USER MOD reduce.3.24.130724 H: found=0, std=0, add=1158, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1158 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 95 SER OG : rot -152:sc= 0.35 USER MOD Set 1.2: A 114 HIS : no HE2:sc= -4.17! C(o=-3.8!,f=-11!) USER MOD Set 1.3: A 121 MET CE :methyl -178:sc= -0.003 (180deg=-0.00159) USER MOD Set 2.1: A 69 ASN : amide:sc= -0.728 K(o=-0.73,f=-2!) USER MOD Set 2.2: A 89 TYR OH : rot 148:sc= 0.00138 USER MOD Set 3.1: A 7 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 28 GLN :FLIP amide:sc= -0.489 F(o=-2.4,f=-0.49) USER MOD Set 3.3: A 30 TYR OH : rot 30:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot -8:sc= 0.403 USER MOD Single : A 39 SER OG : rot 89:sc= 1.24 USER MOD Single : A 41 CYS SG : rot 75:sc= 1.24 USER MOD Single : A 42 THR OG1 : rot -62:sc= 1.26 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 ASN : amide:sc= -0.658 X(o=-0.66,f=-0.6) USER MOD Single : A 55 LYS NZ :NH3+ 165:sc= -0.015 (180deg=-0.218) USER MOD Single : A 63 ASN : amide:sc= 0.298 K(o=0.3,f=-3.6!) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 77 CYS SG : rot 43:sc= -0.374 USER MOD Single : A 84 THR OG1 : rot -105:sc= 0.795 USER MOD Single : A 86 SER OG : rot 170:sc= 0.135 USER MOD Single : A 92 LYS NZ :NH3+ -139:sc= 0.132 (180deg=-0.447) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 89:sc= 0.602 USER MOD Single : A 116 THR OG1 : rot 79:sc= 0.301 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.00255 USER MOD Single : A 118 SER OG : rot 180:sc= 0.0196 USER MOD Single : A 120 GLN :FLIP amide:sc= 0 F(o=-0.56,f=0) USER MOD Single : A 131 MET CE :methyl -161:sc= -0.848 (180deg=-1.65) USER MOD Single : A 138 MET CE :methyl -162:sc= -0.046 (180deg=-0.366) USER MOD Single : A 167 SER OG : rot 180:sc= -0.0148 USER MOD Single : A 168 GLN :FLIP amide:sc= 0 F(o=-0.64,f=0) USER MOD Single : A 179 HIS : no HD1:sc= -0.158 X(o=-0.16,f=-0.0057) USER MOD Single : A 180 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 63 N ALA A 6 14.816 1.930 -1.838 1.00 0.00 N ATOM 64 CA ALA A 6 14.541 2.839 -2.977 1.00 0.00 C ATOM 65 C ALA A 6 13.039 3.116 -3.124 1.00 0.00 C ATOM 66 O ALA A 6 12.355 2.507 -3.947 1.00 0.00 O ATOM 67 CB ALA A 6 15.147 2.282 -4.281 1.00 0.00 C ATOM 0 HA ALA A 6 15.023 3.794 -2.768 1.00 0.00 H new ATOM 0 HB1 ALA A 6 14.933 2.965 -5.103 1.00 0.00 H new ATOM 0 HB2 ALA A 6 16.226 2.180 -4.166 1.00 0.00 H new ATOM 0 HB3 ALA A 6 14.711 1.307 -4.497 1.00 0.00 H new ATOM 73 N THR A 7 12.545 4.051 -2.296 1.00 0.00 N ATOM 74 CA THR A 7 11.136 4.438 -2.261 1.00 0.00 C ATOM 75 C THR A 7 10.874 5.443 -3.385 1.00 0.00 C ATOM 76 O THR A 7 11.464 6.531 -3.403 1.00 0.00 O ATOM 77 CB THR A 7 10.743 5.046 -0.868 1.00 0.00 C ATOM 78 OG1 THR A 7 11.135 4.133 0.181 1.00 0.00 O ATOM 79 CG2 THR A 7 9.225 5.345 -0.765 1.00 0.00 C ATOM 0 H THR A 7 13.123 4.561 -1.628 1.00 0.00 H new ATOM 0 HA THR A 7 10.519 3.552 -2.408 1.00 0.00 H new ATOM 0 HB THR A 7 11.268 5.995 -0.759 1.00 0.00 H new ATOM 0 HG1 THR A 7 10.892 4.511 1.052 1.00 0.00 H new ATOM 0 HG21 THR A 7 9.002 5.764 0.216 1.00 0.00 H new ATOM 0 HG22 THR A 7 8.942 6.060 -1.538 1.00 0.00 H new ATOM 0 HG23 THR A 7 8.662 4.422 -0.901 1.00 0.00 H new ATOM 87 N GLU A 8 10.001 5.062 -4.328 1.00 0.00 N ATOM 88 CA GLU A 8 9.700 5.851 -5.528 1.00 0.00 C ATOM 89 C GLU A 8 8.211 6.218 -5.519 1.00 0.00 C ATOM 90 O GLU A 8 7.352 5.339 -5.671 1.00 0.00 O ATOM 91 CB GLU A 8 10.039 5.017 -6.798 1.00 0.00 C ATOM 92 CG GLU A 8 11.483 4.493 -6.856 1.00 0.00 C ATOM 93 CD GLU A 8 11.714 3.534 -8.034 1.00 0.00 C ATOM 94 OE1 GLU A 8 11.403 2.333 -7.897 1.00 0.00 O ATOM 95 OE2 GLU A 8 12.197 3.971 -9.098 1.00 0.00 O ATOM 0 H GLU A 8 9.479 4.187 -4.277 1.00 0.00 H new ATOM 0 HA GLU A 8 10.298 6.762 -5.537 1.00 0.00 H new ATOM 0 HB2 GLU A 8 9.357 4.169 -6.852 1.00 0.00 H new ATOM 0 HB3 GLU A 8 9.854 5.631 -7.679 1.00 0.00 H new ATOM 0 HG2 GLU A 8 12.169 5.336 -6.938 1.00 0.00 H new ATOM 0 HG3 GLU A 8 11.718 3.981 -5.923 1.00 0.00 H new ATOM 102 N ARG A 9 7.918 7.511 -5.317 1.00 0.00 N ATOM 103 CA ARG A 9 6.545 8.039 -5.422 1.00 0.00 C ATOM 104 C ARG A 9 6.092 7.985 -6.898 1.00 0.00 C ATOM 105 O ARG A 9 6.917 8.152 -7.816 1.00 0.00 O ATOM 106 CB ARG A 9 6.435 9.511 -4.906 1.00 0.00 C ATOM 107 CG ARG A 9 6.632 9.744 -3.380 1.00 0.00 C ATOM 108 CD ARG A 9 8.071 9.544 -2.888 1.00 0.00 C ATOM 109 NE ARG A 9 8.242 10.001 -1.493 1.00 0.00 N ATOM 110 CZ ARG A 9 9.381 10.451 -0.950 1.00 0.00 C ATOM 111 NH1 ARG A 9 10.501 10.496 -1.652 1.00 0.00 N ATOM 112 NH2 ARG A 9 9.388 10.842 0.316 1.00 0.00 N ATOM 0 H ARG A 9 8.616 8.216 -5.079 1.00 0.00 H new ATOM 0 HA ARG A 9 5.904 7.419 -4.796 1.00 0.00 H new ATOM 0 HB2 ARG A 9 7.173 10.112 -5.438 1.00 0.00 H new ATOM 0 HB3 ARG A 9 5.453 9.894 -5.183 1.00 0.00 H new ATOM 0 HG2 ARG A 9 6.315 10.758 -3.136 1.00 0.00 H new ATOM 0 HG3 ARG A 9 5.977 9.065 -2.834 1.00 0.00 H new ATOM 0 HD2 ARG A 9 8.337 8.489 -2.960 1.00 0.00 H new ATOM 0 HD3 ARG A 9 8.756 10.090 -3.536 1.00 0.00 H new ATOM 0 HE ARG A 9 7.420 9.971 -0.890 1.00 0.00 H new ATOM 0 HH11 ARG A 9 10.507 10.185 -2.623 1.00 0.00 H new ATOM 0 HH12 ARG A 9 11.359 10.842 -1.222 1.00 0.00 H new ATOM 0 HH21 ARG A 9 8.531 10.799 0.868 1.00 0.00 H new ATOM 0 HH22 ARG A 9 10.250 11.186 0.739 1.00 0.00 H new ATOM 126 N ALA A 10 4.789 7.771 -7.116 1.00 0.00 N ATOM 127 CA ALA A 10 4.222 7.618 -8.466 1.00 0.00 C ATOM 128 C ALA A 10 2.723 7.930 -8.456 1.00 0.00 C ATOM 129 O ALA A 10 2.079 7.896 -7.406 1.00 0.00 O ATOM 130 CB ALA A 10 4.484 6.197 -8.998 1.00 0.00 C ATOM 0 H ALA A 10 4.099 7.699 -6.368 1.00 0.00 H new ATOM 0 HA ALA A 10 4.711 8.328 -9.133 1.00 0.00 H new ATOM 0 HB1 ALA A 10 4.059 6.098 -9.997 1.00 0.00 H new ATOM 0 HB2 ALA A 10 5.558 6.017 -9.041 1.00 0.00 H new ATOM 0 HB3 ALA A 10 4.020 5.468 -8.333 1.00 0.00 H new ATOM 136 N LEU A 11 2.173 8.200 -9.647 1.00 0.00 N ATOM 137 CA LEU A 11 0.752 8.514 -9.814 1.00 0.00 C ATOM 138 C LEU A 11 0.253 7.928 -11.145 1.00 0.00 C ATOM 139 O LEU A 11 0.982 7.925 -12.146 1.00 0.00 O ATOM 140 CB LEU A 11 0.514 10.066 -9.731 1.00 0.00 C ATOM 141 CG LEU A 11 -0.760 10.553 -8.966 1.00 0.00 C ATOM 142 CD1 LEU A 11 -2.076 10.162 -9.661 1.00 0.00 C ATOM 143 CD2 LEU A 11 -0.736 10.093 -7.496 1.00 0.00 C ATOM 0 H LEU A 11 2.701 8.206 -10.519 1.00 0.00 H new ATOM 0 HA LEU A 11 0.180 8.061 -9.005 1.00 0.00 H new ATOM 0 HB2 LEU A 11 1.386 10.517 -9.257 1.00 0.00 H new ATOM 0 HB3 LEU A 11 0.467 10.456 -10.748 1.00 0.00 H new ATOM 0 HG LEU A 11 -0.729 11.642 -8.983 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.919 10.531 -9.077 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -2.105 10.601 -10.658 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -2.137 9.077 -9.741 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -1.634 10.446 -6.989 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -0.701 9.004 -7.456 1.00 0.00 H new ATOM 0 HD23 LEU A 11 0.145 10.502 -7.001 1.00 0.00 H new ATOM 155 N GLY A 12 -0.991 7.456 -11.137 1.00 0.00 N ATOM 156 CA GLY A 12 -1.675 6.998 -12.337 1.00 0.00 C ATOM 157 C GLY A 12 -3.174 7.089 -12.161 1.00 0.00 C ATOM 158 O GLY A 12 -3.657 7.397 -11.064 1.00 0.00 O ATOM 0 H GLY A 12 -1.554 7.381 -10.290 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -1.366 7.601 -13.191 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -1.390 5.968 -12.554 1.00 0.00 H new ATOM 162 N ARG A 13 -3.914 6.867 -13.244 1.00 0.00 N ATOM 163 CA ARG A 13 -5.379 6.734 -13.184 1.00 0.00 C ATOM 164 C ARG A 13 -5.724 5.243 -13.083 1.00 0.00 C ATOM 165 O ARG A 13 -4.901 4.378 -13.420 1.00 0.00 O ATOM 166 CB ARG A 13 -6.047 7.405 -14.405 1.00 0.00 C ATOM 167 CG ARG A 13 -5.640 6.834 -15.778 1.00 0.00 C ATOM 168 CD ARG A 13 -6.278 7.614 -16.941 1.00 0.00 C ATOM 169 NE ARG A 13 -5.956 7.022 -18.255 1.00 0.00 N ATOM 170 CZ ARG A 13 -6.859 6.650 -19.177 1.00 0.00 C ATOM 171 NH1 ARG A 13 -8.165 6.737 -18.930 1.00 0.00 N ATOM 172 NH2 ARG A 13 -6.444 6.178 -20.340 1.00 0.00 N ATOM 0 H ARG A 13 -3.526 6.774 -14.183 1.00 0.00 H new ATOM 0 HA ARG A 13 -5.767 7.248 -12.305 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -7.128 7.317 -14.300 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -5.810 8.469 -14.388 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -4.555 6.863 -15.875 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -5.938 5.787 -15.838 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -7.360 7.637 -16.810 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -5.932 8.647 -16.916 1.00 0.00 H new ATOM 0 HE ARG A 13 -4.971 6.885 -18.480 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -8.491 7.090 -18.030 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -8.839 6.451 -19.640 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -5.445 6.099 -20.531 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -7.123 5.893 -21.046 1.00 0.00 H new ATOM 186 N ARG A 14 -6.938 4.948 -12.621 1.00 0.00 N ATOM 187 CA ARG A 14 -7.335 3.585 -12.264 1.00 0.00 C ATOM 188 C ARG A 14 -8.867 3.538 -12.235 1.00 0.00 C ATOM 189 O ARG A 14 -9.496 4.266 -11.475 1.00 0.00 O ATOM 190 CB ARG A 14 -6.711 3.218 -10.867 1.00 0.00 C ATOM 191 CG ARG A 14 -6.573 1.708 -10.510 1.00 0.00 C ATOM 192 CD ARG A 14 -7.895 0.916 -10.550 1.00 0.00 C ATOM 193 NE ARG A 14 -7.837 -0.395 -9.892 1.00 0.00 N ATOM 194 CZ ARG A 14 -7.082 -1.441 -10.268 1.00 0.00 C ATOM 195 NH1 ARG A 14 -6.270 -1.365 -11.315 1.00 0.00 N ATOM 196 NH2 ARG A 14 -7.167 -2.580 -9.593 1.00 0.00 N ATOM 0 H ARG A 14 -7.672 5.643 -12.484 1.00 0.00 H new ATOM 0 HA ARG A 14 -6.973 2.856 -12.989 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -5.719 3.667 -10.814 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -7.317 3.691 -10.094 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -5.868 1.248 -11.202 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -6.143 1.622 -9.512 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -8.676 1.512 -10.077 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -8.188 0.774 -11.590 1.00 0.00 H new ATOM 0 HE ARG A 14 -8.427 -0.524 -9.070 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -6.210 -0.500 -11.852 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -5.706 -2.172 -11.582 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -7.801 -2.655 -8.797 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -6.599 -3.380 -9.870 1.00 0.00 H new ATOM 210 N THR A 15 -9.451 2.655 -13.043 1.00 0.00 N ATOM 211 CA THR A 15 -10.904 2.469 -13.082 1.00 0.00 C ATOM 212 C THR A 15 -11.293 1.457 -11.994 1.00 0.00 C ATOM 213 O THR A 15 -10.728 0.366 -11.930 1.00 0.00 O ATOM 214 CB THR A 15 -11.372 1.977 -14.493 1.00 0.00 C ATOM 215 OG1 THR A 15 -10.897 2.895 -15.496 1.00 0.00 O ATOM 216 CG2 THR A 15 -12.910 1.859 -14.600 1.00 0.00 C ATOM 0 H THR A 15 -8.937 2.052 -13.685 1.00 0.00 H new ATOM 0 HA THR A 15 -11.399 3.422 -12.895 1.00 0.00 H new ATOM 0 HB THR A 15 -10.956 0.981 -14.647 1.00 0.00 H new ATOM 0 HG1 THR A 15 -11.186 2.590 -16.381 1.00 0.00 H new ATOM 0 HG21 THR A 15 -13.180 1.514 -15.598 1.00 0.00 H new ATOM 0 HG22 THR A 15 -13.273 1.146 -13.859 1.00 0.00 H new ATOM 0 HG23 THR A 15 -13.363 2.833 -14.418 1.00 0.00 H new ATOM 224 N ILE A 16 -12.282 1.808 -11.172 1.00 0.00 N ATOM 225 CA ILE A 16 -12.714 1.021 -10.002 1.00 0.00 C ATOM 226 C ILE A 16 -14.235 0.740 -10.116 1.00 0.00 C ATOM 227 O ILE A 16 -14.898 1.352 -10.967 1.00 0.00 O ATOM 228 CB ILE A 16 -12.361 1.757 -8.633 1.00 0.00 C ATOM 229 CG1 ILE A 16 -13.106 3.119 -8.476 1.00 0.00 C ATOM 230 CG2 ILE A 16 -10.832 1.954 -8.483 1.00 0.00 C ATOM 231 CD1 ILE A 16 -12.954 3.771 -7.101 1.00 0.00 C ATOM 0 H ILE A 16 -12.821 2.665 -11.298 1.00 0.00 H new ATOM 0 HA ILE A 16 -12.172 0.075 -9.993 1.00 0.00 H new ATOM 0 HB ILE A 16 -12.710 1.105 -7.832 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -12.737 3.810 -9.234 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -14.166 2.964 -8.675 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -10.621 2.458 -7.540 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -10.337 0.983 -8.494 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -10.460 2.560 -9.310 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -13.504 4.712 -7.082 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -13.351 3.103 -6.336 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -11.899 3.963 -6.904 1.00 0.00 H new ATOM 243 N PRO A 17 -14.812 -0.223 -9.311 1.00 0.00 N ATOM 244 CA PRO A 17 -16.278 -0.516 -9.313 1.00 0.00 C ATOM 245 C PRO A 17 -17.190 0.731 -9.157 1.00 0.00 C ATOM 246 O PRO A 17 -18.295 0.781 -9.715 1.00 0.00 O ATOM 247 CB PRO A 17 -16.447 -1.470 -8.110 1.00 0.00 C ATOM 248 CG PRO A 17 -15.136 -2.180 -8.008 1.00 0.00 C ATOM 249 CD PRO A 17 -14.085 -1.158 -8.384 1.00 0.00 C ATOM 0 HA PRO A 17 -16.587 -0.931 -10.272 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -16.673 -0.920 -7.196 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -17.266 -2.171 -8.271 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -14.972 -2.556 -6.998 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -15.103 -3.039 -8.678 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -13.703 -0.635 -7.507 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -13.231 -1.624 -8.875 1.00 0.00 H new ATOM 257 N ALA A 18 -16.709 1.725 -8.390 1.00 0.00 N ATOM 258 CA ALA A 18 -17.446 2.981 -8.125 1.00 0.00 C ATOM 259 C ALA A 18 -17.512 3.886 -9.375 1.00 0.00 C ATOM 260 O ALA A 18 -18.480 4.626 -9.567 1.00 0.00 O ATOM 261 CB ALA A 18 -16.808 3.732 -6.944 1.00 0.00 C ATOM 0 H ALA A 18 -15.797 1.684 -7.934 1.00 0.00 H new ATOM 0 HA ALA A 18 -18.471 2.715 -7.865 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -17.359 4.654 -6.759 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -16.841 3.105 -6.053 