USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 949 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 18 ASN : amide:sc= 0.00971 X(o=0.019,f=0.12) USER MOD Set 1.2: A 124 THR OG1 : rot 180:sc= 0.00881 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl -171:sc= -0.148 (180deg=-0.286) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 33:sc=-0.00492 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 120:sc= -0.386 USER MOD Single : A 36 LYS NZ :NH3+ 148:sc= -0.812 (180deg=-1.94!) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 153:sc= 0.343 USER MOD Single : A 43 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.456) USER MOD Single : A 44 LYS NZ :NH3+ 172:sc= -0.754 (180deg=-0.904) USER MOD Single : A 47 ASN : amide:sc= -1.51 K(o=-1.5,f=-2.3!) USER MOD Single : A 50 ASN :FLIP amide:sc= -0.785 F(o=-4!,f=-0.78) USER MOD Single : A 54 ASN : amide:sc= -2.49! X(o=-2.5!,f=-2.9) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 35:sc= 1.27 USER MOD Single : A 71 SER OG : rot 180:sc= -0.885 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -53:sc= 0.182 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= -0.205 USER MOD Single : A 102 GLN : amide:sc= -0.213 K(o=-0.21,f=-0.83) USER MOD Single : A 103 SER OG : rot 54:sc= 0.335 USER MOD Single : A 105 SER OG : rot 36:sc= 0.712 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= -0.553 K(o=-0.55,f=-11!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc= -0.129 X(o=-0.13,f=-0.49) USER MOD Single : A 121 THR OG1 : rot -55:sc= 0.525 USER MOD Single : A 131 TYR OH : rot 163:sc= 0.384 USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 6 -8.096 -22.788 2.745 1.00 0.00 N ATOM 49 CA SER A 6 -7.846 -22.791 1.309 1.00 0.00 C ATOM 50 C SER A 6 -6.913 -21.649 0.917 1.00 0.00 C ATOM 51 O SER A 6 -7.058 -21.051 -0.148 1.00 0.00 O ATOM 52 CB SER A 6 -9.164 -22.674 0.540 1.00 0.00 C ATOM 53 OG SER A 6 -9.846 -23.916 0.504 1.00 0.00 O ATOM 0 HA SER A 6 -7.365 -23.735 1.051 1.00 0.00 H new ATOM 0 HB2 SER A 6 -9.797 -21.921 1.010 1.00 0.00 H new ATOM 0 HB3 SER A 6 -8.966 -22.335 -0.477 1.00 0.00 H new ATOM 0 HG SER A 6 -10.685 -23.814 0.009 1.00 0.00 H new ATOM 59 N GLY A 7 -5.953 -21.352 1.788 1.00 0.00 N ATOM 60 CA GLY A 7 -5.010 -20.283 1.517 1.00 0.00 C ATOM 61 C GLY A 7 -5.689 -18.939 1.349 1.00 0.00 C ATOM 62 O GLY A 7 -6.763 -18.849 0.755 1.00 0.00 O ATOM 0 H GLY A 7 -5.812 -21.833 2.676 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.290 -20.223 2.333 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.449 -20.518 0.613 1.00 0.00 H new ATOM 66 N MET A 8 -5.063 -17.891 1.876 1.00 0.00 N ATOM 67 CA MET A 8 -5.615 -16.545 1.781 1.00 0.00 C ATOM 68 C MET A 8 -4.531 -15.496 2.008 1.00 0.00 C ATOM 69 O MET A 8 -3.860 -15.496 3.041 1.00 0.00 O ATOM 70 CB MET A 8 -6.742 -16.360 2.800 1.00 0.00 C ATOM 71 CG MET A 8 -7.052 -14.904 3.105 1.00 0.00 C ATOM 72 SD MET A 8 -8.756 -14.653 3.638 1.00 0.00 S ATOM 73 CE MET A 8 -9.523 -14.157 2.097 1.00 0.00 C ATOM 0 H MET A 8 -4.174 -17.948 2.373 1.00 0.00 H new ATOM 0 HA MET A 8 -6.018 -16.414 0.777 1.00 0.00 H new ATOM 0 HB2 MET A 8 -7.644 -16.844 2.424 1.00 0.00 H new ATOM 0 HB3 MET A 8 -6.470 -16.867 3.726 1.00 0.00 H new ATOM 0 HG2 MET A 8 -6.376 -14.548 3.883 1.00 0.00 H new ATOM 0 HG3 MET A 8 -6.861 -14.302 2.217 1.00 0.00 H new ATOM 0 HE1 MET A 8 -10.539 -13.813 2.291 1.00 0.00 H new ATOM 0 HE2 MET A 8 -8.946 -13.350 1.647 1.00 0.00 H new ATOM 0 HE3 MET A 8 -9.552 -15.007 1.415 1.00 0.00 H new ATOM 83 N LEU A 9 -4.365 -14.604 1.038 1.00 0.00 N ATOM 84 CA LEU A 9 -3.362 -13.549 1.132 1.00 0.00 C ATOM 85 C LEU A 9 -3.969 -12.269 1.697 1.00 0.00 C ATOM 86 O LEU A 9 -5.006 -11.802 1.225 1.00 0.00 O ATOM 87 CB LEU A 9 -2.752 -13.274 -0.243 1.00 0.00 C ATOM 88 CG LEU A 9 -1.786 -12.092 -0.325 1.00 0.00 C ATOM 89 CD1 LEU A 9 -0.371 -12.534 0.017 1.00 0.00 C ATOM 90 CD2 LEU A 9 -1.830 -11.461 -1.709 1.00 0.00 C ATOM 0 H LEU A 9 -4.912 -14.590 0.177 1.00 0.00 H new ATOM 0 HA LEU A 9 -2.578 -13.887 1.809 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -2.226 -14.171 -0.571 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -3.563 -13.104 -0.951 1.00 0.00 H new ATOM 0 HG LEU A 9 -2.097 -11.343 0.403 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.303 -11.679 -0.047 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.351 -12.938 1.029 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -0.050 -13.302 -0.686 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -1.136 -10.621 -1.748 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -1.546 -12.202 -2.456 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -2.840 -11.107 -1.915 1.00 0.00 H new ATOM 102 N ARG A 10 -3.316 -11.705 2.707 1.00 0.00 N ATOM 103 CA ARG A 10 -3.791 -10.478 3.335 1.00 0.00 C ATOM 104 C ARG A 10 -2.808 -9.334 3.106 1.00 0.00 C ATOM 105 O ARG A 10 -1.617 -9.458 3.391 1.00 0.00 O ATOM 106 CB ARG A 10 -3.996 -10.695 4.836 1.00 0.00 C ATOM 107 CG ARG A 10 -5.389 -11.188 5.195 1.00 0.00 C ATOM 108 CD ARG A 10 -5.610 -11.184 6.700 1.00 0.00 C ATOM 109 NE ARG A 10 -6.795 -11.948 7.080 1.00 0.00 N ATOM 110 CZ ARG A 10 -7.121 -12.220 8.339 1.00 0.00 C ATOM 111 NH1 ARG A 10 -6.354 -11.792 9.333 1.00 0.00 N ATOM 112 NH2 ARG A 10 -8.215 -12.921 8.606 1.00 0.00 N ATOM 0 H ARG A 10 -2.456 -12.078 3.108 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.745 -10.212 2.879 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -3.261 -11.416 5.194 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -3.805 -9.758 5.360 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -6.135 -10.555 4.715 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.530 -12.197 4.808 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -4.734 -11.602 7.196 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -5.714 -10.156 7.049 1.00 0.00 H new ATOM 0 HE ARG A 10 -7.406 -12.291 6.339 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -5.512 -11.253 9.132 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -6.606 -12.002 10.299 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -8.807 -13.252 7.844 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -8.464 -13.129 9.573 1.00 0.00 H new ATOM 126 N VAL A 11 -3.315 -8.220 2.587 1.00 0.00 N ATOM 127 CA VAL A 11 -2.483 -7.054 2.319 1.00 0.00 C ATOM 128 C VAL A 11 -2.927 -5.858 3.155 1.00 0.00 C ATOM 129 O VAL A 11 -3.887 -5.169 2.809 1.00 0.00 O ATOM 130 CB VAL A 11 -2.521 -6.667 0.829 1.00 0.00 C ATOM 131 CG1 VAL A 11 -1.515 -5.564 0.537 1.00 0.00 C ATOM 132 CG2 VAL A 11 -2.258 -7.885 -0.044 1.00 0.00 C ATOM 0 H VAL A 11 -4.298 -8.101 2.344 1.00 0.00 H new ATOM 0 HA VAL A 11 -1.463 -7.325 2.590 1.00 0.00 H new ATOM 0 HB VAL A 11 -3.516 -6.288 0.595 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -1.557 -5.304 -0.521 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -1.754 -4.685 1.136 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -0.512 -5.911 0.786 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -2.289 -7.594 -1.094 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.276 -8.295 0.190 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -3.021 -8.640 0.145 1.00 0.00 H new ATOM 142 N ILE A 12 -2.222 -5.618 4.255 1.00 0.00 N ATOM 143 CA ILE A 12 -2.542 -4.504 5.139 1.00 0.00 C ATOM 144 C ILE A 12 -1.893 -3.213 4.654 1.00 0.00 C ATOM 145 O ILE A 12 -0.679 -3.149 4.464 1.00 0.00 O ATOM 146 CB ILE A 12 -2.087 -4.783 6.584 1.00 0.00 C ATOM 147 CG1 ILE A 12 -2.605 -6.145 7.051 1.00 0.00 C ATOM 148 CG2 ILE A 12 -2.569 -3.680 7.514 1.00 0.00 C ATOM 149 CD1 ILE A 12 -1.758 -6.774 8.135 1.00 0.00 C ATOM 0 H ILE A 12 -1.426 -6.180 4.556 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.626 -4.391 5.124 1.00 0.00 H new ATOM 0 HB ILE A 12 -0.997 -4.802 6.609 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -3.625 -6.030 7.419 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.648 -6.821 6.197 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.239 -3.892 8.531 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -2.156 -2.725 7.190 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -3.658 -3.632 7.488 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.184 -7.737 8.417 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -0.743 -6.921 7.765 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.735 -6.118 9.005 1.00 0.00 H new ATOM 161 N VAL A 13 -2.711 -2.184 4.457 1.00 0.00 N ATOM 162 CA VAL A 13 -2.217 -0.892 3.996 1.00 0.00 C ATOM 163 C VAL A 13 -2.119 0.101 5.149 1.00 0.00 C ATOM 164 O VAL A 13 -3.091 0.779 5.481 1.00 0.00 O ATOM 165 CB VAL A 13 -3.125 -0.301 2.901 1.00 0.00 C ATOM 166 CG1 VAL A 13 -2.538 0.994 2.361 1.00 0.00 C ATOM 167 CG2 VAL A 13 -3.332 -1.310 1.780 1.00 0.00 C ATOM 0 H VAL A 13 -3.719 -2.220 4.609 1.00 0.00 H new ATOM 0 HA VAL A 13 -1.224 -1.063 3.581 1.00 0.00 H new ATOM 0 HB VAL A 13 -4.096 -0.075 3.341 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.193 1.396 1.589 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -2.445 1.717 3.171 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -1.554 0.798 1.936 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -3.976 -0.877 1.015 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -2.369 -1.568 1.340 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -3.800 -2.209 2.181 1.00 0.00 H new ATOM 177 N GLU A 14 -0.938 0.182 5.755 1.00 0.00 N ATOM 178 CA GLU A 14 -0.714 1.093 6.871 1.00 0.00 C ATOM 179 C GLU A 14 -0.999 2.535 6.462 1.00 0.00 C ATOM 180 O GLU A 14 -2.027 3.104 6.831 1.00 0.00 O ATOM 181 CB GLU A 14 0.725 0.970 7.377 1.00 0.00 C ATOM 182 CG GLU A 14 1.059 -0.404 7.934 1.00 0.00 C ATOM 183 CD GLU A 14 -0.023 -0.941 8.849 1.00 0.00 C ATOM 184 OE1 GLU A 14 -0.506 -0.175 9.710 1.00 0.00 O ATOM 185 OE2 GLU A 14 -0.388 -2.127 8.705 1.00 0.00 O ATOM 0 H GLU A 14 -0.123 -0.372 5.492 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.399 0.819 7.673 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.409 1.198 6.560 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.894 1.718 8.152 1.00 0.00 H new ATOM 0 HG2 GLU A 14 1.210 -1.100 7.109 1.00 0.00 H new ATOM 0 HG3 GLU A 14 2.000 -0.351 8.482 1.00 0.00 H new ATOM 192 N SER A 15 -0.082 3.121 5.699 1.00 0.00 N ATOM 193 CA SER A 15 -0.232 4.498 5.244 1.00 0.00 C ATOM 194 C SER A 15 0.893 4.879 4.287 1.00 0.00 C ATOM 195 O SER A 15 1.845 4.122 4.098 1.00 0.00 O ATOM 196 CB SER A 15 -0.248 5.453 6.438 1.00 0.00 C ATOM 197 OG SER A 15 0.842 5.201 7.308 1.00 0.00 O ATOM 0 H SER A 15 0.773 2.663 5.383 1.00 0.00 H new ATOM 0 HA SER A 15 -1.180 4.578 4.712 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.204 6.483 6.084 1.00 0.00 H new ATOM 0 HB3 SER A 15 -1.185 5.343 6.983 1.00 0.00 H new ATOM 0 HG SER A 15 0.810 5.826 8.062 1.00 0.00 H new ATOM 203 N ALA A 16 0.777 6.059 3.687 1.00 0.00 N ATOM 204 CA ALA A 16 1.784 6.544 2.752 1.00 0.00 C ATOM 205 C ALA A 16 2.272 7.935 3.142 1.00 0.00 C ATOM 206 O ALA A 16 1.614 8.642 3.904 1.00 0.00 O ATOM 207 CB ALA A 16 1.228 6.555 1.336 1.00 0.00 C ATOM 0 H ALA A 16 -0.005 6.697 3.832 1.00 0.00 H new ATOM 0 HA ALA A 16 2.636 5.865 2.791 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.991 6.920 0.648 1.00 0.00 H new ATOM 0 HB2 ALA A 16 0.936 5.544 1.052 1.00 0.00 H new ATOM 0 HB3 ALA A 16 0.357 7.209 1.292 1.00 0.00 H new ATOM 213 N SER A 17 3.430 8.320 2.615 1.00 0.00 N ATOM 214 CA SER A 17 4.008 9.625 2.912 1.00 0.00 C ATOM 215 C SER A 17 4.901 10.097 1.768 1.00 0.00 C ATOM 216 O SER A 17 5.296 9.310 0.910 1.00 0.00 O ATOM 217 CB SER A 17 4.813 9.566 4.211 1.00 0.00 C ATOM 218 OG SER A 17 3.961 9.615 5.342 1.00 0.00 O ATOM 0 H SER A 17 3.986 7.747 1.980 1.00 0.00 H new ATOM 0 HA SER A 17 3.192 10.338 3.031 1.00 0.00 H new ATOM 0 HB2 SER A 17 5.403 8.650 4.236 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.516 10.398 4.245 1.00 0.00 H new ATOM 0 HG SER A 17 3.113 9.170 5.132 1.00 0.00 H new ATOM 224 N ASN A 18 5.214 11.389 1.765 1.00 0.00 N ATOM 225 CA ASN A 18 6.060 11.967 0.727 1.00 0.00 C ATOM 226 C ASN A 18 5.365 11.920 -0.630 1.00 0.00 C ATOM 227 O ASN A 18 5.966 11.535 -1.634 1.00 0.00 O ATOM 228 CB ASN A 18 7.395 11.224 0.655 1.00 0.00 C ATOM 229 CG ASN A 18 8.088 11.148 2.002 1.00 0.00 C ATOM 230 OD1 ASN A 18 8.634 12.138 2.489 1.00 0.00 O ATOM 231 ND2 ASN A 18 8.068 9.968 2.611 1.00 0.00 N ATOM 0 H ASN A 18 4.895 12.055 2.469 1.00 0.00 H new ATOM 0 HA ASN A 18 6.246 13.010 0.984 1.00 0.00 H new ATOM 0 HB2 ASN A 18 7.226 10.215 0.279 1.00 0.00 H new ATOM 0 HB3 ASN A 18 8.049 11.725 -0.059 1.00 0.00 H new ATOM 0 HD21 ASN A 18 8.517 9.855 3.520 1.00 0.00 H new ATOM 0 HD22 ASN A 18 7.603 9.174 2.170 1.00 0.00 H new ATOM 238 N ILE A 19 4.096 12.313 -0.653 1.00 0.00 N ATOM 239 CA ILE A 19 3.320 12.317 -1.887 1.00 0.00 C ATOM 240 C ILE A 19 3.437 13.657 -2.606 1.00 0.00 C ATOM 241 O ILE A 19 3.328 14.724 -2.003 1.00 0.00 O ATOM 242 CB ILE A 19 1.833 12.020 -1.618 1.00 0.00 C ATOM 243 CG1 ILE A 19 1.667 10.609 -1.048 1.00 0.00 C ATOM 244 CG2 ILE A 19 1.021 12.180 -2.895 1.00 0.00 C ATOM 245 CD1 ILE A 19 0.246 10.096 -1.110 1.00 0.00 C ATOM 0 H ILE A 19 3.583 12.633 0.169 1.00 0.00 H new ATOM 0 HA ILE A 19 3.731 11.530 -2.520 1.00 0.00 H new ATOM 0 HB ILE A 19 1.462 12.735 -0.883 1.00 0.00 H new ATOM 0 HG12 ILE A 19 2.316 9.926 -1.596 1.00 0.00 H new ATOM 0 HG13 ILE A 19 2.002 10.603 -0.011 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -0.028 11.967 -2.688 1.00 0.00 H new ATOM 0 HG22 ILE A 19 1.118 13.202 -3.262 1.00 0.00 H new ATOM 0 HG23 ILE A 19 1.390 11.486 -3.650 1.00 0.00 H new ATOM 0 HD11 ILE A 19 0.203 9.091 -0.689 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.405 10.757 -0.538 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -0.086 10.069 -2.148 1.00 0.00 H new ATOM 257 N PRO A 20 3.662 13.601 -3.927 1.00 0.00 N ATOM 258 CA PRO A 20 3.796 14.802 -4.758 1.00 0.00 C ATOM 259 C PRO A 20 2.476 15.548 -4.915 1.00 0.00 C ATOM 260 O PRO A 20 1.606 15.137 -5.683 1.00 0.00 O ATOM 261 CB PRO A 20 4.262 14.249 -6.107 1.00 0.00 C ATOM 262 CG PRO A 20 3.761 12.846 -6.135 1.00 0.00 C ATOM 263 CD PRO A 20 3.803 12.363 -4.712 1.00 0.00 C ATOM 0 HA PRO A 20 4.481 15.527 -4.319 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.856 14.831 -6.935 1.00 0.00 H new ATOM 0 HB3 PRO A 20 5.348 14.283 -6.195 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.747 12.802 -6.532 1.00 0.00 H new ATOM 0 HG3 PRO A 20 4.383 12.222 -6.777 1.00 0.00 H new ATOM 0 HD2 PRO A 20 2.997 11.660 -4.502 1.00 0.00 H new ATOM 0 HD3 PRO A 20 4.739 11.850 -4.489 1.00 0.00 H new ATOM 271 N LYS A 21 2.334 16.649 -4.184 1.00 0.00 N ATOM 272 CA LYS A 21 1.120 17.455 -4.243 1.00 0.00 C ATOM 273 C LYS A 21 0.941 18.068 -5.628 1.00 0.00 C ATOM 274 O LYS A 21 1.754 17.847 -6.527 1.00 0.00 O ATOM 275 CB LYS A 21 1.166 18.561 -3.186 1.00 0.00 C ATOM 276 CG LYS A 21 2.416 19.422 -3.261 1.00 0.00 C ATOM 277 CD LYS A 21 2.280 20.675 -2.413 1.00 0.00 C ATOM 278 CE LYS A 21 3.628 21.134 -1.877 1.00 0.00 C ATOM 279 NZ LYS A 21 3.634 22.590 -1.564 1.00 0.00 N ATOM 0 H LYS A 21 3.045 17.003 -3.544 1.00 0.00 H new ATOM 0 HA LYS A 21 0.270 16.803 -4.041 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.289 19.198 -3.300 1.00 0.00 H new ATOM 0 HB3 LYS A 21 1.105 18.109 -2.196 1.00 0.00 H new ATOM 0 HG2 LYS A 21 3.277 18.845 -2.924 1.00 0.00 H new ATOM 0 HG3 LYS A 21 2.605 19.701 -4.297 1.00 0.00 H new ATOM 0 HD2 LYS A 21 1.833 21.472 -3.008 1.00 0.00 H new ATOM 0 HD3 LYS A 21 1.603 20.481 -1.581 1.00 0.00 H new ATOM 0 HE2 LYS A 21 3.873 20.568 -0.978 1.00 0.00 H new ATOM 0 HE3 LYS A 21 4.404 20.917 -2.