 13.678 -0.599 1.00 0.00 N ATOM 0 H ARG A 53 -9.218 11.392 1.783 1.00 0.00 H new ATOM 0 HA ARG A 53 -10.918 10.996 4.175 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -11.216 10.268 1.261 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -11.987 9.275 2.481 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -13.333 11.107 3.263 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -12.396 12.277 2.355 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -13.152 10.712 0.295 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -14.469 10.336 1.388 1.00 0.00 H new ATOM 0 HE ARG A 53 -14.307 13.124 1.434 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -14.733 10.612 -1.011 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -15.694 11.647 -2.073 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -15.544 14.446 0.067 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -16.152 13.809 -1.465 1.00 0.00 H new ATOM 752 N VAL A 54 -10.217 8.562 4.533 1.00 0.00 N ATOM 753 CA VAL A 54 -9.567 7.323 4.942 1.00 0.00 C ATOM 754 C VAL A 54 -10.552 6.160 4.943 1.00 0.00 C ATOM 755 O VAL A 54 -11.521 6.152 5.703 1.00 0.00 O ATOM 756 CB VAL A 54 -8.942 7.453 6.344 1.00 0.00 C ATOM 757 CG1 VAL A 54 -8.440 6.103 6.832 1.00 0.00 C ATOM 758 CG2 VAL A 54 -7.818 8.478 6.333 1.00 0.00 C ATOM 0 H VAL A 54 -11.081 8.770 5.034 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.777 7.126 4.217 1.00 0.00 H new ATOM 0 HB VAL A 54 -9.711 7.799 7.035 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -8.002 6.215 7.824 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -9.272 5.401 6.880 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -7.685 5.724 6.142 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -7.388 8.557 7.331 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -7.047 8.165 5.629 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -8.213 9.448 6.030 1.00 0.00 H new ATOM 768 N THR A 55 -10.298 5.176 4.086 1.00 0.00 N ATOM 769 CA THR A 55 -11.163 4.006 3.987 1.00 0.00 C ATOM 770 C THR A 55 -10.464 2.759 4.516 1.00 0.00 C ATOM 771 O THR A 55 -9.286 2.533 4.240 1.00 0.00 O ATOM 772 CB THR A 55 -11.603 3.756 2.532 1.00 0.00 C ATOM 773 OG1 THR A 55 -10.469 3.809 1.660 1.00 0.00 O ATOM 774 CG2 THR A 55 -12.635 4.785 2.094 1.00 0.00 C ATOM 0 H THR A 55 -9.500 5.166 3.450 1.00 0.00 H new ATOM 0 HA THR A 55 -12.044 4.211 4.596 1.00 0.00 H new ATOM 0 HB THR A 55 -12.055 2.766 2.478 1.00 0.00 H new ATOM 0 HG1 THR A 55 -10.758 3.647 0.738 1.00 0.00 H new ATOM 0 HG21 THR A 55 -12.930 4.588 1.063 1.00 0.00 H new ATOM 0 HG22 THR A 55 -13.510 4.721 2.741 1.00 0.00 H new ATOM 0 HG23 THR A 55 -12.205 5.784 2.163 1.00 0.00 H new ATOM 782 N GLU A 56 -11.197 1.953 5.277 1.00 0.00 N ATOM 783 CA GLU A 56 -10.646 0.728 5.844 1.00 0.00 C ATOM 784 C GLU A 56 -10.773 -0.432 4.862 1.00 0.00 C ATOM 785 O GLU A 56 -11.798 -0.587 4.198 1.00 0.00 O ATOM 786 CB GLU A 56 -11.356 0.382 7.155 1.00 0.00 C ATOM 787 CG GLU A 56 -10.759 -0.817 7.872 1.00 0.00 C ATOM 788 CD GLU A 56 -11.355 -1.028 9.251 1.00 0.00 C ATOM 789 OE1 GLU A 56 -12.533 -1.433 9.331 1.00 0.00 O ATOM 790 OE2 GLU A 56 -10.643 -0.787 10.248 1.00 0.00 O ATOM 0 H GLU A 56 -12.174 2.126 5.515 1.00 0.00 H new ATOM 0 HA GLU A 56 -9.588 0.895 6.046 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -11.319 1.247 7.818 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -12.408 0.184 6.948 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -10.918 -1.712 7.270 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -9.681 -0.682 7.963 1.00 0.00 H new ATOM 797 N ALA A 57 -9.725 -1.245 4.776 1.00 0.00 N ATOM 798 CA ALA A 57 -9.720 -2.392 3.876 1.00 0.00 C ATOM 799 C ALA A 57 -9.816 -3.700 4.654 1.00 0.00 C ATOM 800 O ALA A 57 -9.592 -3.730 5.864 1.00 0.00 O ATOM 801 CB ALA A 57 -8.467 -2.380 3.013 1.00 0.00 C ATOM 0 H ALA A 57 -8.869 -1.131 5.318 1.00 0.00 H new ATOM 0 HA ALA A 57 -10.594 -2.319 3.229 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -8.476 -3.242 2.346 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -8.441 -1.464 2.422 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -7.585 -2.425 3.652 1.00 0.00 H new ATOM 807 N GLU A 58 -10.151 -4.778 3.952 1.00 0.00 N ATOM 808 CA GLU A 58 -10.278 -6.088 4.579 1.00 0.00 C ATOM 809 C GLU A 58 -9.117 -6.996 4.182 1.00 0.00 C ATOM 810 O GLU A 58 -8.608 -6.916 3.063 1.00 0.00 O ATOM 811 CB GLU A 58 -11.606 -6.739 4.187 1.00 0.00 C ATOM 812 CG GLU A 58 -11.989 -7.917 5.067 1.00 0.00 C ATOM 813 CD GLU A 58 -12.309 -7.503 6.490 1.00 0.00 C ATOM 814 OE1 GLU A 58 -13.301 -6.771 6.687 1.00 0.00 O ATOM 815 OE2 GLU A 58 -11.565 -7.911 7.407 1.00 0.00 O ATOM 0 H GLU A 58 -10.339 -4.770 2.950 1.00 0.00 H new ATOM 0 HA GLU A 58 -10.255 -5.949 5.660 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -12.396 -5.990 4.233 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -11.545 -7.074 3.152 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -12.854 -8.421 4.636 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -11.172 -8.638 5.078 1.00 0.00 H new ATOM 822 N ILE A 59 -8.705 -7.857 5.106 1.00 0.00 N ATOM 823 CA ILE A 59 -7.605 -8.780 4.852 1.00 0.00 C ATOM 824 C ILE A 59 -8.068 -10.229 4.961 1.00 0.00 C ATOM 825 O ILE A 59 -8.190 -10.773 6.059 1.00 0.00 O ATOM 826 CB ILE A 59 -6.440 -8.550 5.832 1.00 0.00 C ATOM 827 CG1 ILE A 59 -6.086 -7.063 5.898 1.00 0.00 C ATOM 828 CG2 ILE A 59 -5.228 -9.370 5.417 1.00 0.00 C ATOM 829 CD1 ILE A 59 -5.253 -6.693 7.105 1.00 0.00 C ATOM 0 H ILE A 59 -9.116 -7.935 6.036 1.00 0.00 H new ATOM 0 HA ILE A 59 -7.258 -8.587 3.837 1.00 0.00 H new ATOM 0 HB ILE A 59 -6.751 -8.875 6.825 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -5.544 -6.787 4.994 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -7.006 -6.479 5.909 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -4.413 -9.196 6.120 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -5.488 -10.429 5.417 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -4.913 -9.074 4.416 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -5.040 -5.624 7.086 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -5.802 -6.938 8.015 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -4.316 -7.250 7.085 1.00 0.00 H new ATOM 841 N VAL A 60 -8.323 -10.851 3.814 1.00 0.00 N ATOM 842 CA VAL A 60 -8.769 -12.238 3.779 1.00 0.00 C ATOM 843 C VAL A 60 -7.634 -13.190 4.142 1.00 0.00 C ATOM 844 O VAL A 60 -6.512 -13.074 3.650 1.00 0.00 O ATOM 845 CB VAL A 60 -9.317 -12.617 2.391 1.00 0.00 C ATOM 846 CG1 VAL A 60 -9.848 -14.042 2.396 1.00 0.00 C ATOM 847 CG2 VAL A 60 -10.399 -11.638 1.960 1.00 0.00 C ATOM 0 H VAL A 60 -8.228 -10.415 2.897 1.00 0.00 H new ATOM 0 HA VAL A 60 -9.568 -12.332 4.515 1.00 0.00 H new ATOM 0 HB VAL A 60 -8.501 -12.562 1.671 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -10.231 -14.291 1.406 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -9.043 -14.729 2.657 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -10.651 -14.128 3.128 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -10.775 -11.921 0.977 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -11.216 -11.659 2.681 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -9.982 -10.632 1.913 1.00 0.00 H new ATOM 857 N PRO A 61 -7.931 -14.155 5.025 1.00 0.00 N ATOM 858 CA PRO A 61 -6.950 -15.147 5.473 1.00 0.00 C ATOM 859 C PRO A 61 -6.577 -16.133 4.372 1.00 0.00 C ATOM 860 O PRO A 61 -7.420 -16.892 3.894 1.00 0.00 O ATOM 861 CB PRO A 61 -7.670 -15.868 6.615 1.00 0.00 C ATOM 862 CG PRO A 61 -9.119 -15.696 6.317 1.00 0.00 C ATOM 863 CD PRO A 61 -9.249 -14.353 5.652 1.00 0.00 C ATOM 0 HA PRO A 61 -6.009 -14.684 5.769 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -7.396 -16.922 6.653 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -7.411 -15.436 7.582 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -9.480 -16.491 5.665 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -9.713 -15.738 7.230 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -10.051 -14.346 4.913 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -9.473 -13.567 6.373 1.00 0.00 H new ATOM 871 N MET A 62 -5.309 -16.117 3.973 1.00 0.00 N ATOM 872 CA MET A 62 -4.825 -17.012 2.928 1.00 0.00 C ATOM 873 C MET A 62 -4.307 -18.316 3.526 1.00 0.00 C ATOM 874 O MET A 62 -4.648 -19.402 3.060 1.00 0.00 O ATOM 875 CB MET A 62 -3.719 -16.334 2.118 1.00 0.00 C ATOM 876 CG MET A 62 -4.236 -15.533 0.934 1.00 0.00 C ATOM 877 SD MET A 62 -3.054 -15.460 -0.425 1.00 0.00 S ATOM 878 CE MET A 62 -4.071 -16.020 -1.789 1.00 0.00 C ATOM 0 H MET A 62 -4.598 -15.494 4.357 1.00 0.00 H new ATOM 0 HA MET A 62 -5.660 -17.243 2.267 1.00 0.00 H new ATOM 0 HB2 MET A 62 -3.153 -15.673 2.774 1.00 0.00 H new ATOM 0 HB3 MET A 62 -3.026 -17.094 1.757 1.00 0.00 H new ATOM 0 HG2 MET A 62 -5.166 -15.977 0.578 1.00 0.00 H new ATOM 0 HG3 MET A 62 -4.471 -14.520 1.261 1.00 0.00 H new ATOM 0 HE1 MET A 62 -3.479 -16.030 -2.704 1.00 0.00 H new ATOM 0 HE2 MET A 62 -4.435 -17.026 -1.582 1.00 0.00 H new ATOM 0 HE3 MET A 62 -4.918 -15.345 -1.912 1.00 0.00 H new ATOM 888 N GLY A 63 -3.481 -18.200 4.562 1.00 0.00 N ATOM 889 CA GLY A 63 -2.930 -19.378 5.206 1.00 0.00 C ATOM 890 C GLY A 63 -2.286 -19.061 6.541 1.00 0.00 C ATOM 891 O GLY A 63 -2.941 -18.545 7.447 1.00 0.00 O ATOM 0 H GLY A 63 -3.184 -17.312 4.966 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -3.722 -20.112 5.353 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -2.190 -19.835 4.549 1.00 0.00 H new ATOM 895 N LYS A 64 -1.001 -19.372 6.665 1.00 0.00 N ATOM 896 CA LYS A 64 -0.267 -19.118 7.900 1.00 0.00 C ATOM 897 C LYS A 64 0.555 -17.837 7.791 1.00 0.00 C ATOM 898 O LYS A 64 0.523 -16.991 8.682 1.00 0.00 O ATOM 899 CB LYS A 64 0.649 -20.299 8.225 1.00 0.00 C ATOM 900 CG LYS A 64 1.696 -20.569 7.157 1.00 0.00 C ATOM 901 CD LYS A 64 2.344 -21.930 7.344 1.00 0.00 C ATOM 902 CE LYS A 64 3.318 -22.243 6.218 1.00 0.00 C ATOM 903 NZ LYS A 64 4.347 -23.235 6.634 1.00 0.00 N ATOM 0 H LYS A 64 -0.445 -19.801 5.925 1.00 0.00 H new ATOM 0 HA LYS A 64 -0.991 -18.996 8.705 1.00 0.00 H new ATOM 0 HB2 LYS A 64 1.151 -20.109 9.174 1.00 0.00 H new ATOM 0 HB3 LYS A 64 0.041 -21.193 8.360 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.233 -20.517 6.171 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.461 -19.793 7.191 1.00 0.00 H new ATOM 0 HD2 LYS A 64 2.869 -21.956 8.299 1.00 0.00 H new ATOM 0 HD3 LYS A 64 1.573 -22.699 7.384 1.00 0.00 H new ATOM 0 HE2 LYS A 64 2.768 -22.628 5.359 1.00 0.00 H new ATOM 0 HE3 LYS A 64 3.808 -21.324 5.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 4.991 -23.421 5.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 4.889 -22.857 7.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 3.881 -24.121 6.917 1.00 0.00 H new ATOM 917 N ASN A 65 1.289 -17.703 6.691 1.00 0.00 N ATOM 918 CA ASN A 65 2.119 -16.525 6.465 1.00 0.00 C ATOM 919 C ASN A 65 1.706 -15.806 5.185 1.00 0.00 C ATOM 920 O ASN A 65 2.501 -15.088 4.579 1.00 0.00 O ATOM 921 CB ASN A 65 3.594 -16.922 6.387 1.00 0.00 C ATOM 922 CG ASN A 65 3.990 -17.406 5.005 1.00 0.00 C ATOM 923 OD1 ASN A 65 3.198 -18.037 4.306 1.00 0.00 O ATOM 924 ND2 ASN A 65 5.222 -17.111 4.606 1.00 0.00 N ATOM 0 H ASN A 65 1.326 -18.395 5.943 1.00 0.00 H new ATOM 0 HA ASN A 65 1.977 -15.845 7.305 1.00 0.00 H new ATOM 0 HB2 ASN A 65 4.213 -16.067 6.661 1.00 0.00 H new ATOM 0 HB3 ASN A 65 3.795 -17.707 7.116 1.00 0.00 H new ATOM 0 HD21 ASN A 65 5.545 -17.410 3.686 1.00 0.00 H new ATOM 0 HD22 ASN A 65 5.845 -16.585 5.220 1.00 0.00 H new ATOM 931 N SER A 66 0.456 -16.004 4.778 1.00 0.00 N ATOM 932 CA SER A 66 -0.063 -15.377 3.568 1.00 0.00 C ATOM 933 C SER A 66 -1.358 -14.625 3.858 1.00 0.00 C ATOM 934 O SER A 66 -2.140 -15.022 4.723 1.00 0.00 O ATOM 935 CB SER A 66 -0.303 -16.431 2.485 1.00 0.00 C ATOM 936 