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -15.771 3.970 -7.182 1.00 0.00 H new ATOM 267 N GLY A 19 -16.466 3.813 -10.208 1.00 0.00 N ATOM 268 CA GLY A 19 -16.317 4.665 -11.396 1.00 0.00 C ATOM 269 C GLY A 19 -14.853 4.842 -11.745 1.00 0.00 C ATOM 270 O GLY A 19 -14.029 4.089 -11.255 1.00 0.00 O ATOM 0 H GLY A 19 -15.695 3.158 -10.077 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -16.846 4.219 -12.238 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -16.773 5.638 -11.212 1.00 0.00 H new ATOM 274 N GLU A 20 -14.499 5.821 -12.593 1.00 0.00 N ATOM 275 CA GLU A 20 -13.079 6.142 -12.828 1.00 0.00 C ATOM 276 C GLU A 20 -12.529 6.903 -11.612 1.00 0.00 C ATOM 277 O GLU A 20 -13.215 7.753 -11.039 1.00 0.00 O ATOM 278 CB GLU A 20 -12.860 6.936 -14.147 1.00 0.00 C ATOM 279 CG GLU A 20 -13.191 6.130 -15.418 1.00 0.00 C ATOM 280 CD GLU A 20 -12.622 6.741 -16.713 1.00 0.00 C ATOM 281 OE1 GLU A 20 -13.224 7.695 -17.252 1.00 0.00 O ATOM 282 OE2 GLU A 20 -11.561 6.275 -17.192 1.00 0.00 O ATOM 0 H GLU A 20 -15.159 6.394 -13.118 1.00 0.00 H new ATOM 0 HA GLU A 20 -12.529 5.209 -12.950 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -13.477 7.834 -14.126 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -11.821 7.263 -14.195 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -12.803 5.118 -15.305 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -14.274 6.048 -15.512 1.00 0.00 H new ATOM 289 N ALA A 21 -11.310 6.555 -11.214 1.00 0.00 N ATOM 290 CA ALA A 21 -10.638 7.064 -10.006 1.00 0.00 C ATOM 291 C ALA A 21 -9.167 7.347 -10.310 1.00 0.00 C ATOM 292 O ALA A 21 -8.668 6.972 -11.373 1.00 0.00 O ATOM 293 CB ALA A 21 -10.753 6.015 -8.893 1.00 0.00 C ATOM 0 H ALA A 21 -10.737 5.890 -11.734 1.00 0.00 H new ATOM 0 HA ALA A 21 -11.112 7.991 -9.684 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -10.258 6.383 -7.994 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -11.805 5.827 -8.677 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -10.278 5.089 -9.216 1.00 0.00 H new ATOM 299 N ARG A 22 -8.465 8.039 -9.402 1.00 0.00 N ATOM 300 CA ARG A 22 -6.991 8.146 -9.481 1.00 0.00 C ATOM 301 C ARG A 22 -6.393 7.233 -8.425 1.00 0.00 C ATOM 302 O ARG A 22 -7.090 6.786 -7.498 1.00 0.00 O ATOM 303 CB ARG A 22 -6.452 9.597 -9.314 1.00 0.00 C ATOM 304 CG ARG A 22 -6.843 10.590 -10.438 1.00 0.00 C ATOM 305 CD ARG A 22 -8.302 11.066 -10.332 1.00 0.00 C ATOM 306 NE ARG A 22 -8.537 11.731 -9.042 1.00 0.00 N ATOM 307 CZ ARG A 22 -9.699 11.803 -8.389 1.00 0.00 C ATOM 308 NH1 ARG A 22 -10.777 11.194 -8.840 1.00 0.00 N ATOM 309 NH2 ARG A 22 -9.766 12.487 -7.264 1.00 0.00 N ATOM 0 H ARG A 22 -8.882 8.530 -8.611 1.00 0.00 H new ATOM 0 HA ARG A 22 -6.691 7.843 -10.484 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -6.811 9.992 -8.364 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -5.365 9.557 -9.252 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -6.180 11.454 -10.400 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -6.690 10.114 -11.407 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -8.526 11.753 -11.148 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -8.976 10.216 -10.437 1.00 0.00 H new ATOM 0 HE ARG A 22 -7.734 12.181 -8.603 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -10.734 10.654 -9.704 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -11.655 11.262 -8.325 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -8.935 12.954 -6.901 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -10.649 12.549 -6.757 1.00 0.00 H new ATOM 323 N SER A 23 -5.088 6.998 -8.540 1.00 0.00 N ATOM 324 CA SER A 23 -4.374 6.058 -7.694 1.00 0.00 C ATOM 325 C SER A 23 -3.010 6.631 -7.323 1.00 0.00 C ATOM 326 O SER A 23 -2.288 7.135 -8.192 1.00 0.00 O ATOM 327 CB SER A 23 -4.233 4.690 -8.405 1.00 0.00 C ATOM 328 OG SER A 23 -3.706 4.827 -9.714 1.00 0.00 O ATOM 0 H SER A 23 -4.496 7.461 -9.230 1.00 0.00 H new ATOM 0 HA SER A 23 -4.941 5.898 -6.777 1.00 0.00 H new ATOM 0 HB2 SER A 23 -3.583 4.041 -7.818 1.00 0.00 H new ATOM 0 HB3 SER A 23 -5.208 4.204 -8.455 1.00 0.00 H new ATOM 0 HG SER A 23 -3.659 5.777 -9.950 1.00 0.00 H new ATOM 334 N ILE A 24 -2.695 6.604 -6.015 1.00 0.00 N ATOM 335 CA ILE A 24 -1.341 6.874 -5.523 1.00 0.00 C ATOM 336 C ILE A 24 -0.566 5.551 -5.548 1.00 0.00 C ATOM 337 O ILE A 24 -1.117 4.502 -5.190 1.00 0.00 O ATOM 338 CB ILE A 24 -1.354 7.545 -4.081 1.00 0.00 C ATOM 339 CG1 ILE A 24 -1.996 6.628 -2.960 1.00 0.00 C ATOM 340 CG2 ILE A 24 -2.073 8.922 -4.146 1.00 0.00 C ATOM 341 CD1 ILE A 24 -1.015 5.757 -2.179 1.00 0.00 C ATOM 0 H ILE A 24 -3.369 6.396 -5.279 1.00 0.00 H new ATOM 0 HA ILE A 24 -0.845 7.600 -6.167 1.00 0.00 H new ATOM 0 HB ILE A 24 -0.313 7.684 -3.789 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -2.529 7.266 -2.255 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -2.738 5.980 -3.427 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -2.079 9.377 -3.155 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -1.546 9.575 -4.842 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -3.099 8.781 -4.486 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -1.559 5.171 -1.438 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -0.498 5.086 -2.865 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -0.286 6.392 -1.675 1.00 0.00 H new ATOM 353 N ILE A 25 0.684 5.583 -6.025 1.00 0.00 N ATOM 354 CA ILE A 25 1.527 4.379 -6.113 1.00 0.00 C ATOM 355 C ILE A 25 2.841 4.637 -5.368 1.00 0.00 C ATOM 356 O ILE A 25 3.625 5.516 -5.751 1.00 0.00 O ATOM 357 CB ILE A 25 1.831 3.916 -7.601 1.00 0.00 C ATOM 358 CG1 ILE A 25 0.523 3.621 -8.425 1.00 0.00 C ATOM 359 CG2 ILE A 25 2.759 2.671 -7.603 1.00 0.00 C ATOM 360 CD1 ILE A 25 -0.150 4.826 -9.054 1.00 0.00 C ATOM 0 H ILE A 25 1.138 6.433 -6.358 1.00 0.00 H new ATOM 0 HA ILE A 25 0.968 3.564 -5.654 1.00 0.00 H new ATOM 0 HB ILE A 25 2.337 4.747 -8.092 1.00 0.00 H new ATOM 0 HG12 ILE A 25 0.767 2.912 -9.216 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -0.195 3.131 -7.767 1.00 0.00 H new ATOM 0 HG21 ILE A 25 2.957 2.367 -8.631 1.00 0.00 H new ATOM 0 HG22 ILE A 25 3.699 2.917 -7.110 1.00 0.00 H new ATOM 0 HG23 ILE A 25 2.273 1.854 -7.070 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -1.039 4.504 -9.596 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -0.436 5.532 -8.274 1.00 0.00 H new ATOM 0 HD13 ILE A 25 0.541 5.309 -9.745 1.00 0.00 H new ATOM 372 N ILE A 26 3.057 3.878 -4.286 1.00 0.00 N ATOM 373 CA ILE A 26 4.291 3.922 -3.504 1.00 0.00 C ATOM 374 C ILE A 26 5.096 2.666 -3.818 1.00 0.00 C ATOM 375 O ILE A 26 4.734 1.555 -3.415 1.00 0.00 O ATOM 376 CB ILE A 26 3.975 4.012 -1.967 1.00 0.00 C ATOM 377 CG1 ILE A 26 2.934 5.144 -1.727 1.00 0.00 C ATOM 378 CG2 ILE A 26 5.272 4.234 -1.135 1.00 0.00 C ATOM 379 CD1 ILE A 26 2.541 5.371 -0.301 1.00 0.00 C ATOM 0 H ILE A 26 2.372 3.212 -3.929 1.00 0.00 H new ATOM 0 HA ILE A 26 4.867 4.809 -3.768 1.00 0.00 H new ATOM 0 HB ILE A 26 3.550 3.066 -1.630 1.00 0.00 H new ATOM 0 HG12 ILE A 26 3.338 6.075 -2.126 1.00 0.00 H new ATOM 0 HG13 ILE A 26 2.036 4.914 -2.300 1.00 0.00 H new ATOM 0 HG21 ILE A 26 5.020 4.292 -0.076 1.00 0.00 H new ATOM 0 HG22 ILE A 26 5.957 3.402 -1.300 1.00 0.00 H new ATOM 0 HG23 ILE A 26 5.749 5.164 -1.446 1.00 0.00 H new ATOM 0 HD11 ILE A 26 1.813 6.180 -0.249 1.00 0.00 H new ATOM 0 HD12 ILE A 26 2.101 4.460 0.105 1.00 0.00 H new ATOM 0 HD13 ILE A 26 3.423 5.638 0.281 1.00 0.00 H new ATOM 391 N ARG A 27 6.170 2.870 -4.570 1.00 0.00 N ATOM 392 CA ARG A 27 7.099 1.818 -4.975 1.00 0.00 C ATOM 393 C ARG A 27 8.284 1.776 -4.005 1.00 0.00 C ATOM 394 O ARG A 27 8.530 2.739 -3.262 1.00 0.00 O ATOM 395 CB ARG A 27 7.568 2.049 -6.442 1.00 0.00 C ATOM 396 CG ARG A 27 6.410 2.047 -7.460 1.00 0.00 C ATOM 397 CD ARG A 27 6.826 2.486 -8.871 1.00 0.00 C ATOM 398 NE ARG A 27 7.608 1.462 -9.600 1.00 0.00 N ATOM 399 CZ ARG A 27 8.692 1.715 -10.366 1.00 0.00 C ATOM 400 NH1 ARG A 27 9.263 2.922 -10.361 1.00 0.00 N ATOM 401 NH2 ARG A 27 9.212 0.742 -11.110 1.00 0.00 N ATOM 0 H ARG A 27 6.427 3.791 -4.924 1.00 0.00 H new ATOM 0 HA ARG A 27 6.595 0.852 -4.939 1.00 0.00 H new ATOM 0 HB2 ARG A 27 8.094 3.002 -6.502 1.00 0.00 H new ATOM 0 HB3 ARG A 27 8.283 1.273 -6.714 1.00 0.00 H new ATOM 0 HG2 ARG A 27 5.986 1.044 -7.512 1.00 0.00 H new ATOM 0 HG3 ARG A 27 5.622 2.709 -7.101 1.00 0.00 H new ATOM 0 HD2 ARG A 27 5.932 2.727 -9.446 1.00 0.00 H new ATOM 0 HD3 ARG A 27 7.416 3.400 -8.800 1.00 0.00 H new ATOM 0 HE ARG A 27 7.305 0.491 -9.518 1.00 0.00 H new ATOM 0 HH11 ARG A 27 8.881 3.664 -9.775 1.00 0.00 H new ATOM 0 HH12 ARG A 27 10.081 3.102 -10.943 1.00 0.00 H new ATOM 0 HH21 ARG A 27 8.792 -0.188 -11.100 1.00 0.00 H new ATOM 0 HH22 ARG A 27 10.030 0.926 -11.691 1.00 0.00 H new ATOM 415 N GLN A 28 8.985 0.640 -4.045 1.00 0.00 N ATOM 416 CA GLN A 28 10.136 0.432 -3.151 1.00 0.00 C ATOM 417 C GLN A 28 10.932 -0.795 -3.563 1.00 0.00 C ATOM 418 O GLN A 28 10.393 -1.898 -3.609 1.00 0.00 O ATOM 419 CB GLN A 28 9.677 0.339 -1.659 1.00 0.00 C ATOM 420 CG GLN A 28 10.808 0.567 -0.625 1.00 0.00 C ATOM 421 CD GLN A 28 10.303 0.941 0.785 1.00 0.00 C ATOM 422 OE1 GLN A 28 9.205 1.691 0.867 1.00 0.00 O flip ATOM 423 NE2 GLN A 28 10.923 0.598 1.792 1.00 0.00 N flip ATOM 0 H GLN A 28 8.784 -0.139 -4.673 1.00 0.00 H new ATOM 0 HA GLN A 28 10.793 1.297 -3.241 1.00 0.00 H new ATOM 0 HB2 GLN A 28 8.891 1.074 -1.487 1.00 0.00 H new ATOM 0 HB3 GLN A 28 9.237 -0.644 -1.488 1.00 0.00 H new ATOM 0 HG2 GLN A 28 11.411 -0.338 -0.556 1.00 0.00 H new ATOM 0 HG3 GLN A 28 11.463 1.359 -0.987 1.00 0.00 H new ATOM 0 HE21 GLN A 28 11.761 0.023 1.704 1.00 0.00 H new ATOM 0 HE22 GLN A 28 10.598 0.888 2.714 1.00 0.00 H new ATOM 432 N ARG A 29 12.223 -0.598 -3.876 1.00 0.00 N ATOM 433 CA ARG A 29 13.155 -1.705 -4.089 1.00 0.00 C ATOM 434 C ARG A 29 13.786 -2.075 -2.737 1.00 0.00 C ATOM 435 O ARG A 29 14.637 -1.350 -2.206 1.00 0.00 O ATOM 436 CB ARG A 29 14.240 -1.322 -5.158 1.00 0.00 C ATOM 437 CG ARG A 29 13.909 -1.744 -6.615 1.00 0.00 C ATOM 438 CD ARG A 29 12.599 -1.156 -7.162 1.00 0.00 C ATOM 439 NE ARG A 29 12.203 -1.814 -8.422 1.00 0.00 N ATOM 440 CZ ARG A 29 11.754 -1.210 -9.532 1.00 0.00 C ATOM 441 NH1 ARG A 29 11.659 0.104 -9.605 1.00 0.00 N ATOM 442 NH2 ARG A 29 11.399 -1.952 -10.571 1.00 0.00 N ATOM 0 H ARG A 29 12.642 0.325 -3.986 1.00 0.00 H new ATOM 0 HA ARG A 29 12.625 -2.573 -4.482 1.00 0.00 H new ATOM 0 HB2 ARG A 29 14.386 -0.242 -5.134 1.00 0.00 H new ATOM 0 HB3 ARG A 29 15.187 -1.778 -4.871 1.00 0.00 H new ATOM 0 HG2 ARG A 29 14.730 -1.439 -7.264 1.00 0.00 H new ATOM 0 HG3 ARG A 29 13.853 -2.832 -6.662 1.00 0.00 H new ATOM 0 HD2 ARG A 29 11.807 -1.275 -6.422 1.00 0.00 H new ATOM 0 HD3 ARG A 29 12.720 -0.086 -7.330 1.00 0.00 H new ATOM 0 HE ARG A 29 12.278 -2.831 -8.452 1.00 0.00 H new ATOM 0 HH11 ARG A 29 11.930 0.680 -8.808 1.00 0.00 H new ATOM 0 HH12 ARG A 29 11.315 0.544 -10.459 1.00 0.00 H new ATOM 0 HH21 ARG A 29 11.469 -2.968 -10.520 1.00 0.00 H new ATOM 0 HH22 ARG A 29 11.056 -1.507 -11.422 1.00 0.00 H new ATOM 456 N TYR A 30 13.291 -3.192 -2.177 1.00 0.00 N ATOM 457 CA TYR A 30 13.880 -3.848 -1.000 1.00 0.00 C ATOM 458 C TYR A 30 15.017 -4.765 -1.467 1.00 0.00 C ATOM 459 O TYR A 30 14.909 -5.392 -2.506 1.00 0.00 O ATOM 460 CB TYR A 30 12.818 -4.686 -0.228 1.00 0.00 C ATOM 461 CG TYR A 30 11.783 -3.856 0.554 1.00 0.00 C ATOM 462 CD1 TYR A 30 12.052 -3.402 1.851 1.00 0.00 C ATOM 463 CD2 TYR A 30 10.534 -3.542 0.008 1.00 0.00 C ATOM 464 CE1 TYR A 30 11.123 -2.676 2.567 1.00 0.00 C ATOM 465 CE2 TYR A 30 9.605 -2.808 0.729 1.00 0.00 C ATOM 466 CZ TYR A 30 9.904 -2.377 2.003 1.00 0.00 C ATOM 467 OH TYR A 30 8.980 -1.641 2.715 1.00 0.00 O ATOM 0 H TYR A 30 12.462 -3.668 -2.533 1.00 0.00 H new ATOM 0 HA TYR A 30 14.259 -3.082 -0.323 1.00 0.00 H new ATOM 0 HB2 TYR A 30 12.290 -5.322 -0.939 1.00 0.00 H new ATOM 0 HB3 TYR A 30 13.334 -5.347 0.469 1.00 0.00 H new ATOM 0 HD1 TYR A 30 13.008 -3.625 2.301 1.00 0.00 H new ATOM 0 HD2 TYR A 30 10.290 -3.876 -0.990 1.00 0.00 H new ATOM 0 HE1 TYR A 30 11.352 -2.343 3.568 1.00 0.00 H new ATOM 0 HE2 TYR A 30 8.646 -2.574 0.292 1.00 0.00 H new ATOM 0 HH TYR A 30 9.447 -1.033 3.326 1.00 0.00 H new ATOM 477 N ASP A 31 16.094 -4.804 -0.692 1.00 0.00 N ATOM 478 CA ASP A 31 17.224 -5.733 -0.954 1.00 0.00 C ATOM 479 C ASP A 31 16.905 -7.163 -0.455 1.00 0.00 C ATOM 480 O ASP A 31 17.645 -8.103 -0.753 1.00 0.00 O ATOM 481 CB ASP A 31 18.523 -5.195 -0.297 1.00 0.00 C ATOM 482 CG ASP A 31 18.361 -4.937 1.204 1.00 0.00 C ATOM 483 OD1 ASP A 31 17.804 -3.881 1.561 1.00 0.00 O ATOM 484 OD2 ASP A 31 18.757 -5.787 2.035 1.00 0.00 O ATOM 0 H ASP A 31 16.224 -4.209 0.127 1.00 0.00 H new ATOM 0 HA ASP A 31 17.375 -5.789 -2.032 1.00 0.00 H new ATOM 0 HB2 ASP A 31 19.329 -5.912 -0.454 1.00 0.00 H new ATOM 0 HB3 ASP A 31 18.819 -4.270 -0.791 1.00 0.00 H new ATOM 489 N ALA A 32 15.818 -7.312 0.326 1.00 0.00 N ATOM 490 CA ALA A 32 15.382 -8.626 0.838 1.00 0.00 C ATOM 491 C ALA A 32 14.686 -9.447 -0.277 1.00 0.00 C ATOM 492 O ALA A 32 14.125 -8.851 -1.217 1.00 0.00 O ATOM 493 CB ALA A 32 14.437 -8.456 2.038 1.00 0.00 C ATOM 0 H ALA A 32 15.224 -6.536 0.617 1.00 0.00 H new ATOM 0 HA ALA A 32 16.268 -9.169 1.167 1.00 0.00 H new ATOM 0 HB1 ALA A 32 14.128 -9.437 2.399 1.00 0.00 H new ATOM 0 HB2 ALA A 32 14.954 -7.922 2.835 1.00 0.00 H new ATOM 0 HB3 ALA A 32 13.558 -7.889 1.732 1.00 0.00 H new ATOM 499 N PRO A 33 14.724 -10.819 -0.205 1.00 0.00 N ATOM 500 CA PRO A 33 13.943 -11.690 -1.107 1.00 0.00 C ATOM 501 C PRO A 33 12.415 -11.493 -0.948 1.00 0.00 C ATOM 502 O PRO A 33 11.921 -11.178 0.149 1.00 0.00 O ATOM 503 CB PRO A 33 14.380 -13.135 -0.729 1.00 0.00 C ATOM 504 CG PRO A 33 14.950 -13.013 0.647 1.00 0.00 C ATOM 505 CD PRO A 33 15.561 -11.625 0.723 1.00 0.00 C ATOM 0 HA PRO A 33 14.137 -11.458 -2.154 1.00 0.00 H new ATOM 0 HB2 PRO A 33 