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 4.570 22.863 -1.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 3.425 23.131 -2.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 2.911 22.793 -0.844 1.00 0.00 H new ATOM 293 N THR A 22 -0.128 18.841 -5.795 1.00 0.00 N ATOM 294 CA THR A 22 -0.413 19.486 -7.070 1.00 0.00 C ATOM 295 C THR A 22 -0.538 20.996 -6.906 1.00 0.00 C ATOM 296 O THR A 22 -0.468 21.519 -5.794 1.00 0.00 O ATOM 297 CB THR A 22 -1.710 18.940 -7.698 1.00 0.00 C ATOM 298 OG1 THR A 22 -2.847 19.439 -6.984 1.00 0.00 O ATOM 299 CG2 THR A 22 -1.721 17.419 -7.681 1.00 0.00 C ATOM 0 H THR A 22 -0.811 19.035 -5.062 1.00 0.00 H new ATOM 0 HA THR A 22 0.424 19.263 -7.731 1.00 0.00 H new ATOM 0 HB THR A 22 -1.756 19.276 -8.734 1.00 0.00 H new ATOM 0 HG1 THR A 22 -3.668 19.089 -7.390 1.00 0.00 H new ATOM 0 HG21 THR A 22 -2.646 17.057 -8.129 1.00 0.00 H new ATOM 0 HG22 THR A 22 -0.871 17.043 -8.250 1.00 0.00 H new ATOM 0 HG23 THR A 22 -1.654 17.066 -6.652 1.00 0.00 H new ATOM 356 N LYS A 26 -3.498 19.659 -2.586 1.00 0.00 N ATOM 357 CA LYS A 26 -3.182 18.280 -2.231 1.00 0.00 C ATOM 358 C LYS A 26 -4.195 17.316 -2.840 1.00 0.00 C ATOM 359 O LYS A 26 -5.386 17.350 -2.528 1.00 0.00 O ATOM 360 CB LYS A 26 -3.157 18.116 -0.710 1.00 0.00 C ATOM 361 CG LYS A 26 -2.253 19.113 -0.006 1.00 0.00 C ATOM 362 CD LYS A 26 -2.178 18.840 1.487 1.00 0.00 C ATOM 363 CE LYS A 26 -0.848 19.293 2.071 1.00 0.00 C ATOM 364 NZ LYS A 26 -0.773 20.774 2.197 1.00 0.00 N ATOM 0 HA LYS A 26 -2.196 18.045 -2.632 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.171 18.223 -0.325 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -2.828 17.106 -0.467 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.253 19.065 -0.436 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.624 20.124 -0.174 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -2.994 19.356 1.994 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -2.313 17.774 1.670 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -0.708 18.838 3.051 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.034 18.941 1.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 0.148 21.042 2.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -0.881 21.208 1.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -1.534 21.108 2.822 1.00 0.00 H new ATOM 378 N PRO A 27 -3.714 16.435 -3.730 1.00 0.00 N ATOM 379 CA PRO A 27 -4.561 15.444 -4.400 1.00 0.00 C ATOM 380 C PRO A 27 -5.052 14.361 -3.445 1.00 0.00 C ATOM 381 O PRO A 27 -4.638 14.307 -2.287 1.00 0.00 O ATOM 382 CB PRO A 27 -3.635 14.843 -5.460 1.00 0.00 C ATOM 383 CG PRO A 27 -2.261 15.049 -4.921 1.00 0.00 C ATOM 384 CD PRO A 27 -2.306 16.339 -4.151 1.00 0.00 C ATOM 0 HA PRO A 27 -5.466 15.892 -4.811 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -3.845 13.785 -5.616 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -3.761 15.338 -6.423 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -1.966 14.220 -4.277 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.530 15.101 -5.727 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.631 16.320 -3.295 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.013 17.187 -4.770 1.00 0.00 H new ATOM 392 N ASP A 28 -5.935 13.499 -3.938 1.00 0.00 N ATOM 393 CA ASP A 28 -6.480 12.416 -3.129 1.00 0.00 C ATOM 394 C ASP A 28 -5.827 11.085 -3.491 1.00 0.00 C ATOM 395 O ASP A 28 -6.203 10.425 -4.460 1.00 0.00 O ATOM 396 CB ASP A 28 -7.995 12.323 -3.317 1.00 0.00 C ATOM 397 CG ASP A 28 -8.677 13.672 -3.202 1.00 0.00 C ATOM 398 OD1 ASP A 28 -8.288 14.598 -3.944 1.00 0.00 O ATOM 399 OD2 ASP A 28 -9.599 13.802 -2.370 1.00 0.00 O ATOM 0 H ASP A 28 -6.288 13.530 -4.894 1.00 0.00 H new ATOM 0 HA ASP A 28 -6.264 12.633 -2.083 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -8.211 11.892 -4.295 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -8.410 11.645 -2.571 1.00 0.00 H new ATOM 404 N PRO A 29 -4.825 10.682 -2.696 1.00 0.00 N ATOM 405 CA PRO A 29 -4.099 9.427 -2.913 1.00 0.00 C ATOM 406 C PRO A 29 -4.957 8.202 -2.619 1.00 0.00 C ATOM 407 O PRO A 29 -5.878 8.259 -1.803 1.00 0.00 O ATOM 408 CB PRO A 29 -2.935 9.515 -1.923 1.00 0.00 C ATOM 409 CG PRO A 29 -3.420 10.425 -0.848 1.00 0.00 C ATOM 410 CD PRO A 29 -4.325 11.418 -1.523 1.00 0.00 C ATOM 0 HA PRO A 29 -3.786 9.312 -3.951 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -2.679 8.533 -1.525 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -2.038 9.909 -2.401 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -3.956 9.869 -0.078 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -2.587 10.927 -0.357 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -5.138 11.730 -0.868 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -3.786 12.320 -1.814 1.00 0.00 H new ATOM 418 N ILE A 30 -4.650 7.095 -3.287 1.00 0.00 N ATOM 419 CA ILE A 30 -5.393 5.856 -3.095 1.00 0.00 C ATOM 420 C ILE A 30 -4.516 4.640 -3.378 1.00 0.00 C ATOM 421 O ILE A 30 -3.722 4.640 -4.319 1.00 0.00 O ATOM 422 CB ILE A 30 -6.637 5.800 -4.001 1.00 0.00 C ATOM 423 CG1 ILE A 30 -7.501 4.589 -3.642 1.00 0.00 C ATOM 424 CG2 ILE A 30 -6.225 5.748 -5.465 1.00 0.00 C ATOM 425 CD1 ILE A 30 -8.558 4.888 -2.602 1.00 0.00 C ATOM 0 H ILE A 30 -3.892 7.031 -3.966 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.712 5.837 -2.053 1.00 0.00 H new ATOM 0 HB ILE A 30 -7.225 6.704 -3.842 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.986 4.218 -4.545 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -6.857 3.790 -3.275 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.115 5.709 -6.092 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -5.646 6.638 -5.712 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -5.618 4.860 -5.641 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -9.132 3.985 -2.397 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -8.079 5.230 -1.684 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -9.225 5.665 -2.974 1.00 0.00 H new ATOM 437 N VAL A 31 -4.668 3.605 -2.559 1.00 0.00 N ATOM 438 CA VAL A 31 -3.893 2.381 -2.722 1.00 0.00 C ATOM 439 C VAL A 31 -4.699 1.314 -3.456 1.00 0.00 C ATOM 440 O VAL A 31 -5.820 0.990 -3.064 1.00 0.00 O ATOM 441 CB VAL A 31 -3.437 1.820 -1.363 1.00 0.00 C ATOM 442 CG1 VAL A 31 -2.565 0.589 -1.558 1.00 0.00 C ATOM 443 CG2 VAL A 31 -2.698 2.886 -0.568 1.00 0.00 C ATOM 0 H VAL A 31 -5.321 3.589 -1.776 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.014 2.639 -3.313 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.320 1.524 -0.797 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.252 0.207 -0.586 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.132 -0.179 -2.085 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -1.685 0.856 -2.143 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.383 2.472 0.390 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.822 3.215 -1.127 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.359 3.736 -0.396 1.00 0.00 H new ATOM 453 N SER A 32 -4.119 0.771 -4.521 1.00 0.00 N ATOM 454 CA SER A 32 -4.785 -0.258 -5.312 1.00 0.00 C ATOM 455 C SER A 32 -4.046 -1.589 -5.204 1.00 0.00 C ATOM 456 O SER A 32 -2.828 -1.651 -5.371 1.00 0.00 O ATOM 457 CB SER A 32 -4.872 0.172 -6.778 1.00 0.00 C ATOM 458 OG SER A 32 -3.705 -0.201 -7.489 1.00 0.00 O ATOM 0 H SER A 32 -3.190 1.026 -4.856 1.00 0.00 H new ATOM 0 HA SER A 32 -5.793 -0.388 -4.918 1.00 0.00 H new ATOM 0 HB2 SER A 32 -5.746 -0.284 -7.243 1.00 0.00 H new ATOM 0 HB3 SER A 32 -5.007 1.252 -6.836 1.00 0.00 H new ATOM 0 HG SER A 32 -3.948 -0.804 -8.223 1.00 0.00 H new ATOM 464 N VAL A 33 -4.793 -2.652 -4.923 1.00 0.00 N ATOM 465 CA VAL A 33 -4.211 -3.982 -4.793 1.00 0.00 C ATOM 466 C VAL A 33 -4.865 -4.965 -5.758 1.00 0.00 C ATOM 467 O VAL A 33 -6.064 -5.231 -5.671 1.00 0.00 O ATOM 468 CB VAL A 33 -4.353 -4.519 -3.357 1.00 0.00 C ATOM 469 CG1 VAL A 33 -3.766 -5.918 -3.249 1.00 0.00 C ATOM 470 CG2 VAL A 33 -3.687 -3.575 -2.367 1.00 0.00 C ATOM 0 H VAL A 33 -5.802 -2.618 -4.781 1.00 0.00 H new ATOM 0 HA VAL A 33 -3.152 -3.889 -5.035 1.00 0.00 H new ATOM 0 HB VAL A 33 -5.414 -4.576 -3.113 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -3.876 -6.281 -2.227 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -4.292 -6.587 -3.930 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -2.709 -5.890 -3.513 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.797 -3.970 -1.357 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.628 -3.484 -2.608 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -4.158 -2.594 -2.426 1.00 0.00 H new ATOM 480 N ILE A 34 -4.070 -5.501 -6.678 1.00 0.00 N ATOM 481 CA ILE A 34 -4.571 -6.455 -7.658 1.00 0.00 C ATOM 482 C ILE A 34 -3.860 -7.798 -7.532 1.00 0.00 C ATOM 483 O ILE A 34 -2.637 -7.879 -7.653 1.00 0.00 O ATOM 484 CB ILE A 34 -4.399 -5.929 -9.096 1.00 0.00 C ATOM 485 CG1 ILE A 34 -5.250 -4.675 -9.308 1.00 0.00 C ATOM 486 CG2 ILE A 34 -4.772 -7.006 -10.103 1.00 0.00 C ATOM 487 CD1 ILE A 34 -4.533 -3.391 -8.956 1.00 0.00 C ATOM 0 H ILE A 34 -3.076 -5.290 -6.765 1.00 0.00 H new ATOM 0 HA ILE A 34 -5.633 -6.588 -7.453 1.00 0.00 H new ATOM 0 HB ILE A 34 -3.352 -5.665 -9.248 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -5.565 -4.632 -10.351 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -6.155 -4.753 -8.705 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.645 -6.619 -11.114 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.127 -7.874 -9.963 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.811 -7.299 -9.954 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -5.196 -2.544 -9.131 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -4.242 -3.413 -7.906 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -3.643 -3.289 -9.577 1.00 0.00 H new ATOM 499 N PHE A 35 -4.633 -8.851 -7.290 1.00 0.00 N ATOM 500 CA PHE A 35 -4.078 -10.192 -7.148 1.00 0.00 C ATOM 501 C PHE A 35 -5.114 -11.251 -7.512 1.00 0.00 C ATOM 502 O PHE A 35 -6.263 -11.189 -7.076 1.00 0.00 O ATOM 503 CB PHE A 35 -3.586 -10.414 -5.716 1.00 0.00 C ATOM 504 CG PHE A 35 -2.886 -11.729 -5.520 1.00 0.00 C ATOM 505 CD1 PHE A 35 -1.527 -11.848 -5.764 1.00 0.00 C ATOM 506 CD2 PHE A 35 -3.587 -12.845 -5.092 1.00 0.00 C ATOM 507 CE1 PHE A 35 -0.881 -13.056 -5.585 1.00 0.00 C ATOM 508 CE2 PHE A 35 -2.946 -14.056 -4.911 1.00 0.00 C ATOM 509 CZ PHE A 35 -1.591 -14.161 -5.157 1.00 0.00 C ATOM 0 H PHE A 35 -5.647 -8.802 -7.188 1.00 0.00 H new ATOM 0 HA PHE A 35 -3.235 -10.284 -7.833 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -2.907 -9.606 -5.444 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -4.436 -10.359 -5.036 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.967 -10.987 -6.098 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -4.647 -12.768 -4.898 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.178 -13.136 -5.780 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.504 -14.919 -4.578 1.00 0.00 H new ATOM 0 HZ PHE A 35 -1.087 -15.106 -5.015 1.00 0.00 H new ATOM 519 N LYS A 36 -4.698 -12.224 -8.317 1.00 0.00 N ATOM 520 CA LYS A 36 -5.588 -13.298 -8.741 1.00 0.00 C ATOM 521 C LYS A 36 -6.802 -12.741 -9.477 1.00 0.00 C ATOM 522 O LYS A 36 -7.939 -13.122 -9.195 1.00 0.00 O ATOM 523 CB LYS A 36 -6.043 -14.119 -7.532 1.00 0.00 C ATOM 524 CG LYS A 36 -4.933 -14.945 -6.905 1.00 0.00 C ATOM 525 CD LYS A 36 -4.847 -16.328 -7.528 1.00 0.00 C ATOM 526 CE LYS A 36 -5.810 -17.299 -6.863 1.00 0.00 C ATOM 527 NZ LYS A 36 -7.203 -17.129 -7.362 1.00 0.00 N ATOM 0 H LYS A 36 -3.750 -12.290 -8.688 1.00 0.00 H new ATOM 0 HA LYS A 36 -5.037 -13.944 -9.424 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -6.453 -13.445 -6.779 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -6.851 -14.784 -7.838 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -3.981 -14.430 -7.028 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -5.109 -15.038 -5.833 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -5.071 -16.263 -8.593 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -3.828 -16.706 -7.439 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -5.480 -18.321 -7.048 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -5.790 -17.148 -5.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -7.691 -18.047 -7.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -7.711 -16.459 -6.