OG SER A 66 -0.831 -17.622 3.041 1.00 0.00 O ATOM 0 H SER A 66 -0.216 -16.594 5.269 1.00 0.00 H new ATOM 0 HA SER A 66 0.679 -14.663 3.212 1.00 0.00 H new ATOM 0 HB2 SER A 66 -0.992 -16.038 1.737 1.00 0.00 H new ATOM 0 HB3 SER A 66 0.633 -16.649 1.972 1.00 0.00 H new ATOM 0 HG SER A 66 -0.977 -18.279 2.329 1.00 0.00 H new ATOM 942 N HIS A 67 -1.579 -13.536 3.128 1.00 0.00 N ATOM 943 CA HIS A 67 -2.780 -12.728 3.305 1.00 0.00 C ATOM 944 C HIS A 67 -3.145 -12.006 2.011 1.00 0.00 C ATOM 945 O HIS A 67 -2.270 -11.530 1.287 1.00 0.00 O ATOM 946 CB HIS A 67 -2.575 -11.712 4.429 1.00 0.00 C ATOM 947 CG HIS A 67 -2.482 -12.334 5.789 1.00 0.00 C ATOM 948 ND1 HIS A 67 -3.588 -12.645 6.552 1.00 0.00 N ATOM 949 CD2 HIS A 67 -1.405 -12.704 6.521 1.00 0.00 C ATOM 950 CE1 HIS A 67 -3.195 -13.178 7.695 1.00 0.00 C ATOM 951 NE2 HIS A 67 -1.875 -13.225 7.701 1.00 0.00 N ATOM 0 H HIS A 67 -0.942 -13.193 2.409 1.00 0.00 H new ATOM 0 HA HIS A 67 -3.600 -13.394 3.572 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -1.664 -11.146 4.234 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -3.401 -11.000 4.420 1.00 0.00 H new ATOM 0 HD2 HIS A 67 -0.369 -12.607 6.231 1.00 0.00 H new ATOM 0 HE1 HIS A 67 -3.843 -13.518 8.490 1.00 0.00 H new ATOM 0 HE2 HIS A 67 -1.298 -13.589 8.459 1.00 0.00 H new ATOM 959 N CYS A 68 -4.441 -11.929 1.728 1.00 0.00 N ATOM 960 CA CYS A 68 -4.921 -11.266 0.521 1.00 0.00 C ATOM 961 C CYS A 68 -5.911 -10.158 0.866 1.00 0.00 C ATOM 962 O CYS A 68 -6.828 -10.356 1.663 1.00 0.00 O ATOM 963 CB CYS A 68 -5.579 -12.281 -0.415 1.00 0.00 C ATOM 964 SG CYS A 68 -5.462 -11.853 -2.168 1.00 0.00 S ATOM 0 H CYS A 68 -5.177 -12.317 2.318 1.00 0.00 H new ATOM 0 HA CYS A 68 -4.065 -10.819 0.017 1.00 0.00 H new ATOM 0 HB2 CYS A 68 -5.117 -13.256 -0.258 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -6.631 -12.379 -0.145 1.00 0.00 H new ATOM 0 HG CYS A 68 -6.045 -12.772 -2.879 1.00 0.00 H new ATOM 970 N VAL A 69 -5.717 -8.990 0.261 1.00 0.00 N ATOM 971 CA VAL A 69 -6.592 -7.849 0.504 1.00 0.00 C ATOM 972 C VAL A 69 -7.406 -7.506 -0.738 1.00 0.00 C ATOM 973 O VAL A 69 -6.882 -7.493 -1.852 1.00 0.00 O ATOM 974 CB VAL A 69 -5.789 -6.609 0.938 1.00 0.00 C ATOM 975 CG1 VAL A 69 -6.631 -5.350 0.794 1.00 0.00 C ATOM 976 CG2 VAL A 69 -5.293 -6.768 2.367 1.00 0.00 C ATOM 0 H VAL A 69 -4.962 -8.809 -0.401 1.00 0.00 H new ATOM 0 HA VAL A 69 -7.268 -8.135 1.310 1.00 0.00 H new ATOM 0 HB VAL A 69 -4.921 -6.514 0.285 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -6.047 -4.484 1.105 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -6.931 -5.230 -0.247 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -7.519 -5.433 1.420 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -4.728 -5.882 2.657 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -6.145 -6.890 3.036 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -4.651 -7.646 2.434 1.00 0.00 H new ATOM 986 N ARG A 70 -8.691 -7.228 -0.539 1.00 0.00 N ATOM 987 CA ARG A 70 -9.578 -6.885 -1.644 1.00 0.00 C ATOM 988 C ARG A 70 -10.368 -5.617 -1.333 1.00 0.00 C ATOM 989 O ARG A 70 -11.030 -5.524 -0.300 1.00 0.00 O ATOM 990 CB ARG A 70 -10.539 -8.040 -1.932 1.00 0.00 C ATOM 991 CG ARG A 70 -11.274 -8.543 -0.700 1.00 0.00 C ATOM 992 CD ARG A 70 -12.073 -9.800 -1.002 1.00 0.00 C ATOM 993 NE ARG A 70 -12.963 -10.161 0.098 1.00 0.00 N ATOM 994 CZ ARG A 70 -13.857 -11.141 0.030 1.00 0.00 C ATOM 995 NH1 ARG A 70 -13.979 -11.855 -1.081 1.00 0.00 N ATOM 996 NH2 ARG A 70 -14.630 -11.409 1.074 1.00 0.00 N ATOM 0 H ARG A 70 -9.140 -7.234 0.377 1.00 0.00 H new ATOM 0 HA ARG A 70 -8.965 -6.703 -2.527 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -11.269 -7.717 -2.674 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -9.980 -8.865 -2.373 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -10.556 -8.749 0.094 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -11.943 -7.765 -0.331 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -12.660 -9.647 -1.908 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -11.389 -10.625 -1.201 1.00 0.00 H new ATOM 0 HE ARG A 70 -12.894 -9.631 0.967 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -13.386 -11.652 -1.885 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -14.666 -12.607 -1.131 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -14.538 -10.862 1.930 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -15.316 -12.162 1.021 1.00 0.00 H new ATOM 1010 N PHE A 71 -10.293 -4.644 -2.234 1.00 0.00 N ATOM 1011 CA PHE A 71 -11.000 -3.381 -2.056 1.00 0.00 C ATOM 1012 C PHE A 71 -11.168 -2.659 -3.390 1.00 0.00 C ATOM 1013 O PHE A 71 -10.547 -3.022 -4.388 1.00 0.00 O ATOM 1014 CB PHE A 71 -10.246 -2.485 -1.070 1.00 0.00 C ATOM 1015 CG PHE A 71 -8.814 -2.243 -1.454 1.00 0.00 C ATOM 1016 CD1 PHE A 71 -8.499 -1.386 -2.497 1.00 0.00 C ATOM 1017 CD2 PHE A 71 -7.785 -2.870 -0.772 1.00 0.00 C ATOM 1018 CE1 PHE A 71 -7.182 -1.162 -2.853 1.00 0.00 C ATOM 1019 CE2 PHE A 71 -6.466 -2.650 -1.123 1.00 0.00 C ATOM 1020 CZ PHE A 71 -6.164 -1.794 -2.164 1.00 0.00 C ATOM 0 H PHE A 71 -9.750 -4.705 -3.095 1.00 0.00 H new ATOM 0 HA PHE A 71 -11.989 -3.600 -1.654 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -10.761 -1.527 -0.995 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -10.276 -2.941 -0.081 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -9.291 -0.888 -3.037 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -8.016 -3.539 0.044 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -6.949 -0.494 -3.669 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -5.673 -3.147 -0.584 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.134 -1.619 -2.439 1.00 0.00 H new ATOM 1030 N VAL A 72 -12.014 -1.633 -3.398 1.00 0.00 N ATOM 1031 CA VAL A 72 -12.265 -0.859 -4.607 1.00 0.00 C ATOM 1032 C VAL A 72 -11.558 0.491 -4.553 1.00 0.00 C ATOM 1033 O VAL A 72 -12.085 1.476 -4.036 1.00 0.00 O