13.534 -13.822 -0.747 1.00 0.00 H new ATOM 0 HB3 PRO A 33 15.119 -13.521 -1.431 1.00 0.00 H new ATOM 0 HG2 PRO A 33 14.176 -13.141 1.403 1.00 0.00 H new ATOM 0 HG3 PRO A 33 15.702 -13.781 0.828 1.00 0.00 H new ATOM 0 HD2 PRO A 33 15.529 -11.229 1.738 1.00 0.00 H new ATOM 0 HD3 PRO A 33 16.607 -11.631 0.416 1.00 0.00 H new ATOM 513 N VAL A 34 11.711 -11.693 -2.078 1.00 0.00 N ATOM 514 CA VAL A 34 10.234 -11.609 -2.188 1.00 0.00 C ATOM 515 C VAL A 34 9.526 -12.388 -1.061 1.00 0.00 C ATOM 516 O VAL A 34 8.517 -11.935 -0.546 1.00 0.00 O ATOM 517 CB VAL A 34 9.750 -12.142 -3.598 1.00 0.00 C ATOM 518 CG1 VAL A 34 8.210 -12.273 -3.698 1.00 0.00 C ATOM 519 CG2 VAL A 34 10.285 -11.253 -4.743 1.00 0.00 C ATOM 0 H VAL A 34 12.160 -11.923 -2.964 1.00 0.00 H new ATOM 0 HA VAL A 34 9.964 -10.558 -2.088 1.00 0.00 H new ATOM 0 HB VAL A 34 10.165 -13.145 -3.701 1.00 0.00 H new ATOM 0 HG11 VAL A 34 7.940 -12.643 -4.687 1.00 0.00 H new ATOM 0 HG12 VAL A 34 7.854 -12.971 -2.940 1.00 0.00 H new ATOM 0 HG13 VAL A 34 7.751 -11.298 -3.537 1.00 0.00 H new ATOM 0 HG21 VAL A 34 9.937 -11.643 -5.699 1.00 0.00 H new ATOM 0 HG22 VAL A 34 9.921 -10.234 -4.613 1.00 0.00 H new ATOM 0 HG23 VAL A 34 11.375 -11.254 -4.726 1.00 0.00 H new ATOM 529 N ASP A 35 10.077 -13.572 -0.755 1.00 0.00 N ATOM 530 CA ASP A 35 9.572 -14.462 0.323 1.00 0.00 C ATOM 531 C ASP A 35 9.384 -13.680 1.652 1.00 0.00 C ATOM 532 O ASP A 35 8.307 -13.703 2.241 1.00 0.00 O ATOM 533 CB ASP A 35 10.553 -15.636 0.556 1.00 0.00 C ATOM 534 CG ASP A 35 10.852 -16.430 -0.725 1.00 0.00 C ATOM 535 OD1 ASP A 35 11.789 -16.054 -1.468 1.00 0.00 O ATOM 536 OD2 ASP A 35 10.140 -17.419 -1.009 1.00 0.00 O ATOM 0 H ASP A 35 10.889 -13.948 -1.245 1.00 0.00 H new ATOM 0 HA ASP A 35 8.605 -14.852 0.005 1.00 0.00 H new ATOM 0 HB2 ASP A 35 11.487 -15.247 0.962 1.00 0.00 H new ATOM 0 HB3 ASP A 35 10.135 -16.309 1.305 1.00 0.00 H new ATOM 541 N GLU A 36 10.442 -12.942 2.052 1.00 0.00 N ATOM 542 CA GLU A 36 10.440 -12.182 3.339 1.00 0.00 C ATOM 543 C GLU A 36 9.496 -10.960 3.267 1.00 0.00 C ATOM 544 O GLU A 36 8.897 -10.557 4.274 1.00 0.00 O ATOM 545 CB GLU A 36 11.874 -11.736 3.739 1.00 0.00 C ATOM 546 CG GLU A 36 12.872 -12.894 3.940 1.00 0.00 C ATOM 547 CD GLU A 36 14.173 -12.443 4.630 1.00 0.00 C ATOM 548 OE1 GLU A 36 15.065 -11.885 3.962 1.00 0.00 O ATOM 549 OE2 GLU A 36 14.298 -12.619 5.858 1.00 0.00 O ATOM 0 H GLU A 36 11.304 -12.851 1.515 1.00 0.00 H new ATOM 0 HA GLU A 36 10.068 -12.857 4.110 1.00 0.00 H new ATOM 0 HB2 GLU A 36 12.261 -11.069 2.969 1.00 0.00 H new ATOM 0 HB3 GLU A 36 11.817 -11.158 4.662 1.00 0.00 H new ATOM 0 HG2 GLU A 36 12.401 -13.675 4.537 1.00 0.00 H new ATOM 0 HG3 GLU A 36 13.112 -13.334 2.972 1.00 0.00 H new ATOM 556 N VAL A 37 9.357 -10.421 2.043 1.00 0.00 N ATOM 557 CA VAL A 37 8.481 -9.259 1.789 1.00 0.00 C ATOM 558 C VAL A 37 6.986 -9.662 1.806 1.00 0.00 C ATOM 559 O VAL A 37 6.155 -8.949 2.374 1.00 0.00 O ATOM 560 CB VAL A 37 8.861 -8.555 0.428 1.00 0.00 C ATOM 561 CG1 VAL A 37 8.043 -7.260 0.222 1.00 0.00 C ATOM 562 CG2 VAL A 37 10.382 -8.257 0.354 1.00 0.00 C ATOM 0 H VAL A 37 9.838 -10.769 1.214 1.00 0.00 H new ATOM 0 HA VAL A 37 8.638 -8.544 2.597 1.00 0.00 H new ATOM 0 HB VAL A 37 8.612 -9.246 -0.378 1.00 0.00 H new ATOM 0 HG11 VAL A 37 8.326 -6.797 -0.723 1.00 0.00 H new ATOM 0 HG12 VAL A 37 6.980 -7.500 0.204 1.00 0.00 H new ATOM 0 HG13 VAL A 37 8.245 -6.568 1.040 1.00 0.00 H new ATOM 0 HG21 VAL A 37 10.612 -7.772 -0.595 1.00 0.00 H new ATOM 0 HG22 VAL A 37 10.664 -7.599 1.176 1.00 0.00 H new ATOM 0 HG23 VAL A 37 10.940 -9.190 0.429 1.00 0.00 H new ATOM 572 N TRP A 38 6.676 -10.835 1.227 1.00 0.00 N ATOM 573 CA TRP A 38 5.297 -11.356 1.118 1.00 0.00 C ATOM 574 C TRP A 38 4.826 -11.868 2.482 1.00 0.00 C ATOM 575 O TRP A 38 3.640 -11.793 2.810 1.00 0.00 O ATOM 576 CB TRP A 38 5.205 -12.475 0.039 1.00 0.00 C ATOM 577 CG TRP A 38 3.798 -13.000 -0.174 1.00 0.00 C ATOM 578 CD1 TRP A 38 3.301 -14.203 0.236 1.00 0.00 C ATOM 579 CD2 TRP A 38 2.708 -12.319 -0.829 1.00 0.00 C ATOM 580 NE1 TRP A 38 1.985 -14.316 -0.122 1.00 0.00 N ATOM 581 CE2 TRP A 38 1.598 -13.178 -0.774 1.00 0.00 C ATOM 582 CE3 TRP A 38 2.562 -11.074 -1.450 1.00 0.00 C ATOM 583 CZ2 TRP A 38 0.361 -12.835 -1.315 1.00 0.00 C ATOM 584 CZ3 TRP A 38 1.338 -10.736 -1.990 1.00 0.00 C ATOM 585 CH2 TRP A 38 0.249 -11.615 -1.919 1.00 0.00 C ATOM 0 H TRP A 38 7.377 -11.453 0.819 1.00 0.00 H new ATOM 0 HA TRP A 38 4.641 -10.544 0.803 1.00 0.00 H new ATOM 0 HB2 TRP A 38 5.587 -12.089 -0.906 1.00 0.00 H new ATOM 0 HB3 TRP A 38 5.852 -13.302 0.330 1.00 0.00 H new ATOM 0 HD1 TRP A 38 3.864 -14.957 0.766 1.00 0.00 H new ATOM 0 HE1 TRP A 38 1.388 -15.121 0.067 1.00 0.00 H new ATOM 0 HE3 TRP A 38 3.394 -10.388 -1.506 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -0.480 -13.510 -1.259 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 1.217 -9.779 -2.475 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -0.697 -11.322 -2.350 1.00 0.00 H new ATOM 596 N SER A 39 5.790 -12.311 3.302 1.00 0.00 N ATOM 597 CA SER A 39 5.532 -12.782 4.662 1.00 0.00 C ATOM 598 C SER A 39 5.119 -11.597 5.538 1.00 0.00 C ATOM 599 O SER A 39 4.166 -11.691 6.311 1.00 0.00 O ATOM 600 CB SER A 39 6.785 -13.482 5.218 1.00 0.00 C ATOM 601 OG SER A 39 7.084 -14.660 4.488 1.00 0.00 O ATOM 0 H SER A 39 6.774 -12.351 3.035 1.00 0.00 H new ATOM 0 HA SER A 39 4.718 -13.507 4.658 1.00 0.00 H new ATOM 0 HB2 SER A 39 7.634 -12.800 5.175 1.00 0.00 H new ATOM 0 HB3 SER A 39 6.629 -13.732 6.267 1.00 0.00 H new ATOM 0 HG SER A 39 7.667 -14.438 3.733 1.00 0.00 H new ATOM 607 N ALA A 40 5.845 -10.478 5.393 1.00 0.00 N ATOM 608 CA ALA A 40 5.544 -9.208 6.083 1.00 0.00 C ATOM 609 C ALA A 40 4.139 -8.685 5.718 1.00 0.00 C ATOM 610 O ALA A 40 3.378 -8.242 6.586 1.00 0.00 O ATOM 611 CB ALA A 40 6.614 -8.176 5.700 1.00 0.00 C ATOM 0 H ALA A 40 6.665 -10.426 4.789 1.00 0.00 H new ATOM 0 HA ALA A 40 5.555 -9.378 7.160 1.00 0.00 H new ATOM 0 HB1 ALA A 40 6.405 -7.232 6.202 1.00 0.00 H new ATOM 0 HB2 ALA A 40 7.596 -8.539 6.004 1.00 0.00 H new ATOM 0 HB3 ALA A 40 6.602 -8.023 4.621 1.00 0.00 H new ATOM 617 N CYS A 41 3.830 -8.739 4.414 1.00 0.00 N ATOM 618 CA CYS A 41 2.575 -8.216 3.852 1.00 0.00 C ATOM 619 C CYS A 41 1.319 -9.017 4.274 1.00 0.00 C ATOM 620 O CYS A 41 0.249 -8.426 4.422 1.00 0.00 O ATOM 621 CB CYS A 41 2.679 -8.164 2.309 1.00 0.00 C ATOM 622 SG CYS A 41 3.961 -7.045 1.692 1.00 0.00 S ATOM 0 H CYS A 41 4.448 -9.150 3.714 1.00 0.00 H new ATOM 0 HA CYS A 41 2.445 -7.214 4.261 1.00 0.00 H new ATOM 0 HB2 CYS A 41 2.878 -9.168 1.935 1.00 0.00 H new ATOM 0 HB3 CYS A 41 1.716 -7.856 1.901 1.00 0.00 H new ATOM 0 HG CYS A 41 5.130 -7.586 1.866 1.00 0.00 H new ATOM 628 N THR A 42 1.433 -10.354 4.454 1.00 0.00 N ATOM 629 CA THR A 42 0.236 -11.223 4.630 1.00 0.00 C ATOM 630 C THR A 42 0.092 -11.821 6.044 1.00 0.00 C ATOM 631 O THR A 42 -1.039 -11.996 6.509 1.00 0.00 O ATOM 632 CB THR A 42 0.221 -12.370 3.570 1.00 0.00 C ATOM 633 OG1 THR A 42 1.419 -13.153 3.668 1.00 0.00 O ATOM 634 CG2 THR A 42 0.071 -11.812 2.143 1.00 0.00 C ATOM 0 H THR A 42 2.323 -10.851 4.482 1.00 0.00 H new ATOM 0 HA THR A 42 -0.620 -10.565 4.483 1.00 0.00 H new ATOM 0 HB THR A 42 -0.640 -13.005 3.777 1.00 0.00 H new ATOM 0 HG1 THR A 42 2.196 -12.588 3.472 1.00 0.00 H new ATOM 0 HG21 THR A 42 0.064 -12.636 1.429 1.00 0.00 H new ATOM 0 HG22 THR A 42 -0.864 -11.257 2.066 1.00 0.00 H new ATOM 0 HG23 THR A 42 0.907 -11.148 1.922 1.00 0.00 H new ATOM 642 N ASP A 43 1.212 -12.154 6.718 1.00 0.00 N ATOM 643 CA ASP A 43 1.164 -12.769 8.070 1.00 0.00 C ATOM 644 C ASP A 43 0.706 -11.739 9.124 1.00 0.00 C ATOM 645 O ASP A 43 1.429 -10.772 9.353 1.00 0.00 O ATOM 646 CB ASP A 43 2.542 -13.359 8.463 1.00 0.00 C ATOM 647 CG ASP A 43 2.559 -14.003 9.862 1.00 0.00 C ATOM 648 OD1 ASP A 43 1.765 -14.929 10.108 1.00 0.00 O ATOM 649 OD2 ASP A 43 3.380 -13.612 10.708 1.00 0.00 O ATOM 0 H ASP A 43 2.155 -12.011 6.356 1.00 0.00 H new ATOM 0 HA ASP A 43 0.439 -13.582 8.039 1.00 0.00 H new ATOM 0 HB2 ASP A 43 2.832 -14.106 7.724 1.00 0.00 H new ATOM 0 HB3 ASP A 43 3.291 -12.568 8.427 1.00 0.00 H new ATOM 654 N PRO A 44 -0.500 -11.934 9.780 1.00 0.00 N ATOM 655 CA PRO A 44 -1.033 -11.005 10.826 1.00 0.00 C ATOM 656 C PRO A 44 -0.031 -10.702 11.958 1.00 0.00 C ATOM 657 O PRO A 44 0.034 -9.566 12.449 1.00 0.00 O ATOM 658 CB PRO A 44 -2.264 -11.770 11.381 1.00 0.00 C ATOM 659 CG PRO A 44 -2.719 -12.614 10.235 1.00 0.00 C ATOM 660 CD PRO A 44 -1.453 -13.061 9.534 1.00 0.00 C ATOM 0 HA PRO A 44 -1.260 -10.025 10.406 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -1.998 -12.380 12.244 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -3.046 -11.084 11.705 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -3.298 -13.470 10.583 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -3.362 -12.047 9.561 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -1.078 -14.000 9.942 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -1.619 -13.221 8.469 1.00 0.00 H new ATOM 668 N ASN A 45 0.776 -11.723 12.299 1.00 0.00 N ATOM 669 CA ASN A 45 1.765 -11.643 13.402 1.00 0.00 C ATOM 670 C ASN A 45 2.956 -10.735 13.002 1.00 0.00 C ATOM 671 O ASN A 45 3.668 -10.209 13.861 1.00 0.00 O ATOM 672 CB ASN A 45 2.227 -13.069 13.801 1.00 0.00 C ATOM 673 CG ASN A 45 3.254 -13.102 14.948 1.00 0.00 C ATOM 674 OD1 ASN A 45 4.463 -13.123 14.721 1.00 0.00 O ATOM 675 ND2 ASN A 45 2.779 -13.084 16.181 1.00 0.00 N ATOM 0 H ASN A 45 0.765 -12.625 11.823 1.00 0.00 H new ATOM 0 HA ASN A 45 1.296 -11.189 14.275 1.00 0.00 H new ATOM 0 HB2 ASN A 45 1.354 -13.653 14.093 1.00 0.00 H new ATOM 0 HB3 ASN A 45 2.659 -13.557 12.927 1.00 0.00 H new ATOM 0 HD21 ASN A 45 3.420 -13.087 16.975 1.00 0.00 H new ATOM 0 HD22 ASN A 45 1.771 -13.067 16.339 1.00 0.00 H new ATOM 682 N ARG A 46 3.142 -10.538 11.688 1.00 0.00 N ATOM 683 CA ARG A 46 4.116 -9.574 11.143 1.00 0.00 C ATOM 684 C ARG A 46 3.462 -8.220 10.833 1.00 0.00 C ATOM 685 O ARG A 46 4.146 -7.194 10.892 1.00 0.00 O ATOM 686 CB ARG A 46 4.791 -10.137 9.870 1.00 0.00 C ATOM 687 CG ARG A 46 5.716 -11.340 10.141 1.00 0.00 C ATOM 688 CD ARG A 46 6.350 -11.893 8.866 1.00 0.00 C ATOM 689 NE ARG A 46 7.145 -13.111 9.115 1.00 0.00 N ATOM 690 CZ ARG A 46 6.796 -14.355 8.748 1.00 0.00 C ATOM 691 NH1 ARG A 46 5.627 -14.592 8.151 1.00 0.00 N ATOM 692 NH2 ARG A 46 7.619 -15.358 8.975 1.00 0.00 N ATOM 0 H ARG A 46 2.621 -11.042 10.970 1.00 0.00 H new ATOM 0 HA ARG A 46 4.876 -9.415 11.909 1.00 0.00 H new ATOM 0 HB2 ARG A 46 4.018 -10.436 9.162 1.00 0.00 H new ATOM 0 HB3 ARG A 46 5.369 -9.345 9.395 1.00 0.00 H new ATOM 0 HG2 ARG A 46 6.503 -11.040 10.833 1.00 0.00 H new ATOM 0 HG3 ARG A 46 5.145 -12.129 10.630 1.00 0.00 H new ATOM 0 HD2 ARG A 46 5.567 -12.116 8.141 1.00 0.00 H new ATOM 0 HD3 ARG A 46 6.989 -11.130 8.421 1.00 0.00 H new ATOM 0 HE ARG A 46 8.032 -12.999 9.606 1.00 0.00 H new ATOM 0 HH11 ARG A 46 4.983 -13.823 7.967 1.00 0.00 H new ATOM 0 HH12 ARG A 46 5.377 -15.543 7.878 1.00 0.00 H new ATOM 0 HH21 ARG A 46 8.517 -15.188 9.428 1.00 0.00 H new ATOM 0 HH22 ARG A 46 7.358 -16.304 8.698 1.00 0.00 H new ATOM 706 N ILE A 47 2.137 -8.197 10.560 1.00 0.00 N ATOM 707 CA ILE A 47 1.447 -6.962 10.101 1.00 0.00 C ATOM 708 C ILE A 47 1.231 -6.023 11.301 1.00 0.00 C ATOM 709 O ILE A 47 1.300 -4.808 11.153 1.00 0.00 O ATOM 710 CB ILE A 47 0.071 -7.250 9.368 1.00 0.00 C ATOM 711 CG1 ILE A 47 0.275 -8.139 8.104 1.00 0.00 C ATOM 712 CG2 ILE A 47 -0.653 -5.931 8.966 1.00 0.00 C ATOM 713 CD1 ILE A 47 -1.018 -8.572 7.417 1.00 0.00 C ATOM 0 H ILE A 47 1.526 -9.009 10.647 1.00 0.00 H new ATOM 0 HA ILE A 47 2.091 -6.487 9.361 1.00 0.00 H new ATOM 0 HB ILE A 47 -0.555 -7.788 10.080 1.00 0.00 H new ATOM 0 HG12 ILE A 47 0.887 -7.593 7.386 1.00 0.00 H new ATOM 0 HG13 ILE A 47 0.836 -9.029 8.389 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.592 -6.169 8.466 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -0.857 -5.341 9.860 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -0.017 -5.358 8.290 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -0.780 -9.186 6.548 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -1.625 -9.149 8.115 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -1.573 -7.690 7.097 1.00 0.00 H new ATOM 725 N ASN A 48 1.040 -6.593 12.517 1.00 0.00 N ATOM 726 CA ASN A 48 0.875 -5.809 13.767 1.00 0.00 C ATOM 727 C ASN A 48 2.200 -5.186 14.246 1.00 0.00 C ATOM 728 O ASN A 48 2.218 -4.448 15.232 1.00 0.00 O ATOM 729 CB ASN A 48 0.273 -6.689 14.900 1.00 0.00 C ATOM 730 CG ASN A 48 1.167 -7.852 15.365 1.00 0.00 C ATOM 731 OD1 ASN A 48 1.037 -8.964 14.895 1.00 0.00 O ATOM 732 ND2 ASN A 48 2.066 -7.596 16.308 1.00 0.00 N ATOM 0 H ASN A 48 0.996 -7.602 12.659 1.00 0.00 H new ATOM 0 HA ASN A 48 0.186 -4.997 13.535 1.00 0.00 H new ATOM 0 HB2 ASN A 48 0.056 -6.052 15.758 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -0.678 -7.096 14.557 1.00 0.00 H new ATOM 0 HD21 ASN A 48 2.668 -8.343 16.655 1.00 0.00 H new ATOM 0 HD22 ASN A 48 2.154 -6.653 16.686 1.00 0.00 H new ATOM 739 N ARG A 49 3.299 -5.499 13.548 1.00 0.00 N ATOM 740 CA ARG A 49 4.654 -5.105 13.954 1.00 0.00 C ATOM 741 C ARG A 49 5.089 -3.811 13.225 1.00 0.00 C ATOM 742 O ARG A 49 5.861 -3.022 13.772 1.00 0.00 O ATOM 743 CB ARG A 49 5.636 -6.295 13.683 1.00 0.00 C ATOM 744 CG ARG A 49 6.604 -6.629 14.843 1.00 0.00 C ATOM 745 CD ARG A 49 7.603 -5.513 15.158 1.00 0.00 C ATOM 746 NE ARG A 49 8.298 -5.750 16.436 1.00 0.00 N ATOM 747 CZ ARG A 49 9.556 -5.401 16.716 1.00 0.00 C ATOM 748 NH1 ARG A 49 10.359 -4.956 15.771 1.00 0.00 N ATOM 749 NH2 ARG A 49 10.018 -5.559 17.944 1.00 0.00 N ATOM 0 H ARG A 49 3.273 -6.036 12.681 1.00 0.00 H new ATOM 0 HA ARG A 49 4.671 -4.883 15.021 1.00 0.00 H new ATOM 0 HB2 ARG A 49 5.049 -7.184 13.454 1.00 0.00 H new ATOM 0 HB3 ARG A 49 6.225 -6.064 12.795 