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -7.181 -16.762 -8.335 1.00 0.00 H new ATOM 541 N ASP A 37 -6.554 -11.839 -10.419 1.00 0.00 N ATOM 542 CA ASP A 37 -7.628 -11.231 -11.197 1.00 0.00 C ATOM 543 C ASP A 37 -8.681 -10.615 -10.281 1.00 0.00 C ATOM 544 O ASP A 37 -9.873 -10.644 -10.584 1.00 0.00 O ATOM 545 CB ASP A 37 -8.275 -12.271 -12.113 1.00 0.00 C ATOM 546 CG ASP A 37 -7.334 -12.752 -13.199 1.00 0.00 C ATOM 547 OD1 ASP A 37 -7.235 -12.073 -14.243 1.00 0.00 O ATOM 548 OD2 ASP A 37 -6.695 -13.807 -13.006 1.00 0.00 O ATOM 0 H ASP A 37 -5.619 -11.512 -10.663 1.00 0.00 H new ATOM 0 HA ASP A 37 -7.197 -10.439 -11.809 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -8.602 -13.123 -11.517 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -9.166 -11.842 -12.572 1.00 0.00 H new ATOM 553 N GLU A 38 -8.232 -10.060 -9.160 1.00 0.00 N ATOM 554 CA GLU A 38 -9.137 -9.440 -8.200 1.00 0.00 C ATOM 555 C GLU A 38 -8.648 -8.047 -7.812 1.00 0.00 C ATOM 556 O GLU A 38 -7.630 -7.900 -7.136 1.00 0.00 O ATOM 557 CB GLU A 38 -9.266 -10.313 -6.949 1.00 0.00 C ATOM 558 CG GLU A 38 -10.605 -10.174 -6.246 1.00 0.00 C ATOM 559 CD GLU A 38 -11.685 -11.035 -6.871 1.00 0.00 C ATOM 560 OE1 GLU A 38 -11.804 -11.025 -8.115 1.00 0.00 O ATOM 561 OE2 GLU A 38 -12.412 -11.717 -6.119 1.00 0.00 O ATOM 0 H GLU A 38 -7.248 -10.027 -8.894 1.00 0.00 H new ATOM 0 HA GLU A 38 -10.115 -9.345 -8.671 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -9.118 -11.356 -7.227 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -8.470 -10.053 -6.251 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -10.490 -10.447 -5.197 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -10.918 -9.130 -6.272 1.00 0.00 H new ATOM 568 N LYS A 39 -9.380 -7.028 -8.247 1.00 0.00 N ATOM 569 CA LYS A 39 -9.024 -5.646 -7.947 1.00 0.00 C ATOM 570 C LYS A 39 -9.632 -5.203 -6.620 1.00 0.00 C ATOM 571 O LYS A 39 -10.824 -5.392 -6.378 1.00 0.00 O ATOM 572 CB LYS A 39 -9.496 -4.720 -9.070 1.00 0.00 C ATOM 573 CG LYS A 39 -8.871 -3.337 -9.021 1.00 0.00 C ATOM 574 CD LYS A 39 -9.046 -2.598 -10.337 1.00 0.00 C ATOM 575 CE LYS A 39 -8.226 -3.236 -11.448 1.00 0.00 C ATOM 576 NZ LYS A 39 -8.221 -2.404 -12.682 1.00 0.00 N ATOM 0 H LYS A 39 -10.225 -7.133 -8.809 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.939 -5.587 -7.867 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -9.264 -5.180 -10.031 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -10.580 -4.622 -9.017 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -9.325 -2.760 -8.216 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -7.809 -3.425 -8.791 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -10.100 -2.595 -10.617 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.746 -1.557 -10.214 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -7.202 -3.383 -11.105 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -8.630 -4.222 -11.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -7.652 -2.873 -13.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -9.196 -2.285 -13.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -7.812 -1.471 -12.470 1.00 0.00 H new ATOM 590 N LYS A 40 -8.805 -4.613 -5.763 1.00 0.00 N ATOM 591 CA LYS A 40 -9.261 -4.140 -4.462 1.00 0.00 C ATOM 592 C LYS A 40 -8.386 -2.996 -3.961 1.00 0.00 C ATOM 593 O LYS A 40 -7.167 -3.134 -3.853 1.00 0.00 O ATOM 594 CB LYS A 40 -9.250 -5.286 -3.447 1.00 0.00 C ATOM 595 CG LYS A 40 -10.434 -6.228 -3.581 1.00 0.00 C ATOM 596 CD LYS A 40 -10.502 -7.207 -2.421 1.00 0.00 C ATOM 597 CE LYS A 40 -11.208 -8.494 -2.818 1.00 0.00 C ATOM 598 NZ LYS A 40 -12.688 -8.374 -2.697 1.00 0.00 N ATOM 0 H LYS A 40 -7.815 -4.451 -5.947 1.00 0.00 H new ATOM 0 HA LYS A 40 -10.281 -3.772 -4.575 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -8.328 -5.856 -3.565 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.241 -4.868 -2.440 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -11.357 -5.650 -3.625 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -10.358 -6.778 -4.519 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -9.493 -7.435 -2.077 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -11.027 -6.746 -1.585 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -10.947 -8.750 -3.845 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -10.857 -9.311 -2.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -13.133 -9.271 -2.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -12.939 -8.155 -1.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -13.026 -7.612 -3.318 1.00 0.00 H new ATOM 612 N LYS A 41 -9.015 -1.866 -3.656 1.00 0.00 N ATOM 613 CA LYS A 41 -8.294 -0.697 -3.163 1.00 0.00 C ATOM 614 C LYS A 41 -8.827 -0.263 -1.802 1.00 0.00 C ATOM 615 O LYS A 41 -9.843 -0.774 -1.329 1.00 0.00 O ATOM 616 CB LYS A 41 -8.412 0.457 -4.161 1.00 0.00 C ATOM 617 CG LYS A 41 -9.779 0.560 -4.814 1.00 0.00 C ATOM 618 CD LYS A 41 -9.884 1.791 -5.698 1.00 0.00 C ATOM 619 CE LYS A 41 -11.324 2.065 -6.104 1.00 0.00 C ATOM 620 NZ LYS A 41 -11.406 2.790 -7.403 1.00 0.00 N ATOM 0 H LYS A 41 -10.023 -1.734 -3.741 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.244 -0.968 -3.052 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -8.192 1.393 -3.648 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -7.657 0.334 -4.937 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -9.967 -0.334 -5.409 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -10.549 0.598 -4.044 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -9.483 2.656 -5.169 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -9.273 1.653 -6.590 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -11.866 1.122 -6.180 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -11.814 2.653 -5.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -12.404 2.958 -7.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -10.911 3.701 -7.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -10.961 2.218 -8.149 1.00 0.00 H new ATOM 634 N THR A 42 -8.136 0.684 -1.175 1.00 0.00 N ATOM 635 CA THR A 42 -8.540 1.187 0.131 1.00 0.00 C ATOM 636 C THR A 42 -9.486 2.375 -0.005 1.00 0.00 C ATOM 637 O THR A 42 -9.890 2.736 -1.110 1.00 0.00 O ATOM 638 CB THR A 42 -7.321 1.610 0.972 1.00 0.00 C ATOM 639 OG1 THR A 42 -6.723 2.785 0.412 1.00 0.00 O ATOM 640 CG2 THR A 42 -6.292 0.491 1.034 1.00 0.00 C ATOM 0 H THR A 42 -7.293 1.118 -1.552 1.00 0.00 H new ATOM 0 HA THR A 42 -9.056 0.371 0.637 1.00 0.00 H new ATOM 0 HB THR A 42 -7.663 1.824 1.985 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.262 3.285 1.117 1.00 0.00 H new ATOM 0 HG21 THR A 42 -5.440 0.813 1.633 1.00 0.00 H new ATOM 0 HG22 THR A 42 -6.742 -0.392 1.488 1.00 0.00 H new ATOM 0 HG23 THR A 42 -5.956 0.250 0.026 1.00 0.00 H new ATOM 648 N LYS A 43 -9.834 2.980 1.125 1.00 0.00 N ATOM 649 CA LYS A 43 -10.731 4.130 1.133 1.00 0.00 C ATOM 650 C LYS A 43 -9.978 5.410 0.785 1.00 0.00 C ATOM 651 O LYS A 43 -9.081 5.833 1.514 1.00 0.00 O ATOM 652 CB LYS A 43 -11.397 4.274 2.503 1.00 0.00 C ATOM 653 CG LYS A 43 -10.425 4.611 3.620 1.00 0.00 C ATOM 654 CD LYS A 43 -11.090 4.528 4.983 1.00 0.00 C ATOM 655 CE LYS A 43 -10.292 5.275 6.040 1.00 0.00 C ATOM 656 NZ LYS A 43 -9.225 4.423 6.635 1.00 0.00 N ATOM 0 H LYS A 43 -9.508 2.693 2.048 1.00 0.00 H new ATOM 0 HA LYS A 43 -11.499 3.965 0.378 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -12.158 5.053 2.448 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -11.910 3.344 2.748 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.578 3.926 3.585 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -10.029 5.615 3.468 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -12.096 4.944 4.924 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -11.194 3.483 5.275 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -9.842 6.163 5.595 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -10.964 5.618 6.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -8.514 5.027 7.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -9.644 3.783 7.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -8.770 3.863 5.886 1.00 0.00 H new ATOM 670 N LYS A 44 -10.350 6.024 -0.333 1.00 0.00 N ATOM 671 CA LYS A 44 -9.712 7.258 -0.777 1.00 0.00 C ATOM 672 C LYS A 44 -9.600 8.256 0.371 1.00 0.00 C ATOM 673 O LYS A 44 -10.524 8.403 1.172 1.00 0.00 O ATOM 674 CB LYS A 44 -10.502 7.878 -1.931 1.00 0.00 C ATOM 675 CG LYS A 44 -11.584 8.844 -1.478 1.00 0.00 C ATOM 676 CD LYS A 44 -11.054 10.263 -1.367 1.00 0.00 C ATOM 677 CE LYS A 44 -12.177 11.260 -1.124 1.00 0.00 C ATOM 678 NZ LYS A 44 -11.674 12.526 -0.523 1.00 0.00 N ATOM 0 H LYS A 44 -11.090 5.687 -0.949 1.00 0.00 H new ATOM 0 HA LYS A 44 -8.707 7.014 -1.122 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.812 8.402 -2.592 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -10.960 7.081 -2.516 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.414 8.819 -2.184 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -11.977 8.525 -0.513 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -10.332 10.320 -0.552 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -10.523 10.527 -2.282 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -12.678 11.480 -2.067 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -12.921 10.815 -0.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -12.442 13.227 -0.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -11.341 12.342 0.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -10.888 12.894 -1.096 1.00 0.00 H new ATOM 692 N VAL A 45 -8.464 8.942 0.444 1.00 0.00 N ATOM 693 CA VAL A 45 -8.233 9.929 1.493 1.00 0.00 C ATOM 694 C VAL A 45 -8.358 11.348 0.949 1.00 0.00 C ATOM 695 O VAL A 45 -7.858 11.655 -0.133 1.00 0.00 O ATOM 696 CB VAL A 45 -6.841 9.756 2.129 1.00 0.00 C ATOM 697 CG1 VAL A 45 -6.588 10.841 3.164 1.00 0.00 C ATOM 698 CG2 VAL A 45 -6.708 8.373 2.751 1.00 0.00 C ATOM 0 H VAL A 45 -7.689 8.833 -0.210 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.995 9.766 2.255 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.089 9.852 1.346 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.600 10.702 3.602 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -6.639 11.819 2.686 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -7.344 10.780 3.947 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -5.718 8.268 3.196 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.468 8.246 3.522 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.842 7.613 1.981 1.00 0.00 H new ATOM 708 N ASP A 46 -9.027 12.209 1.708 1.00 0.00 N ATOM 709 CA ASP A 46 -9.217 13.597 1.303 1.00 0.00 C ATOM 710 C ASP A 46 -7.875 14.295 1.108 1.00 0.00 C ATOM 711 O ASP A 46 -6.830 13.770 1.491 1.00 0.00 O ATOM 712 CB ASP A 46 -10.048 14.345 2.347 1.00 0.00 C ATOM 713 CG ASP A 46 -9.275 14.605 3.625 1.00 0.00 C ATOM 714 OD1 ASP A 46 -9.081 13.649 4.406 1.00 0.00 O ATOM 715 OD2 ASP A 46 -8.864 15.763 3.844 1.00 0.00 O ATOM 0 H ASP A 46 -9.447 11.970 2.607 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.750 13.603 0.352 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -10.382 15.294 1.929 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -10.942 13.766 2.578 1.00 0.00 H new ATOM 720 N ASN A 47 -7.912 15.481 0.510 1.00 0.00 N ATOM 721 CA ASN A 47 -6.698 16.250 0.262 1.00 0.00 C ATOM 722 C ASN A 47 -5.694 16.062 1.396 1.00 0.00 C ATOM 723 O ASN A 47 -5.831 16.659 2.463 1.00 0.00 O ATOM 724 CB ASN A 47 -7.033 17.734 0.103 1.00 0.00 C ATOM 725 CG ASN A 47 -7.475 18.370 1.407 1.00 0.00 C ATOM 726 OD1 ASN A 47 -6.664 18.938 2.139 1.00 0.00 O ATOM 727 ND2 ASN A 47 -8.766 18.277 1.702 1.00 0.00 N ATOM 0 H ASN A 47 -8.769 15.930 0.188 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.249 15.885 -0.662 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -6.159 18.262 -0.278 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -7.823 17.848 -0.640 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -9.123 18.686 2.566 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -9.401 17.797 1.065 1.00 0.00 H new ATOM 734 N GLU A 48 -4.686 15.230 1.155 1.00 0.00 N ATOM 735 CA GLU A 48 -3.660 14.964 2.157 1.00 0.00 C ATOM 736 C GLU A 48 -2.443 14.294 1.525 1.00 0.00 C ATOM 737 O GLU A 48 -2.576 13.354 0.740 1.00 0.00 O ATOM 738 CB GLU A 48 -4.221 14.080 3.272 1.00 0.00 C ATOM 739 CG GLU A 48 -3.156 13.521 4.200 1.00 0.00 C ATOM 740 CD GLU A 48 -2.401 14.606 4.942 1.00 0.00 C ATOM 741 OE1 GLU A 48 -2.986 15.215 5.861 1.00 0.00 O ATOM 742 OE2 GLU A 48 -1.223 14.846 4.603 1.00 0.00 O ATOM 0 H GLU A 48 -4.558 14.729 0.276 1.00 0.00 H new ATOM 0 HA GLU A 48 -3.348 15.918 2.582 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -4.935 14.659 3.859 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -4.772 13.253 2.825 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -3.623 12.851 4.921 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -2.451 12.924 3.621 1.00 0.00 H new ATOM 749 N LEU A 49 -1.259 14.785 1.871 1.00 0.00 N ATOM 750 CA LEU A 49 -0.017 14.235 1.338 1.00 0.00 C ATOM 751 C LEU A 49 0.273 12.863 1.939 1.00 0.00 C ATOM 752 O LEU A 49 0.588 11.915 1.223 1.00 0.00 O ATOM 753 CB LEU A 49 1.148 15.185 1.621 1.00 0.00 C ATOM 754 CG LEU A 49 1.429 16.239 0.549 1.00 0.00 C ATOM 755 CD1 LEU A 49 0.135 16.686 -0.113 1.00 0.00 C ATOM 756 CD2 LEU A 49 2.161 17.430 1.152 1.00 0.00 C ATOM 0 H LEU A 49 -1.132 15.563 2.518 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.132 14.122 0.260 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.953 15.697 2.563 1.00 0.00 H new ATOM 0 HB3 LEU A 49 2.050 14.590 1.762 1.00 0.00 H new ATOM 0 HG LEU A 49 2.067 15.793 -0.214 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.355 17.436 -0.873 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.350 15.829 -0.579 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.529 17.114 0.638 1.00 0.00 H new ATOM 0 HD21 LEU A 49 2.353 