ATOM 1034 CB VAL A 72 -13.773 -0.627 -4.823 1.00 0.00 C ATOM 1035 CG1 VAL A 72 -14.018 0.109 -6.131 1.00 0.00 C ATOM 1036 CG2 VAL A 72 -14.523 -1.950 -4.797 1.00 0.00 C ATOM 0 H VAL A 72 -12.537 -1.319 -2.580 1.00 0.00 H new ATOM 0 HA VAL A 72 -11.871 -1.440 -5.441 1.00 0.00 H new ATOM 0 HB VAL A 72 -14.148 -0.006 -4.010 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -15.088 0.264 -6.266 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -13.512 1.074 -6.106 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -13.629 -0.483 -6.960 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -15.587 -1.768 -4.951 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -14.147 -2.597 -5.589 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -14.374 -2.434 -3.832 1.00 0.00 H new ATOM 1046 N PRO A 73 -10.333 0.539 -5.099 1.00 0.00 N ATOM 1047 CA PRO A 73 -9.527 1.763 -5.127 1.00 0.00 C ATOM 1048 C PRO A 73 -10.098 2.813 -6.074 1.00 0.00 C ATOM 1049 O PRO A 73 -9.669 2.925 -7.222 1.00 0.00 O ATOM 1050 CB PRO A 73 -8.164 1.278 -5.626 1.00 0.00 C ATOM 1051 CG PRO A 73 -8.463 0.046 -6.408 1.00 0.00 C ATOM 1052 CD PRO A 73 -9.643 -0.597 -5.733 1.00 0.00 C ATOM 0 HA PRO A 73 -9.492 2.250 -4.152 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -7.678 2.032 -6.245 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -7.491 1.066 -4.795 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -8.692 0.288 -7.446 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -7.605 -0.627 -6.419 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -10.286 -1.109 -6.449 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -9.331 -1.339 -4.998 1.00 0.00 H new ATOM 1060 N GLN A 74 -11.068 3.579 -5.585 1.00 0.00 N ATOM 1061 CA GLN A 74 -11.697 4.620 -6.389 1.00 0.00 C ATOM 1062 C GLN A 74 -11.481 5.995 -5.765 1.00 0.00 C ATOM 1063 O GLN A 74 -12.002 6.287 -4.689 1.00 0.00 O ATOM 1064 CB GLN A 74 -13.194 4.343 -6.537 1.00 0.00 C ATOM 1065 CG GLN A 74 -13.972 5.506 -7.133 1.00 0.00 C ATOM 1066 CD GLN A 74 -15.470 5.354 -6.963 1.00 0.00 C ATOM 1067 OE1 GLN A 74 -16.152 6.274 -6.511 1.00 0.00 O ATOM 1068 NE2 GLN A 74 -15.992 4.188 -7.326 1.00 0.00 N ATOM 0 H GLN A 74 -11.435 3.498 -4.637 1.00 0.00 H new ATOM 0 HA GLN A 74 -11.234 4.613 -7.376 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -13.332 3.464 -7.166 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -13.609 4.103 -5.558 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -13.649 6.434 -6.661 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -13.737 5.589 -8.194 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -15.390 3.453 -7.696 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -16.995 4.028 -7.235 1.00 0.00 H new ATOM 1077 N GLU A 75 -10.710 6.835 -6.449 1.00 0.00 N ATOM 1078 CA GLU A 75 -10.426 8.179 -5.960 1.00 0.00 C ATOM 1079 C GLU A 75 -10.353 9.174 -7.115 1.00 0.00 C ATOM 1080 O GLU A 75 -10.524 8.805 -8.277 1.00 0.00 O ATOM 1081 CB GLU A 75 -9.111 8.193 -5.178 1.00 0.00 C ATOM 1082 CG GLU A 75 -9.275 7.853 -3.706 1.00 0.00 C ATOM 1083 CD GLU A 75 -9.593 6.388 -3.478 1.00 0.00 C ATOM 1084 OE1 GLU A 75 -9.336 5.576 -4.392 1.00 0.00 O ATOM 1085 OE2 GLU A 75 -10.100 6.053 -2.387 1.00 0.00 O ATOM 0 H GLU A 75 -10.272 6.609 -7.342 1.00 0.00 H new ATOM 0 HA GLU A 75 -11.239 8.476 -5.297 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -8.421 7.482 -5.632 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -8.656 9.180 -5.266 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -8.359 8.109 -3.173 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -10.072 8.464 -3.282 1.00 0.00 H new ATOM 1092 N MET A 76 -10.100 10.436 -6.786 1.00 0.00 N ATOM 1093 CA MET A 76 -10.004 11.484 -7.796 1.00 0.00 C ATOM 1094 C MET A 76 -8.546 11.822 -8.093 1.00 0.00 C ATOM 1095 O MET A 76 -8.255 12.750 -8.846 1.00 0.00 O ATOM 1096 CB MET A 76 -10.745 12.739 -7.330 1.00 0.00 C ATOM 1097 CG MET A 76 -12.250 12.551 -7.222 1.00 0.00 C ATOM 1098 SD MET A 76 -13.153 14.108 -7.318 1.00 0.00 S ATOM 1099 CE MET A 76 -13.743 14.054 -9.008 1.00 0.00 C ATOM 0 H MET A 76 -9.958 10.758 -5.829 1.00 0.00 H new ATOM 0 HA MET A 76 -10.467 11.115 -8.711 1.00 0.00 H new ATOM 0 HB2 MET A 76 -10.354 13.042 -6.359 1.00 0.00 H new ATOM 0 HB3 MET A 76 -10.538 13.553 -8.025 1.00 0.00 H new ATOM 0 HG2 MET A 76 -12.588 11.890 -8.020 1.00 0.00 H new ATOM 0 HG3 MET A 76 -12.484 12.057 -6.279 1.00 0.00 H new ATOM 0 HE1 MET A 76 -14.322 14.953 -9.220 1.00 0.00 H new ATOM 0 HE2 MET A 76 -12.893 14.001 -9.689 1.00 0.00 H new ATOM 0 HE3 MET A 76 -14.374 13.176 -9.145 1.00 0.00 H new ATOM 1109 N GLY A 77 -7.634 11.061 -7.496 1.00 0.00 N ATOM 1110 CA GLY A 77 -6.218 11.296 -7.709 1.00 0.00 C ATOM 1111 C GLY A 77 -5.382 10.052 -7.479 1.00 0.00 C ATOM 1112 O GLY A 77 -5.669 8.991 -8.034 1.00 0.00 O ATOM 0 H GLY A 77 -7.850 10.286 -6.869 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -6.061 11.652 -8.727 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -5.879 12.086 -7.039 1.00 0.00 H new ATOM 1116 N VAL A 78 -4.345 10.182 -6.658 1.00 0.00 N ATOM 1117 CA VAL A 78 -3.465 9.059 -6.355 1.00 0.00 C ATOM 1118 C VAL A 78 -3.976 8.267 -5.158 1.00 0.00 C ATOM 1119 O VAL A 78 -4.494 8.838 -4.197 1.00 0.00 O ATOM 1120 CB VAL A 78 -2.028 9.534 -6.067 1.00 0.00 C ATOM 1121 CG1 VAL A 78 -1.983 10.352 -4.785 1.00 0.00 C ATOM 1122 CG2 VAL A 78 -1.081 8.347 -5.985 1.00 0.00 C ATOM 0 H VAL A 78 -4.093 11.053 -6.191 1.00 0.00 H new ATOM 0 HA VAL A 78 -3.458 8.416 -7.235 1.00 0.00 H new ATOM 0 HB VAL A 78 -1.703 10.172 -6.889 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -0.960 10.679 -4.598 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -2.630 11.224 -4.887 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -2.327 9.740 -3.951 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -0.071 8.701 -5.781 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -1.401 7.681 -5.184 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -1.092 7.807 -6.932 1.00 0.00 H new ATOM 1132 N HIS A 79 -3.827 6.947 -5.220 1.00 0.00 N ATOM 1133 CA HIS A 79 -4.273 6.075 -4.140 1.00 0.00 C ATOM 1134 C HIS A 79 -3.100 5.666 -3.253 1.00 0.00 C ATOM 1135 O HIS A 79 -2.063 5.219 -3.744 1.00 0.00 O ATOM 1136 CB HIS A 79 -4.956 4.831 -4.709 1.00 0.00 C ATOM 1137 CG HIS A 79 -6.100 5.142 -5.623 1.00 0.00 C ATOM 1138 ND1 HIS A 79 -6.046 6.124 -6.590 1.00 0.00 N ATOM 1139 CD2 HIS A 79 -7.334 4.593 -5.716 1.00 0.00 C ATOM 1140 CE1 HIS A 79 -7.197 6.167 -7.237 1.00 0.00 C ATOM 1141 NE2 HIS A 79 -7.996 5.248 -6.725 1.00 0.00 N ATOM 0 H HIS A 79 -3.401 6.458 -6.007 1.00 0.00 H new ATOM 0 HA HIS A 79 -4.990 6.627 -3.533 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -4.219 4.238 -5.251 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -5.317 4.216 -3.885 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -7.725 3.789 -5.109 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -7.443 6.839 -8.046 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -8.950 5.056 -7.030 1.00 0.00 H new ATOM 1149 N THR A 80 -3.272 5.821 -1.944 1.00 0.00 N ATOM 1150 CA THR A 80 -2.228 5.469 -0.989 1.00 0.00 C ATOM 1151 C THR A 80 -2.757 4.518 0.078 1.00 0.00 C ATOM 1152 O THR A 80 -3.781 4.783 0.708 1.00 0.00 O ATOM 1153 CB THR A 80 -1.649 6.721 -0.304 1.00 0.00 C ATOM 1154 OG1 THR A 80 -1.365 7.728 -1.282 1.00 0.00 O ATOM 1155 CG2 THR A 80 -0.380 6.380 0.463 1.00 0.00 C ATOM 0 H THR A 80 -4.124 6.188 -1.521 1.00 0.00 H new ATOM 0 HA THR A 80 -1.437 4.974 -1.553 1.00 0.00 H new ATOM 0 HB THR A 80 -2.390 7.098 0.400 1.00 0.00 H new ATOM 0 HG1 THR A 80 -0.999 8.521 -0.838 1.00 0.00 H new ATOM 0 HG21 THR A 80 0.011 7.280 0.938 1.00 0.00 H new ATOM 0 HG22 THR A 80 -0.605 5.635 1.226 1.00 0.00 H new ATOM 0 HG23 THR A 80 0.365 5.981 -0.225 1.00 0.00 H new ATOM 1163 N VAL A 81 -2.052 3.409 0.277 1.00 0.00 N ATOM 1164 CA VAL A 81 -2.450 2.418 1.270 1.00 0.00 C ATOM 1165 C VAL A 81 -1.542 2.471 2.493 1.00 0.00 C ATOM 1166 O VAL A 81 -0.352 2.165 2.410 1.00 0.00 O ATOM 1167 CB VAL A 81 -2.423 0.994 0.685 1.00 0.00 C ATOM 1168 CG1 VAL A 81 -3.249 0.048 1.543 1.00 0.00 C ATOM 1169 CG2 VAL A 81 -2.924 0.999 -0.752 1.00 0.00 C ATOM 0 H VAL A 81 -1.202 3.174 -0.236 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.470 2.660 1.568 1.00 0.00 H new ATOM 0 HB VAL A 81 -1.392 0.639 0.685 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -3.218 -0.953 1.114 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -2.841 0.023 2.553 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -4.281 0.396 1.578 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -2.898 -0.015 -1.150 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -3.947 1.374 -0.779 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.286 1.643 -1.358 1.00 0.00 H new ATOM 1179 N SER A 82 -2.110 2.861 3.630 1.00 0.00 N ATOM 1180 CA SER A 82 -1.351 2.957 4.871 1.00 0.00 C ATOM 1181 C SER A 82 -1.352 1.623 5.613 1.00 0.00 C ATOM 1182 O SER A 82 -2.254 1.338 6.400 1.00 0.00 O ATOM 1183 CB SER A 82 -1.934 4.052 5.767 1.00 0.00 C ATOM 1184 OG SER A 82 -1.101 4.290 6.888 1.00 0.00 O ATOM 0 H SER A 82 -3.094 3.116 3.717 1.00 0.00 H new ATOM 0 HA SER A 82 -0.322 3.213 4.620 1.00 0.00 H new ATOM 0 HB2 SER A 82 -2.050 4.972 5.194 1.00 0.00 H new ATOM 0 HB3 SER A 82 -2.928 3.759 6.104 1.00 0.00 H new ATOM 0 HG SER A 82 -1.494 4.995 7.444 1.00 0.00 H new ATOM 1190 N VAL A 83 -0.332 0.810 5.356 1.00 0.00 N ATOM 1191 CA VAL A 83 -0.213 -0.493 5.999 1.00 0.00 C ATOM 1192 C VAL A 83 0.790 -0.450 7.146 1.00 0.00 C ATOM 1193 O VAL A 83 1.997 -0.346 6.928 1.00 0.00 O ATOM 1194 CB VAL A 83 0.220 -1.577 4.994 1.00 0.00 C ATOM 1195 CG1 VAL A 83 0.101 -2.960 5.616 1.00 0.00 C ATOM 1196 CG2 VAL A 83 -0.606 -1.483 3.720 1.00 0.00 C ATOM 0 H VAL A 83 0.423 1.031 4.707 1.00 0.00 H new ATOM 0 HA VAL A 83 -1.199 -0.744 6.391 1.00 0.00 H new ATOM 0 HB VAL A 83 1.266 -1.411 4.735 1.00 0.00 H new ATOM 0 HG11 VAL A 83 0.411 -3.713 4.891 1.00 0.00 H new ATOM 0 HG12 VAL A 83 0.740 -3.019 6.497 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -0.934 -3.141 5.906 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -0.287 -2.256 3.021 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -1.660 -1.623 3.959 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -0.464 -0.502 3.266 1.00 0.00 H new ATOM 1206 N LYS A 84 0.282 -0.530 8.371 1.00 0.00 N ATOM 1207 CA LYS A 84 1.132 -0.503 9.556 1.00 0.00 C ATOM 1208 C LYS A 84 0.991 -1.793 10.357 1.00 0.00 C ATOM 1209 O LYS A 84 0.092 -2.596 10.106 1.00 0.00 O ATOM 1210 CB LYS A 84 0.776 0.698 10.436 1.00 0.00 C ATOM 1211 CG LYS A 84 0.695 2.009 9.672 1.00 0.00 C ATOM 1212 CD LYS A 84 0.326 3.165 10.587 1.00 0.00 C ATOM 1213 CE LYS A 84 -0.419 4.256 9.833 1.00 0.00 C ATOM 1214 NZ LYS A 84 -0.791 5.390 10.724 1.00 0.00 N ATOM 0 H LYS A 84 -0.715 -0.614 8.570 1.00 0.00 H new ATOM 0 HA LYS A 84 2.167 -0.412 9.228 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -0.181 0.511 10.922 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.521 0.793 11.226 1.00 0.00 H new ATOM 0 HG2 LYS A 84 1.653 2.213 9.195 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -0.045 1.923 8.877 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -0.293 2.799 11.406 1.00 0.00 H new ATOM 0 HD3 LYS A 84 1.230 3.581 11.032 1.00 0.00 H new ATOM 0 HE2 LYS A 84 0.203 4.624 9.017 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -1.319 3.837 9.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -1.297 6.113 10.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -1.406 5.044 11.