1.00 0.00 H new ATOM 0 HG2 ARG A 49 6.021 -6.845 15.739 1.00 0.00 H new ATOM 0 HG3 ARG A 49 7.154 -7.536 14.594 1.00 0.00 H new ATOM 0 HD2 ARG A 49 8.335 -5.441 14.353 1.00 0.00 H new ATOM 0 HD3 ARG A 49 7.080 -4.557 15.199 1.00 0.00 H new ATOM 0 HE ARG A 49 7.772 -6.222 17.171 1.00 0.00 H new ATOM 0 HH11 ARG A 49 10.022 -4.875 14.812 1.00 0.00 H new ATOM 0 HH12 ARG A 49 11.318 -4.693 15.999 1.00 0.00 H new ATOM 0 HH21 ARG A 49 9.415 -5.945 18.670 1.00 0.00 H new ATOM 0 HH22 ARG A 49 10.978 -5.295 18.166 1.00 0.00 H new ATOM 763 N TRP A 50 4.586 -3.602 11.984 1.00 0.00 N ATOM 764 CA TRP A 50 4.898 -2.390 11.171 1.00 0.00 C ATOM 765 C TRP A 50 3.631 -1.577 10.843 1.00 0.00 C ATOM 766 O TRP A 50 3.722 -0.391 10.500 1.00 0.00 O ATOM 767 CB TRP A 50 5.644 -2.779 9.859 1.00 0.00 C ATOM 768 CG TRP A 50 4.883 -3.710 8.928 1.00 0.00 C ATOM 769 CD1 TRP A 50 4.888 -5.073 8.958 1.00 0.00 C ATOM 770 CD2 TRP A 50 4.044 -3.347 7.811 1.00 0.00 C ATOM 771 NE1 TRP A 50 4.092 -5.575 7.963 1.00 0.00 N ATOM 772 CE2 TRP A 50 3.564 -4.544 7.246 1.00 0.00 C ATOM 773 CE3 TRP A 50 3.646 -2.130 7.244 1.00 0.00 C ATOM 774 CZ2 TRP A 50 2.711 -4.562 6.143 1.00 0.00 C ATOM 775 CZ3 TRP A 50 2.800 -2.150 6.149 1.00 0.00 C ATOM 776 CH2 TRP A 50 2.337 -3.357 5.612 1.00 0.00 C ATOM 0 H TRP A 50 3.959 -4.258 11.518 1.00 0.00 H new ATOM 0 HA TRP A 50 5.551 -1.759 11.774 1.00 0.00 H new ATOM 0 HB2 TRP A 50 5.886 -1.866 9.314 1.00 0.00 H new ATOM 0 HB3 TRP A 50 6.589 -3.252 10.125 1.00 0.00 H new ATOM 0 HD1 TRP A 50 5.441 -5.672 9.666 1.00 0.00 H new ATOM 0 HE1 TRP A 50 3.921 -6.565 7.787 1.00 0.00 H new ATOM 0 HE3 TRP A 50 3.993 -1.193 7.654 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 2.358 -5.492 5.723 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 2.491 -1.217 5.701 1.00 0.00 H new ATOM 0 HH2 TRP A 50 1.671 -3.337 4.762 1.00 0.00 H new ATOM 787 N PHE A 51 2.458 -2.225 10.933 1.00 0.00 N ATOM 788 CA PHE A 51 1.167 -1.615 10.567 1.00 0.00 C ATOM 789 C PHE A 51 0.163 -1.775 11.732 1.00 0.00 C ATOM 790 O PHE A 51 0.269 -1.055 12.735 1.00 0.00 O ATOM 791 CB PHE A 51 0.664 -2.246 9.225 1.00 0.00 C ATOM 792 CG PHE A 51 -0.568 -1.594 8.597 1.00 0.00 C ATOM 793 CD1 PHE A 51 -0.511 -0.285 8.116 1.00 0.00 C ATOM 794 CD2 PHE A 51 -1.768 -2.294 8.463 1.00 0.00 C ATOM 795 CE1 PHE A 51 -1.624 0.304 7.539 1.00 0.00 C ATOM 796 CE2 PHE A 51 -2.872 -1.704 7.886 1.00 0.00 C ATOM 797 CZ PHE A 51 -2.802 -0.405 7.420 1.00 0.00 C ATOM 0 H PHE A 51 2.377 -3.187 11.262 1.00 0.00 H new ATOM 0 HA PHE A 51 1.277 -0.544 10.399 1.00 0.00 H new ATOM 0 HB2 PHE A 51 1.478 -2.209 8.502 1.00 0.00 H new ATOM 0 HB3 PHE A 51 0.443 -3.299 9.402 1.00 0.00 H new ATOM 0 HD1 PHE A 51 0.410 0.274 8.194 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -1.832 -3.312 8.816 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -1.570 1.322 7.181 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -3.795 -2.259 7.798 1.00 0.00 H new ATOM 0 HZ PHE A 51 -3.667 0.054 6.964 1.00 0.00 H new ATOM 807 N ILE A 52 -0.782 -2.741 11.627 1.00 0.00 N ATOM 808 CA ILE A 52 -1.932 -2.888 12.557 1.00 0.00 C ATOM 809 C ILE A 52 -2.310 -4.380 12.651 1.00 0.00 C ATOM 810 O ILE A 52 -2.202 -5.101 11.661 1.00 0.00 O ATOM 811 CB ILE A 52 -3.203 -2.059 12.075 1.00 0.00 C ATOM 812 CG1 ILE A 52 -2.894 -0.526 11.995 1.00 0.00 C ATOM 813 CG2 ILE A 52 -4.436 -2.317 12.981 1.00 0.00 C ATOM 814 CD1 ILE A 52 -3.970 0.296 11.326 1.00 0.00 C ATOM 0 H ILE A 52 -0.769 -3.446 10.890 1.00 0.00 H new ATOM 0 HA ILE A 52 -1.630 -2.498 13.529 1.00 0.00 H new ATOM 0 HB ILE A 52 -3.444 -2.410 11.072 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -2.740 -0.146 13.005 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -1.958 -0.385 11.455 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.282 -1.733 12.619 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -4.690 -3.377 12.957 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -4.204 -2.023 14.004 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -3.673 1.345 11.315 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -4.111 -0.052 10.303 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -4.904 0.190 11.877 1.00 0.00 H new ATOM 826 N GLU A 53 -2.696 -4.805 13.870 1.00 0.00 N ATOM 827 CA GLU A 53 -3.238 -6.170 14.097 1.00 0.00 C ATOM 828 C GLU A 53 -4.544 -6.391 13.271 1.00 0.00 C ATOM 829 O GLU A 53 -5.573 -5.769 13.559 1.00 0.00 O ATOM 830 CB GLU A 53 -3.444 -6.424 15.625 1.00 0.00 C ATOM 831 CG GLU A 53 -4.315 -5.380 16.366 1.00 0.00 C ATOM 832 CD GLU A 53 -4.245 -5.520 17.901 1.00 0.00 C ATOM 833 OE1 GLU A 53 -4.953 -6.381 18.466 1.00 0.00 O ATOM 834 OE2 GLU A 53 -3.466 -4.782 18.545 1.00 0.00 O ATOM 0 H GLU A 53 -2.645 -4.231 14.711 1.00 0.00 H new ATOM 0 HA GLU A 53 -2.515 -6.905 13.743 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -3.898 -7.406 15.754 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -2.466 -6.460 16.104 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -3.992 -4.378 16.083 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -5.351 -5.484 16.044 1.00 0.00 H new ATOM 841 N PRO A 54 -4.503 -7.228 12.174 1.00 0.00 N ATOM 842 CA PRO A 54 -5.666 -7.467 11.301 1.00 0.00 C ATOM 843 C PRO A 54 -6.462 -8.751 11.668 1.00 0.00 C ATOM 844 O PRO A 54 -5.883 -9.800 11.999 1.00 0.00 O ATOM 845 CB PRO A 54 -4.989 -7.582 9.919 1.00 0.00 C ATOM 846 CG PRO A 54 -3.672 -8.275 10.201 1.00 0.00 C ATOM 847 CD PRO A 54 -3.317 -7.979 11.663 1.00 0.00 C ATOM 0 HA PRO A 54 -6.423 -6.686 11.372 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -5.600 -8.158 9.224 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -4.834 -6.601 9.470 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -3.757 -9.349 10.034 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -2.892 -7.909 9.533 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -3.151 -8.896 12.228 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -2.405 -7.387 11.741 1.00 0.00 H new ATOM 855 N LYS A 55 -7.796 -8.648 11.608 1.00 0.00 N ATOM 856 CA LYS A 55 -8.735 -9.765 11.823 1.00 0.00 C ATOM 857 C LYS A 55 -9.747 -9.811 10.668 1.00 0.00 C ATOM 858 O LYS A 55 -10.207 -8.769 10.199 1.00 0.00 O ATOM 859 CB LYS A 55 -9.481 -9.616 13.185 1.00 0.00 C ATOM 860 CG LYS A 55 -8.609 -9.857 14.439 1.00 0.00 C ATOM 861 CD LYS A 55 -7.976 -11.275 14.466 1.00 0.00 C ATOM 862 CE LYS A 55 -7.307 -11.599 15.816 1.00 0.00 C ATOM 863 NZ LYS A 55 -8.286 -11.613 16.939 1.00 0.00 N ATOM 0 H LYS A 55 -8.267 -7.766 11.404 1.00 0.00 H new ATOM 0 HA LYS A 55 -8.169 -10.696 11.851 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -9.904 -8.613 13.242 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -10.317 -10.316 13.202 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -7.817 -9.109 14.475 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -9.218 -9.719 15.332 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -8.747 -12.017 14.259 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -7.236 -11.354 13.670 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -6.815 -12.570 15.752 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -6.531 -10.862 16.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -7.858 -12.075 17.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -8.547 -10.637 17.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -9.137 -12.137 16.651 1.00 0.00 H new ATOM 877 N GLY A 56 -10.105 -11.023 10.238 1.00 0.00 N ATOM 878 CA GLY A 56 -11.076 -11.232 9.168 1.00 0.00 C ATOM 879 C GLY A 56 -10.989 -12.647 8.625 1.00 0.00 C ATOM 880 O GLY A 56 -10.416 -13.529 9.278 1.00 0.00 O ATOM 0 H GLY A 56 -9.727 -11.888 10.625 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -12.082 -11.043 9.543 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -10.896 -10.518 8.364 1.00 0.00 H new ATOM 884 N ASP A 57 -11.561 -12.865 7.435 1.00 0.00 N ATOM 885 CA ASP A 57 -11.454 -14.163 6.740 1.00 0.00 C ATOM 886 C ASP A 57 -10.037 -14.310 6.135 1.00 0.00 C ATOM 887 O ASP A 57 -9.455 -15.398 6.154 1.00 0.00 O ATOM 888 CB ASP A 57 -12.549 -14.294 5.650 1.00 0.00 C ATOM 889 CG ASP A 57 -12.515 -15.652 4.928 1.00 0.00 C ATOM 890 OD1 ASP A 57 -13.015 -16.649 5.493 1.00 0.00 O ATOM 891 OD2 ASP A 57 -11.970 -15.736 3.808 1.00 0.00 O ATOM 0 H ASP A 57 -12.103 -12.164 6.930 1.00 0.00 H new ATOM 0 HA ASP A 57 -11.612 -14.969 7.457 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -13.529 -14.156 6.108 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -12.424 -13.496 4.918 1.00 0.00 H new ATOM 896 N LEU A 58 -9.530 -13.194 5.561 1.00 0.00 N ATOM 897 CA LEU A 58 -8.123 -13.020 5.095 1.00 0.00 C ATOM 898 C LEU A 58 -7.777 -13.851 3.825 1.00 0.00 C ATOM 899 O LEU A 58 -6.713 -13.647 3.223 1.00 0.00 O ATOM 900 CB LEU A 58 -7.108 -13.295 6.253 1.00 0.00 C ATOM 901 CG LEU A 58 -7.303 -12.454 7.567 1.00 0.00 C ATOM 902 CD1 LEU A 58 -6.298 -12.888 8.661 1.00 0.00 C ATOM 903 CD2 LEU A 58 -7.212 -10.932 7.285 1.00 0.00 C ATOM 0 H LEU A 58 -10.100 -12.363 5.402 1.00 0.00 H new ATOM 0 HA LEU A 58 -8.032 -11.976 4.796 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -7.164 -14.352 6.512 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -6.102 -13.112 5.876 1.00 0.00 H new ATOM 0 HG LEU A 58 -8.307 -12.655 7.942 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -6.456 -12.290 9.558 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -6.449 -13.942 8.896 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -5.280 -12.739 8.300 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -7.351 -10.381 8.215 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -6.233 -10.697 6.867 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -7.988 -10.647 6.574 1.00 0.00 H new ATOM 915 N ARG A 59 -8.678 -14.763 3.424 1.00 0.00 N ATOM 916 CA ARG A 59 -8.529 -15.586 2.214 1.00 0.00 C ATOM 917 C ARG A 59 -9.233 -14.912 1.029 1.00 0.00 C ATOM 918 O ARG A 59 -10.052 -14.009 1.221 1.00 0.00 O ATOM 919 CB ARG A 59 -9.113 -17.003 2.443 1.00 0.00 C ATOM 920 CG ARG A 59 -8.322 -17.888 3.426 1.00 0.00 C ATOM 921 CD ARG A 59 -8.871 -19.325 3.486 1.00 0.00 C ATOM 922 NE ARG A 59 -8.002 -20.232 4.266 1.00 0.00 N ATOM 923 CZ ARG A 59 -7.842 -21.547 4.033 1.00 0.00 C ATOM 924 NH1 ARG A 59 -8.494 -22.160 3.047 1.00 0.00 N ATOM 925 NH2 ARG A 59 -7.009 -22.236 4.789 1.00 0.00 N ATOM 0 H ARG A 59 -9.539 -14.951 3.937 1.00 0.00 H new ATOM 0 HA ARG A 59 -7.467 -15.682 1.989 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -10.134 -16.903 2.811 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -9.169 -17.515 1.482 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -7.274 -17.913 3.127 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -8.359 -17.445 4.421 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -9.867 -19.312 3.929 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -8.978 -19.712 2.473 1.00 0.00 H new ATOM 0 HE ARG A 59 -7.481 -19.827 5.044 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -9.130 -21.631 2.450 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -8.357 -23.158 2.889 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -6.497 -21.771 5.538 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -6.877 -23.234 4.624 1.00 0.00 H new ATOM 939 N GLU A 60 -8.928 -15.401 -0.185 1.00 0.00 N ATOM 940 CA GLU A 60 -9.439 -14.840 -1.446 1.00 0.00 C ATOM 941 C GLU A 60 -10.976 -15.015 -1.515 1.00 0.00 C ATOM 942 O GLU A 60 -11.492 -16.136 -1.423 1.00 0.00 O ATOM 943 CB GLU A 60 -8.719 -15.519 -2.659 1.00 0.00 C ATOM 944 CG GLU A 60 -8.662 -14.690 -3.967 1.00 0.00 C ATOM 945 CD GLU A 60 -10.034 -14.335 -4.571 1.00 0.00 C ATOM 946 OE1 GLU A 60 -10.617 -15.166 -5.295 1.00 0.00 O ATOM 947 OE2 GLU A 60 -10.534 -13.222 -4.323 1.00 0.00 O ATOM 0 H GLU A 60 -8.314 -16.204 -0.319 1.00 0.00 H new ATOM 0 HA GLU A 60 -9.226 -13.772 -1.489 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -7.699 -15.761 -2.361 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -9.221 -16.463 -2.872 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -8.118 -13.766 -3.771 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -8.088 -15.247 -4.708 1.00 0.00 H new ATOM 954 N GLY A 61 -11.683 -13.885 -1.690 1.00 0.00 N ATOM 955 CA GLY A 61 -13.150 -13.865 -1.677 1.00 0.00 C ATOM 956 C GLY A 61 -13.729 -13.648 -0.287 1.00 0.00 C ATOM 957 O GLY A 61 -14.948 -13.731 -0.095 1.00 0.00 O ATOM 0 H GLY A 61 -11.256 -12.971 -1.843 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -13.503 -13.074 -2.339 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -13.524 -14.807 -2.078 1.00 0.00 H new ATOM 961 N GLY A 62 -12.842 -13.361 0.680 1.00 0.00 N ATOM 962 CA GLY A 62 -13.229 -13.100 2.062 1.00 0.00 C ATOM 963 C GLY A 62 -13.229 -11.617 2.386 1.00 0.00 C ATOM 964 O GLY A 62 -13.511 -10.793 1.513 1.00 0.00 O ATOM 0 H GLY A 62 -11.837 -13.305 0.518 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -14.223 -13.510 2.243 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -12.544 -13.617 2.734 1.00 0.00 H new ATOM 968 N ASN A 63 -12.906 -11.276 3.647 1.00 0.00 N ATOM 969 CA ASN A 63 -12.859 -9.887 4.129 1.00 0.00 C ATOM 970 C ASN A 63 -11.657 -9.669 5.063 1.00 0.00 C ATOM 971 O ASN A 63 -10.996 -10.629 5.473 1.00 0.00 O ATOM 972 CB ASN A 63 -14.186 -9.510 4.855 1.00 0.00 C ATOM 973 CG ASN A 63 -14.380 -10.201 6.215 1.00 0.00 C ATOM 974 OD1 ASN A 63 -13.956 -11.336 6.428 1.00 0.00 O ATOM 975 ND2 ASN A 63 -15.015 -9.514 7.147 1.00 0.00 N ATOM 0 H ASN A 63 -12.669 -11.962 4.363 1.00 0.00 H new ATOM 0 HA ASN A 63 -12.741 -9.236 3.263 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -14.212 -8.430 5.002 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -15.026 -9.764 4.208 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -15.164 -9.923 8.070 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -15.357 -8.574 6.944 1.00 0.00 H new ATOM 982 N PHE A 64 -11.386 -8.397 5.399 1.00 0.00 N ATOM 983 CA PHE A 64 -10.372 -8.017 6.395 1.00 0.00 C ATOM 984 C PHE A 64 -10.903 -6.807 7.188 1.00 0.00 C ATOM 985 O PHE A 64 -11.742 -6.047 6.690 1.00 0.00 O ATOM 986 CB PHE A 64 -9.001 -7.682 5.722 1.00 0.00 C ATOM 987 CG PHE A 64 -8.962 -6.354 4.957 1.00 0.00 C ATOM 988 CD1 PHE A 64 -9.539 -6.237 3.697 1.00 0.00 C ATOM 989 CD2 PHE A 64 -8.363 -5.214 5.513 1.00 0.00 C ATOM 990 CE1 PHE A 64 -9.524 -5.034 3.022 1.00 0.00 C ATOM 991 CE2 PHE A 64 -8.352 -4.012 4.834 1.00 0.00 C ATOM 992 CZ PHE A 64 -8.933 -3.923 3.586 1.00 0.00 C ATOM 0 H PHE A 64 -11.868 -7.599 4.984 1.00 0.00 H new ATOM 0 HA PHE A 64 -10.194 -8.857 7.067 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -8.230 -7.663 6.492 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -8.744 -8.488 5.034 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -10.005 -7.098 3.241 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -7.903 -5.278 6.488 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -9.978 -4.962 2.045 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -7.890 -3.143 5.279 1.00 0.00 H new ATOM 0 HZ PHE A 64 -8.925 -2.985 3.051 1.00 0.00 H new ATOM 1002 N ALA A 65 -10.415 -6.648 8.415 1.00 0.00 N ATOM 1003 CA ALA A 65 -10.751 -5.513 9.292 1.00 0.00 C ATOM 1004 C ALA A 65 -9.559 -5.185 10.197 1.00 0.00 C ATOM 1005 O ALA A 65 -8.853 -6.091 10.641 1.00 0.00 O ATOM 1006 CB ALA A 65 -12.005 -5.844 10.126 1.00 0.00 C ATOM 0 H ALA A 65 -9.765 -7.309 8.841 1.00 0.00 H new ATOM 0 HA ALA A 65 -10.970 -4.636 8.682 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -12.246 -4.999 10.771 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -12.844 -6.042 9.459 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -11.813 -6.725 10.738 1.00 0.00 H new ATOM 1012 N LEU A 66 -9.321 -3.888 10.455 1.00 0.00 N ATOM 1013 CA LEU A 66 -8.229 -3.439 11.338 1.00 0.00 C ATOM 1014 C LEU A 66 -8.780 -3.231 12.767 1.00 0.00 C ATOM 1015 O LEU A 66 -9.008 -4.220 13.460 1.00 0.00 O ATOM 1016 CB LEU A 66 -7.546 -2.184 10.731 1.00 0.00 C ATOM 1017 CG LEU A 66 -6.901 -2.404 9.324 1.00 0.00 C ATOM 1018 CD1 LEU A 66 -6.353 -1.089 8.749 1.00 0.00 C ATOM 1019 CD2 LEU A 66 -5.810 -3.512 9.365 1.00 0.00 C ATOM 0 H LEU A 66 -9.874 -3.127 10.062 1.00 0.00 H new ATOM 0 HA LEU A 66 -7.449 -4.197 11.416 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -8.285 -1.386 10.656 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -6.774 -1.839 11.419 1.00 0.00 H new ATOM 0 HG LEU A 66 -7.687 -2.750 8.652 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -5.911 -1.276 7.770 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -7.165 -0.369 8.649 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -5.593 -0.687 9.419 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -5.383 -3.639 8.370 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -5.024 -3.223 10.063 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -6.257 -4.451 9.690 1.00 0.00 H new ATOM 1031 N GLN A 67 -9.035 -1.971 13.186 1.00 0.00 N ATOM 1032 CA GLN A 67 -9.673 -1.644 14.495 1.00 0.00 C ATOM 1033 C GLN A 67 -10.341 -0.276 14.392 1.00 0.00 C ATOM 1034 O GLN A 67 -11.546 -0.130 14.612 1.00 0.00 O ATOM 1035 CB GLN A 67 -8.654 -1.607 15.682 1.00 0.00 C ATOM 1036 CG GLN A 67 -8.194 -2.973 16.209 1.00 0.00 C ATOM 1037 CD GLN A 67 -7.377 -2.861 17.494 1.00 0.00 C ATOM 1038 OE1 GLN A 67 -6.153 -2.757 17.467 1.00 0.00 O ATOM 1039 NE2 GLN A 67 -8.058 -2.842 18.630 1.00 0.00 N ATOM 0 H GLN A 67 -8.806 -1.147 12.630 1.00 0.00 H new ATOM 0 HA GLN A 67 -10.395 -2.434 14.704 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -7.775 -1.046 15.364 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -9.104 -1.054 16.506 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -9.066 -3.601 16.391 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -7.597 -3.471 15.445 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -9.074 -2.931 18.617 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -7.566 -2.739 19.518 1.00 0.00 H new ATOM 1048 N GLY A 68 -9.520 0.715 14.028 1.00 0.00 N ATOM 1049 CA GLY A 68 -9.924 2.108 13.966 1.00 0.00 C ATOM 1050 C GLY A 68 -9.334 2.815 12.749 1.00 0.00 C ATOM 1051 O GLY A 68 -8.852 3.949 12.842 1.00 0.00 O ATOM 0 H GLY A 68 -8.546 0.562 13.767 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -11.012 2.170 13.931 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -9.605 2.620 14.874 1.00 0.00 H new ATOM 1055 N ASN A 69 -9.373 2.120 11.603 1.00 0.00 N ATOM 1056 CA ASN A 69 -9.016 2.681 10.283 1.00 0.00 C ATOM 1057 C ASN A 69 -10.062 2.256 9.252 1.00 0.00 C ATOM 1058 O ASN A 69 -10.911 3.062 8.855 1.00 0.00 O ATOM 1059 CB ASN A 69 -7.582 2.259 9.801 1.00 0.00 C ATOM 1060 CG ASN A 69 -6.463 3.225 10.206 1.00 0.00 C ATOM 1061 OD1 ASN A 69 -6.715 4.343 10.640 1.00 0.00 O ATOM 1062 ND2 ASN A 69 -5.220 2.830 9.975 1.00 0.00 N ATOM 0 H ASN A 69 -9.656 1.141 11.561 1.00 0.00 H new ATOM 0 HA ASN A 69 -9.001 3.766 10.386 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -7.354 1.271 10.202 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -7.590 2.168 8.715 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -4.441 3.463 10.159 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -5.041 1.893 9.614 1.00 0.00 H new ATOM 1069 N ALA A 70 -10.017 0.971 8.846 1.00 0.00 N ATOM 1070 CA ALA A 70 -10.800 0.491 7.704 1.00 0.00 C ATOM 1071 C ALA A 70 -11.099 -1.004 7.781 1.00 0.00 C ATOM 1072 O ALA A 70 -10.375 -1.782 8.418 1.00 0.00 O ATOM 1073 CB ALA A 70 -10.069 0.793 6.395 1.00 0.00 C ATOM 0 H ALA A 70 -9.447 0.254 9.294 1.00 0.00 H new ATOM 0 HA ALA A 70 -11.752 1.021 7.735 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -10.662 0.431 5.555 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -9.924 1.869 6.299 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -9.100 0.295 6.396 1.00 0.00 H new ATOM 1079 N SER A 71 -12.199 -1.353 7.116 1.00 0.00 N ATOM 1080 CA SER A 71 -12.587 -2.732 6.826 1.00 0.00 C ATOM 1081 C SER A 71 -12.944 -2.826 5.335 1.00 0.00 C ATOM 1082 O SER A 71 -13.343 -1.825 4.714 1.00 0.00 O ATOM 1083 CB SER A 71 -13.781 -3.167 7.711 1.00 0.00 C ATOM 1084 OG SER A 71 -13.463 -3.057 9.092 1.00 0.00 O ATOM 0 H SER A 71 -12.862 -0.667 6.755 1.00 0.00 H new ATOM 0 HA SER A 71 -11.760 -3.406 7.051 1.00 0.00 H new ATOM 0 HB2 SER A 71 -14.649 -2.548 7.485 1.00 0.00 H new ATOM 0 HB3 SER A 71 -14.054 -4.196 7.479 1.00 0.00 H new ATOM 0 HG SER A 71 -14.234 -3.336 9.628 1.00 0.00 H new ATOM 1090 N GLY A 72 -12.805 -4.023 4.770 1.00 0.00 N ATOM 1091 CA GLY A 72 -13.096 -4.252 3.366 1.00 0.00 C ATOM 1092 C GLY A 72 -13.113 -5.716 3.024 1.00 0.00 C ATOM 1093 O GLY A 72 -13.299 -6.553 3.903 1.00 0.00 O ATOM 0 H GLY A 72 -12.490 -4.853 5.272 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -14.062 -3.811 3.120 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -12.349 -3.746 2.754 1.00 0.00 H new ATOM 1097 N ASP A 73 -12.893 -6.030 1.741 1.00 0.00 N ATOM 1098 CA ASP A 73 -12.918 -7.412 1.230 1.00 0.00 C ATOM 1099 C ASP A 73 -11.579 -7.766 0.579 1.00 0.00 C ATOM 1100 O ASP A 73 -10.737 -6.896 0.356 1.00 0.00 O ATOM 1101 CB ASP A 73 -14.076 -7.600 0.211 1.00 0.00 C ATOM 1102 CG ASP A 73 -15.466 -7.425 0.848 1.00 0.00 C ATOM 1103 OD1 ASP A 73 -15.934 -8.353 1.541 1.00 0.00 O ATOM 1104 OD2 ASP A 73 -16.099 -6.363 0.654 1.00 0.00 O ATOM 0 H ASP A 73 -12.692 -5.333 1.024 1.00 0.00 H new ATOM 0 HA ASP A 73 -13.086 -8.083 2.072 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -13.960 -6.881 -0.600 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -14.007 -8.594 -0.231 1.00 0.00 H new ATOM 1109 N ILE A 74 -11.424 -9.055 0.236 1.00 0.00 N ATOM 1110 CA ILE A 74 -10.244 -9.567 -0.466 1.00 0.00 C ATOM 1111 C ILE A 74 -10.641 -9.782 -1.929 1.00 0.00 C ATOM 1112 O ILE A 74 -11.395 -10.720 -2.242 1.00 0.00 O ATOM 1113 CB ILE A 74 -9.716 -10.923 0.145 1.00 0.00 C ATOM 1114 CG1 ILE A 74 -9.603 -10.856 1.707 1.00 0.00 C ATOM 1115 CG2 ILE A 74 -8.356 -11.321 -0.493 1.00 0.00 C ATOM 1116 CD1 ILE A 74 -8.586 -9.878 2.257 1.00 0.00 C ATOM 0 H ILE A 74 -12.120 -9.772 0.441 1.00 0.00 H new ATOM 0 HA ILE A 74 -9.433 -8.845 -0.367 1.00 0.00 H new ATOM 0 HB ILE A 74 -10.448 -11.695 -0.093 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -10.582 -10.598 2.112 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -9.357 -11.852 2.077 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -8.010 -12.258 -0.057 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -8.481 -11.445 -1.569 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -7.621 -10.539 -0.301 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -8.595 -9.917 3.346 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -7.593 -10.142 1.893 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -8.836 -8.869 1.928 1.00 0.00 H new ATOM 1128 N LEU A 75 -10.153 -8.895 -2.814 1.00 0.00 N ATOM 1129 CA LEU A 75 -10.515 -8.910 -4.236 1.00 0.00 C ATOM 1130 C LEU A 75 -9.747 -10.023 -4.968 1.00 0.00 C ATOM 1131 O LEU A 75 -10.325 -10.698 -5.825 1.00 0.00 O ATOM 1132 CB LEU A 75 -10.251 -7.526 -4.880 1.00 0.00 C ATOM 1133 CG LEU A 75 -11.049 -6.328 -4.276 1.00 0.00 C ATOM 1134 CD1 LEU A 75 -10.727 -5.013 -5.017 1.00 0.00 C ATOM 1135 CD2 LEU A 75 -12.569 -6.606 -4.257 1.00 0.00 C ATOM 0 H LEU A 75 -9.500 -8.153 -2.562 1.00 0.00 H new ATOM 0 HA LEU A 75 -11.581 -9.119 -4.326 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -9.187 -7.306 -4.798 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -10.482 -7.592 -5.943 1.00 0.00 H new ATOM 0 HG LEU A 75 -10.729 -6.213 -3.240 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -11.298 -4.197 -4.574 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -9.662 -4.799 -4.932 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -10.994 -5.113 -6.069 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -13.090 -5.749 -3.830 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -12.921 -6.774 -5.275 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -12.770 -7.491 -3.653 1.00 0.00 H new ATOM 1147 N ARG A 76 -8.438 -10.186 -4.626 1.00 0.00 N ATOM 1148 CA ARG A 76 -7.623 -11.348 -5.047 1.00 0.00 C ATOM 1149 C ARG A 76 -6.216 -11.307 -4.422 1.00 0.00 C ATOM 1150 O ARG A 76 -5.419 -10.422 -4.736 1.00 0.00 O ATOM 1151 CB ARG A 76 -7.523 -11.477 -6.595 1.00 0.00 C ATOM 1152 CG ARG A 76 -6.871 -12.792 -7.084 1.00 0.00 C ATOM 1153 CD ARG A 76 -7.114 -13.056 -8.575 1.00 0.00 C ATOM 1154 NE ARG A 76 -8.549 -13.247 -8.867 1.00 0.00 N ATOM 1155 CZ ARG A 76 -9.089 -13.371 -10.088 1.00 0.00 C ATOM 1156 NH1 ARG A 76 -8.342 -13.279 -11.180 1.00 0.00 N ATOM 1157 NH2 ARG A 76 -10.390 -13.585 -10.208 1.00 0.00 N ATOM 0 H ARG A 76 -7.926 -9.515 -4.053 1.00 0.00 H new ATOM 0 HA ARG A 76 -8.142 -12.233 -4.678 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -8.524 -11.402 -7.019 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -6.949 -10.635 -6.982 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -5.798 -12.752 -6.897 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -7.265 -13.626 -6.503 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -6.731 -12.220 -9.160 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -6.558 -13.942 -8.883 1.00 0.00 H new ATOM 0 HE ARG A 76 -9.185 -13.288 -8.070 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -7.339 -13.111 -11.099 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -8.770 -13.376 -12.101 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -10.974 -13.654 -9.375 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -10.808 -13.680 -11.134 1.00 0.00 H new ATOM 1171 N CYS A 77 -5.919 -12.279 -3.540 1.00 0.00 N ATOM 1172 CA CYS A 77 -4.582 -12.460 -2.948 1.00 0.00 C ATOM 1173 C CYS A 77 -3.905 -13.708 -3.570 1.00 0.00 C ATOM 1174 O CYS A 77 -4.258 -14.849 -3.250 1.00 0.00 O ATOM 1175 CB CYS A 77 -4.699 -12.586 -1.406 1.00 0.00 C ATOM 1176 SG CYS A 77 -5.869 -13.851 -0.864 1.00 0.00 S ATOM 0 H CYS A 77 -6.603 -12.963 -3.217 1.00 0.00 H new ATOM 0 HA CYS A 77 -3.961 -11.591 -3.165 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -3.716 -12.813 -0.994 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -5.002 -11.623 -0.994 1.00 0.00 H new ATOM 0 HG CYS A 77 -5.726 -14.916 -1.595 1.00 0.00 H new ATOM 1182 N GLU A 78 -2.956 -13.462 -4.491 1.00 0.00 N ATOM 1183 CA GLU A 78 -2.162 -14.500 -5.175 1.00 0.00 C ATOM 1184 C GLU A 78 -0.731 -14.530 -4.584 1.00 0.00 C ATOM 1185 O GLU A 78 0.012 -13.560 -4.756 1.00 0.00 O ATOM 1186 CB GLU A 78 -2.100 -14.211 -6.702 1.00 0.00 C ATOM 1187 CG GLU A 78 -3.469 -14.185 -7.398 1.00 0.00 C ATOM 1188 CD GLU A 78 -3.377 -13.926 -8.914 1.00 0.00 C ATOM 1189 OE1 GLU A 78 -3.206 -12.763 -9.326 1.00 0.00 O ATOM 1190 OE2 GLU A 78 -3.484 -14.885 -9.707 1.00 0.00 O ATOM 0 H GLU A 78 -2.714 -12.516 -4.787 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.636 -15.470 -5.023 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -1.608 -13.251 -6.858 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.478 -14.969 -7.178 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -3.973 -15.137 -7.229 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -4.087 -13.412 -6.941 1.00 0.00 H new ATOM 1197 N PRO A 79 -0.330 -15.628 -3.860 1.00 0.00 N ATOM 1198 CA PRO A 79 1.033 -15.769 -3.302 1.00 0.00 C ATOM 1199 C PRO A 79 2.067 -16.232 -4.370 1.00 0.00 C ATOM 1200 O PRO A 79 1.831 -17.245 -5.036 1.00 0.00 O ATOM 1201 CB PRO A 79 0.856 -16.845 -2.178 1.00 0.00 C ATOM 1202 CG PRO A 79 -0.618 -17.176 -2.142 1.00 0.00 C ATOM 1203 CD PRO A 79 -1.163 -16.796 -3.497 1.00 0.00 C ATOM 0 HA PRO A 79 1.427 -14.822 -2.934 1.00 0.00 H new ATOM 0 HB2 PRO A 79 1.450 -17.734 -2.392 1.00 0.00 H new ATOM 0 HB3 PRO A 79 1.193 -16.461 -1.215 1.00 0.00 H new ATOM 0 HG2 PRO A 79 -0.775 -18.236 -1.942 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -1.123 -16.623 -1.349 1.00 0.00 H new ATOM 0 HD2 PRO A 79 -1.061 -17.607 -4.218 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -2.222 -16.541 -3.452 1.00 0.00 H new ATOM 1211 N PRO A 80 3.221 -15.513 -4.580 1.00 0.00 N ATOM 1212 CA PRO A 80 3.539 -14.188 -3.999 1.00 0.00 C ATOM 1213 C PRO A 80 3.380 -13.032 -5.021 1.00 0.00 C ATOM 1214 O PRO A 80 4.000 -11.970 -4.874 1.00 0.00 O ATOM 1215 CB PRO A 80 5.017 -14.408 -3.623 1.00 0.00 C ATOM 1216 CG PRO A 80 5.569 -15.223 -4.774 1.00 0.00 C ATOM 1217 CD PRO A 80 4.387 -16.001 -5.362 1.00 0.00 C ATOM 0 HA PRO A 80 2.886 -13.891 -3.178 1.00 0.00 H new ATOM 0 HB2 PRO A 80 5.546 -13.462 -3.514 1.00 0.00 H new ATOM 0 HB3 PRO A 80 5.113 -14.938 -2.676 1.00 0.00 H new ATOM 0 HG2 PRO A 80 6.020 -14.576 -5.526 1.00 0.00 H new ATOM 0 HG3 PRO A 80 6.348 -15.903 -4.429 1.00 0.00 H new ATOM 0 HD2 PRO A 80 4.267 -15.802 -6.427 1.00 0.00 H new ATOM 0 HD3 PRO A 80 4.521 -17.077 -5.252 1.00 0.00 H new ATOM 1225 N ARG A 81 2.524 -13.269 -6.035 1.00 0.00 N ATOM 1226 CA ARG A 81 2.356 -12.381 -7.203 1.00 0.00 C ATOM 1227 C ARG A 81 1.863 -10.977 -6.796 1.00 0.00 C ATOM 1228 O ARG A 81 2.596 -9.979 -6.913 1.00 0.00 O ATOM 1229 CB ARG A 81 1.374 -13.038 -8.214 1.00 0.00 C ATOM 1230 CG ARG A 81 1.066 -12.190 -9.469 1.00 0.00 C ATOM 1231 CD ARG A 81 0.068 -12.877 -10.415 1.00 0.00 C ATOM 1232 NE ARG A 81 0.613 -14.107 -11.028 1.00 0.00 N ATOM 1233 CZ ARG A 81 -0.104 -15.015 -11.709 1.00 0.00 C ATOM 1234 NH1 ARG A 81 -1.429 -14.948 -11.756 1.00 0.00 N ATOM 1235 NH2 ARG A 81 0.518 -16.013 -12.321 1.00 0.00 N ATOM 0 H ARG A 81 1.923 -14.092 -6.066 1.00 0.00 H new ATOM 0 HA ARG A 81 3.330 -12.249 -7.674 1.00 0.00 H new ATOM 0 HB2 ARG A 81 1.790 -13.994 -8.533 1.00 0.00 H new ATOM 0 HB3 ARG A 81 0.437 -13.253 -7.700 1.00 0.00 H new ATOM 0 HG2 ARG A 81 0.664 -11.225 -9.161 1.00 0.00 H new ATOM 0 HG3 ARG A 81 1.994 -11.992 -10.006 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -0.839 -13.123 -9.863 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -0.218 -12.180 -11.203 1.00 0.00 H new ATOM 0 HE ARG A 81 1.613 -14.279 -10.925 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -1.919 -14.197 -11.270 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -1.957 -15.647 -12.279 1.00 0.00 H new ATOM 0 HH21 ARG A 81 1.534 -16.087 -12.272 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -0.020 -16.707 -12.840 1.00 0.00 H new ATOM 1249 N ARG A 82 0.618 -10.930 -6.309 1.00 0.00 N ATOM 1250 CA ARG A 82 -0.047 -9.677 -5.937 1.00 0.00 C ATOM 1251 C ARG A 82 -1.084 -9.935 -4.846 1.00 0.00 C ATOM 1252 O ARG A 82 -1.558 -11.049 -4.668 1.00 0.00 O ATOM 1253 CB ARG A 82 -0.746 -9.004 -7.159 1.00 0.00 C ATOM 1254 CG ARG A 82 -1.875 -9.844 -7.805 1.00 0.00 C ATOM 1255 CD ARG A 82 -2.728 -9.036 -8.793 1.00 0.00 C ATOM 1256 NE ARG A 82 -3.757 -9.879 -9.447 1.00 0.00 N ATOM 1257 CZ ARG A 82 -5.072 -9.617 -9.516 1.00 0.00 C ATOM 1258 NH1 ARG A 82 -5.597 -8.544 -8.938 1.00 0.00 N ATOM 1259 NH2 ARG A 82 -5.867 -10.448 -10.171 1.00 0.00 N ATOM 0 H ARG A 82 0.043 -11.760 -6.162 1.00 0.00 H new ATOM 0 HA ARG A 82 0.723 -9.000 -5.568 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -1.161 -8.047 -6.841 1.00 0.00 H new ATOM 0 HB3 ARG A 82 0.007 -8.789 -7.917 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -1.436 -10.696 -8.324 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -2.517 -10.245 -7.021 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -3.212 -8.213 -8.267 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -2.084 -8.594 -9.553 1.00 0.00 H new ATOM 0 HE ARG A 82 -3.435 -10.741 -9.887 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -4.998 -7.896 -8.427 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -6.599 -8.368 -9.005 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -5.479 -11.279 -10.618 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -6.867 -10.258 -10.229 1.00 0.00 H new ATOM 1273 N LEU A 83 -1.399 -8.886 -4.113 1.00 0.00 N ATOM 1274 CA LEU A 83 -2.519 -8.842 -3.177 1.00 0.00 C ATOM 1275 C LEU A 83 -3.444 -7.717 -3.652 1.00 0.00 C ATOM 1276 O LEU A 83 -2.967 -6.669 -4.063 1.00 0.00 O ATOM 1277 CB LEU A 83 -1.977 -8.626 -1.728 1.00 0.00 C ATOM 1278 CG LEU A 83 -3.008 -8.744 -0.542 1.00 0.00 C ATOM 1279 CD1 LEU A 83 -2.315 -9.239 0.752 1.00 0.00 C ATOM 1280 CD2 LEU A 83 -3.736 -7.399 -0.284 1.00 0.00 C ATOM 0 H LEU A 83 -0.872 -8.013 -4.149 1.00 0.00 H new ATOM 0 HA LEU A 83 -3.083 -9.774 -3.151 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -1.181 -9.350 -1.555 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -1.523 -7.636 -1.682 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.756 -9.480 -0.837 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -3.050 -9.311 1.554 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -1.873 -10.220 0.576 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -1.534 -8.535 1.038 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -4.439 -7.518 0.540 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -3.004 -6.632 -0.029 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -4.277 -7.100 -1.182 1.00 0.00 H new ATOM 1292 N THR A 84 -4.755 -7.945 -3.620 1.00 0.00 N ATOM 1293 CA THR A 84 -5.754 -6.942 -4.018 1.00 0.00 C ATOM 1294 C THR A 84 -6.892 -6.980 -3.001 1.00 0.00 C ATOM 1295 O THR A 84 -7.406 -8.058 -2.684 1.00 0.00 O ATOM 1296 CB THR A 84 -6.310 -7.201 -5.465 1.00 0.00 C ATOM 1297 OG1 THR A 84 -5.219 -7.530 -6.339 1.00 0.00 O ATOM 1298 CG2 THR A 84 -7.066 -5.966 -6.032 1.00 0.00 C ATOM 0 H THR A 84 -5.161 -8.831 -3.318 1.00 0.00 H new ATOM 0 HA THR A 84 -5.281 -5.960 -4.036 1.00 0.00 H new ATOM 0 HB THR A 84 -7.019 -8.026 -5.406 1.00 0.00 H new ATOM 0 HG1 THR A 84 -5.023 -6.765 -6.920 1.00 0.00 H new ATOM 0 HG21 THR A 84 -7.432 -6.192 -7.034 1.00 0.00 H new ATOM 0 HG22 THR A 84 -7.908 -5.726 -5.383 1.00 0.00 H new ATOM 0 HG23 THR A 84 -6.388 -5.114 -6.077 1.00 0.00 H new ATOM 1306 N ILE A 85 -7.261 -5.806 -2.494 1.00 0.00 N ATOM 1307 CA ILE A 85 -8.289 -5.638 -1.456 1.00 0.00 C ATOM 1308 C ILE A 85 -9.075 -4.351 -1.713 1.00 0.00 C ATOM 1309 O ILE A 85 -8.531 -3.376 -2.242 1.00 0.00 O ATOM 1310 CB ILE A 85 -7.671 -5.596 0.003 1.00 0.00 C ATOM 1311 CG1 ILE A 85 -6.468 -4.597 0.073 1.00 0.00 C ATOM 1312 CG2 ILE A 85 -7.274 -7.005 0.500 1.00 0.00 C ATOM 1313 CD1 ILE A 85 -5.820 -4.447 1.443 1.00 0.00 C ATOM 0 H ILE A 85 -6.848 -4.923 -2.796 1.00 0.00 H new ATOM 0 HA ILE A 85 -8.950 -6.503 -1.510 1.00 0.00 H new ATOM 0 HB ILE A 85 -8.445 -5.231 0.678 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -5.707 -4.922 -0.636 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -6.813 -3.617 -0.256 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -6.855 -6.932 1.503 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -8.156 -7.645 0.521 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -6.531 -7.432 -0.173 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -4.999 -3.733 1.381 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -6.560 -4.088 2.158 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -5.437 -5.413 1.772 1.00 0.00 H new ATOM 1325 N SER A 86 -10.369 -4.363 -1.370 1.00 0.00 N ATOM 1326 CA SER A 86 -11.204 -3.162 -1.377 1.00 0.00 C ATOM 1327 C SER A 86 -11.110 -2.543 0.021 1.00 0.00 C ATOM 1328 O SER A 86 -11.236 -3.258 1.014 1.00 0.00 O ATOM 1329 CB SER A 86 -12.655 -3.539 -1.730 1.00 0.00 C ATOM 1330 OG SER A 86 -13.125 -4.598 -0.913 1.00 0.00 O ATOM 0 H SER A 86 -10.864 -5.207 -1.080 1.00 0.00 H new ATOM 0 HA SER A 86 -10.867 -2.443 -2.124 1.00 0.00 H new ATOM 0 HB2 SER A 86 -13.299 -2.668 -1.607 1.00 0.00 H new ATOM 0 HB3 SER A 86 -12.712 -3.833 -2.778 1.00 0.00 H new ATOM 0 HG SER A 86 -14.090 -4.709 -1.044 1.00 0.00 H new ATOM 1336 N TRP A 87 -10.887 -1.230 0.112 1.00 0.00 N ATOM 1337 CA TRP A 87 -10.591 -0.520 1.363 1.00 0.00 C ATOM 1338 C TRP A 87 -11.665 0.553 1.539 1.00 0.00 C ATOM 1339 O TRP A 87 -11.691 1.547 0.800 1.00 0.00 O ATOM 1340 CB TRP A 87 -9.167 0.102 1.239 1.00 0.00 C ATOM 1341 CG TRP A 87 -8.693 1.018 2.363 1.00 0.00 C ATOM 1342 CD1 TRP A 87 -8.973 2.348 2.520 1.00 0.00 C ATOM 1343 CD2 TRP A 87 -7.809 0.679 3.439 1.00 0.00 C ATOM 1344 NE1 TRP A 87 -8.327 2.850 3.616 1.00 0.00 N ATOM 1345 CE2 TRP A 87 -7.603 1.849 4.198 1.00 0.00 C ATOM 1346 CE3 TRP A 87 -7.180 -0.496 3.832 1.00 0.00 C ATOM 1347 CZ2 TRP A 87 -6.791 1.872 5.331 1.00 0.00 C ATOM 1348 CZ3 TRP A 87 -6.372 -0.479 4.956 1.00 0.00 C ATOM 1349 CH2 TRP A 87 -6.181 0.703 5.693 1.00 0.00 C ATOM 0 H TRP A 87 -10.907 -0.614 -0.701 1.00 0.00 H new ATOM 0 HA TRP A 87 -10.601 -1.178 2.232 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -8.451 -0.715 1.148 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -9.127 0.666 0.307 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -9.615 2.922 1.869 1.00 0.00 H new ATOM 0 HE1 TRP A 87 -8.378 3.814 3.945 1.00 0.00 H new ATOM 0 HE3 TRP A 87 -7.319 -1.408 3.270 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 -6.649 2.778 5.901 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -5.881 -1.388 5.272 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -5.540 0.687 6.562 1.00 0.00 H new ATOM 1360 N VAL A 88 -12.607 0.298 2.450 1.00 0.00 N ATOM 1361 CA VAL A 88 -13.570 1.308 2.881 1.00 0.00 C ATOM 1362 C VAL A 88 -13.106 1.807 4.247 1.00 0.00 C ATOM 1363 O VAL A 88 -13.232 1.094 5.254 1.00 0.00 O ATOM 1364 CB VAL A 88 -15.041 0.748 2.971 1.00 0.00 C ATOM 1365 CG1 VAL A 88 -16.050 1.885 3.302 1.00 0.00 C ATOM 1366 CG2 VAL A 88 -15.435 0.016 1.666 1.00 0.00 C ATOM 0 H VAL A 88 -12.722 -0.608 2.905 1.00 0.00 H new ATOM 0 HA VAL A 88 -13.604 2.113 2.147 1.00 0.00 H new ATOM 0 HB VAL A 88 -15.076 0.023 3.784 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -17.057 1.472 3.358 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -15.789 2.336 4.259 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -16.012 2.644 2.521 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -16.454 -0.361 1.754 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -15.376 0.710 0.827 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -14.753 -0.817 1.496 1.00 0.00 H new ATOM 1376 N TYR A 89 -12.502 3.001 4.256 1.00 0.00 N ATOM 1377 CA TYR A 89 -12.085 3.679 5.490 1.00 0.00 C ATOM 1378 C TYR A 89 -13.336 4.294 6.135 1.00 0.00 C ATOM 1379 O TYR A 89 -14.268 4.687 5.423 1.00 0.00 O ATOM 1380 CB TYR A 89 -11.002 4.738 5.152 1.00 0.00 C ATOM 1381 CG TYR A 89 -10.259 5.355 6.350 1.00 0.00 C ATOM 1382 CD1 TYR A 89 -10.735 6.496 6.989 1.00 0.00 C ATOM 1383 CD2 TYR A 89 -9.054 4.815 6.812 1.00 0.00 C ATOM 1384 CE1 TYR A 89 -10.059 7.076 8.034 1.00 0.00 C ATOM 1385 CE2 TYR A 89 -8.367 5.396 7.860 1.00 0.00 C ATOM 1386 CZ TYR A 89 -8.870 6.528 8.467 1.00 0.00 C ATOM 1387 OH TYR A 89 -8.191 7.108 9.514 1.00 0.00 O ATOM 0 H TYR A 89 -12.288 3.525 3.408 1.00 0.00 H new ATOM 0 HA TYR A 89 -11.638 2.986 6.202 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -10.266 4.277 4.493 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -11.474 5.544 4.590 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -11.662 6.938 6.654 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -8.654 3.929 6.341 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -10.457 7.958 8.515 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -7.438 4.965 8.203 1.00 0.00 H new ATOM 0 HH TYR A 89 -7.714 6.416 10.018 1.00 0.00 H new ATOM 1397 N GLU A 90 -13.362 4.345 7.473 1.00 0.00 N ATOM 1398 CA GLU A 90 -14.549 4.759 8.247 1.00 0.00 C ATOM 1399 C GLU A 90 -14.955 6.215 7.929 1.00 0.00 C ATOM 1400 O GLU A 90 -14.194 7.150 8.200 1.00 0.00 O ATOM 1401 CB GLU A 90 -14.273 4.572 9.753 1.00 0.00 C ATOM 1402 CG GLU A 90 -14.011 3.111 10.150 1.00 0.00 C ATOM 1403 CD GLU A 90 -13.675 2.920 11.631 1.00 0.00 C ATOM 1404 OE1 GLU A 90 -14.568 3.106 12.481 1.00 0.00 O ATOM 1405 OE2 GLU A 90 -12.533 2.559 11.957 1.00 0.00 O ATOM 0 H GLU A 90 -12.561 4.101 8.055 1.00 0.00 H new ATOM 0 HA GLU A 90 -15.390 4.128 7.960 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -13.411 5.177 10.034 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -15.125 4.947 10.320 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -14.891 2.516 9.908 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -13.189 2.723 9.548 1.00 0.00 H new ATOM 1412 N GLY A 91 -16.141 6.360 7.303 1.00 0.00 N ATOM 1413 CA GLY A 91 -16.702 7.656 6.918 1.00 0.00 C ATOM 1414 C GLY A 91 -16.175 8.171 5.575 1.00 0.00 C ATOM 1415 O GLY A 91 -16.473 9.296 5.172 1.00 0.00 O ATOM 0 H GLY A 91 -16.735 5.570 7.052 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -17.788 7.573 6.866 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -16.475 8.387 7.694 1.00 0.00 H new ATOM 1419 N LYS A 92 -15.399 7.329 4.875 1.00 0.00 N ATOM 1420 CA LYS A 92 -14.666 7.693 3.641 1.00 0.00 C ATOM 1421 C LYS A 92 -15.040 6.695 2.513 1.00 0.00 C ATOM 1422 O LYS A 92 -15.460 5.569 2.816 1.00 0.00 O ATOM 1423 CB LYS A 92 -13.136 7.679 3.942 1.00 0.00 C ATOM 1424 CG LYS A 92 -12.712 8.597 5.117 1.00 0.00 C ATOM 1425 CD LYS A 92 -12.890 10.100 4.828 1.00 0.00 C ATOM 1426 CE LYS A 92 -11.780 10.661 3.923 1.00 0.00 C ATOM 1427 NZ LYS A 92 -10.477 10.722 4.621 1.00 0.00 N ATOM 0 H LYS A 92 -15.257 6.357 5.151 1.00 0.00 H new ATOM 0 HA LYS A 92 -14.939 8.694 3.307 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -12.830 6.657 4.165 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -12.598 7.984 3.045 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -13.296 8.335 5.999 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -11.666 8.404 5.357 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -13.858 10.263 4.354 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -12.899 10.649 5.769 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -11.687 10.037 3.034 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -12.058 11.659 3.