18.170 0.375 1.00 0.00 H new ATOM 0 HD22 LEU A 49 1.547 17.876 1.935 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.108 17.098 1.578 1.00 0.00 H new ATOM 768 N ASN A 50 0.163 12.767 3.260 1.00 0.00 N ATOM 769 CA ASN A 50 0.413 11.511 3.958 1.00 0.00 C ATOM 770 C ASN A 50 -0.893 10.892 4.448 1.00 0.00 C ATOM 771 O ASN A 50 -1.301 11.068 5.596 1.00 0.00 O ATOM 772 CB ASN A 50 1.357 11.739 5.141 1.00 0.00 C ATOM 773 CG ASN A 50 2.386 12.817 4.860 1.00 0.00 C ATOM 774 OD1 ASN A 50 2.718 13.000 3.587 1.00 0.00 O flip ATOM 775 ND2 ASN A 50 2.876 13.477 5.776 1.00 0.00 N flip ATOM 0 H ASN A 50 -0.097 13.543 3.868 1.00 0.00 H new ATOM 0 HA ASN A 50 0.881 10.821 3.256 1.00 0.00 H new ATOM 0 HB2 ASN A 50 0.774 12.017 6.019 1.00 0.00 H new ATOM 0 HB3 ASN A 50 1.868 10.806 5.380 1.00 0.00 H new ATOM 0 HD21 ASN A 50 2.591 13.302 6.740 1.00 0.00 H new ATOM 0 HD22 ASN A 50 3.567 14.199 5.571 1.00 0.00 H new ATOM 782 N PRO A 51 -1.566 10.148 3.557 1.00 0.00 N ATOM 783 CA PRO A 51 -2.835 9.487 3.875 1.00 0.00 C ATOM 784 C PRO A 51 -2.657 8.330 4.852 1.00 0.00 C ATOM 785 O PRO A 51 -1.578 7.744 4.946 1.00 0.00 O ATOM 786 CB PRO A 51 -3.316 8.970 2.517 1.00 0.00 C ATOM 787 CG PRO A 51 -2.073 8.811 1.710 1.00 0.00 C ATOM 788 CD PRO A 51 -1.139 9.896 2.170 1.00 0.00 C ATOM 0 HA PRO A 51 -3.537 10.165 4.361 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -3.846 8.023 2.619 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -4.006 9.672 2.048 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -1.632 7.826 1.863 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -2.285 8.904 0.645 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -0.098 9.577 2.122 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -1.227 10.791 1.553 1.00 0.00 H new ATOM 796 N VAL A 52 -3.721 8.006 5.579 1.00 0.00 N ATOM 797 CA VAL A 52 -3.683 6.918 6.549 1.00 0.00 C ATOM 798 C VAL A 52 -4.897 6.008 6.402 1.00 0.00 C ATOM 799 O VAL A 52 -5.999 6.353 6.829 1.00 0.00 O ATOM 800 CB VAL A 52 -3.628 7.454 7.992 1.00 0.00 C ATOM 801 CG1 VAL A 52 -3.788 6.317 8.990 1.00 0.00 C ATOM 802 CG2 VAL A 52 -2.327 8.205 8.231 1.00 0.00 C ATOM 0 H VAL A 52 -4.621 8.482 5.515 1.00 0.00 H new ATOM 0 HA VAL A 52 -2.777 6.346 6.347 1.00 0.00 H new ATOM 0 HB VAL A 52 -4.455 8.150 8.135 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -3.747 6.714 10.004 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.748 5.826 8.832 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -2.984 5.594 8.850 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.305 8.577 9.255 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.484 7.533 8.070 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.259 9.044 7.539 1.00 0.00 H new ATOM 812 N TRP A 53 -4.687 4.844 5.797 1.00 0.00 N ATOM 813 CA TRP A 53 -5.766 3.883 5.594 1.00 0.00 C ATOM 814 C TRP A 53 -5.863 2.918 6.770 1.00 0.00 C ATOM 815 O TRP A 53 -6.955 2.621 7.252 1.00 0.00 O ATOM 816 CB TRP A 53 -5.545 3.104 4.296 1.00 0.00 C ATOM 817 CG TRP A 53 -5.463 3.981 3.084 1.00 0.00 C ATOM 818 CD1 TRP A 53 -6.509 4.486 2.365 1.00 0.00 C ATOM 819 CD2 TRP A 53 -4.271 4.455 2.448 1.00 0.00 C ATOM 820 NE1 TRP A 53 -6.039 5.245 1.320 1.00 0.00 N ATOM 821 CE2 TRP A 53 -4.669 5.243 1.350 1.00 0.00 C ATOM 822 CE3 TRP A 53 -2.906 4.293 2.701 1.00 0.00 C ATOM 823 CZ2 TRP A 53 -3.751 5.863 0.507 1.00 0.00 C ATOM 824 CZ3 TRP A 53 -1.996 4.909 1.863 1.00 0.00 C ATOM 825 CH2 TRP A 53 -2.421 5.687 0.778 1.00 0.00 C ATOM 0 H TRP A 53 -3.781 4.543 5.439 1.00 0.00 H new ATOM 0 HA TRP A 53 -6.703 4.435 5.523 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -4.625 2.525 4.380 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -6.359 2.391 4.165 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -7.552 4.314 2.585 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -6.616 5.731 0.634 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -2.569 3.697 3.536 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -4.077 6.462 -0.331 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -0.939 4.789 2.048 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -1.685 6.157 0.143 1.00 0.00 H new ATOM 836 N ASN A 54 -4.714 2.433 7.229 1.00 0.00 N ATOM 837 CA ASN A 54 -4.671 1.500 8.349 1.00 0.00 C ATOM 838 C ASN A 54 -5.738 0.420 8.200 1.00 0.00 C ATOM 839 O ASN A 54 -6.277 -0.073 9.189 1.00 0.00 O ATOM 840 CB ASN A 54 -4.867 2.248 9.670 1.00 0.00 C ATOM 841 CG ASN A 54 -3.728 3.203 9.968 1.00 0.00 C ATOM 842 OD1 ASN A 54 -2.626 3.057 9.439 1.00 0.00 O ATOM 843 ND2 ASN A 54 -3.989 4.187 10.821 1.00 0.00 N ATOM 0 H ASN A 54 -3.800 2.671 6.843 1.00 0.00 H new ATOM 0 HA ASN A 54 -3.692 1.020 8.352 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -5.804 2.804 9.634 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -4.955 1.527 10.483 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -3.261 4.860 11.061 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -4.917 4.270 11.236 1.00 0.00 H new ATOM 850 N GLU A 55 -6.036 0.059 6.956 1.00 0.00 N ATOM 851 CA GLU A 55 -7.039 -0.962 6.678 1.00 0.00 C ATOM 852 C GLU A 55 -6.381 -2.313 6.411 1.00 0.00 C ATOM 853 O GLU A 55 -5.154 -2.425 6.396 1.00 0.00 O ATOM 854 CB GLU A 55 -7.895 -0.554 5.477 1.00 0.00 C ATOM 855 CG GLU A 55 -7.322 -0.999 4.142 1.00 0.00 C ATOM 856 CD GLU A 55 -8.277 -0.758 2.988 1.00 0.00 C ATOM 857 OE1 GLU A 55 -9.248 0.005 3.172 1.00 0.00 O ATOM 858 OE2 GLU A 55 -8.053 -1.333 1.902 1.00 0.00 O ATOM 0 H GLU A 55 -5.598 0.458 6.126 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.678 -1.055 7.556 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -8.893 -0.976 5.593 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -8.006 0.530 5.472 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -6.390 -0.466 3.955 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -7.078 -2.060 4.191 1.00 0.00 H new ATOM 865 N ILE A 56 -7.204 -3.335 6.202 1.00 0.00 N ATOM 866 CA ILE A 56 -6.702 -4.677 5.935 1.00 0.00 C ATOM 867 C ILE A 56 -7.413 -5.302 4.740 1.00 0.00 C ATOM 868 O ILE A 56 -8.643 -5.345 4.687 1.00 0.00 O ATOM 869 CB ILE A 56 -6.875 -5.596 7.159 1.00 0.00 C ATOM 870 CG1 ILE A 56 -6.269 -4.944 8.404 1.00 0.00 C ATOM 871 CG2 ILE A 56 -6.235 -6.951 6.899 1.00 0.00 C ATOM 872 CD1 ILE A 56 -6.610 -5.663 9.690 1.00 0.00 C ATOM 0 H ILE A 56 -8.221 -3.259 6.212 1.00 0.00 H new ATOM 0 HA ILE A 56 -5.640 -4.578 5.712 1.00 0.00 H new ATOM 0 HB ILE A 56 -7.940 -5.747 7.333 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.185 -4.908 8.294 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -6.617 -3.913 8.470 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.366 -7.589 7.773 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -6.709 -7.417 6.035 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -5.171 -6.819 6.702 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -6.147 -5.145 10.530 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -7.692 -5.676 9.824 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -6.237 -6.686 9.645 1.00 0.00 H new ATOM 884 N LEU A 57 -6.631 -5.789 3.782 1.00 0.00 N ATOM 885 CA LEU A 57 -7.185 -6.415 2.587 1.00 0.00 C ATOM 886 C LEU A 57 -6.894 -7.912 2.571 1.00 0.00 C ATOM 887 O LEU A 57 -5.899 -8.366 3.135 1.00 0.00 O ATOM 888 CB LEU A 57 -6.610 -5.759 1.330 1.00 0.00 C ATOM 889 CG LEU A 57 -6.758 -4.239 1.239 1.00 0.00 C ATOM 890 CD1 LEU A 57 -5.606 -3.637 0.450 1.00 0.00 C ATOM 891 CD2 LEU A 57 -8.091 -3.871 0.604 1.00 0.00 C ATOM 0 H LEU A 57 -5.612 -5.762 3.810 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.266 -6.274 2.601 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -5.550 -6.005 1.268 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -7.092 -6.204 0.459 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.733 -3.829 2.249 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.728 -2.555 0.396 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.664 -3.871 0.946 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -5.599 -4.052 -0.558 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -8.180 -2.786 0.547 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -8.145 -4.293 -0.400 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -8.905 -4.270 1.209 1.00 0.00 H new ATOM 903 N GLU A 58 -7.768 -8.673 1.920 1.00 0.00 N ATOM 904 CA GLU A 58 -7.602 -10.119 1.830 1.00 0.00 C ATOM 905 C GLU A 58 -7.948 -10.620 0.431 1.00 0.00 C ATOM 906 O GLU A 58 -8.611 -9.928 -0.343 1.00 0.00 O ATOM 907 CB GLU A 58 -8.482 -10.821 2.867 1.00 0.00 C ATOM 908 CG GLU A 58 -8.650 -10.033 4.155 1.00 0.00 C ATOM 909 CD GLU A 58 -9.838 -9.092 4.113 1.00 0.00 C ATOM 910 OE1 GLU A 58 -10.956 -9.530 4.456 1.00 0.00 O ATOM 911 OE2 GLU A 58 -9.650 -7.916 3.736 1.00 0.00 O ATOM 0 H GLU A 58 -8.597 -8.313 1.448 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.557 -10.353 2.033 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.465 -11.005 2.433 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -8.049 -11.794 3.100 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.770 -10.726 4.988 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -7.743 -9.459 4.346 1.00 0.00 H new ATOM 918 N PHE A 59 -7.494 -11.828 0.112 1.00 0.00 N ATOM 919 CA PHE A 59 -7.754 -12.422 -1.194 1.00 0.00 C ATOM 920 C PHE A 59 -7.878 -13.939 -1.086 1.00 0.00 C ATOM 921 O PHE A 59 -7.211 -14.571 -0.266 1.00 0.00 O ATOM 922 CB PHE A 59 -6.636 -12.059 -2.174 1.00 0.00 C ATOM 923 CG PHE A 59 -6.589 -10.597 -2.513 1.00 0.00 C ATOM 924 CD1 PHE A 59 -5.991 -9.691 -1.651 1.00 0.00 C ATOM 925 CD2 PHE A 59 -7.141 -10.128 -3.694 1.00 0.00 C ATOM 926 CE1 PHE A 59 -5.945 -8.345 -1.961 1.00 0.00 C ATOM 927 CE2 PHE A 59 -7.098 -8.783 -4.009 1.00 0.00 C ATOM 928 CZ PHE A 59 -6.500 -7.890 -3.141 1.00 0.00 C ATOM 0 H PHE A 59 -6.944 -12.414 0.740 1.00 0.00 H new ATOM 0 HA PHE A 59 -8.698 -12.023 -1.566 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -5.678 -12.356 -1.747 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -6.767 -12.633 -3.091 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -5.556 -10.041 -0.727 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -7.610 -10.821 -4.376 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -5.475 -7.650 -1.281 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -7.532 -8.430 -4.933 1.00 0.00 H new ATOM 0 HZ PHE A 59 -6.467 -6.838 -3.385 1.00 0.00 H new ATOM 938 N ASP A 60 -8.737 -14.517 -1.919 1.00 0.00 N ATOM 939 CA ASP A 60 -8.949 -15.960 -1.919 1.00 0.00 C ATOM 940 C ASP A 60 -7.895 -16.664 -2.766 1.00 0.00 C ATOM 941 O ASP A 60 -7.566 -16.217 -3.866 1.00 0.00 O ATOM 942 CB ASP A 60 -10.347 -16.291 -2.442 1.00 0.00 C ATOM 943 CG ASP A 60 -10.890 -17.584 -1.867 1.00 0.00 C ATOM 944 OD1 ASP A 60 -10.098 -18.534 -1.692 1.00 0.00 O ATOM 945 OD2 ASP A 60 -12.106 -17.648 -1.591 1.00 0.00 O ATOM 0 H ASP A 60 -9.298 -14.008 -2.603 1.00 0.00 H new ATOM 0 HA ASP A 60 -8.860 -16.316 -0.893 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -11.026 -15.474 -2.197 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -10.317 -16.365 -3.529 1.00 0.00 H new ATOM 950 N LEU A 61 -7.367 -17.768 -2.248 1.00 0.00 N ATOM 951 CA LEU A 61 -6.348 -18.535 -2.957 1.00 0.00 C ATOM 952 C LEU A 61 -6.936 -19.819 -3.534 1.00 0.00 C ATOM 953 O LEU A 61 -6.369 -20.417 -4.448 1.00 0.00 O ATOM 954 CB LEU A 61 -5.188 -18.868 -2.018 1.00 0.00 C ATOM 955 CG LEU A 61 -4.328 -17.687 -1.568 1.00 0.00 C ATOM 956 CD1 LEU A 61 -3.199 -18.161 -0.665 1.00 0.00 C ATOM 957 CD2 LEU A 61 -3.772 -16.942 -2.773 1.00 0.00 C ATOM 0 H LEU A 61 -7.628 -18.152 -1.340 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.977 -17.926 -3.781 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.593 -19.355 -1.131 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.543 -19.593 -2.513 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.956 -17.001 -1.000 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.598 -17.306 -0.355 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.618 -18.649 0.215 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.572 -18.868 -1.208 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.162 -16.105 -2.434 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -3.159 -17.619 -3.368 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.596 -16.568 -3.381 1.00 0.00 H new ATOM 969 N ARG A 62 -8.077 -20.235 -2.995 1.00 0.00 N ATOM 970 CA ARG A 62 -8.743 -21.447 -3.456 1.00 0.00 C ATOM 971 C ARG A 62 -7.793 -22.640 -3.410 1.00 0.00 C ATOM 972 O ARG A 62 -7.804 -23.491 -4.299 1.00 0.00 O ATOM 973 CB ARG A 62 -9.269 -21.255 -4.880 1.00 0.00 C ATOM 974 CG ARG A 62 -9.875 -19.883 -5.125 1.00 0.00 C ATOM 975 CD ARG A 62 -10.984 -19.942 -6.164 1.00 0.00 C ATOM 976 NE ARG A 62 -10.475 -19.759 -7.520 1.00 0.00 N ATOM 977 CZ ARG A 62 -11.176 -20.040 -8.613 1.00 0.00 C ATOM 978 NH1 ARG A 62 -12.411 -20.512 -8.509 1.00 0.00 N ATOM 979 NH2 ARG A 62 -10.643 -19.847 -9.813 1.00 0.00 N ATOM 0 H ARG A 62 -8.560 -19.750 -2.238 1.00 0.00 H new ATOM 0 HA ARG A 62 -9.582 -21.647 -2.790 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.452 -21.413 -5.584 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -10.020 -22.017 -5.087 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -10.271 -19.487 -4.190 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -9.098 -19.195 -5.459 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -11.494 -20.903 -6.095 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -11.724 -19.172 -5.948 1.00 0.00 H new ATOM 0 HE ARG A 62 -9.529 -19.395 -7.635 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -12.825 -20.660 -7.588 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -12.947 -20.727 -9.350 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -9.694 -19.483 -9.897 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -11.182 -20.063 -10.651 1.00 0.00 H new ATOM 993 N GLY A 63 -6.970 -22.695 -2.367 1.00 0.00 N ATOM 994 CA GLY A 63 -6.025 -23.787 -2.225 1.00 0.00 C ATOM 995 C GLY A 63 -4.786 -23.597 -3.078 1.00 0.00 C ATOM 996 O GLY A 63 -3.855 -24.400 -3.020 1.00 0.00 O ATOM 0 H GLY A 63 -6.941 -22.003 -1.618 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.732 -23.876 -1.179 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.512 -24.723 -2.500 1.00 0.00 H new ATOM 1000 N ILE A 64 -4.776 -22.532 -3.873 1.00 0.00 N ATOM 1001 CA ILE A 64 -3.643 -22.240 -4.742 1.00 0.00 C ATOM 1002 C ILE A 64 -2.551 -21.489 -3.988 1.00 0.00 C ATOM 1003 O ILE A 64 -2.725 -20.345 -3.569 1.00 0.00 O ATOM 1004 CB ILE A 64 -4.072 -21.407 -5.965 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -5.141 -22.152 -6.767 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -2.868 -21.094 -6.841 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -4.615 -23.376 -7.484 1.00 0.00 C ATOM 0 H ILE A 64 -5.539 -21.858 -3.933 1.00 0.00 H new ATOM 0 HA ILE A 64 -3.252 -23.198 -5.084 1.00 0.00 H new ATOM 0 HB ILE A 64 -4.497 -20.466 -5.615 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -5.945 -22.452 -6.095 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -5.575 -21.471 -7.499 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -3.187 -20.505 -7.701 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.136 -20.528 -6.265 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.417 -22.025 -7.186 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -5.427 -23.854 -8.032 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -3.831 -23.080 -8.182 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -4.207 -24.077 -6.756 1.00 0.00 H new ATOM 1019 N PRO A 65 -1.395 -22.147 -3.811 1.00 0.00 N ATOM 1020 CA PRO A 65 -0.250 -21.560 -3.109 1.00 0.00 C ATOM 1021 C PRO A 65 0.400 -20.431 -3.902 1.00 0.00 C ATOM 1022 O PRO A 65 -0.036 -20.103 -5.006 1.00 0.00 O ATOM 1023 CB PRO A 65 0.718 -22.737 -2.963 1.00 0.00 C ATOM 1024 CG PRO A 65 0.366 -23.657 -4.080 1.00 0.00 C ATOM 1025 CD PRO A 65 -1.117 -23.513 -4.284 1.00 0.00 C ATOM 0 HA PRO A 65 -0.541 -21.109 -2.160 1.00 0.00 H new ATOM 0 HB2 PRO A 65 1.755 -22.408 -3.033 1.00 0.00 H new ATOM 0 HB3 PRO A 65 0.603 -23.226 -1.996 1.00 0.00 H new ATOM 0 HG2 PRO A 65 0.912 -23.396 -4.987 1.00 0.00 H new ATOM 0 HG3 PRO A 65 0.628 -24.686 -3.835 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -1.393 -23.640 -5.331 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -1.675 -24.257 -3.715 1.00 0.00 H new ATOM 1033 N LEU A 66 1.445 -19.840 -3.333 1.00 0.00 N ATOM 1034 CA LEU A 66 2.156 -18.748 -3.988 1.00 0.00 C ATOM 1035 C LEU A 66 3.442 -19.247 -4.638 1.00 0.00 C ATOM 1036 O LEU A 66 4.044 -20.219 -4.181 1.00 0.00 O ATOM 1037 CB LEU A 66 2.478 -17.645 -2.978 1.00 0.00 C ATOM 1038 CG LEU A 66 1.282 -16.858 -2.440 1.00 0.00 C ATOM 1039 CD1 LEU A 66 1.748 -15.738 -1.522 1.00 0.00 C ATOM 1040 CD2 LEU A 66 0.451 -16.300 -3.586 1.00 0.00 C ATOM 0 H LEU A 66 1.819 -20.099 -2.420 1.00 0.00 H new ATOM 0 HA LEU A 66 1.510 -18.343 -4.767 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.001 -18.094 -2.134 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.169 -16.943 -3.445 1.00 0.00 H new ATOM 0 HG LEU A 66 0.656 -17.537 -1.861 1.00 0.00 H new ATOM 0 HD11 LEU A 66 0.883 -15.189 -1.149 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.299 -16.161 -0.682 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.397 -15.060 -2.076 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.395 -15.743 -3.184 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.067 -15.636 -4.193 1.00 0.00 H new ATOM 0 HD23 LEU A 66 0.085 -17.120 -4.203 1.00 0.00 H new ATOM 1052 N ASP A 67 3.858 -18.576 -5.706 1.00 0.00 N ATOM 1053 CA ASP A 67 5.075 -18.950 -6.418 1.00 0.00 C ATOM 1054 C ASP A 67 5.929 -17.721 -6.717 1.00 0.00 C ATOM 1055 O ASP A 67 5.532 -16.592 -6.429 1.00 0.00 O ATOM 1056 CB ASP A 67 4.728 -19.673 -7.720 1.00 0.00 C ATOM 1057 CG ASP A 67 4.459 -18.713 -8.863 1.00 0.00 C ATOM 1058 OD1 ASP A 67 3.603 -17.819 -8.697 1.00 0.00 O ATOM 1059 OD2 ASP A 67 5.105 -18.855 -9.922 1.00 0.00 O ATOM 0 H ASP A 67 3.371 -17.770 -6.098 1.00 0.00 H new ATOM 0 HA ASP A 67 5.648 -19.622 -5.779 1.00 0.00 H new ATOM 0 HB2 ASP A 67 5.548 -20.337 -7.993 1.00 0.00 H new ATOM 0 HB3 ASP A 67 3.850 -20.299 -7.561 1.00 0.00 H new ATOM 1064 N PHE A 68 7.103 -17.950 -7.295 1.00 0.00 N ATOM 1065 CA PHE A 68 8.015 -16.862 -7.630 1.00 0.00 C ATOM 1066 C PHE A 68 7.347 -15.864 -8.572 1.00 0.00 C ATOM 1067 O PHE A 68 7.620 -14.665 -8.518 1.00 0.00 O ATOM 1068 CB PHE A 68 9.288 -17.415 -8.274 1.00 0.00 C ATOM 1069 CG PHE A 68 10.265 -17.978 -7.282 1.00 0.00 C ATOM 1070 CD1 PHE A 68 9.987 -19.157 -6.608 1.00 0.00 C ATOM 1071 CD2 PHE A 68 11.462 -17.330 -7.023 1.00 0.00 C ATOM 1072 CE1 PHE A 68 10.884 -19.677 -5.694 1.00 0.00 C ATOM 1073 CE2 PHE A 68 12.363 -17.845 -6.110 1.00 0.00 C ATOM 1074 CZ PHE A 68 12.074 -19.021 -5.446 1.00 0.00 C ATOM 0 H PHE A 68 7.446 -18.879 -7.541 1.00 0.00 H new ATOM 0 HA PHE A 68 8.278 -16.345 -6.708 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.016 -18.194 -8.987 1.00 0.00 H new ATOM 0 HB3 PHE A 68 9.774 -16.620 -8.840 1.00 0.00 H new ATOM 0 HD1 PHE A 68 9.059 -19.675 -6.799 1.00 0.00 H new ATOM 0 HD2 PHE A 68 11.694 -16.411 -7.541 1.00 0.00 H new ATOM 0 HE1 PHE A 68 10.655 -20.595 -5.174 1.00 0.00 H new ATOM 0 HE2 PHE A 68 13.292 -17.329 -5.916 1.00 0.00 H new ATOM 0 HZ PHE A 68 12.777 -19.427 -4.734 1.00 0.00 H new ATOM 1084 N SER A 69 6.472 -16.369 -9.436 1.00 0.00 N ATOM 1085 CA SER A 69 5.769 -15.524 -10.394 1.00 0.00 C ATOM 1086 C SER A 69 4.687 -14.702 -9.700 1.00 0.00 C ATOM 1087 O SER A 69 4.306 -13.631 -10.174 1.00 0.00 O ATOM 1088 CB SER A 69 5.146 -16.379 -11.499 1.00 0.00 C ATOM 1089 OG SER A 69 4.621 -15.568 -12.536 1.00 0.00 O ATOM 0 H SER A 69 6.233 -17.359 -9.492 1.00 0.00 H new ATOM 0 HA SER A 69 6.492 -14.840 -10.838 1.00 0.00 H new ATOM 0 HB2 SER A 69 5.897 -17.055 -11.907 1.00 0.00 H new ATOM 0 HB3 SER A 69 4.353 -16.998 -11.080 1.00 0.00 H new ATOM 0 HG SER A 69 4.230 -16.138 -13.231 1.00 0.00 H new ATOM 1095 N SER A 70 4.195 -15.212 -8.576 1.00 0.00 N ATOM 1096 CA SER A 70 3.153 -14.528 -7.818 1.00 0.00 C ATOM 1097 C SER A 70 3.692 -13.247 -7.188 1.00 0.00 C ATOM 1098 O SER A 70 4.706 -13.264 -6.490 1.00 0.00 O ATOM 1099 CB SER A 70 2.596 -15.449 -6.731 1.00 0.00 C ATOM 1100 OG SER A 70 1.965 -16.584 -7.298 1.00 0.00 O ATOM 0 H SER A 70 4.501 -16.096 -8.170 1.00 0.00 H new ATOM 0 HA SER A 70 2.351 -14.264 -8.507 1.00 0.00 H new ATOM 0 HB2 SER A 70 3.403 -15.769 -6.072 1.00 0.00 H new ATOM 0 HB3 SER A 70 1.882 -14.901 -6.117 1.00 0.00 H new ATOM 0 HG SER A 70 2.439 -16.848 -8.114 1.00 0.00 H new ATOM 1106 N SER A 71 3.006 -12.137 -7.441 1.00 0.00 N ATOM 1107 CA SER A 71 3.417 -10.845 -6.902 1.00 0.00 C ATOM 1108 C SER A 71 2.216 -9.920 -6.735 1.00 0.00 C ATOM 1109 O SER A 71 1.143 -10.170 -7.285 1.00 0.00 O ATOM 1110 CB SER A 71 4.454 -10.193 -7.819 1.00 0.00 C ATOM 1111 OG SER A 71 5.595 -11.019 -7.968 1.00 0.00 O ATOM 0 H SER A 71 2.164 -12.106 -8.015 1.00 0.00 H new ATOM 0 HA SER A 71 3.864 -11.013 -5.922 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.010 -10.001 -8.796 1.00 0.00 H new ATOM 0 HB3 SER A 71 4.751 -9.228 -7.409 1.00 0.00 H new ATOM 0 HG SER A 71 6.241 -10.580 -8.560 1.00 0.00 H new ATOM 1117 N LEU A 72 2.404 -8.849 -5.971 1.00 0.00 N ATOM 1118 CA LEU A 72 1.337 -7.885 -5.729 1.00 0.00 C ATOM 1119 C LEU A 72 1.576 -6.599 -6.514 1.00 0.00 C ATOM 1120 O LEU A 72 2.718 -6.217 -6.765 1.00 0.00 O ATOM 1121 CB LEU A 72 1.234 -7.572 -4.235 1.00 0.00 C ATOM 1122 CG LEU A 72 -0.144 -7.137 -3.734 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -1.142 -8.277 -3.860 1.00 0.00 C ATOM 1124 CD2 LEU A 72 -0.059 -6.656 -2.293 1.00 0.00 C ATOM 0 H LEU A 72 3.286 -8.627 -5.509 1.00 0.00 H new ATOM 0 HA LEU A 72 0.399 -8.326 -6.067 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.539 -8.457 -3.677 1.00 0.00 H new ATOM 0 HB3 LEU A 72 1.950 -6.784 -3.999 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.490 -6.309 -4.353 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.117 -7.949 -3.499 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.224 -8.575 -4.905 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.802 -9.126 -3.266 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.048 -6.350 -1.953 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.309 -7.464 -1.661 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.624 -5.808 -2.232 1.00 0.00 H new ATOM 1136 N GLY A 73 0.491 -5.935 -6.898 1.00 0.00 N ATOM 1137 CA GLY A 73 0.604 -4.698 -7.649 1.00 0.00 C ATOM 1138 C GLY A 73 0.051 -3.507 -6.892 1.00 0.00 C ATOM 1139 O GLY A 73 -1.150 -3.433 -6.630 1.00 0.00 O ATOM 0 H GLY A 73 -0.465 -6.231 -6.703 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.652 -4.517 -7.889 1.00 0.00 H new ATOM 0 HA3 GLY A 73 0.073 -4.801 -8.595 1.00 0.00 H new ATOM 1143 N ILE A 74 0.928 -2.574 -6.537 1.00 0.00 N ATOM 1144 CA ILE A 74 0.520 -1.381 -5.805 1.00 0.00 C ATOM 1145 C ILE A 74 0.582 -0.143 -6.693 1.00 0.00 C ATOM 1146 O ILE A 74 1.665 0.336 -7.032 1.00 0.00 O ATOM 1147 CB ILE A 74 1.401 -1.154 -4.563 1.00 0.00 C ATOM 1148 CG1 ILE A 74 1.355 -2.378 -3.647 1.00 0.00 C ATOM 1149 CG2 ILE A 74 0.951 0.092 -3.815 1.00 0.00 C ATOM 1150 CD1 ILE A 74 -0.049 -2.854 -3.345 1.00 0.00 C ATOM 0 H ILE A 74 1.926 -2.621 -6.744 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.509 -1.544 -5.485 1.00 0.00 H new ATOM 0 HB ILE A 74 2.431 -1.006 -4.888 1.00 0.00 H new ATOM 0 HG12 ILE A 74 1.913 -3.191 -4.112 1.00 0.00 H new ATOM 0 HG13 ILE A 74 1.859 -2.140 -2.710 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.583 0.239 -2.939 1.00 0.00 H new ATOM 0 HG22 ILE A 74 1.032 0.959 -4.471 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -0.085 -0.028 -3.498 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -0.005 -3.725 -2.691 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.605 -2.057 -2.852 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.550 -3.124 -4.275 1.00 0.00 H new ATOM 1162 N ILE A 75 -0.585 0.372 -7.064 1.00 0.00 N ATOM 1163 CA ILE A 75 -0.663 1.556 -7.910 1.00 0.00 C ATOM 1164 C ILE A 75 -1.317 2.718 -7.170 1.00 0.00 C ATOM 1165 O ILE A 75 -2.507 2.677 -6.856 1.00 0.00 O ATOM 1166 CB ILE A 75 -1.453 1.275 -9.202 1.00 0.00 C ATOM 1167 CG1 ILE A 75 -1.027 -0.065 -9.805 1.00 0.00 C ATOM 1168 CG2 ILE A 75 -1.248 2.401 -10.204 1.00 0.00 C ATOM 1169 CD1 ILE A 75 -2.046 -0.651 -10.756 1.00 0.00 C ATOM 0 H ILE A 75 -1.490 -0.012 -6.792 1.00 0.00 H new ATOM 0 HA ILE A 75 0.361 1.824 -8.172 1.00 0.00 H new ATOM 0 HB ILE A 75 -2.514 1.221 -8.957 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.083 0.067 -10.333 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.844 -0.775 -8.999 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -1.813 2.188 -11.112 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -1.596 3.340 -9.773 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.189 2.484 -10.447 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.677 -1.600 -11.145 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.985 -0.816 -10.227 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -2.212 0.040 -11.583 1.00 0.00 H new ATOM 1181 N VAL A 76 -0.532 3.755 -6.896 1.00 0.00 N ATOM 1182 CA VAL A 76 -1.035 4.931 -6.195 1.00 0.00 C ATOM 1183 C VAL A 76 -1.368 6.052 -7.173 1.00 0.00 C ATOM 1184 O VAL A 76 -0.483 6.607 -7.824 1.00 0.00 O ATOM 1185 CB VAL A 76 -0.015 5.449 -5.164 1.00 0.00 C ATOM 1186 CG1 VAL A 76 -0.563 6.667 -4.436 1.00 0.00 C ATOM 1187 CG2 VAL A 76 0.353 4.349 -4.180 1.00 0.00 C ATOM 0 H VAL A 76 0.455 3.805 -7.149 1.00 0.00 H new ATOM 0 HA VAL A 76 -1.943 4.626 -5.674 1.00 0.00 H new ATOM 0 HB VAL A 76 0.890 5.749 -5.693 1.00 0.00 H new ATOM 0 HG11 VAL A 76 0.172 7.019 -3.712 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -0.770 7.458 -5.156 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -1.483 6.398 -3.918 1.00 0.00 H new ATOM 0 HG21 VAL A 76 1.075 4.733 -3.459 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -0.542 4.016 -3.655 1.00 0.00 H new ATOM 0 HG23 VAL A 76 0.791 3.509 -4.720 1.00 0.00 H new ATOM 1197 N LYS A 77 -2.652 6.382 -7.271 1.00 0.00 N ATOM 1198 CA LYS A 77 -3.104 7.439 -8.167 1.00 0.00 C ATOM 1199 C LYS A 77 -4.191 8.283 -7.509 1.00 0.00 C ATOM 1200 O LYS A 77 -4.811 7.861 -6.533 1.00 0.00 O ATOM 1201 CB LYS A 77 -3.630 6.839 -9.473 1.00 0.00 C ATOM 1202 CG LYS A 77 -2.574 6.091 -10.268 1.00 0.00 C ATOM 1203 CD LYS A 77 -3.180 4.948 -11.064 1.00 0.00 C ATOM 1204 CE LYS A 77 -4.244 5.445 -12.032 1.00 0.00 C ATOM 1205 NZ LYS A 77 -5.136 4.344 -12.489 1.00 0.00 N ATOM 0 H LYS A 77 -3.398 5.932 -6.740 1.00 0.00 H new ATOM 0 HA LYS A 77 -2.252 8.083 -8.387 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -4.451 6.159 -9.246 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -4.040 7.638 -10.091 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -2.071 6.781 -10.946 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -1.815 5.701 -9.590 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -2.395 4.433 -11.618 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -3.619 4.220 -10.381 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -4.841 6.219 -11.550 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -3.763 5.905 -12.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -5.847 4.723 -13.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -4.571 3.617 -12.