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 0.069 5.806 11.134 1.00 0.00 H new ATOM 1228 N TYR A 85 1.883 -1.985 11.322 1.00 0.00 N ATOM 1229 CA TYR A 85 1.858 -3.178 12.160 1.00 0.00 C ATOM 1230 C TYR A 85 2.040 -2.815 13.631 1.00 0.00 C ATOM 1231 O TYR A 85 3.164 -2.695 14.118 1.00 0.00 O ATOM 1232 CB TYR A 85 2.953 -4.154 11.725 1.00 0.00 C ATOM 1233 CG TYR A 85 3.234 -5.240 12.740 1.00 0.00 C ATOM 1234 CD1 TYR A 85 2.218 -6.069 13.198 1.00 0.00 C ATOM 1235 CD2 TYR A 85 4.515 -5.434 13.241 1.00 0.00 C ATOM 1236 CE1 TYR A 85 2.470 -7.062 14.126 1.00 0.00 C ATOM 1237 CE2 TYR A 85 4.776 -6.425 14.168 1.00 0.00 C ATOM 1238 CZ TYR A 85 3.750 -7.236 14.607 1.00 0.00 C ATOM 1239 OH TYR A 85 4.007 -8.223 15.531 1.00 0.00 O ATOM 0 H TYR A 85 2.633 -1.330 11.544 1.00 0.00 H new ATOM 0 HA TYR A 85 0.885 -3.655 12.040 1.00 0.00 H new ATOM 0 HB2 TYR A 85 2.662 -4.616 10.782 1.00 0.00 H new ATOM 0 HB3 TYR A 85 3.871 -3.597 11.537 1.00 0.00 H new ATOM 0 HD1 TYR A 85 1.214 -5.935 12.823 1.00 0.00 H new ATOM 0 HD2 TYR A 85 5.320 -4.800 12.900 1.00 0.00 H new ATOM 0 HE1 TYR A 85 1.669 -7.698 14.472 1.00 0.00 H new ATOM 0 HE2 TYR A 85 5.778 -6.564 14.547 1.00 0.00 H new ATOM 0 HH TYR A 85 4.974 -8.374 15.588 1.00 0.00 H new ATOM 1249 N ARG A 86 0.925 -2.642 14.333 1.00 0.00 N ATOM 1250 CA ARG A 86 0.959 -2.293 15.747 1.00 0.00 C ATOM 1251 C ARG A 86 1.477 -0.871 15.944 1.00 0.00 C ATOM 1252 O ARG A 86 2.045 -0.545 16.985 1.00 0.00 O ATOM 1253 CB ARG A 86 1.839 -3.279 16.517 1.00 0.00 C ATOM 1254 CG ARG A 86 1.525 -4.736 16.220 1.00 0.00 C ATOM 1255 CD ARG A 86 2.451 -5.672 16.981 1.00 0.00 C ATOM 1256 NE ARG A 86 3.851 -5.476 16.612 1.00 0.00 N ATOM 1257 CZ ARG A 86 4.853 -6.173 17.136 1.00 0.00 C ATOM 1258 NH1 ARG A 86 4.612 -7.106 18.046 1.00 0.00 N ATOM 1259 NH2 ARG A 86 6.100 -5.937 16.748 1.00 0.00 N ATOM 0 H ARG A 86 -0.013 -2.738 13.945 1.00 0.00 H new ATOM 0 HA ARG A 86 -0.059 -2.347 16.133 1.00 0.00 H new ATOM 0 HB2 ARG A 86 2.884 -3.085 16.276 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.720 -3.101 17.586 1.00 0.00 H new ATOM 0 HG2 ARG A 86 0.490 -4.948 16.489 1.00 0.00 H new ATOM 0 HG3 ARG A 86 1.620 -4.919 15.150 1.00 0.00 H new ATOM 0 HD2 ARG A 86 2.332 -5.508 18.052 1.00 0.00 H new ATOM 0 HD3 ARG A 86 2.165 -6.705 16.783 1.00 0.00 H new ATOM 0 HE ARG A 86 4.071 -4.765 15.914 1.00 0.00 H new ATOM 0 HH11 ARG A 86 3.655 -7.291 18.346 1.00 0.00 H new ATOM 0 HH12 ARG A 86 5.384 -7.639 18.446 1.00 0.00 H new ATOM 0 HH21 ARG A 86 6.289 -5.220 16.047 1.00 0.00 H new ATOM 0 HH22 ARG A 86 6.869 -6.472 17.151 1.00 0.00 H new ATOM 1273 N GLY A 87 1.278 -0.029 14.934 1.00 0.00 N ATOM 1274 CA GLY A 87 1.731 1.347 15.015 1.00 0.00 C ATOM 1275 C GLY A 87 3.101 1.544 14.396 1.00 0.00 C ATOM 1276 O GLY A 87 3.936 2.265 14.940 1.00 0.00 O ATOM 0 H GLY A 87 0.811 -0.276 14.061 1.00 0.00 H new ATOM 0 HA2 GLY A 87 1.012 1.993 14.512 1.00 0.00 H new ATOM 0 HA3 GLY A 87 1.760 1.656 16.060 1.00 0.00 H new ATOM 1280 N GLN A 88 3.331 0.900 13.256 1.00 0.00 N ATOM 1281 CA GLN A 88 4.610 1.006 12.564 1.00 0.00 C ATOM 1282 C GLN A 88 4.468 0.622 11.095 1.00 0.00 C ATOM 1283 O GLN A 88 4.136 -0.519 10.771 1.00 0.00 O ATOM 1284 CB GLN A 88 5.654 0.115 13.238 1.00 0.00 C ATOM 1285 CG GLN A 88 5.586 -1.340 12.802 1.00 0.00 C ATOM 1286 CD GLN A 88 6.239 -2.279 13.796 1.00 0.00 C ATOM 1287 OE1 GLN A 88 5.706 -2.523 14.879 1.00 0.00 O ATOM 1288 NE2 GLN A 88 7.399 -2.813 13.433 1.00 0.00 N ATOM 0 H GLN A 88 2.649 0.300 12.793 1.00 0.00 H new ATOM 0 HA GLN A 88 4.939 2.044 12.619 1.00 0.00 H new ATOM 0 HB2 GLN A 88 6.648 0.505 13.019 1.00 0.00 H new ATOM 0 HB3 GLN A 88 5.522 0.168 14.319 1.00 0.00 H new ATOM 0 HG2 GLN A 88 4.543 -1.627 12.669 1.00 0.00 H new ATOM 0 HG3 GLN A 88 6.073 -1.448 11.833 1.00 0.00 H new ATOM 0 HE21 GLN A 88 7.805 -2.583 12.526 1.00 0.00 H new ATOM 0 HE22 GLN A 88 7.885 -3.453 14.061 1.00 0.00 H new ATOM 1297 N HIS A 89 4.720 1.581 10.210 1.00 0.00 N ATOM 1298 CA HIS A 89 4.621 1.342 8.775 1.00 0.00 C ATOM 1299 C HIS A 89 5.501 0.168 8.357 1.00 0.00 C ATOM 1300 O HIS A 89 6.683 0.114 8.697 1.00 0.00 O ATOM 1301 CB HIS A 89 5.021 2.597 7.999 1.00 0.00 C ATOM 1302 CG HIS A 89 3.937 3.628 7.926 1.00 0.00 C ATOM 1303 ND1 HIS A 89 3.003 3.667 6.912 1.00 0.00 N ATOM 1304 CD2 HIS A 89 3.639 4.660 8.750 1.00 0.00 C ATOM 1305 CE1 HIS A 89 2.179 4.680 7.114 1.00 0.00 C ATOM 1306 NE2 HIS A 89 2.543 5.298 8.223 1.00 0.00 N ATOM 0 H HIS A 89 4.994 2.531 10.461 1.00 0.00 H new ATOM 0 HA HIS A 89 3.585 1.096 8.543 1.00 0.00 H new ATOM 0 HB2 HIS A 89 5.900 3.039 8.468 1.00 0.00 H new ATOM 0 HB3 HIS A 89 5.309 2.312 6.987 1.00 0.00 H new ATOM 0 HD2 HIS A 89 4.165 4.931 9.653 1.00 0.00 H new ATOM 0 HE1 HIS A 89 1.349 4.956 6.480 1.00 0.00 H new ATOM 0 HE2 HIS A 89 2.084 6.116 8.623 1.00 0.00 H new ATOM 1314 N VAL A 90 4.918 -0.769 7.617 1.00 0.00 N ATOM 1315 CA VAL A 90 5.649 -1.942 7.153 1.00 0.00 C ATOM 1316 C VAL A 90 6.538 -1.599 5.962 1.00 0.00 C ATOM 1317 O VAL A 90 6.589 -0.450 5.521 1.00 0.00 O ATOM 1318 CB VAL A 90 4.691 -3.079 6.753 1.00 0.00 C ATOM 1319 CG1 VAL A 90 3.856 -3.519 7.946 1.00 0.00 C ATOM 1320 CG2 VAL A 90 3.799 -2.644 5.600 1.00 0.00 C ATOM 0 H VAL A 90 3.941 -0.739 7.326 1.00 0.00 H new ATOM 0 HA VAL A 90 6.271 -2.277 7.983 1.00 0.00 H new ATOM 0 HB VAL A 90 5.285 -3.931 6.422 1.00 0.00 H new ATOM 0 HG11 VAL A 90 3.185 -4.323 7.644 1.00 0.00 H new ATOM 0 HG12 VAL A 90 4.514 -3.874 8.739 1.00 0.00 H new ATOM 0 HG13 VAL A 90 3.270 -2.675 8.311 1.00 0.00 H new ATOM 0 HG21 VAL A 90 3.129 -3.460 5.331 1.00 0.00 H new ATOM 0 HG22 VAL A 90 3.212 -1.777 5.901 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.417 -2.383 4.741 1.00 0.00 H new ATOM 1330 N THR A 91 7.238 -2.604 5.445 1.00 0.00 N ATOM 1331 CA THR A 91 8.126 -2.409 4.305 1.00 0.00 C ATOM 1332 C THR A 91 7.389 -1.762 3.138 1.00 0.00 C ATOM 1333 O THR A 91 6.229 -2.075 2.873 1.00 0.00 O ATOM 1334 CB THR A 91 8.737 -3.743 3.835 1.00 0.00 C ATOM 1335 OG1 THR A 91 9.413 -4.382 4.923 1.00 0.00 O ATOM 1336 CG2 THR A 91 9.710 -3.518 2.688 1.00 0.00 C ATOM 0 H THR A 91 7.207 -3.561 5.797 1.00 0.00 H new ATOM 0 HA THR A 91 8.926 -1.748 4.637 1.00 0.00 H new ATOM 0 HB