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -9.994 11.610 4.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -10.632 10.683 5.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -9.888 9.916 4.328 1.00 0.00 H new ATOM 1441 N PRO A 93 -14.923 7.090 1.197 1.00 0.00 N ATOM 1442 CA PRO A 93 -15.376 6.238 0.057 1.00 0.00 C ATOM 1443 C PRO A 93 -14.505 4.974 -0.180 1.00 0.00 C ATOM 1444 O PRO A 93 -13.510 4.724 0.518 1.00 0.00 O ATOM 1445 CB PRO A 93 -15.319 7.214 -1.150 1.00 0.00 C ATOM 1446 CG PRO A 93 -14.245 8.193 -0.788 1.00 0.00 C ATOM 1447 CD PRO A 93 -14.361 8.389 0.710 1.00 0.00 C ATOM 0 HA PRO A 93 -16.364 5.816 0.240 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -15.082 6.688 -2.075 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -16.276 7.713 -1.303 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -13.260 7.812 -1.058 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -14.379 9.136 -1.318 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -13.392 8.600 1.162 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -15.016 9.225 0.955 1.00 0.00 H new ATOM 1455 N ASP A 94 -14.922 4.195 -1.196 1.00 0.00 N ATOM 1456 CA ASP A 94 -14.306 2.903 -1.561 1.00 0.00 C ATOM 1457 C ASP A 94 -12.966 3.108 -2.268 1.00 0.00 C ATOM 1458 O ASP A 94 -12.767 4.119 -2.959 1.00 0.00 O ATOM 1459 CB ASP A 94 -15.247 2.105 -2.500 1.00 0.00 C ATOM 1460 CG ASP A 94 -16.619 1.821 -1.879 1.00 0.00 C ATOM 1461 OD1 ASP A 94 -17.478 2.731 -1.858 1.00 0.00 O ATOM 1462 OD2 ASP A 94 -16.851 0.691 -1.403 1.00 0.00 O ATOM 0 H ASP A 94 -15.707 4.448 -1.796 1.00 0.00 H new ATOM 0 HA ASP A 94 -14.140 2.347 -0.638 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -15.383 2.662 -3.427 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -14.772 1.160 -2.763 1.00 0.00 H new ATOM 1467 N SER A 95 -12.063 2.133 -2.094 1.00 0.00 N ATOM 1468 CA SER A 95 -10.737 2.138 -2.725 1.00 0.00 C ATOM 1469 C SER A 95 -10.348 0.726 -3.200 1.00 0.00 C ATOM 1470 O SER A 95 -10.869 -0.263 -2.688 1.00 0.00 O ATOM 1471 CB SER A 95 -9.694 2.645 -1.712 1.00 0.00 C ATOM 1472 OG SER A 95 -10.075 3.887 -1.139 1.00 0.00 O ATOM 0 H SER A 95 -12.233 1.315 -1.509 1.00 0.00 H new ATOM 0 HA SER A 95 -10.767 2.797 -3.593 1.00 0.00 H new ATOM 0 HB2 SER A 95 -9.565 1.905 -0.922 1.00 0.00 H new ATOM 0 HB3 SER A 95 -8.729 2.754 -2.208 1.00 0.00 H new ATOM 0 HG SER A 95 -9.273 4.389 -0.883 1.00 0.00 H new ATOM 1478 N GLU A 96 -9.432 0.643 -4.184 1.00 0.00 N ATOM 1479 CA GLU A 96 -8.727 -0.606 -4.531 1.00 0.00 C ATOM 1480 C GLU A 96 -7.249 -0.460 -4.162 1.00 0.00 C ATOM 1481 O GLU A 96 -6.509 0.291 -4.808 1.00 0.00 O ATOM 1482 CB GLU A 96 -8.854 -0.966 -6.041 1.00 0.00 C ATOM 1483 CG GLU A 96 -10.221 -1.523 -6.467 1.00 0.00 C ATOM 1484 CD GLU A 96 -10.178 -2.103 -7.887 1.00 0.00 C ATOM 1485 OE1 GLU A 96 -9.656 -3.221 -8.056 1.00 0.00 O ATOM 1486 OE2 GLU A 96 -10.611 -1.436 -8.843 1.00 0.00 O ATOM 0 H GLU A 96 -9.160 1.439 -4.760 1.00 0.00 H new ATOM 0 HA GLU A 96 -9.191 -1.416 -3.969 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -8.644 -0.073 -6.630 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -8.087 -1.700 -6.289 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -10.533 -2.298 -5.766 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -10.968 -0.731 -6.420 1.00 0.00 H new ATOM 1493 N VAL A 97 -6.832 -1.170 -3.110 1.00 0.00 N ATOM 1494 CA VAL A 97 -5.426 -1.276 -2.727 1.00 0.00 C ATOM 1495 C VAL A 97 -4.850 -2.550 -3.366 1.00 0.00 C ATOM 1496 O VAL A 97 -5.334 -3.652 -3.098 1.00 0.00 O ATOM 1497 CB VAL A 97 -5.222 -1.306 -1.161 1.00 0.00 C ATOM 1498 CG1 VAL A 97 -3.712 -1.363 -0.774 1.00 0.00 C ATOM 1499 CG2 VAL A 97 -5.921 -0.104 -0.488 1.00 0.00 C ATOM 0 H VAL A 97 -7.464 -1.688 -2.500 1.00 0.00 H new ATOM 0 HA VAL A 97 -4.902 -0.390 -3.085 1.00 0.00 H new ATOM 0 HB VAL A 97 -5.686 -2.220 -0.791 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -3.615 -1.382 0.312 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -3.262 -2.262 -1.194 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -3.202 -0.484 -1.168 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -5.765 -0.149 0.590 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -5.503 0.824 -0.877 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -6.989 -0.138 -0.702 1.00 0.00 H new ATOM 1509 N GLU A 98 -3.823 -2.391 -4.221 1.00 0.00 N ATOM 1510 CA GLU A 98 -3.148 -3.546 -4.838 1.00 0.00 C ATOM 1511 C GLU A 98 -1.647 -3.503 -4.550 1.00 0.00 C ATOM 1512 O GLU A 98 -0.937 -2.595 -4.979 1.00 0.00 O ATOM 1513 CB GLU A 98 -3.440 -3.641 -6.367 1.00 0.00 C ATOM 1514 CG GLU A 98 -2.861 -4.919 -7.029 1.00 0.00 C ATOM 1515 CD GLU A 98 -3.431 -5.227 -8.429 1.00 0.00 C ATOM 1516 OE1 GLU A 98 -4.521 -5.816 -8.514 1.00 0.00 O ATOM 1517 OE2 GLU A 98 -2.793 -4.897 -9.444 1.00 0.00 O ATOM 0 H GLU A 98 -3.446 -1.484 -4.498 1.00 0.00 H new ATOM 0 HA GLU A 98 -3.554 -4.452 -4.388 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -4.518 -3.616 -6.525 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -3.025 -2.764 -6.863 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -1.779 -4.815 -7.106 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -3.054 -5.770 -6.376 1.00 0.00 H new ATOM 1524 N LEU A 99 -1.198 -4.512 -3.810 1.00 0.00 N ATOM 1525 CA LEU A 99 0.202 -4.754 -3.477 1.00 0.00 C ATOM 1526 C LEU A 99 0.770 -5.650 -4.598 1.00 0.00 C ATOM 1527 O LEU A 99 0.102 -6.582 -5.019 1.00 0.00 O ATOM 1528 CB LEU A 99 0.241 -5.462 -2.077 1.00 0.00 C ATOM 1529 CG LEU A 99 1.548 -5.367 -1.227 1.00 0.00 C ATOM 1530 CD1 LEU A 99 2.741 -6.101 -1.870 1.00 0.00 C ATOM 1531 CD2 LEU A 99 1.888 -3.899 -0.907 1.00 0.00 C ATOM 0 H LEU A 99 -1.824 -5.211 -3.410 1.00 0.00 H new ATOM 0 HA LEU A 99 0.798 -3.844 -3.411 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -0.574 -5.056 -1.478 1.00 0.00 H new ATOM 0 HB3 LEU A 99 0.025 -6.519 -2.234 1.00 0.00 H new ATOM 0 HG LEU A 99 1.351 -5.885 -0.288 1.00 0.00 H new ATOM 0 HD11 LEU A 99 3.618 -5.998 -1.232 1.00 0.00 H new ATOM 0 HD12 LEU A 99 2.499 -7.157 -1.986 1.00 0.00 H new ATOM 0 HD13 LEU A 99 2.951 -5.667 -2.848 1.00 0.00 H new ATOM 0 HD21 LEU A 99 2.802 -3.858 -0.314 1.00 0.00 H new ATOM 0 HD22 LEU A 99 2.033 -3.348 -1.836 1.00 0.00 H new ATOM 0 HD23 LEU A 99 1.070 -3.451 -0.344 1.00 0.00 H new ATOM 1543 N ARG A 100 1.979 -5.354 -5.091 1.00 0.00 N ATOM 1544 CA ARG A 100 2.604 -6.103 -6.208 1.00 0.00 C ATOM 1545 C ARG A 100 4.072 -6.375 -5.853 1.00 0.00 C ATOM 1546 O ARG A 100 4.782 -5.451 -5.452 1.00 0.00 O ATOM 1547 CB ARG A 100 2.538 -5.290 -7.536 1.00 0.00 C ATOM 1548 CG ARG A 100 1.130 -4.825 -7.953 1.00 0.00 C ATOM 1549 CD ARG A 100 1.149 -3.957 -9.220 1.00 0.00 C ATOM 1550 NE ARG A 100 -0.212 -3.539 -9.595 1.00 0.00 N ATOM 1551 CZ ARG A 100 -0.662 -2.279 -9.663 1.00 0.00 C ATOM 1552 NH1 ARG A 100 0.149 -1.244 -9.451 1.00 0.00 N ATOM 1553 NH2 ARG A 100 -1.936 -2.068 -9.955 1.00 0.00 N ATOM 0 H ARG A 100 2.556 -4.593 -4.734 1.00 0.00 H new ATOM 0 HA ARG A 100 2.062 -7.037 -6.354 1.00 0.00 H new ATOM 0 HB2 ARG A 100 3.178 -4.413 -7.438 1.00 0.00 H new ATOM 0 HB3 ARG A 100 2.954 -5.901 -8.338 1.00 0.00 H new ATOM 0 HG2 ARG A 100 0.498 -5.697 -8.123 1.00 0.00 H new ATOM 0 HG3 ARG A 100 0.681 -4.260 -7.136 1.00 0.00 H new ATOM 0 HD2 ARG A 100 1.770 -3.077 -9.053 1.00 0.00 H new ATOM 0 HD3 ARG A 100 1.601 -4.515 -10.040 1.00 0.00 H new ATOM 0 HE ARG A 100 -0.875 -4.279 -9.825 1.00 0.00 H new ATOM 0 HH11 ARG A 100 1.132 -1.403 -9.232 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -0.213 -0.292 -9.507 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -2.558 -2.858 -10.124 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -2.295 -1.115 -10.011 1.00 0.00 H new ATOM 1567 N LEU A 101 4.515 -7.638 -5.983 1.00 0.00 N ATOM 1568 CA LEU A 101 5.923 -8.022 -5.756 1.00 0.00 C ATOM 1569 C LEU A 101 6.547 -8.552 -7.050 1.00 0.00 C ATOM 1570 O LEU A 101 5.849 -9.147 -7.877 1.00 0.00 O ATOM 1571 CB LEU A 101 6.041 -9.080 -4.630 1.00 0.00 C ATOM 1572 CG LEU A 101 5.539 -8.640 -3.217 1.00 0.00 C ATOM 1573 CD1 LEU A 101 5.878 -9.690 -2.153 1.00 0.00 C ATOM 1574 CD2 LEU A 101 6.097 -7.257 -2.819 1.00 0.00 C ATOM 0 H LEU A 101 3.913 -8.418 -6.247 1.00 0.00 H new ATOM 0 HA LEU A 101 6.467 -7.132 -5.441 1.00 0.00 H new ATOM 0 HB2 LEU A 101 5.482 -9.966 -4.932 1.00 0.00 H new ATOM 0 HB3 LEU A 101 7.087 -9.376 -4.546 1.00 0.00 H new ATOM 0 HG LEU A 101 4.454 -8.555 -3.274 1.00 0.00 H new ATOM 0 HD11 LEU A 101 5.515 -9.354 -1.182 1.00 0.00 H new ATOM 0 HD12 LEU A 101 5.402 -10.636 -2.411 1.00 0.00 H new ATOM 0 HD13 LEU A 101 6.958 -9.828 -2.109 1.00 0.00 H new ATOM 0 HD21 LEU A 101 5.726 -6.986 -1.831 1.00 0.00 H new ATOM 0 HD22 LEU A 101 7.186 -7.296 -2.799 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.774 -6.511 -3.545 1.00 0.00 H new ATOM 1586 N SER A 102 7.858 -8.302 -7.228 1.00 0.00 N ATOM 1587 CA SER A 102 8.645 -8.841 -8.355 1.00 0.00 C ATOM 1588 C SER A 102 10.115 -9.021 -7.948 1.00 0.00 C ATOM 1589 O SER A 102 10.742 -8.068 -7.483 1.00 0.00 O ATOM 1590 CB SER A 102 8.542 -7.887 -9.568 1.00 0.00 C ATOM 1591 OG SER A 102 9.322 -8.344 -10.662 1.00 0.00 O ATOM 0 H SER A 102 8.403 -7.719 -6.593 1.00 0.00 H new ATOM 0 HA SER A 102 8.242 -9.816 -8.630 1.00 0.00 H new ATOM 0 HB2 SER A 102 7.500 -7.800 -9.875 1.00 0.00 H new ATOM 0 HB3 SER A 102 8.873 -6.890 -9.276 1.00 0.00 H new ATOM 0 HG SER A 102 9.232 -7.719 -11.411 1.00 0.00 H new ATOM 1597 N GLU A 103 10.661 -10.247 -8.117 1.00 0.00 N ATOM 1598 CA GLU A 103 12.094 -10.523 -7.897 1.00 0.00 C ATOM 1599 C GLU A 103 12.885 -9.936 -9.065 1.00 0.00 C ATOM 1600 O GLU A 103 12.602 -10.246 -10.231 1.00 0.00 O ATOM 1601 CB GLU A 103 12.367 -12.059 -7.799 1.00 0.00 C ATOM 1602 CG GLU A 103 13.428 -12.486 -6.760 1.00 0.00 C ATOM 1603 CD GLU A 103 14.876 -12.060 -7.114 1.00 0.00 C ATOM 1604 OE1 GLU A 103 15.477 -12.685 -8.007 1.00 0.00 O ATOM 1605 OE2 GLU A 103 15.411 -11.099 -6.508 1.00 0.00 O ATOM 0 H GLU A 103 10.124 -11.064 -8.407 1.00 0.00 H new ATOM 0 HA GLU A 103 12.402 -10.068 -6.956 1.00 0.00 H new ATOM 0 HB2 GLU A 103 11.429 -12.562 -7.561 1.00 0.00 H new ATOM 0 HB3 GLU A 103 12.681 -12.417 -8.780 1.00 0.00 H new ATOM 0 HG2 GLU A 103 13.163 -12.061 -5.792 1.00 0.00 H new ATOM 0 HG3 GLU A 103 13.397 -13.570 -6.651 1.00 0.00 H new ATOM 1612 N GLU A 104 13.846 -9.080 -8.761 1.00 0.00 N ATOM 1613 CA GLU A 104 14.737 -8.474 -9.736 1.00 0.00 C ATOM 1614 C GLU A 104 16.116 -8.267 -9.094 1.00 0.00 C ATOM 1615 O GLU A 104 16.208 -7.670 -8.005 1.00 0.00 O ATOM 1616 CB GLU A 104 14.127 -7.117 -10.193 1.00 0.00 C ATOM 1617 CG GLU A 104 13.684 -6.171 -9.053 1.00 0.00 C ATOM 1618 CD GLU A 104 13.111 -4.846 -9.565 1.00 0.00 C ATOM 1619 OE1 GLU A 104 13.889 -3.895 -9.797 1.00 0.00 O ATOM 1620 OE2 GLU A 104 11.886 -4.743 -9.749 1.00 0.00 O ATOM 0 H GLU A 104 14.033 -8.780 -7.804 1.00 0.00 H new ATOM 0 HA GLU A 104 14.854 -9.119 -10.607 1.00 0.00 H new ATOM 0 HB2 GLU A 104 14.861 -6.597 -10.809 1.00 0.00 H new ATOM 0 HB3 GLU A 104 13.265 -7.321 -10.828 1.00 0.00 H new ATOM 0 HG2 GLU A 104 12.934 -6.673 -8.442 1.00 0.00 H new ATOM 0 HG3 GLU A 104 14.537 -5.966 -8.406 1.00 0.00 H new ATOM 1627 N GLY A 105 17.185 -8.789 -9.731 1.00 0.00 N ATOM 1628 CA GLY A 105 18.553 -8.488 -9.279 1.00 0.00 C ATOM 1629 C GLY A 105 18.943 -9.353 -8.100 1.00 0.00 C ATOM 1630 O GLY A 105 19.502 -10.444 -8.259 1.00 0.00 O ATOM 0 H GLY A 105 17.128 -9.406 -10.541 1.00 0.00 H new ATOM 0 HA2 GLY A 105 19.253 -8.649 -10.099 1.00 0.00 H new ATOM 0 HA3 GLY A 105 18.624 -7.436 -9.001 1.00 0.00 H new ATOM 1634 N ASP A 106 18.630 -8.830 -6.921 1.00 0.00 N ATOM 1635 CA ASP A 106 18.920 -9.446 -5.627 1.00 0.00 C ATOM 1636 C ASP A 106 17.985 -8.770 -4.612 1.00 0.00 C ATOM 1637 O ASP A 106 18.344 -8.509 -3.460 1.00 0.00 O ATOM 1638 CB ASP A 106 20.432 -9.291 -5.277 1.00 0.00 C ATOM 1639 CG ASP A 106 20.917 -10.230 -4.159 1.00 0.00 C ATOM 1640 OD1 ASP A 106 20.678 -11.453 -4.262 1.00 0.00 O ATOM 1641 OD2 ASP A 106 21.579 -9.771 -3.197 1.00 0.00 O ATOM 0 H ASP A 106 18.150 -7.934 -6.834 1.00 0.00 H new ATOM 0 HA ASP A 106 18.738 -10.521 -5.627 1.00 0.00 H new ATOM 0 HB2 ASP A 106 21.023 -9.476 -6.174 1.00 0.00 H new ATOM 0 HB3 ASP A 106 20.621 -8.260 -4.978 1.00 0.00 H new ATOM 1646 N GLY A 107 16.739 -8.546 -5.085 1.00 0.00 N ATOM 1647 CA GLY A 107 15.768 -7.767 -4.338 1.00 0.00 C ATOM 1648 C GLY A 107 14.374 -7.791 -4.950 1.00 0.00 C ATOM 1649 O GLY A 107 14.107 -8.551 -5.873 1.00 0.00 O ATOM 0 H GLY A 107 16.398 -8.899 -5.979 1.00 0.00 H new ATOM 0 HA2 GLY A 107 15.715 -8.147 -3.318 1.00 0.00 H new ATOM 0 HA3 GLY A 107 16.112 -6.735 -4.276 1.00 0.00 H new ATOM 1653 N THR A 108 13.501 -6.909 -4.462 1.00 0.00 N ATOM 1654 CA THR A 108 12.050 -6.961 -4.708 1.00 0.00 C ATOM 1655 C THR A 108 11.505 -5.561 -4.996 1.00 0.00 C ATOM 1656 O THR A 108 11.789 -4.626 -4.246 1.00 0.00 O ATOM 1657 CB THR A 108 11.291 -7.526 -3.450 1.00 0.00 C ATOM 1658 OG1 THR A 108 11.861 -8.774 -3.067 1.00 0.00 O ATOM 1659 CG2 THR A 108 9.780 -7.717 -3.688 1.00 0.00 C ATOM 0 H THR A 108 13.782 -6.124 -3.875 1.00 0.00 H new ATOM 0 HA THR A 108 11.888 -7.613 -5.566 1.00 0.00 H new ATOM 0 HB THR A 108 11.404 -6.785 -2.659 1.00 0.00 H new ATOM 0 HG1 THR A 108 12.595 -8.619 -2.436 1.00 0.00 H new ATOM 0 HG21 THR A 108 9.316 -8.109 -2.783 1.00 0.00 H new ATOM 0 HG22 THR A 108 9.328 -6.758 -3.942 1.00 0.00 H new ATOM 0 HG23 THR A 108 9.627 -8.419 -4.508 1.00 0.00 H new ATOM 1667 N LEU A 109 10.722 -5.427 -6.072 1.00 0.00 N ATOM 1668 CA LEU A 109 9.814 -4.288 -6.221 1.00 0.00 C ATOM 1669 C LEU A 109 8.558 -4.582 -5.406 1.00 0.00 C ATOM 1670 