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -5.615 3.922 -11.668 1.00 0.00 H new ATOM 1219 N ASP A 78 -4.416 9.475 -8.050 1.00 0.00 N ATOM 1220 CA ASP A 78 -5.430 10.377 -7.517 1.00 0.00 C ATOM 1221 C ASP A 78 -6.831 9.827 -7.763 1.00 0.00 C ATOM 1222 O ASP A 78 -7.258 9.676 -8.909 1.00 0.00 O ATOM 1223 CB ASP A 78 -5.294 11.763 -8.149 1.00 0.00 C ATOM 1224 CG ASP A 78 -6.259 12.769 -7.552 1.00 0.00 C ATOM 1225 OD1 ASP A 78 -6.786 12.505 -6.451 1.00 0.00 O ATOM 1226 OD2 ASP A 78 -6.486 13.821 -8.186 1.00 0.00 O ATOM 0 H ASP A 78 -3.910 9.839 -8.857 1.00 0.00 H new ATOM 0 HA ASP A 78 -5.276 10.461 -6.441 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -4.273 12.121 -8.017 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -5.469 11.689 -9.222 1.00 0.00 H new ATOM 1231 N PHE A 79 -7.543 9.527 -6.682 1.00 0.00 N ATOM 1232 CA PHE A 79 -8.895 8.991 -6.781 1.00 0.00 C ATOM 1233 C PHE A 79 -9.743 9.826 -7.736 1.00 0.00 C ATOM 1234 O PHE A 79 -10.414 9.289 -8.616 1.00 0.00 O ATOM 1235 CB PHE A 79 -9.553 8.950 -5.400 1.00 0.00 C ATOM 1236 CG PHE A 79 -10.808 8.127 -5.358 1.00 0.00 C ATOM 1237 CD1 PHE A 79 -10.791 6.793 -5.735 1.00 0.00 C ATOM 1238 CD2 PHE A 79 -12.005 8.685 -4.940 1.00 0.00 C ATOM 1239 CE1 PHE A 79 -11.944 6.033 -5.697 1.00 0.00 C ATOM 1240 CE2 PHE A 79 -13.163 7.930 -4.901 1.00 0.00 C ATOM 1241 CZ PHE A 79 -13.132 6.602 -5.279 1.00 0.00 C ATOM 0 H PHE A 79 -7.206 9.646 -5.727 1.00 0.00 H new ATOM 0 HA PHE A 79 -8.828 7.977 -7.174 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -8.841 8.549 -4.679 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -9.785 9.968 -5.087 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -9.866 6.343 -6.062 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -12.034 9.722 -4.641 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -11.917 4.995 -5.994 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -14.090 8.378 -4.575 1.00 0.00 H new ATOM 0 HZ PHE A 79 -14.034 6.009 -5.248 1.00 0.00 H new ATOM 1378 N ILE A 88 0.514 9.021 -9.754 1.00 0.00 N ATOM 1379 CA ILE A 88 1.380 9.461 -8.667 1.00 0.00 C ATOM 1380 C ILE A 88 2.599 8.555 -8.534 1.00 0.00 C ATOM 1381 O ILE A 88 3.730 9.029 -8.436 1.00 0.00 O ATOM 1382 CB ILE A 88 0.627 9.491 -7.324 1.00 0.00 C ATOM 1383 CG1 ILE A 88 -0.665 10.299 -7.457 1.00 0.00 C ATOM 1384 CG2 ILE A 88 1.513 10.074 -6.233 1.00 0.00 C ATOM 1385 CD1 ILE A 88 -1.646 10.059 -6.330 1.00 0.00 C ATOM 0 HA ILE A 88 1.707 10.471 -8.913 1.00 0.00 H new ATOM 0 HB ILE A 88 0.367 8.469 -7.047 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -0.418 11.360 -7.494 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -1.144 10.050 -8.404 1.00 0.00 H new ATOM 0 HG21 ILE A 88 0.967 10.089 -5.290 1.00 0.00 H new ATOM 0 HG22 ILE A 88 2.408 9.461 -6.125 1.00 0.00 H new ATOM 0 HG23 ILE A 88 1.800 11.091 -6.502 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -2.538 10.664 -6.489 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -1.922 9.005 -6.306 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -1.185 10.335 -5.382 1.00 0.00 H new ATOM 1397 N GLY A 89 2.360 7.247 -8.534 1.00 0.00 N ATOM 1398 CA GLY A 89 3.448 6.294 -8.414 1.00 0.00 C ATOM 1399 C GLY A 89 2.957 4.870 -8.247 1.00 0.00 C ATOM 1400 O GLY A 89 1.842 4.641 -7.775 1.00 0.00 O ATOM 0 H GLY A 89 1.432 6.830 -8.615 1.00 0.00 H new ATOM 0 HA2 GLY A 89 4.080 6.355 -9.300 1.00 0.00 H new ATOM 0 HA3 GLY A 89 4.070 6.563 -7.560 1.00 0.00 H new ATOM 1404 N THR A 90 3.788 3.909 -8.635 1.00 0.00 N ATOM 1405 CA THR A 90 3.431 2.500 -8.529 1.00 0.00 C ATOM 1406 C THR A 90 4.530 1.705 -7.833 1.00 0.00 C ATOM 1407 O THR A 90 5.608 2.230 -7.556 1.00 0.00 O ATOM 1408 CB THR A 90 3.166 1.881 -9.914 1.00 0.00 C ATOM 1409 OG1 THR A 90 4.383 1.823 -10.666 1.00 0.00 O ATOM 1410 CG2 THR A 90 2.130 2.692 -10.679 1.00 0.00 C ATOM 0 H THR A 90 4.714 4.081 -9.026 1.00 0.00 H new ATOM 0 HA THR A 90 2.518 2.450 -7.936 1.00 0.00 H new ATOM 0 HB THR A 90 2.781 0.872 -9.769 1.00 0.00 H new ATOM 0 HG1 THR A 90 4.799 2.710 -10.684 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.959 2.236 -11.654 1.00 0.00 H new ATOM 0 HG22 THR A 90 1.196 2.710 -10.118 1.00 0.00 H new ATOM 0 HG23 THR A 90 2.493 3.711 -10.813 1.00 0.00 H new ATOM 1418 N ALA A 91 4.250 0.437 -7.553 1.00 0.00 N ATOM 1419 CA ALA A 91 5.216 -0.431 -6.891 1.00 0.00 C ATOM 1420 C ALA A 91 4.712 -1.869 -6.831 1.00 0.00 C ATOM 1421 O ALA A 91 3.575 -2.124 -6.433 1.00 0.00 O ATOM 1422 CB ALA A 91 5.516 0.083 -5.491 1.00 0.00 C ATOM 0 H ALA A 91 3.362 -0.013 -7.774 1.00 0.00 H new ATOM 0 HA ALA A 91 6.136 -0.420 -7.475 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.239 -0.575 -5.009 1.00 0.00 H new ATOM 0 HB2 ALA A 91 5.928 1.090 -5.554 1.00 0.00 H new ATOM 0 HB3 ALA A 91 4.597 0.103 -4.906 1.00 0.00 H new ATOM 1428 N THR A 92 5.565 -2.808 -7.231 1.00 0.00 N ATOM 1429 CA THR A 92 5.205 -4.220 -7.225 1.00 0.00 C ATOM 1430 C THR A 92 5.979 -4.980 -6.154 1.00 0.00 C ATOM 1431 O THR A 92 7.199 -4.854 -6.048 1.00 0.00 O ATOM 1432 CB THR A 92 5.470 -4.873 -8.594 1.00 0.00 C ATOM 1433 OG1 THR A 92 4.861 -4.098 -9.633 1.00 0.00 O ATOM 1434 CG2 THR A 92 4.928 -6.294 -8.630 1.00 0.00 C ATOM 0 H THR A 92 6.510 -2.615 -7.563 1.00 0.00 H new ATOM 0 HA THR A 92 4.139 -4.273 -7.006 1.00 0.00 H new ATOM 0 HB THR A 92 6.548 -4.908 -8.752 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.036 -4.519 -10.500 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.127 -6.735 -9.607 1.00 0.00 H new ATOM 0 HG22 THR A 92 5.415 -6.889 -7.858 1.00 0.00 H new ATOM 0 HG23 THR A 92 3.853 -6.278 -8.451 1.00 0.00 H new ATOM 1442 N VAL A 93 5.263 -5.770 -5.360 1.00 0.00 N ATOM 1443 CA VAL A 93 5.883 -6.552 -4.298 1.00 0.00 C ATOM 1444 C VAL A 93 5.915 -8.034 -4.653 1.00 0.00 C ATOM 1445 O VAL A 93 4.888 -8.712 -4.624 1.00 0.00 O ATOM 1446 CB VAL A 93 5.140 -6.371 -2.961 1.00 0.00 C ATOM 1447 CG1 VAL A 93 5.905 -7.041 -1.830 1.00 0.00 C ATOM 1448 CG2 VAL A 93 4.923 -4.895 -2.667 1.00 0.00 C ATOM 0 H VAL A 93 4.252 -5.885 -5.433 1.00 0.00 H new ATOM 0 HA VAL A 93 6.904 -6.186 -4.190 1.00 0.00 H new ATOM 0 HB VAL A 93 4.164 -6.849 -3.041 1.00 0.00 H new ATOM 0 HG11 VAL A 93 5.365 -6.903 -0.893 1.00 0.00 H new ATOM 0 HG12 VAL A 93 6.003 -8.106 -2.038 1.00 0.00 H new ATOM 0 HG13 VAL A 93 6.896 -6.595 -1.747 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.397 -4.786 -1.719 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.887 -4.390 -2.607 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.329 -4.449 -3.465 1.00 0.00 H new ATOM 1458 N ALA A 94 7.101 -8.531 -4.988 1.00 0.00 N ATOM 1459 CA ALA A 94 7.267 -9.934 -5.347 1.00 0.00 C ATOM 1460 C ALA A 94 7.037 -10.840 -4.142 1.00 0.00 C ATOM 1461 O ALA A 94 7.759 -10.761 -3.146 1.00 0.00 O ATOM 1462 CB ALA A 94 8.652 -10.170 -5.930 1.00 0.00 C ATOM 0 H ALA A 94 7.961 -7.983 -5.018 1.00 0.00 H new ATOM 0 HA ALA A 94 6.520 -10.181 -6.102 1.00 0.00 H new ATOM 0 HB1 ALA A 94 8.761 -11.222 -6.193 1.00 0.00 H new ATOM 0 HB2 ALA A 94 8.780 -9.557 -6.822 1.00 0.00 H new ATOM 0 HB3 ALA A 94 9.408 -9.900 -5.193 1.00 0.00 H new ATOM 1468 N LEU A 95 6.029 -11.699 -4.237 1.00 0.00 N ATOM 1469 CA LEU A 95 5.704 -12.620 -3.153 1.00 0.00 C ATOM 1470 C LEU A 95 6.631 -13.831 -3.171 1.00 0.00 C ATOM 1471 O LEU A 95 6.392 -14.821 -2.479 1.00 0.00 O ATOM 1472 CB LEU A 95 4.248 -13.077 -3.265 1.00 0.00 C ATOM 1473 CG LEU A 95 3.199 -11.966 -3.323 1.00 0.00 C ATOM 1474 CD1 LEU A 95 1.905 -12.485 -3.930 1.00 0.00 C ATOM 1475 CD2 LEU A 95 2.948 -11.396 -1.935 1.00 0.00 C ATOM 0 H LEU A 95 5.422 -11.777 -5.053 1.00 0.00 H new ATOM 0 HA LEU A 95 5.842 -12.094 -2.209 1.00 0.00 H new ATOM 0 HB2 LEU A 95 4.148 -13.690 -4.160 1.00 0.00 H new ATOM 0 HB3 LEU A 95 4.023 -13.718 -2.413 1.00 0.00 H new ATOM 0 HG LEU A 95 3.580 -11.166 -3.959 1.00 0.00 H new ATOM 0 HD11 LEU A 95 1.170 -11.680 -3.963 1.00 0.00 H new ATOM 0 HD12 LEU A 95 2.096 -12.844 -4.941 1.00 0.00 H new ATOM 0 HD13 LEU A 95 1.520 -13.303 -3.321 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.199 -10.607 -1.996 1.00 0.00 H new ATOM 0 HD22 LEU A 95 2.589 -12.187 -1.276 1.00 0.00 H new ATOM 0 HD23 LEU A 95 3.876 -10.985 -1.537 1.00 0.00 H new ATOM 1487 N LYS A 96 7.693 -13.745 -3.966 1.00 0.00 N ATOM 1488 CA LYS A 96 8.659 -14.832 -4.072 1.00 0.00 C ATOM 1489 C LYS A 96 9.426 -15.008 -2.765 1.00 0.00 C ATOM 1490 O LYS A 96 10.104 -16.015 -2.563 1.00 0.00 O ATOM 1491 CB LYS A 96 9.638 -14.561 -5.217 1.00 0.00 C ATOM 1492 CG LYS A 96 10.699 -13.528 -4.879 1.00 0.00 C ATOM 1493 CD LYS A 96 11.870 -13.594 -5.845 1.00 0.00 C ATOM 1494 CE LYS A 96 13.134 -13.015 -5.230 1.00 0.00 C ATOM 1495 NZ LYS A 96 14.280 -13.051 -6.180 1.00 0.00 N ATOM 0 H LYS A 96 7.906 -12.934 -4.546 1.00 0.00 H new ATOM 0 HA LYS A 96 8.112 -15.752 -4.279 1.00 0.00 H new ATOM 0 HB2 LYS A 96 10.127 -15.495 -5.494 1.00 0.00 H new ATOM 0 HB3 LYS A 96 9.079 -14.223 -6.090 1.00 0.00 H new ATOM 0 HG2 LYS A 96 10.259 -12.531 -4.907 1.00 0.00 H new ATOM 0 HG3 LYS A 96 11.056 -13.691 -3.862 1.00 0.00 H new ATOM 0 HD2 LYS A 96 12.047 -14.630 -6.134 1.00 0.00 H new ATOM 0 HD3 LYS A 96 11.623 -13.047 -6.755 1.00 0.00 H new ATOM 0 HE2 LYS A 96 12.950 -11.986 -4.922 1.00 0.00 H new ATOM 0 HE3 LYS A 96 13.390 -13.575 -4.331 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 15.123 -12.648 -5.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 14.473 -14.035 -6.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 14.046 -12.495 -7.027 1.00 0.00 H new ATOM 1509 N ASP A 97 9.313 -14.023 -1.881 1.00 0.00 N ATOM 1510 CA ASP A 97 9.993 -14.071 -0.592 1.00 0.00 C ATOM 1511 C ASP A 97 9.091 -14.681 0.477 1.00 0.00 C ATOM 1512 O ASP A 97 9.571 -15.260 1.452 1.00 0.00 O ATOM 1513 CB ASP A 97 10.429 -12.667 -0.169 1.00 0.00 C ATOM 1514 CG ASP A 97 11.385 -12.034 -1.161 1.00 0.00 C ATOM 1515 OD1 ASP A 97 12.019 -12.782 -1.933 1.00 0.00 O ATOM 1516 OD2 ASP A 97 11.500 -10.790 -1.164 1.00 0.00 O ATOM 0 H ASP A 97 8.757 -13.182 -2.033 1.00 0.00 H new ATOM 0 HA ASP A 97 10.876 -14.701 -0.698 1.00 0.00 H new ATOM 0 HB2 ASP A 97 9.549 -12.033 -0.062 1.00 0.00 H new ATOM 0 HB3 ASP A 97 10.906 -12.717 0.810 1.00 0.00 H new ATOM 1521 N LEU A 98 7.783 -14.545 0.287 1.00 0.00 N ATOM 1522 CA LEU A 98 6.813 -15.082 1.235 1.00 0.00 C ATOM 1523 C LEU A 98 6.468 -16.530 0.900 1.00 0.00 C ATOM 1524 O LEU A 98 6.014 -17.286 1.759 1.00 0.00 O ATOM 1525 CB LEU A 98 5.543 -14.229 1.233 1.00 0.00 C ATOM 1526 CG LEU A 98 5.723 -12.757 1.603 1.00 0.00 C ATOM 1527 CD1 LEU A 98 4.649 -11.905 0.943 1.00 0.00 C ATOM 1528 CD2 LEU A 98 5.692 -12.579 3.114 1.00 0.00 C ATOM 0 H LEU A 98 7.370 -14.068 -0.514 1.00 0.00 H new ATOM 0 HA LEU A 98 7.260 -15.055 2.229 1.00 0.00 H new ATOM 0 HB2 LEU A 98 5.096 -14.281 0.240 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.830 -14.673 1.928 1.00 0.00 H new ATOM 0 HG LEU A 98 6.696 -12.427 1.238 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.793 -10.860 1.218 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.717 -12.008 -0.140 1.00 0.00 H new ATOM 0 HD13 LEU A 98 3.666 -12.236 1.278 1.00 0.00 H new ATOM 0 HD21 LEU A 98 5.822 -11.525 3.359 1.00 0.00 H new ATOM 0 HD22 LEU A 98 4.734 -12.927 3.502 1.00 0.00 H new ATOM 0 HD23 LEU A 98 6.498 -13.158 3.565 1.00 0.00 H new ATOM 1540 N THR A 99 6.689 -16.910 -0.354 1.00 0.00 N ATOM 1541 CA THR A 99 6.403 -18.267 -0.803 1.00 0.00 C ATOM 1542 C THR A 99 6.940 -19.297 0.184 1.00 0.00 C ATOM 1543 O THR A 99 7.871 -19.021 0.940 1.00 0.00 O ATOM 1544 CB THR A 99 7.009 -18.539 -2.192 1.00 0.00 C ATOM 1545 OG1 THR A 99 8.316 -17.961 -2.278 1.00 0.00 O ATOM 1546 CG2 THR A 99 6.123 -17.969 -3.290 1.00 0.00 C ATOM 0 H THR A 99 7.065 -16.297 -1.077 1.00 0.00 H new ATOM 0 HA THR A 99 5.318 -18.357 -0.864 1.00 0.00 H new ATOM 0 HB THR A 99 7.080 -19.618 -2.328 1.00 0.00 H new ATOM 0 HG1 THR A 99 8.695 -18.140 -3.164 1.00 0.00 H new ATOM 0 HG21 THR A 99 6.571 -18.173 -4.262 1.00 0.00 H new ATOM 0 HG22 THR A 99 5.138 -18.433 -3.240 1.00 0.00 H new ATOM 0 HG23 THR A 99 6.024 -16.892 -3.155 1.00 0.00 H new ATOM 1554 N GLY A 100 6.348 -20.488 0.172 1.00 0.00 N ATOM 1555 CA GLY A 100 6.782 -21.542 1.070 1.00 0.00 C ATOM 1556 C GLY A 100 5.637 -22.428 1.519 1.00 0.00 C ATOM 1557 O GLY A 100 4.520 -22.313 1.016 1.00 0.00 O ATOM 0 H GLY A 100 5.575 -20.741 -0.444 1.00 0.00 H new ATOM 0 HA2 GLY A 100 7.536 -22.152 0.572 1.00 0.00 H new ATOM 0 HA3 GLY A 100 7.258 -21.098 1.944 1.00 0.00 H new ATOM 1561 N ASP A 101 5.916 -23.315 2.468 1.00 0.00 N ATOM 1562 CA ASP A 101 4.901 -24.226 2.985 1.00 0.00 C ATOM 1563 C ASP A 101 4.398 -23.762 4.348 1.00 0.00 C ATOM 1564 O ASP A 101 3.639 -24.466 5.013 1.00 0.00 O ATOM 1565 CB ASP A 101 5.464 -25.644 3.091 1.00 0.00 C ATOM 1566 CG ASP A 101 4.376 -26.700 3.092 1.00 0.00 C ATOM 1567 OD1 ASP A 101 3.479 -26.627 3.959 1.00 0.00 O ATOM 1568 OD2 ASP A 101 4.421 -27.600 2.228 1.00 0.00 O ATOM 0 H ASP A 101 6.836 -23.423 2.895 1.00 0.00 H new ATOM 0 HA ASP A 101 4.062 -24.228 2.289 1.00 0.00 H new ATOM 0 HB2 ASP A 101 6.142 -25.826 2.257 1.00 0.00 H new ATOM 0 HB3 ASP A 101 6.052 -25.731 4.005 1.00 0.00 H new ATOM 1573 N GLN A 102 4.829 -22.573 4.759 1.00 0.00 N ATOM 1574 CA GLN A 102 4.423 -22.016 6.044 1.00 0.00 C ATOM 1575 C GLN A 102 4.014 -20.554 5.899 1.00 0.00 C ATOM 1576 O GLN A 102 4.334 -19.905 4.903 1.00 0.00 O ATOM 1577 CB GLN A 102 5.561 -22.142 7.059 1.00 0.00 C ATOM 1578 CG GLN A 102 5.598 -23.486 7.768 1.00 0.00 C ATOM 1579 CD GLN A 102 4.394 -23.708 8.662 1.00 0.00 C ATOM 1580 OE1 GLN A 102 3.857 -22.765 9.245 1.00 0.00 O ATOM 1581 NE2 GLN A 102 3.962 -24.958 8.776 1.00 0.00 N ATOM 0 H GLN A 102 5.459 -21.978 4.221 1.00 0.00 H new ATOM 0 HA GLN A 102 3.562 -22.581 6.401 1.00 0.00 H new ATOM 0 HB2 GLN A 102 6.511 -21.984 6.549 1.00 0.00 H new ATOM 0 HB3 GLN A 102 5.463 -21.351 7.802 1.00 0.00 H new ATOM 0 HG2 GLN A 102 5.646 -24.283 7.026 1.00 0.00 H new ATOM 0 HG3 GLN A 102 6.507 -23.552 8.366 1.00 0.00 H new ATOM 0 HE21 GLN A 102 4.437 -25.709 8.275 1.00 0.00 H new ATOM 0 HE22 GLN A 102 3.155 -25.167 9.364 1.00 0.00 H new ATOM 1590 N SER A 103 3.305 -20.041 6.899 1.00 0.00 N ATOM 1591 CA SER A 103 2.848 -18.656 6.881 1.00 0.00 C ATOM 1592 C SER A 103 3.986 -17.704 7.237 1.00 0.00 C ATOM 1593 O SER A 103 4.679 -17.894 8.236 1.00 0.00 O ATOM 1594 CB SER A 103 1.686 -18.468 7.859 1.00 0.00 C ATOM 1595 OG SER A 103 1.401 -17.093 8.052 1.00 0.00 O ATOM 0 H SER A 103 3.034 -20.563 7.732 