THR A 91 7.929 -4.384 3.484 1.00 0.00 H new ATOM 0 HG1 THR A 91 9.797 -5.230 4.617 1.00 0.00 H new ATOM 0 HG21 THR A 91 10.129 -4.474 2.373 1.00 0.00 H new ATOM 0 HG22 THR A 91 9.185 -3.058 1.851 1.00 0.00 H new ATOM 0 HG23 THR A 91 10.515 -2.860 3.017 1.00 0.00 H new ATOM 1344 N GLY A 92 8.070 -0.856 2.443 1.00 0.00 N ATOM 1345 CA GLY A 92 7.464 -0.179 1.312 1.00 0.00 C ATOM 1346 C GLY A 92 6.169 0.518 1.679 1.00 0.00 C ATOM 1347 O GLY A 92 5.333 0.785 0.816 1.00 0.00 O ATOM 0 H GLY A 92 9.031 -0.579 2.643 1.00 0.00 H new ATOM 0 HA2 GLY A 92 8.166 0.553 0.912 1.00 0.00 H new ATOM 0 HA3 GLY A 92 7.272 -0.903 0.520 1.00 0.00 H new ATOM 1351 N SER A 93 6.001 0.811 2.964 1.00 0.00 N ATOM 1352 CA SER A 93 4.796 1.476 3.445 1.00 0.00 C ATOM 1353 C SER A 93 5.103 2.904 3.888 1.00 0.00 C ATOM 1354 O SER A 93 6.155 3.191 4.459 1.00 0.00 O ATOM 1355 CB SER A 93 4.183 0.691 4.606 1.00 0.00 C ATOM 1356 OG SER A 93 2.773 0.834 4.631 1.00 0.00 O ATOM 0 H SER A 93 6.684 0.598 3.691 1.00 0.00 H new ATOM 0 HA SER A 93 4.080 1.515 2.624 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.443 -0.363 4.513 1.00 0.00 H new ATOM 0 HB3 SER A 93 4.604 1.042 5.548 1.00 0.00 H new ATOM 0 HG SER A 93 2.426 0.509 5.488 1.00 0.00 H new ATOM 1362 N PRO A 94 4.162 3.821 3.619 1.00 0.00 N ATOM 1363 CA PRO A 94 2.906 3.491 2.940 1.00 0.00 C ATOM 1364 C PRO A 94 3.117 3.135 1.472 1.00 0.00 C ATOM 1365 O PRO A 94 4.186 3.377 0.912 1.00 0.00 O ATOM 1366 CB PRO A 94 2.086 4.778 3.065 1.00 0.00 C ATOM 1367 CG PRO A 94 3.100 5.860 3.208 1.00 0.00 C ATOM 1368 CD PRO A 94 4.253 5.252 3.957 1.00 0.00 C ATOM 0 HA PRO A 94 2.423 2.617 3.378 1.00 0.00 H new ATOM 0 HB2 PRO A 94 1.460 4.936 2.187 1.00 0.00 H new ATOM 0 HB3 PRO A 94 1.421 4.742 3.928 1.00 0.00 H new ATOM 0 HG2 PRO A 94 3.419 6.227 2.232 1.00 0.00 H new ATOM 0 HG3 PRO A 94 2.688 6.711 3.750 1.00 0.00 H new ATOM 0 HD2 PRO A 94 5.206 5.679 3.644 1.00 0.00 H new ATOM 0 HD3 PRO A 94 4.167 5.418 5.031 1.00 0.00 H new ATOM 1376 N PHE A 95 2.091 2.558 0.855 1.00 0.00 N ATOM 1377 CA PHE A 95 2.165 2.168 -0.548 1.00 0.00 C ATOM 1378 C PHE A 95 1.490 3.208 -1.438 1.00 0.00 C ATOM 1379 O PHE A 95 0.398 3.686 -1.133 1.00 0.00 O ATOM 1380 CB PHE A 95 1.508 0.801 -0.754 1.00 0.00 C ATOM 1381 CG PHE A 95 2.218 -0.318 -0.047 1.00 0.00 C ATOM 1382 CD1 PHE A 95 3.361 -0.883 -0.588 1.00 0.00 C ATOM 1383 CD2 PHE A 95 1.741 -0.805 1.160 1.00 0.00 C ATOM 1384 CE1 PHE A 95 4.017 -1.912 0.060 1.00 0.00 C ATOM 1385 CE2 PHE A 95 2.393 -1.834 1.813 1.00 0.00 C ATOM 1386 CZ PHE A 95 3.531 -2.389 1.262 1.00 0.00 C ATOM 0 H PHE A 95 1.199 2.350 1.304 1.00 0.00 H new ATOM 0 HA PHE A 95 3.217 2.104 -0.827 1.00 0.00 H new ATOM 0 HB2 PHE A 95 0.477 0.846 -0.403 1.00 0.00 H new ATOM 0 HB3 PHE A 95 1.472 0.581 -1.821 1.00 0.00 H new ATOM 0 HD1 PHE A 95 3.744 -0.515 -1.528 1.00 0.00 H new ATOM 0 HD2 PHE A 95 0.850 -0.376 1.595 1.00 0.00 H new ATOM 0 HE1 PHE A 95 4.908 -2.343 -0.372 1.00 0.00 H new ATOM 0 HE2 PHE A 95 2.013 -2.204 2.754 1.00 0.00 H new ATOM 0 HZ PHE A 95 4.040 -3.195 1.770 1.00 0.00 H new ATOM 1396 N GLN A 96 2.151 3.553 -2.539 1.00 0.00 N ATOM 1397 CA GLN A 96 1.616 4.537 -3.472 1.00 0.00 C ATOM 1398 C GLN A 96 1.532 3.961 -4.882 1.00 0.00 C ATOM 1399 O GLN A 96 2.519 3.455 -5.416 1.00 0.00 O ATOM 1400 CB GLN A 96 2.487 5.795 -3.474 1.00 0.00 C ATOM 1401 CG GLN A 96 2.057 6.834 -2.450 1.00 0.00 C ATOM 1402 CD GLN A 96 2.989 8.028 -2.403 1.00 0.00 C ATOM 1403 OE1 GLN A 96 4.139 7.916 -1.976 1.00 0.00 O ATOM 1404 NE2 GLN A 96 2.498 9.180 -2.843 1.00 0.00 N ATOM 0 H GLN A 96 3.056 3.166 -2.806 1.00 0.00 H new ATOM 0 HA GLN A 96 0.610 4.800 -3.146 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.521 5.511 -3.279 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.461 6.243 -4.467 1.00 0.00 H new ATOM 0 HG2 GLN A 96 1.048 7.174 -2.685 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.016 6.371 -1.464 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.539 9.227 -3.188 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.079 10.018 -2.836 1.00 0.00 H new ATOM 1413 N PHE A 97 0.348 4.041 -5.479 1.00 0.00 N ATOM 1414 CA PHE A 97 0.135 3.526 -6.827 1.00 0.00 C ATOM 1415 C PHE A 97 -0.875 4.384 -7.583 1.00 0.00 C ATOM 1416 O PHE A 97 -1.842 4.882 -7.005 1.00 0.00 O ATOM 1417 CB PHE A 97 -0.351 2.077 -6.771 1.00 0.00 C ATOM 1418 CG PHE A 97 -1.713 1.924 -6.155 1.00 0.00 C ATOM 1419 CD1 PHE A 97 -2.855 2.046 -6.929 1.00 0.00 C ATOM 1420 CD2 PHE A 97 -1.850 1.659 -4.802 1.00 0.00 C ATOM 1421 CE1 PHE A 97 -4.110 1.906 -6.366 1.00 0.00 C ATOM 1422 CE2 PHE A 97 -3.102 1.517 -4.234 1.00 0.00 C ATOM 1423 CZ PHE A 97 -4.233 1.642 -5.016 1.00 0.00 C ATOM 0 H PHE A 97 -0.479 4.457 -5.051 1.00 0.00 H new ATOM 0 HA PHE A 97 1.086 3.563 -7.358 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -0.370 1.670 -7.782 1.00 0.00 H new ATOM 0 HB3 PHE A 97 0.365 1.484 -6.202 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -2.764 2.253 -7.985 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -0.969 1.562 -4.185 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -4.993 2.003 -6.981 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -3.196 1.308 -3.179 1.00 0.00 H new ATOM 0 HZ PHE A 97 -5.212 1.534 -4.573 1.00 0.00 H new ATOM 1433 N THR A 98 -0.644 4.554 -8.881 1.00 0.00 N ATOM 1434 CA THR A 98 -1.531 5.352 -9.718 1.00 0.00 C ATOM 1435 C THR A 98 -2.628 4.491 -10.334 1.00 0.00 C ATOM 1436 O THR A 98 -2.389 3.349 -10.725 1.00 0.00 O ATOM 1437 CB THR A 98 -0.755 6.059 -10.845 1.00 0.00 C ATOM 1438 OG1 THR A 98 -1.546 7.120 -11.393 1.00 0.00 O ATOM 1439 CG2 THR A 98 -0.383 5.077 -11.945 1.00 0.00 C ATOM 0 H THR A 98 0.151 4.149 -9.376 1.00 0.00 H new ATOM 0 HA THR A 98 -1.983 6.104 -9.072 1.00 0.00 H new ATOM 0 HB THR A 98 0.162 6.470 -10.422 1.00 0.00 H new ATOM 0 HG1 THR A 98 -1.045 7.566 -12.108 1.00 0.00 H new ATOM 0 HG21 THR A 98 0.164 5.600 -12.730 1.00 0.00 H new