1.00 0.00 H new ATOM 0 HA SER A 103 2.506 -18.425 5.872 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.800 -18.977 7.479 1.00 0.00 H new ATOM 0 HB3 SER A 103 1.933 -18.930 8.815 1.00 0.00 H new ATOM 0 HG SER A 103 1.254 -16.664 7.183 1.00 0.00 H new ATOM 1601 N ARG A 104 4.173 -16.681 6.410 1.00 0.00 N ATOM 1602 CA ARG A 104 5.227 -15.699 6.635 1.00 0.00 C ATOM 1603 C ARG A 104 4.752 -14.297 6.266 1.00 0.00 C ATOM 1604 O ARG A 104 4.401 -14.032 5.116 1.00 0.00 O ATOM 1605 CB ARG A 104 6.470 -16.059 5.821 1.00 0.00 C ATOM 1606 CG ARG A 104 7.519 -14.959 5.792 1.00 0.00 C ATOM 1607 CD ARG A 104 8.774 -15.405 5.058 1.00 0.00 C ATOM 1608 NE ARG A 104 9.344 -16.619 5.636 1.00 0.00 N ATOM 1609 CZ ARG A 104 8.957 -17.844 5.301 1.00 0.00 C ATOM 1610 NH1 ARG A 104 8.004 -18.018 4.396 1.00 0.00 N ATOM 1611 NH2 ARG A 104 9.524 -18.900 5.872 1.00 0.00 N ATOM 0 H ARG A 104 3.608 -16.510 5.578 1.00 0.00 H new ATOM 0 HA ARG A 104 5.480 -15.710 7.695 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.916 -16.963 6.235 1.00 0.00 H new ATOM 0 HB3 ARG A 104 6.170 -16.290 4.799 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.107 -14.075 5.306 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.775 -14.672 6.812 1.00 0.00 H new ATOM 0 HD2 ARG A 104 8.537 -15.580 4.008 1.00 0.00 H new ATOM 0 HD3 ARG A 104 9.515 -14.606 5.089 1.00 0.00 H new ATOM 0 HE ARG A 104 10.080 -16.520 6.335 1.00 0.00 H new ATOM 0 HH11 ARG A 104 7.566 -17.209 3.955 1.00 0.00 H new ATOM 0 HH12 ARG A 104 7.709 -18.960 4.141 1.00 0.00 H new ATOM 0 HH21 ARG A 104 10.258 -18.771 6.569 1.00 0.00 H new ATOM 0 HH22 ARG A 104 9.226 -19.841 5.614 1.00 0.00 H new ATOM 1625 N SER A 105 4.743 -13.402 7.249 1.00 0.00 N ATOM 1626 CA SER A 105 4.307 -12.028 7.029 1.00 0.00 C ATOM 1627 C SER A 105 5.477 -11.059 7.163 1.00 0.00 C ATOM 1628 O SER A 105 5.948 -10.784 8.268 1.00 0.00 O ATOM 1629 CB SER A 105 3.204 -11.655 8.022 1.00 0.00 C ATOM 1630 OG SER A 105 3.654 -11.795 9.359 1.00 0.00 O ATOM 0 H SER A 105 5.033 -13.604 8.206 1.00 0.00 H new ATOM 0 HA SER A 105 3.913 -11.956 6.015 1.00 0.00 H new ATOM 0 HB2 SER A 105 2.885 -10.627 7.848 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.333 -12.290 7.859 1.00 0.00 H new ATOM 0 HG SER A 105 4.599 -11.542 9.414 1.00 0.00 H new ATOM 1636 N LEU A 106 5.943 -10.544 6.031 1.00 0.00 N ATOM 1637 CA LEU A 106 7.059 -9.604 6.020 1.00 0.00 C ATOM 1638 C LEU A 106 6.571 -8.181 5.767 1.00 0.00 C ATOM 1639 O LEU A 106 5.968 -7.880 4.736 1.00 0.00 O ATOM 1640 CB LEU A 106 8.077 -10.004 4.951 1.00 0.00 C ATOM 1641 CG LEU A 106 8.836 -11.307 5.200 1.00 0.00 C ATOM 1642 CD1 LEU A 106 9.413 -11.847 3.901 1.00 0.00 C ATOM 1643 CD2 LEU A 106 9.939 -11.094 6.227 1.00 0.00 C ATOM 0 H LEU A 106 5.566 -10.761 5.109 1.00 0.00 H new ATOM 0 HA LEU A 106 7.538 -9.635 6.999 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.558 -10.087 3.996 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.803 -9.198 4.850 1.00 0.00 H new ATOM 0 HG LEU A 106 8.135 -12.042 5.595 1.00 0.00 H new ATOM 0 HD11 LEU A 106 9.950 -12.775 4.099 1.00 0.00 H new ATOM 0 HD12 LEU A 106 8.604 -12.039 3.196 1.00 0.00 H new ATOM 0 HD13 LEU A 106 10.099 -11.115 3.476 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.469 -12.032 6.392 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.638 -10.342 5.860 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.501 -10.755 7.166 1.00 0.00 H new ATOM 1655 N PRO A 107 6.837 -7.284 6.728 1.00 0.00 N ATOM 1656 CA PRO A 107 6.436 -5.878 6.631 1.00 0.00 C ATOM 1657 C PRO A 107 7.227 -5.121 5.569 1.00 0.00 C ATOM 1658 O PRO A 107 8.401 -4.804 5.763 1.00 0.00 O ATOM 1659 CB PRO A 107 6.746 -5.324 8.023 1.00 0.00 C ATOM 1660 CG PRO A 107 7.821 -6.209 8.553 1.00 0.00 C ATOM 1661 CD PRO A 107 7.552 -7.574 7.982 1.00 0.00 C ATOM 0 HA PRO A 107 5.392 -5.772 6.337 1.00 0.00 H new ATOM 0 HB2 PRO A 107 7.077 -4.287 7.971 1.00 0.00 H new ATOM 0 HB3 PRO A 107 5.864 -5.346 8.663 1.00 0.00 H new ATOM 0 HG2 PRO A 107 8.806 -5.848 8.255 1.00 0.00 H new ATOM 0 HG3 PRO A 107 7.806 -6.232 9.643 1.00 0.00 H new ATOM 0 HD2 PRO A 107 8.476 -8.123 7.800 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.949 -8.181 8.658 1.00 0.00 H new ATOM 1669 N TYR A 108 6.577 -4.835 4.446 1.00 0.00 N ATOM 1670 CA TYR A 108 7.220 -4.117 3.352 1.00 0.00 C ATOM 1671 C TYR A 108 7.051 -2.610 3.515 1.00 0.00 C ATOM 1672 O TYR A 108 5.998 -2.053 3.203 1.00 0.00 O ATOM 1673 CB TYR A 108 6.640 -4.564 2.010 1.00 0.00 C ATOM 1674 CG TYR A 108 7.134 -5.920 1.558 1.00 0.00 C ATOM 1675 CD1 TYR A 108 8.296 -6.043 0.806 1.00 0.00 C ATOM 1676 CD2 TYR A 108 6.439 -7.078 1.883 1.00 0.00 C ATOM 1677 CE1 TYR A 108 8.750 -7.279 0.390 1.00 0.00 C ATOM 1678 CE2 TYR A 108 6.887 -8.319 1.473 1.00 0.00 C ATOM 1679 CZ TYR A 108 8.043 -8.415 0.727 1.00 0.00 C ATOM 1680 OH TYR A 108 8.492 -9.649 0.315 1.00 0.00 O ATOM 0 H TYR A 108 5.605 -5.090 4.270 1.00 0.00 H new ATOM 0 HA TYR A 108 8.285 -4.349 3.376 1.00 0.00 H new ATOM 0 HB2 TYR A 108 5.553 -4.589 2.084 1.00 0.00 H new ATOM 0 HB3 TYR A 108 6.891 -3.824 1.251 1.00 0.00 H new ATOM 0 HD1 TYR A 108 8.854 -5.157 0.542 1.00 0.00 H new ATOM 0 HD2 TYR A 108 5.533 -7.007 2.466 1.00 0.00 H new ATOM 0 HE1 TYR A 108 9.654 -7.356 -0.196 1.00 0.00 H new ATOM 0 HE2 TYR A 108 6.335 -9.209 1.735 1.00 0.00 H new ATOM 0 HH TYR A 108 7.880 -10.344 0.637 1.00 0.00 H new ATOM 1690 N LYS A 109 8.096 -1.953 4.007 1.00 0.00 N ATOM 1691 CA LYS A 109 8.067 -0.510 4.211 1.00 0.00 C ATOM 1692 C LYS A 109 9.205 0.170 3.456 1.00 0.00 C ATOM 1693 O LYS A 109 10.146 -0.487 3.008 1.00 0.00 O ATOM 1694 CB LYS A 109 8.163 -0.183 5.703 1.00 0.00 C ATOM 1695 CG LYS A 109 7.451 -1.186 6.593 1.00 0.00 C ATOM 1696 CD LYS A 109 7.024 -0.560 7.909 1.00 0.00 C ATOM 1697 CE LYS A 109 6.705 -1.619 8.953 1.00 0.00 C ATOM 1698 NZ LYS A 109 7.923 -2.055 9.691 1.00 0.00 N ATOM 0 H LYS A 109 8.975 -2.398 4.272 1.00 0.00 H new ATOM 0 HA LYS A 109 7.121 -0.133 3.823 1.00 0.00 H new ATOM 0 HB2 LYS A 109 9.214 -0.138 5.989 1.00 0.00 H new ATOM 0 HB3 LYS A 109 7.742 0.807 5.877 1.00 0.00 H new ATOM 0 HG2 LYS A 109 6.576 -1.577 6.074 1.00 0.00 H new ATOM 0 HG3 LYS A 109 8.110 -2.032 6.789 1.00 0.00 H new ATOM 0 HD2 LYS A 109 7.818 0.089 8.279 1.00 0.00 H new ATOM 0 HD3 LYS A 109 6.148 0.068 7.747 1.00 0.00 H new ATOM 0 HE2 LYS A 109 5.974 -1.224 9.659 1.00 0.00 H new ATOM 0 HE3 LYS A 109 6.246 -2.481 8.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 7.664 -2.777 10.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 8.610 -2.455 9.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 8.347 -1.238 10.175 1.00 0.00 H new ATOM 1712 N LEU A 110 9.113 1.488 3.319 1.00 0.00 N ATOM 1713 CA LEU A 110 10.137 2.257 2.619 1.00 0.00 C ATOM 1714 C LEU A 110 10.187 1.880 1.142 1.00 0.00 C ATOM 1715 O LEU A 110 11.261 1.818 0.543 1.00 0.00 O ATOM 1716 CB LEU A 110 11.505 2.027 3.263 1.00 0.00 C ATOM 1717 CG LEU A 110 11.597 2.308 4.763 1.00 0.00 C ATOM 1718 CD1 LEU A 110 12.787 1.582 5.370 1.00 0.00 C ATOM 1719 CD2 LEU A 110 11.695 3.805 5.020 1.00 0.00 C ATOM 0 H LEU A 110 8.341 2.046 3.683 1.00 0.00 H new ATOM 0 HA LEU A 110 9.879 3.313 2.696 1.00 0.00 H new ATOM 0 HB2 LEU A 110 11.796 0.991 3.089 1.00 0.00 H new ATOM 0 HB3 LEU A 110 12.235 2.654 2.751 1.00 0.00 H new ATOM 0 HG LEU A 110 10.690 1.936 5.239 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.836 1.794 6.438 1.00 0.00 H new ATOM 0 HD12 LEU A 110 12.675 0.509 5.218 1.00 0.00 H new ATOM 0 HD13 LEU A 110 13.704 1.922 4.890 1.00 0.00 H new ATOM 0 HD21 LEU A 110 11.760 3.987 6.093 1.00 0.00 H new ATOM 0 HD22 LEU A 110 12.585 4.201 4.531 1.00 0.00 H new ATOM 0 HD23 LEU A 110 10.811 4.301 4.621 1.00 0.00 H new ATOM 1731 N ILE A 111 9.018 1.630 0.560 1.00 0.00 N ATOM 1732 CA ILE A 111 8.929 1.262 -0.847 1.00 0.00 C ATOM 1733 C ILE A 111 8.924 2.499 -1.739 1.00 0.00 C ATOM 1734 O ILE A 111 8.057 3.363 -1.615 1.00 0.00 O ATOM 1735 CB ILE A 111 7.664 0.431 -1.133 1.00 0.00 C ATOM 1736 CG1 ILE A 111 7.696 -0.876 -0.338 1.00 0.00 C ATOM 1737 CG2 ILE A 111 7.542 0.148 -2.623 1.00 0.00 C ATOM 1738 CD1 ILE A 111 6.418 -1.678 -0.444 1.00 0.00 C ATOM 0 H ILE A 111 8.120 1.676 1.042 1.00 0.00 H new ATOM 0 HA ILE A 111 9.808 0.658 -1.072 1.00 0.00 H new ATOM 0 HB ILE A 111 6.792 1.004 -0.819 1.00 0.00 H new ATOM 0 HG12 ILE A 111 8.528 -1.486 -0.690 1.00 0.00 H new ATOM 0 HG13 ILE A 111 7.888 -0.649 0.711 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.643 -0.440 -2.809 1.00 0.00 H new ATOM 0 HG22 ILE A 111 7.479 1.090 -3.168 1.00 0.00 H new ATOM 0 HG23 ILE A 111 8.416 -0.409 -2.960 1.00 0.00 H new ATOM 0 HD11 ILE A 111 6.512 -2.591 0.144 1.00 0.00 H new ATOM 0 HD12 ILE A 111 5.585 -1.086 -0.065 1.00 0.00 H new ATOM 0 HD13 ILE A 111 6.235 -1.935 -1.487 1.00 0.00 H new ATOM 1750 N SER A 112 9.898 2.575 -2.641 1.00 0.00 N ATOM 1751 CA SER A 112 10.007 3.707 -3.554 1.00 0.00 C ATOM 1752 C SER A 112 9.014 3.575 -4.704 1.00 0.00 C ATOM 1753 O SER A 112 9.047 2.603 -5.460 1.00 0.00 O ATOM 1754 CB SER A 112 11.431 3.811 -4.103 1.00 0.00 C ATOM 1755 OG SER A 112 12.252 4.590 -3.250 1.00 0.00 O ATOM 0 H SER A 112 10.622 1.867 -2.759 1.00 0.00 H new ATOM 0 HA SER A 112 9.773 4.615 -2.998 1.00 0.00 H new ATOM 0 HB2 SER A 112 11.856 2.813 -4.210 1.00 0.00 H new ATOM 0 HB3 SER A 112 11.409 4.256 -5.098 1.00 0.00 H new ATOM 0 HG SER A 112 13.157 4.639 -3.623 1.00 0.00 H new ATOM 1761 N LEU A 113 8.132 4.560 -4.832 1.00 0.00 N ATOM 1762 CA LEU A 113 7.128 4.555 -5.890 1.00 0.00 C ATOM 1763 C LEU A 113 7.686 5.164 -7.173 1.00 0.00 C ATOM 1764 O LEU A 113 8.477 6.108 -7.132 1.00 0.00 O ATOM 1765 CB LEU A 113 5.885 5.328 -5.444 1.00 0.00 C ATOM 1766 CG LEU A 113 5.113 4.734 -4.265 1.00 0.00 C ATOM 1767 CD1 LEU A 113 4.174 5.770 -3.666 1.00 0.00 C ATOM 1768 CD2 LEU A 113 4.339 3.499 -4.701 1.00 0.00 C ATOM 0 H LEU A 113 8.092 5.372 -4.216 1.00 0.00 H new ATOM 0 HA LEU A 113 6.852 3.520 -6.091 1.00 0.00 H new ATOM 0 HB2 LEU A 113 6.187 6.342 -5.181 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.207 5.408 -6.294 1.00 0.00 H new ATOM 0 HG LEU A 113 5.830 4.437 -3.499 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.633 5.330 -2.828 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.752 6.625 -3.315 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.463 6.099 -4.424 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.796 3.090 -3.849 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.632 3.771 -5.485 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.033 2.750 -5.082 1.00 0.00 H new ATOM 1780 N LEU A 114 7.268 4.620 -8.310 1.00 0.00 N ATOM 1781 CA LEU A 114 7.724 5.111 -9.606 1.00 0.00 C ATOM 1782 C LEU A 114 6.541 5.451 -10.506 1.00 0.00 C ATOM 1783 O LEU A 114 5.536 4.742 -10.523 1.00 0.00 O ATOM 1784 CB LEU A 114 8.613 4.067 -10.285 1.00 0.00 C ATOM 1785 CG LEU A 114 9.466 3.205 -9.354 1.00 0.00 C ATOM 1786 CD1 LEU A 114 9.962 1.965 -10.082 1.00 0.00 C ATOM 1787 CD2 LEU A 114 10.636 4.008 -8.806 1.00 0.00 C ATOM 0 H LEU A 114 6.614 3.839 -8.361 1.00 0.00 H new ATOM 0 HA LEU A 114 8.303 6.019 -9.440 1.00 0.00 H new ATOM 0 HB2 LEU A 114 7.978 3.408 -10.877 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.276 4.581 -10.981 1.00 0.00 H new ATOM 0 HG LEU A 114 8.847 2.886 -8.516 1.00 0.00 H new ATOM 0 HD11 LEU A 114 10.567 1.363 -9.404 1.00 0.00 H new ATOM 0 HD12 LEU A 114 9.109 1.379 -10.425 1.00 0.00 H new ATOM 0 HD13 LEU A 114 10.565 2.263 -10.939 1.00 0.00 H new ATOM 0 HD21 LEU A 114 11.232 3.378 -8.145 1.00 0.00 H new ATOM 0 HD22 LEU A 114 11.256 4.357 -9.632 1.00 0.00 H new ATOM 0 HD23 LEU A 114 10.259 4.865 -8.248 1.00 0.00 H new ATOM 1799 N ASN A 115 6.669 6.541 -11.256 1.00 0.00 N ATOM 1800 CA ASN A 115 5.611 6.975 -12.161 1.00 0.00 C ATOM 1801 C ASN A 115 5.513 6.048 -13.369 1.00 0.00 C ATOM 1802 O ASN A 115 6.277 5.090 -13.491 1.00 0.00 O ATOM 1803 CB ASN A 115 5.865 8.411 -12.626 1.00 0.00 C ATOM 1804 CG ASN A 115 7.334 8.683 -12.883 1.00 0.00 C ATOM 1805 OD1 ASN A 115 8.012 7.907 -13.556 1.00 0.00 O ATOM 1806 ND2 ASN A 115 7.833 9.791 -12.347 1.00 0.00 N ATOM 0 H ASN A 115 7.495 7.140 -11.255 1.00 0.00 H new ATOM 0 HA ASN A 115 4.666 6.937 -11.619 1.00 0.00 H new ATOM 0 HB2 ASN A 115 5.298 8.601 -13.537 1.00 0.00 H new ATOM 0 HB3 ASN A 115 5.496 9.105 -11.871 1.00 0.00 H new ATOM 0 HD21 ASN A 115 8.815 10.027 -12.486 1.00 0.00 H new ATOM 0 HD22 ASN A 115 7.234 10.406 -11.796 1.00 0.00 H new ATOM 1813 N GLU A 116 4.569 6.340 -14.258 1.00 0.00 N ATOM 1814 CA GLU A 116 4.373 5.531 -15.456 1.00 0.00 C ATOM 1815 C GLU A 116 5.654 5.463 -16.282 1.00 0.00 C ATOM 1816 O GLU A 116 5.772 4.650 -17.199 1.00 0.00 O ATOM 1817 CB GLU A 116 3.236 6.105 -16.304 1.00 0.00 C ATOM 1818 CG GLU A 116 3.479 7.534 -16.761 1.00 0.00 C ATOM 1819 CD GLU A 116 2.538 7.959 -17.872 1.00 0.00 C ATOM 1820 OE1 GLU A 116 1.331 8.122 -17.599 1.00 0.00 O ATOM 1821 OE2 GLU A 116 3.011 8.127 -19.016 1.00 0.00 O ATOM 0 H GLU A 116 3.929 7.129 -14.172 1.00 0.00 H new ATOM 0 HA GLU A 116 4.109 4.521 -15.143 1.00 0.00 H new ATOM 0 HB2 GLU A 116 3.092 5.472 -17.180 1.00 0.00 H new ATOM 0 HB3 GLU A 116 2.311 6.069 -15.729 1.00 0.00 H new ATOM 0 HG2 GLU A 116 3.361 8.208 -15.912 1.00 0.00 H new ATOM 0 HG3 GLU A 116 4.509 7.631 -17.105 1.00 0.00 H new ATOM 1828 N LYS A 117 6.611 6.322 -15.951 1.00 0.00 N ATOM 1829 CA LYS A 117 7.885 6.361 -16.660 1.00 0.00 C ATOM 1830 C LYS A 117 8.927 5.500 -15.953 1.00 0.00 C ATOM 1831 O LYS A 117 9.902 5.063 -16.563 1.00 0.00 O ATOM 1832 CB LYS A 117 8.388 7.802 -16.770 1.00 0.00 C ATOM 1833 CG LYS A 117 7.531 8.678 -17.667 1.00 0.00 C ATOM 1834 CD LYS A 117 7.589 8.220 -19.114 1.00 0.00 C ATOM 1835 CE LYS A 117 7.328 9.370 -20.075 1.00 0.00 C ATOM 1836 NZ LYS A 117 7.312 8.916 -21.493 1.00 0.00 N ATOM 0 H LYS A 117 6.529 7.002 -15.195 1.00 0.00 H new ATOM 0 HA LYS A 117 7.727 5.961 -17.662 1.00 0.00 H new ATOM 0 HB2 LYS A 117 8.424 8.242 -15.774 1.00 0.00 H new ATOM 0 HB3 LYS A 117 9.409 7.794 -17.152 1.00 0.00 H new ATOM 0 HG2 LYS A 117 6.498 8.656 -17.319 1.00 0.00 H new ATOM 0 HG3 LYS A 117 7.869 9.712 -17.598 1.00 0.00 H new ATOM 0 HD2 LYS A 117 8.568 7.787 -19.321 1.00 0.00 H new ATOM 0 HD3 LYS A 117 6.852 7.434 -19.277 1.00 0.00 H new ATOM 0 HE2 LYS A 117 6.373 9.836 -19.832 1.00 0.00 H new ATOM 0 HE3 LYS A 117 8.097 10.132 -19.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 7.131 9.729 -22.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 8.232 8.494 -21.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 6.562 8.207 -21.622 1.00 0.00 H new ATOM 1850 N GLY A 118 8.713 5.258 -14.663 1.00 0.00 N ATOM 1851 CA GLY A 118 9.642 4.450 -13.896 1.00 0.00 C ATOM 1852 C GLY A 118 10.686 5.285 -13.183 1.00 0.00 C ATOM 1853 O GLY A 118 11.774 4.799 -12.876 1.00 0.00 O ATOM 0 H GLY A 118 7.913 5.607 -14.136 1.00 0.00 H new ATOM 0 HA2 GLY A 118 9.089 3.863 -13.163 1.00 0.00 H new ATOM 0 HA3 GLY A 118 10.139 3.743 -14.561 1.00 0.00 H new ATOM 1857 N GLN A 119 10.356 6.545 -12.921 1.00 0.00 N ATOM 1858 CA GLN A 119 11.275 7.450 -12.242 1.00 0.00 C ATOM 1859 C GLN A 119 10.825 7.708 -10.808 1.00 0.00 C ATOM 1860 O GLN A 119 9.677 8.081 -10.564 1.00 0.00 O ATOM 1861 CB GLN A 119 11.377 8.774 -13.003 1.00 0.00 C ATOM 1862 CG GLN A 119 12.199 8.680 -14.278 1.00 0.00 C ATOM 1863 CD GLN A 119 13.675 8.468 -14.007 1.00 0.00 C ATOM 1864 OE1 GLN A 119 14.128 7.338 -13.821 1.00 0.00 O ATOM 1865 NE2 GLN A 119 14.436 9.556 -13.984 1.00 0.00 N ATOM 0 H GLN A 119 9.459 6.962 -13.169 1.00 0.00 H new ATOM 0 HA GLN A 119 12.257 6.977 -12.216 1.00 0.00 H new ATOM 0 HB2 GLN A 119 10.373 9.119 -13.252 1.00 0.00 H new ATOM 0 HB3 GLN A 119 11.819 9.526 -12.350 1.00 0.00 H new ATOM 0 HG2 GLN A 119 11.824 7.858 -14.888 1.00 0.00 H new ATOM 0 HG3 GLN A 119 12.068 9.593 -14.858 1.00 0.00 H new ATOM 0 HE21 GLN A 119 14.019 10.473 -14.143 1.00 0.00 H new ATOM 0 HE22 GLN A 119 15.437 9.474 -13.807 1.00 0.00 H new ATOM 1874 N ASP A 120 11.736 7.507 -9.862 1.00 0.00 N ATOM 1875 CA ASP A 120 11.433 7.719 -8.451 1.00 0.00 C ATOM 1876 C ASP A 120 10.522 8.928 -8.266 1.00 0.00 C ATOM 1877 O ASP A 120 10.952 10.072 -8.415 1.00 0.00 O ATOM 1878 CB ASP A 120 12.724 7.911 -7.654 1.00 0.00 C ATOM 1879 CG ASP A 120 13.669 8.898 -8.310 1.00 0.00 C ATOM 1880 OD1 ASP A 120 14.178 8.592 -9.409 1.00 0.00 O ATOM 1881 OD2 ASP A 120 13.899 9.978 -7.726 1.00 0.00 O ATOM 0 H ASP A 120 12.690 7.198 -10.047 1.00 0.00 H new ATOM 0 HA ASP A 120 10.914 6.836 -8.080 1.00 0.00 H new ATOM 0 HB2 ASP A 120 12.479 8.259 -6.650 1.00 0.00 H new ATOM 0 HB3 ASP A 120 13.226 6.950 -7.545 1.00 0.00 H new ATOM 1886 N THR A 121 9.259 8.667 -7.942 1.00 0.00 N ATOM 1887 CA THR A 121 8.286 9.733 -7.739 1.00 0.00 C ATOM 1888 C THR A 121 8.579 10.509 -6.460 1.00 0.00 C ATOM 1889 O THR A 121 8.227 11.681 -6.340 1.00 0.00 O ATOM 1890 CB THR A 121 6.851 9.178 -7.672 1.00 0.00 C ATOM 1891 OG1 THR A 121 6.716 8.303 -6.547 1.00 0.00 O ATOM 1892 CG2 THR A 121 6.500 8.428 -8.948 1.00 0.00 C ATOM 0 H THR A 121 8.886 7.726 -7.815 1.00 0.00 H new ATOM 0 HA THR A 121 8.369 10.404 -8.594 1.00 0.00 H new ATOM 0 HB THR A 121 6.166 10.018 -7.563 1.00 0.00 H new ATOM 0 HG1 THR A 121 7.402 7.604 -6.592 1.00 0.00 H new ATOM 0 HG21 THR A 121 5.482 8.045 -8.877 1.00 0.00 H new ATOM 0 HG22 THR A 121 6.575 9.104 -9.800 1.00 0.00 H new ATOM 0 HG23 THR A 121 7.191 7.596 -9.083 1.00 0.00 H new ATOM 1900 N GLY A 122 9.226 9.846 -5.506 1.00 0.00 N ATOM 1901 CA GLY A 122 9.556 10.490 -4.249 1.00 0.00 C ATOM 1902 C GLY A 122 8.526 10.219 -3.170 1.00 0.00 C ATOM 1903 O GLY A 122 8.415 10.973 -2.205 1.00 0.00 O ATOM 0 H GLY A 122 9.527 8.874 -5.582 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.532 10.141 -3.911 1.00 0.00 H new ATOM 0 HA3 GLY A 122 9.639 11.565 -4.406 1.00 0.00 H new ATOM 1907 N ALA A 123 7.770 9.138 -3.335 1.00 0.00 N ATOM 1908 CA ALA A 123 6.744 8.769 -2.368 1.00 0.00 C ATOM 1909 C ALA A 123 7.004 7.379 -1.796 1.00 0.00 C ATOM 1910 O ALA A 123 7.469 6.483 -2.501 1.00 0.00 O ATOM 1911 CB ALA A 123 5.366 8.828 -3.011 1.00 0.00 C ATOM 0 H ALA A 123 7.849 8.503 -4.129 1.00 0.00 H new ATOM 0 HA ALA A 123 6.780 9.484 -1.546 1.00 0.00 H new ATOM 0 HB1 ALA A 123 4.610 8.550 -2.277 1.00 0.00 H new ATOM 0 HB2 ALA A 123 5.173 9.841 -3.365 1.00 0.00 H new ATOM 0 HB3 ALA A 123 5.327 8.136 -3.852 1.00 0.00 H new ATOM 1917 N THR A 124 6.701 7.206 -0.514 1.00 0.00 N ATOM 1918 CA THR A 124 6.903 5.926 0.153 1.00 0.00 C ATOM 1919 C THR A 124 5.623 5.450 0.831 1.00 0.00 C ATOM 1920 O THR A 124 4.913 6.237 1.458 1.00 0.00 O ATOM 1921 CB THR A 124 8.025 6.012 1.205 1.00 0.00 C ATOM 1922 OG1 THR A 124 7.605 6.828 2.304 1.00 0.00 O ATOM 1923 CG2 THR A 124 9.295 6.587 0.596 1.00 0.00 C ATOM 0 H THR A 124 6.315 7.937 0.084 1.00 0.00 H new ATOM 0 HA THR A 124 7.190 5.211 -0.618 1.00 0.00 H new ATOM 0 HB THR A 124 8.236 5.004 1.562 1.00 0.00 H new ATOM 0 HG1 THR A 124 8.323 6.876 2.969 1.00 0.00 H new ATOM 0 HG21 THR A 124 10.073 6.638 1.358 1.00 0.00 H new ATOM 0 HG22 THR A 124 9.629 5.947 -0.221 1.00 0.00 H new ATOM 0 HG23 THR A 124 9.095 7.588 0.214 1.00 0.00 H new ATOM 1931 N ILE A 125 5.334 4.160 0.700 1.00 0.00 N ATOM 1932 CA ILE A 125 4.139 3.580 1.301 1.00 0.00 C ATOM 1933 C ILE A 125 4.477 2.319 2.088 1.00 0.00 C ATOM 1934 O ILE A 125 5.267 1.488 1.639 1.00 0.00 O ATOM 1935 CB ILE A 125 3.081 3.239 0.235 1.00 0.00 C ATOM 1936 CG1 ILE A 125 1.817 2.688 0.898 1.00 0.00 C ATOM 1937 CG2 ILE A 125 3.641 2.240 -0.765 1.00 0.00 C ATOM 1938 CD1 ILE A 125 0.709 2.373 -0.082 1.00 0.00 C ATOM 0 H ILE A 125 5.911 3.496 0.183 1.00 0.00 H new ATOM 0 HA ILE A 125 3.731 4.330 1.979 1.00 0.00 H new ATOM 0 HB ILE A 125 2.818 4.151 -0.301 1.00 0.00 H new ATOM 0 HG12 ILE A 125 2.071 1.783 1.450 1.00 0.00 H new ATOM 0 HG13 ILE A 125 1.452 3.413 1.625 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.882 2.009 -1.512 1.00 0.00 H new ATOM 0 HG22 ILE A 125 4.515 2.668 -1.256 1.00 0.00 H new ATOM 0 HG23 ILE A 125 3.928 1.326 -0.245 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.155 1.987 0.458 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.427 3.280 -0.617 1.00 0.00 H new ATOM 0 HD13 ILE A 125 1.056 1.625 -0.795 1.00 0.00 H new ATOM 1950 N ASP A 126 3.872 2.181 3.263 1.00 0.00 N ATOM 1951 CA ASP A 126 4.106 1.018 4.112 1.00 0.00 C ATOM 1952 C ASP A 126 2.992 -0.010 3.943 1.00 0.00 C ATOM 1953 O ASP A 126 1.810 0.311 4.074 1.00 0.00 O ATOM 1954 CB ASP A 126 4.208 1.443 5.577 1.00 0.00 C ATOM 1955 CG ASP A 126 5.136 2.625 5.775 1.00 0.00 C ATOM 1956 OD1 ASP A 126 6.348 2.477 5.516 1.00 0.00 O ATOM 1957 OD2 ASP A 126 4.650 3.699 6.188 1.00 0.00 O ATOM 0 H ASP A 126 3.216 2.860 3.649 1.00 0.00 H new ATOM 0 HA ASP A 126 5.047 0.560 3.809 1.00 0.00 H new ATOM 0 HB2 ASP A 126 3.215 1.698 5.948 1.00 0.00 H new ATOM 0 HB3 ASP A 126 4.564 0.602 6.172 1.00 0.00 H new ATOM 1962 N LEU A 127 3.377 -1.248 3.651 1.00 0.00 N ATOM 1963 CA LEU A 127 2.411 -2.325 3.463 1.00 0.00 C ATOM 1964 C LEU A 127 2.882 -3.605 4.145 1.00 0.00 C ATOM 1965 O LEU A 127 4.075 -3.911 4.158 1.00 0.00 O ATOM 1966 CB LEU A 127 2.186 -2.581 1.972 1.00 0.00 C ATOM 1967 CG LEU A 127 1.589 -1.421 1.174 1.00 0.00 C ATOM 1968 CD1 LEU A 127 1.900 -1.576 -0.307 1.00 0.00 C ATOM 1969 CD2 LEU A 127 0.086 -1.338 1.399 1.00 0.00 C ATOM 0 H LEU A 127 4.351 -1.531 3.539 1.00 0.00 H new ATOM 0 HA LEU A 127 1.470 -2.018 3.919 1.00 0.00 H new ATOM 0 HB2 LEU A 127 3.141 -2.851 1.522 1.00 0.00 H new ATOM 0 HB3 LEU A 127 1.529 -3.444 1.867 1.00 0.00 H new ATOM 0 HG LEU A 127 2.041 -0.493 1.524 1.00 0.00 H new ATOM 0 HD11 LEU A 127 1.467 -0.742 -0.859 1.00 0.00 H new ATOM 0 HD12 LEU A 127 2.980 -1.586 -0.453 1.00 0.00 H new ATOM 0 HD13 LEU A 127 1.476 -2.511 -0.672 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -0.323 -0.507 0.824 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.382 -2.268 1.076 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -0.115 -1.179 2.458 1.00 0.00 H new ATOM 1981 N VAL A 128 1.938 -4.351 4.710 1.00 0.00 N ATOM 1982 CA VAL A 128 2.257 -5.601 5.391 1.00 0.00 C ATOM 1983 C VAL A 128 1.514 -6.774 4.762 1.00 0.00 C ATOM 1984 O VAL A 128 0.329 -6.982 5.022 1.00 0.00 O ATOM 1985 CB VAL A 128 1.906 -5.528 6.889 1.00 0.00 C ATOM 1986 CG1 VAL A 128 2.442 -6.748 7.622 1.00 0.00 C ATOM 1987 CG2 VAL A 128 2.449 -4.246 7.502 1.00 0.00 C ATOM 0 H VAL A 128 0.946 -4.112 4.710 1.00 0.00 H new ATOM 0 HA VAL A 128 3.331 -5.756 5.284 1.00 0.00 H new ATOM 0 HB VAL A 128 0.821 -5.520 6.990 1.00 0.00 H new ATOM 0 HG11 VAL A 128 2.185 -6.680 8.679 1.00 0.00 H new ATOM 0 HG12 VAL A 128 2.000 -7.650 7.199 1.00 0.00 H new ATOM 0 HG13 VAL A 128 3.526 -6.790 7.514 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.192 -4.211 8.561 1.00 0.00 H new ATOM 0 HG22 VAL A 128 3.533 -4.220 7.391 1.00 0.00 H new ATOM 0 HG23 VAL A 128 2.012 -3.386 6.994 1.00 0.00 H new ATOM 1997 N ILE A 129 2.219 -7.538 3.935 1.00 0.00 N ATOM 1998 CA ILE A 129 1.627 -8.692 3.270 1.00 0.00 C ATOM 1999 C ILE A 129 1.918 -9.978 4.037 1.00 0.00 C ATOM 2000 O ILE A 129 3.033 -10.190 4.512 1.00 0.00 O ATOM 2001 CB ILE A 129 2.146 -8.839 1.827 1.00 0.00 C ATOM 2002 CG1 ILE A 129 2.168 -7.478 1.129 1.00 0.00 C ATOM 2003 CG2 ILE A 129 1.284 -9.825 1.052 1.00 0.00 C ATOM 2004 CD1 ILE A 129 3.189 -7.386 0.017 1.00 0.00 C ATOM 0 H ILE A 129 3.201 -7.379 3.709 1.00 0.00 H new ATOM 0 HA ILE A 129 0.551 -8.523 3.244 1.00 0.00 H new ATOM 0 HB ILE A 129 3.165 -9.225 1.860 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.179 -7.272 0.721 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.376 -6.703 1.867 1.00 0.00 H new ATOM 0 HG21 ILE A 129 1.663 -9.918 0.034 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.315 -10.798 1.541 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.255 -9.466 1.024 1.00 0.00 H new ATOM 0 HD11 ILE A 129 3.149 -6.394 -0.433 1.00 0.00 H new ATOM 0 HD12 ILE A 129 4.186 -7.560 0.423 1.00 0.00 H new ATOM 0 HD13 ILE A 129 2.970 -8.138 -0.741 1.00 0.00 H new ATOM 2016 N GLY A 130 0.908 -10.834 4.152 1.00 0.00 N ATOM 2017 CA GLY A 130 1.076 -12.090 4.860 1.00 0.00 C ATOM 2018 C GLY A 130 0.638 -13.284 4.036 1.00 0.00 C ATOM 2019 O GLY A 130 -0.486 -13.322 3.534 1.00 0.00 O ATOM 0 H GLY A 130 -0.024 -10.680 3.767 1.00 0.00 H new ATOM 0 HA2 GLY A 130 2.123 -12.209 5.138 1.00 0.00 H new ATOM 0 HA3 GLY A 130 0.501 -12.061 5.786 1.00 0.00 H new ATOM 2023 N TYR A 131 1.527 -14.260 3.893 1.00 0.00 N ATOM 2024 CA TYR A 131 1.228 -15.460 3.120 1.00 0.00 C ATOM 2025 C TYR A 131 0.682 -16.565 4.018 1.00 0.00 C ATOM 2026 O TYR A 131 1.204 -16.812 5.105 1.00 0.00 O ATOM 2027 CB TYR A 131 2.482 -15.950 2.394 1.00 0.00 C ATOM 2028 CG TYR A 131 2.392 -17.388 1.934 1.00 0.00 C ATOM 2029 CD1 TYR A 131 1.363 -17.807 1.099 1.00 0.00 C ATOM 2030 CD2 TYR A 131 3.334 -18.327 2.335 1.00 0.00 C ATOM 2031 CE1 TYR A 131 1.276 -19.120 0.677 1.00 0.00 C ATOM 2032 CE2 TYR A 131 3.257 -19.641 1.916 1.00 0.00 C ATOM 2033 CZ TYR A 131 2.226 -20.033 1.088 1.00 0.00 C ATOM 2034 OH TYR A 131 2.144 -21.341 0.670 1.00 0.00 O ATOM 0 H TYR A 131 2.461 -14.244 4.302 1.00 0.00 H new ATOM 0 HA TYR A 131 0.466 -15.206 2.383 1.00 0.00 H new ATOM 0 HB2 TYR A 131 2.664 -15.311 1.530 1.00 0.00 H new ATOM 0 HB3 TYR A 131 3.341 -15.842 3.057 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.619 -17.095 0.775 1.00 0.00 H new ATOM 0 HD2 TYR A 131 4.141 -18.024 2.986 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.469 -19.430 0.029 1.00 0.00 H new ATOM 0 HE2 TYR A 131 4.000 -20.357 2.235 1.00 0.00 H new ATOM 0 HH TYR A 131 3.007 -21.784 0.811 1.00 0.00 H new ATOM 2044 N ASP A 132 -0.373 -17.227 3.556 1.00 0.00 N ATOM 2045 CA ASP A 132 -0.991 -18.308 4.316 1.00 0.00 C ATOM 2046 C ASP A 132 -1.265 -19.513 3.421 1.00 0.00 C ATOM 2047 O ASP A 132 -2.164 -19.501 2.580 1.00 0.00 O ATOM 2048 CB ASP A 132 -2.292 -17.828 4.959 1.00 0.00 C ATOM 2049 CG ASP A 132 -2.761 -18.746 6.071 1.00 0.00 C ATOM 2050 OD1 ASP A 132 -1.911 -19.447 6.659 1.00 0.00 O ATOM 2051 OD2 ASP A 132 -3.978 -18.764 6.353 1.00 0.00 O ATOM 0 H ASP A 132 -0.818 -17.034 2.659 1.00 0.00 H new ATOM 0 HA ASP A 132 -0.298 -18.611 5.101 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -2.148 -16.824 5.357 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -3.068 -17.760 4.196 1.00 0.00 H new ATOM 2056 N PRO A 133 -0.472 -20.579 3.605 1.00 0.00 N ATOM 2057 CA PRO A 133 -0.610 -21.812 2.824 1.00 0.00 C ATOM 2058 C PRO A 133 -1.883 -22.577 3.168 1.00 0.00 C ATOM 2059 O PRO A 133 -2.279 -22.680 4.329 1.00 0.00 O ATOM 2060 CB PRO A 133 0.626 -22.623 3.221 1.00 0.00 C ATOM 2061 CG PRO A 133 0.990 -22.121 4.575 1.00 0.00 C ATOM 2062 CD PRO A 133 0.620 -20.663 4.589 1.00 0.00 C ATOM 0 HA PRO A 133 -0.680 -21.612 1.755 1.00 0.00 H new ATOM 0 HB2 PRO A 133 0.409 -23.691 3.240 1.00 0.00 H new ATOM 0 HB3 PRO A 133 1.441 -22.476 2.512 1.00 0.00 H new ATOM 0 HG2 PRO A 133 0.454 -22.667 5.351 1.00 0.00 H new ATOM 0 HG3 PRO A 133 2.054 -22.255 4.768 1.00 0.00 H new ATOM 0 HD2 PRO A 133 0.295 -20.340 5.578 1.00 0.00 H new ATOM 0 HD3 PRO A 133 1.463 -20.032 4.309 1.00 0.00 H new ATOM 2070 N PRO A 134 -2.541 -23.127 2.136 1.00 0.00 N ATOM 2071 CA PRO A 134 -3.779 -23.894 2.305 1.00 0.00 C ATOM 2072 C PRO A 134 -3.542 -25.232 2.995 1.00 0.00 C ATOM 2073 O PRO A 134 -2.573 -25.931 2.700 1.00 0.00 O ATOM 2074 CB PRO A 134 -4.261 -24.110 0.869 1.00 0.00 C ATOM 2075 CG PRO A 134 -3.026 -24.034 0.039 1.00 0.00 C ATOM 2076 CD PRO A 134 -2.126 -23.044 0.726 1.00 0.00 C ATOM 0 HA PRO A 134 -4.499 -23.373 2.936 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -4.754 -25.076 0.758 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -4.983 -23.348 0.575 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -2.546 -25.010 -0.037 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -3.257 -23.712 -0.976 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -1.075 -23.303 0.601 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -2.257 -22.038 0.327 1.00 0.00 H new