ATOM 0 HG22 THR A 98 0.243 4.287 -11.531 1.00 0.00 H new ATOM 0 HG23 THR A 98 -1.289 4.640 -12.364 1.00 0.00 H new ATOM 1447 N VAL A 99 -3.833 5.047 -10.419 1.00 0.00 N ATOM 1448 CA VAL A 99 -4.967 4.330 -10.990 1.00 0.00 C ATOM 1449 C VAL A 99 -5.485 5.029 -12.242 1.00 0.00 C ATOM 1450 O VAL A 99 -5.308 6.235 -12.411 1.00 0.00 O ATOM 1451 CB VAL A 99 -6.118 4.201 -9.974 1.00 0.00 C ATOM 1452 CG1 VAL A 99 -7.163 3.215 -10.474 1.00 0.00 C ATOM 1453 CG2 VAL A 99 -5.583 3.780 -8.614 1.00 0.00 C ATOM 0 H VAL A 99 -4.049 5.991 -10.100 1.00 0.00 H new ATOM 0 HA VAL A 99 -4.612 3.334 -11.254 1.00 0.00 H new ATOM 0 HB VAL A 99 -6.595 5.175 -9.865 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -7.968 3.137 -9.744 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -7.568 3.564 -11.424 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -6.703 2.237 -10.613 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -6.410 3.694 -7.909 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -5.080 2.817 -8.703 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -4.875 4.527 -8.254 1.00 0.00 H new ATOM 1463 N GLY A 100 -6.126 4.262 -13.119 1.00 0.00 N ATOM 1464 CA GLY A 100 -6.660 4.825 -14.345 1.00 0.00 C ATOM 1465 C GLY A 100 -8.159 4.634 -14.465 1.00 0.00 C ATOM 1466 O GLY A 100 -8.719 3.640 -14.003 1.00 0.00 O ATOM 0 H GLY A 100 -6.285 3.261 -13.002 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -6.428 5.889 -14.384 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -6.168 4.360 -15.199 1.00 0.00 H new ATOM 1470 N PRO A 101 -8.834 5.605 -15.099 1.00 0.00 N ATOM 1471 CA PRO A 101 -10.287 5.563 -15.292 1.00 0.00 C ATOM 1472 C PRO A 101 -10.708 4.486 -16.287 1.00 0.00 C ATOM 1473 O PRO A 101 -9.907 3.631 -16.668 1.00 0.00 O ATOM 1474 CB PRO A 101 -10.612 6.954 -15.841 1.00 0.00 C ATOM 1475 CG PRO A 101 -9.350 7.411 -16.487 1.00 0.00 C ATOM 1476 CD PRO A 101 -8.231 6.818 -15.676 1.00 0.00 C ATOM 0 HA PRO A 101 -10.814 5.320 -14.369 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -11.432 6.915 -16.558 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -10.917 7.633 -15.044 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -9.300 7.078 -17.524 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -9.289 8.499 -16.498 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -7.367 6.581 -16.297 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -7.889 7.504 -14.901 1.00 0.00 H new ATOM 1484 N LEU A 102 -11.968 4.533 -16.704 1.00 0.00 N ATOM 1485 CA LEU A 102 -12.496 3.562 -17.656 1.00 0.00 C ATOM 1486 C LEU A 102 -12.910 4.243 -18.956 1.00 0.00 C ATOM 1487 O LEU A 102 -12.855 5.466 -19.073 1.00 0.00 O ATOM 1488 CB LEU A 102 -13.690 2.823 -17.050 1.00 0.00 C ATOM 1489 CG LEU A 102 -15.033 3.551 -17.116 1.00 0.00 C ATOM 1490 CD1 LEU A 102 -16.183 2.561 -17.006 1.00 0.00 C ATOM 1491 CD2 LEU A 102 -15.125 4.601 -16.018 1.00 0.00 C ATOM 0 H LEU A 102 -12.643 5.233 -16.398 1.00 0.00 H new ATOM 0 HA LEU A 102 -11.708 2.844 -17.880 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -13.794 1.864 -17.557 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -13.467 2.608 -16.005 1.00 0.00 H new ATOM 0 HG LEU A 102 -15.104 4.054 -18.080 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -17.131 3.097 -17.055 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -16.128 1.846 -17.827 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -16.116 2.029 -16.057 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -16.087 5.109 -16.080 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -15.031 4.119 -15.045 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -14.322 5.328 -16.142 1.00 0.00 H new ATOM 1503 N GLY A 103 -13.328 3.441 -19.931 1.00 0.00 N ATOM 1504 CA GLY A 103 -13.749 3.984 -21.210 1.00 0.00 C ATOM 1505 C GLY A 103 -13.254 3.160 -22.381 1.00 0.00 C ATOM 1506 O GLY A 103 -13.498 1.955 -22.447 1.00 0.00 O ATOM 0 H GLY A 103 -13.383 2.425 -19.858 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -14.837 4.034 -21.239 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -13.380 5.005 -21.307 1.00 0.00 H new ATOM 1510 N GLU A 104 -12.557 3.809 -23.308 1.00 0.00 N ATOM 1511 CA GLU A 104 -12.029 3.127 -24.484 1.00 0.00 C ATOM 1512 C GLU A 104 -10.864 3.907 -25.088 1.00 0.00 C ATOM 1513 O GLU A 104 -11.021 5.053 -25.506 1.00 0.00 O ATOM 1514 CB GLU A 104 -13.130 2.942 -25.531 1.00 0.00 C ATOM 1515 CG GLU A 104 -12.655 2.253 -26.799 1.00 0.00 C ATOM 1516 CD GLU A 104 -13.801 1.757 -27.658 1.00 0.00 C ATOM 1517 OE1 GLU A 104 -14.358 0.684 -27.342 1.00 0.00 O ATOM 1518 OE2 GLU A 104 -14.142 2.440 -28.646 1.00 0.00 O ATOM 0 H GLU A 104 -12.345 4.806 -23.268 1.00 0.00 H new ATOM 0 HA GLU A 104 -11.666 2.148 -24.172 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -13.941 2.360 -25.094 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.541 3.918 -25.790 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -12.046 2.947 -27.378 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -12.015 1.412 -26.533 1.00 0.00 H new ATOM 1525 N GLY A 105 -9.695 3.275 -25.129 1.00 0.00 N ATOM 1526 CA GLY A 105 -8.521 3.923 -25.682 1.00 0.00 C ATOM 1527 C GLY A 105 -7.234 3.227 -25.286 1.00 0.00 C ATOM 1528 O GLY A 105 -6.258 3.876 -24.911 1.00 0.00 O ATOM 0 H GLY A 105 -9.540 2.326 -24.789 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -8.599 3.944 -26.769 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -8.489 4.959 -25.345 1.00 0.00 H new ATOM 1532 N GLY A 106 -7.231 1.900 -25.367 1.00 0.00 N ATOM 1533 CA GLY A 106 -6.049 1.137 -25.009 1.00 0.00 C ATOM 1534 C GLY A 106 -5.807 1.111 -23.513 1.00 0.00 C ATOM 1535 O GLY A 106 -6.653 0.647 -22.749 1.00 0.00 O ATOM 0 H GLY A 106 -8.026 1.340 -25.674 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -6.155 0.116 -25.375 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -5.179 1.565 -25.507 1.00 0.00 H new TER 1539 GLY A 106