O LEU A 109 7.780 -5.465 -5.769 1.00 0.00 O ATOM 1671 CB LEU A 109 9.416 -4.012 -7.701 1.00 0.00 C ATOM 1672 CG LEU A 109 8.363 -2.861 -7.927 1.00 0.00 C ATOM 1673 CD1 LEU A 109 8.864 -1.514 -7.361 1.00 0.00 C ATOM 1674 CD2 LEU A 109 7.991 -2.727 -9.416 1.00 0.00 C ATOM 0 H LEU A 109 10.699 -6.089 -6.847 1.00 0.00 H new ATOM 0 HA LEU A 109 10.330 -3.395 -5.867 1.00 0.00 H new ATOM 0 HB2 LEU A 109 10.319 -3.767 -8.260 1.00 0.00 H new ATOM 0 HB3 LEU A 109 9.017 -4.932 -8.127 1.00 0.00 H new ATOM 0 HG LEU A 109 7.462 -3.136 -7.379 1.00 0.00 H new ATOM 0 HD11 LEU A 109 8.112 -0.744 -7.535 1.00 0.00 H new ATOM 0 HD12 LEU A 109 9.041 -1.613 -6.290 1.00 0.00 H new ATOM 0 HD13 LEU A 109 9.793 -1.233 -7.858 1.00 0.00 H new ATOM 0 HD21 LEU A 109 7.263 -1.925 -9.538 1.00 0.00 H new ATOM 0 HD22 LEU A 109 8.885 -2.497 -9.995 1.00 0.00 H new ATOM 0 HD23 LEU A 109 7.561 -3.664 -9.769 1.00 0.00 H new ATOM 1686 N LEU A 110 8.418 -3.897 -4.269 1.00 0.00 N ATOM 1687 CA LEU A 110 7.132 -3.758 -3.608 1.00 0.00 C ATOM 1688 C LEU A 110 6.482 -2.534 -4.238 1.00 0.00 C ATOM 1689 O LEU A 110 7.100 -1.464 -4.312 1.00 0.00 O ATOM 1690 CB LEU A 110 7.282 -3.616 -2.059 1.00 0.00 C ATOM 1691 CG LEU A 110 5.949 -3.693 -1.214 1.00 0.00 C ATOM 1692 CD1 LEU A 110 6.232 -4.031 0.261 1.00 0.00 C ATOM 1693 CD2 LEU A 110 5.113 -2.389 -1.303 1.00 0.00 C ATOM 0 H LEU A 110 9.188 -3.430 -3.790 1.00 0.00 H new ATOM 0 HA LEU A 110 6.516 -4.647 -3.744 1.00 0.00 H new ATOM 0 HB2 LEU A 110 7.955 -4.398 -1.708 1.00 0.00 H new ATOM 0 HB3 LEU A 110 7.765 -2.662 -1.849 1.00 0.00 H new ATOM 0 HG LEU A 110 5.361 -4.499 -1.654 1.00 0.00 H new ATOM 0 HD11 LEU A 110 5.292 -4.075 0.811 1.00 0.00 H new ATOM 0 HD12 LEU A 110 6.735 -4.996 0.323 1.00 0.00 H new ATOM 0 HD13 LEU A 110 6.870 -3.261 0.695 1.00 0.00 H new ATOM 0 HD21 LEU A 110 4.208 -2.495 -0.705 1.00 0.00 H new ATOM 0 HD22 LEU A 110 5.702 -1.553 -0.925 1.00 0.00 H new ATOM 0 HD23 LEU A 110 4.841 -2.201 -2.342 1.00 0.00 H new ATOM 1705 N GLU A 111 5.251 -2.701 -4.698 1.00 0.00 N ATOM 1706 CA GLU A 111 4.506 -1.644 -5.351 1.00 0.00 C ATOM 1707 C GLU A 111 3.077 -1.663 -4.809 1.00 0.00 C ATOM 1708 O GLU A 111 2.281 -2.540 -5.144 1.00 0.00 O ATOM 1709 CB GLU A 111 4.568 -1.854 -6.890 1.00 0.00 C ATOM 1710 CG GLU A 111 3.804 -0.809 -7.702 1.00 0.00 C ATOM 1711 CD GLU A 111 4.053 -0.913 -9.215 1.00 0.00 C ATOM 1712 OE1 GLU A 111 5.172 -0.587 -9.658 1.00 0.00 O ATOM 1713 OE2 GLU A 111 3.128 -1.295 -9.966 1.00 0.00 O ATOM 0 H GLU A 111 4.741 -3.581 -4.626 1.00 0.00 H new ATOM 0 HA GLU A 111 4.932 -0.662 -5.144 1.00 0.00 H new ATOM 0 HB2 GLU A 111 5.612 -1.848 -7.203 1.00 0.00 H new ATOM 0 HB3 GLU A 111 4.171 -2.841 -7.126 1.00 0.00 H new ATOM 0 HG2 GLU A 111 2.737 -0.918 -7.508 1.00 0.00 H new ATOM 0 HG3 GLU A 111 4.090 0.186 -7.361 1.00 0.00 H new ATOM 1720 N LEU A 112 2.779 -0.691 -3.939 1.00 0.00 N ATOM 1721 CA LEU A 112 1.453 -0.517 -3.352 1.00 0.00 C ATOM 1722 C LEU A 112 0.721 0.553 -4.163 1.00 0.00 C ATOM 1723 O LEU A 112 1.275 1.612 -4.440 1.00 0.00 O ATOM 1724 CB LEU A 112 1.578 -0.135 -1.838 1.00 0.00 C ATOM 1725 CG LEU A 112 0.243 -0.131 -0.986 1.00 0.00 C ATOM 1726 CD1 LEU A 112 0.530 -0.407 0.507 1.00 0.00 C ATOM 1727 CD2 LEU A 112 -0.542 1.200 -1.129 1.00 0.00 C ATOM 0 H LEU A 112 3.459 0.000 -3.623 1.00 0.00 H new ATOM 0 HA LEU A 112 0.881 -1.444 -3.391 1.00 0.00 H new ATOM 0 HB2 LEU A 112 2.277 -0.828 -1.370 1.00 0.00 H new ATOM 0 HB3 LEU A 112 2.024 0.858 -1.775 1.00 0.00 H new ATOM 0 HG LEU A 112 -0.377 -0.934 -1.385 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -0.406 -0.398 1.065 1.00 0.00 H new ATOM 0 HD12 LEU A 112 1.005 -1.382 0.612 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.194 0.364 0.899 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -1.449 1.154 -0.526 1.00 0.00 H new ATOM 0 HD22 LEU A 112 0.079 2.027 -0.787 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -0.808 1.355 -2.175 1.00 0.00 H new ATOM 1739 N GLU A 113 -0.516 0.259 -4.541 1.00 0.00 N ATOM 1740 CA GLU A 113 -1.390 1.173 -5.279 1.00 0.00 C ATOM 1741 C GLU A 113 -2.669 1.349 -4.456 1.00 0.00 C ATOM 1742 O GLU A 113 -3.096 0.404 -3.807 1.00 0.00 O ATOM 1743 CB GLU A 113 -1.684 0.586 -6.687 1.00 0.00 C ATOM 1744 CG GLU A 113 -2.537 1.488 -7.600 1.00 0.00 C ATOM 1745 CD GLU A 113 -2.637 0.955 -9.040 1.00 0.00 C ATOM 1746 OE1 GLU A 113 -1.670 1.128 -9.819 1.00 0.00 O ATOM 1747 OE2 GLU A 113 -3.660 0.334 -9.399 1.00 0.00 O ATOM 0 H GLU A 113 -0.953 -0.641 -4.341 1.00 0.00 H new ATOM 0 HA GLU A 113 -0.921 2.146 -5.427 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -0.736 0.382 -7.185 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -2.193 -0.370 -6.567 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -3.539 1.578 -7.180 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -2.107 2.490 -7.617 1.00 0.00 H new ATOM 1754 N HIS A 114 -3.248 2.553 -4.450 1.00 0.00 N ATOM 1755 CA HIS A 114 -4.514 2.840 -3.750 1.00 0.00 C ATOM 1756 C HIS A 114 -5.351 3.740 -4.654 1.00 0.00 C ATOM 1757 O HIS A 114 -4.982 4.892 -4.884 1.00 0.00 O ATOM 1758 CB HIS A 114 -4.251 3.518 -2.379 1.00 0.00 C ATOM 1759 CG HIS A 114 -5.493 3.801 -1.553 1.00 0.00 C ATOM 1760 ND1 HIS A 114 -5.699 3.182 -0.352 1.00 0.00 N ATOM 1761 CD2 HIS A 114 -6.515 4.680 -1.769 1.00 0.00 C ATOM 1762 CE1 HIS A 114 -6.802 3.690 0.141 1.00 0.00 C ATOM 1763 NE2 HIS A 114 -7.335 4.605 -0.680 1.00 0.00 N ATOM 0 H HIS A 114 -2.855 3.362 -4.931 1.00 0.00 H new ATOM 0 HA HIS A 114 -5.048 1.912 -3.545 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -3.584 2.881 -1.798 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -3.725 4.457 -2.550 1.00 0.00 H new ATOM 0 HD1 HIS A 114 -5.111 2.467 0.076 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -6.649 5.312 -2.634 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -7.229 3.406 1.092 1.00 0.00 H new ATOM 1771 N ALA A 115 -6.495 3.222 -5.121 1.00 0.00 N ATOM 1772 CA ALA A 115 -7.329 3.886 -6.133 1.00 0.00 C ATOM 1773 C ALA A 115 -8.700 4.257 -5.563 1.00 0.00 C ATOM 1774 O ALA A 115 -9.555 3.385 -5.387 1.00 0.00 O ATOM 1775 CB ALA A 115 -7.480 2.952 -7.327 1.00 0.00 C ATOM 0 H ALA A 115 -6.870 2.327 -4.806 1.00 0.00 H new ATOM 0 HA ALA A 115 -6.847 4.813 -6.445 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -8.097 3.431 -8.088 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -6.497 2.731 -7.743 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -7.954 2.025 -7.006 1.00 0.00 H new ATOM 1781 N THR A 116 -8.893 5.548 -5.275 1.00 0.00 N ATOM 1782 CA THR A 116 -10.191 6.091 -4.843 1.00 0.00 C ATOM 1783 C THR A 116 -10.526 7.348 -5.661 1.00 0.00 C ATOM 1784 O THR A 116 -9.647 7.964 -6.301 1.00 0.00 O ATOM 1785 CB THR A 116 -10.250 6.368 -3.295 1.00 0.00 C ATOM 1786 OG1 THR A 116 -11.549 6.869 -2.917 1.00 0.00 O ATOM 1787 CG2 THR A 116 -9.162 7.334 -2.818 1.00 0.00 C ATOM 0 H THR A 116 -8.155 6.249 -5.334 1.00 0.00 H new ATOM 0 HA THR A 116 -10.951 5.333 -5.034 1.00 0.00 H new ATOM 0 HB THR A 116 -10.068 5.411 -2.806 1.00 0.00 H new ATOM 0 HG1 THR A 116 -12.182 6.124 -2.856 1.00 0.00 H new ATOM 0 HG21 THR A 116 -9.255 7.485 -1.743 1.00 0.00 H new ATOM 0 HG22 THR A 116 -8.181 6.916 -3.042 1.00 0.00 H new ATOM 0 HG23 THR A 116 -9.274 8.290 -3.329 1.00 0.00 H new ATOM 1795 N THR A 117 -11.821 7.678 -5.698 1.00 0.00 N ATOM 1796 CA THR A 117 -12.340 8.822 -6.450 1.00 0.00 C ATOM 1797 C THR A 117 -12.128 10.134 -5.676 1.00 0.00 C ATOM 1798 O THR A 117 -12.122 11.209 -6.271 1.00 0.00 O ATOM 1799 CB THR A 117 -13.857 8.619 -6.763 1.00 0.00 C ATOM 1800 OG1 THR A 117 -14.564 8.350 -5.542 1.00 0.00 O ATOM 1801 CG2 THR A 117 -14.095 7.463 -7.751 1.00 0.00 C ATOM 0 H THR A 117 -12.543 7.154 -5.203 1.00 0.00 H new ATOM 0 HA THR A 117 -11.790 8.889 -7.389 1.00 0.00 H new ATOM 0 HB THR A 117 -14.224 9.535 -7.226 1.00 0.00 H new ATOM 0 HG1 THR A 117 -15.516 8.224 -5.736 1.00 0.00 H new ATOM 0 HG21 THR A 117 -15.164 7.359 -7.939 1.00 0.00 H new ATOM 0 HG22 THR A 117 -13.581 7.674 -8.689 1.00 0.00 H new ATOM 0 HG23 THR A 117 -13.709 6.536 -7.326 1.00 0.00 H new ATOM 1809 N SER A 118 -11.952 10.035 -4.348 1.00 0.00 N ATOM 1810 CA SER A 118 -11.707 11.199 -3.486 1.00 0.00 C ATOM 1811 C SER A 118 -10.225 11.588 -3.519 1.00 0.00 C ATOM 1812 O SER A 118 -9.373 10.832 -3.050 1.00 0.00 O ATOM 1813 CB SER A 118 -12.155 10.899 -2.041 1.00 0.00 C ATOM 1814 OG SER A 118 -11.930 12.003 -1.178 1.00 0.00 O ATOM 0 H SER A 118 -11.976 9.148 -3.845 1.00 0.00 H new ATOM 0 HA SER A 118 -12.291 12.039 -3.862 1.00 0.00 H new ATOM 0 HB2 SER A 118 -13.215 10.643 -2.035 1.00 0.00 H new ATOM 0 HB3 SER A 118 -11.615 10.029 -1.667 1.00 0.00 H new ATOM 0 HG SER A 118 -12.227 11.776 -0.272 1.00 0.00 H new ATOM 1820 N GLU A 119 -9.936 12.776 -4.077 1.00 0.00 N ATOM 1821 CA GLU A 119 -8.583 13.364 -4.109 1.00 0.00 C ATOM 1822 C GLU A 119 -8.111 13.705 -2.673 1.00 0.00 C ATOM 1823 O GLU A 119 -6.911 13.661 -2.368 1.00 0.00 O ATOM 1824 CB GLU A 119 -8.608 14.630 -4.988 1.00 0.00 C ATOM 1825 CG GLU A 119 -7.236 15.272 -5.234 1.00 0.00 C ATOM 1826 CD GLU A 119 -7.333 16.610 -5.973 1.00 0.00 C ATOM 1827 OE1 GLU A 119 -7.559 17.647 -5.317 1.00 0.00 O ATOM 1828 OE2 GLU A 119 -7.203 16.632 -7.214 1.00 0.00 O ATOM 0 H GLU A 119 -10.641 13.362 -4.523 1.00 0.00 H new ATOM 0 HA GLU A 119 -7.881 12.646 -4.532 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -9.053 14.378 -5.951 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -9.259 15.368 -4.519 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -6.735 15.425 -4.278 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -6.617 14.586 -5.813 1.00 0.00 H new ATOM 1835 N GLN A 120 -9.102 14.008 -1.817 1.00 0.00 N ATOM 1836 CA GLN A 120 -8.879 14.260 -0.383 1.00 0.00 C ATOM 1837 C GLN A 120 -8.289 13.008 0.294 1.00 0.00 C ATOM 1838 O GLN A 120 -7.258 13.080 0.983 1.00 0.00 O ATOM 1839 CB GLN A 120 -10.218 14.673 0.286 1.00 0.00 C ATOM 1840 CG GLN A 120 -10.821 15.995 -0.252 1.00 0.00 C ATOM 1841 CD GLN A 120 -12.206 16.350 0.315 1.00 0.00 C ATOM 1842 OE1 GLN A 120 -13.047 15.353 0.577 1.00 0.00 O flip ATOM 1843 NE2 GLN A 120 -12.531 17.528 0.475 1.00 0.00 N flip ATOM 0 H GLN A 120 -10.079 14.085 -2.099 1.00 0.00 H new ATOM 0 HA GLN A 120 -8.164 15.074 -0.266 1.00 0.00 H new ATOM 0 HB2 GLN A 120 -10.944 13.872 0.143 1.00 0.00 H new ATOM 0 HB3 GLN A 120 -10.059 14.771 1.360 1.00 0.00 H new ATOM 0 HG2 GLN A 120 -10.132 16.810 -0.028 1.00 0.00 H new ATOM 0 HG3 GLN A 120 -10.894 15.929 -1.338 1.00 0.00 H new ATOM 0 HE21 GLN A 120 -11.867 18.273 0.266 1.00 0.00 H new ATOM 0 HE22 GLN A 120 -13.464 17.758 0.816 1.00 0.00 H new ATOM 1852 N MET A 121 -8.949 11.865 0.058 1.00 0.00 N ATOM 1853 CA MET A 121 -8.525 10.565 0.599 1.00 0.00 C ATOM 1854 C MET A 121 -7.201 10.094 -0.058 1.00 0.00 C ATOM 1855 O MET A 121 -6.409 9.423 0.586 1.00 0.00 O ATOM 1856 CB MET A 121 -9.660 9.523 0.399 1.00 0.00 C ATOM 1857 CG MET A 121 -9.403 8.154 1.035 1.00 0.00 C ATOM 1858 SD MET A 121 -10.785 7.011 0.797 1.00 0.00 S ATOM 1859 CE MET A 121 -10.178 5.535 1.613 1.00 0.00 C ATOM 0 H MET A 121 -9.792 11.816 -0.514 1.00 0.00 H new ATOM 0 HA MET A 121 -8.333 10.670 1.667 1.00 0.00 H new ATOM 0 HB2 MET A 121 -10.583 9.930 0.811 1.00 0.00 H new ATOM 0 HB3 MET A 121 -9.822 9.385 -0.670 1.00 0.00 H new ATOM 0 HG2 MET A 121 -8.499 7.721 0.606 1.00 0.00 H new ATOM 0 HG3 MET A 121 -9.220 8.281 2.102 1.00 0.00 H new ATOM 0 HE1 MET A 121 -10.913 4.736 1.514 1.00 0.00 H new ATOM 0 HE2 MET A 121 -9.240 5.225 1.153 1.00 0.00 H new ATOM 0 HE3 MET A 121 -10.012 5.746 2.669 1.00 0.00 H new ATOM 1869 N LEU A 122 -6.963 10.482 -1.330 1.00 0.00 N ATOM 1870 CA LEU A 122 -5.738 10.101 -2.084 1.00 0.00 C ATOM 1871 C LEU A 122 -4.461 10.726 -1.482 1.00 0.00 C ATOM 1872 O LEU A 122 -3.445 10.042 -1.341 1.00 0.00 O ATOM 1873 CB LEU A 122 -5.898 10.463 -3.586 1.00 0.00 C ATOM 1874 CG LEU A 122 -6.761 9.460 -4.419 1.00 0.00 C ATOM 1875 CD1 LEU A 122 -7.220 10.059 -5.761 1.00 0.00 C ATOM 1876 CD2 LEU A 122 -6.000 8.123 -4.623 1.00 0.00 C ATOM 0 H LEU A 122 -7.607 11.065 -1.864 1.00 0.00 H new ATOM 0 HA LEU A 122 -5.618 9.021 -1.999 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -6.347 11.454 -3.660 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.907 10.528 -4.036 1.00 0.00 H new ATOM 0 HG LEU A 122 -7.666 9.255 -3.847 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -7.816 9.324 -6.303 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -7.822 10.949 -5.575 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -6.348 10.329 -6.356 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -6.617 7.438 -5.205 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -5.068 8.313 -5.155 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -5.780 7.678 -3.653 1.00 0.00 H new ATOM 1888 N VAL A 123 -4.526 12.020 -1.128 1.00 0.00 N ATOM 1889 CA VAL A 123 -3.398 12.717 -0.467 1.00 0.00 C ATOM 1890 C VAL A 123 -3.156 12.102 0.933 1.00 0.00 C ATOM 1891 O VAL A 123 -2.015 11.787 1.297 1.00 0.00 O ATOM 1892 CB VAL A 123 -3.672 14.265 -0.357 1.00 0.00 C ATOM 1893 CG1 VAL A 123 -2.510 15.006 0.357 1.00 0.00 C ATOM 1894 CG2 VAL A 123 -3.928 14.872 -1.760 1.00 0.00 C ATOM 0 H VAL A 123 -5.344 12.608 -1.286 1.00 0.00 H new ATOM 0 HA VAL A 123 -2.502 12.585 -1.074 1.00 0.00 H new ATOM 0 HB VAL A 123 -4.567 14.399 0.251 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -2.737 16.071 0.413 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -2.389 14.608 1.364 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -1.587 14.861 -0.204 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -4.115 15.942 -1.665 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -3.054 14.711 -2.391 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -4.795 14.390 -2.212 1.00 0.00 H new ATOM 1904 N GLU A 124 -4.273 11.893 1.660 1.00 0.00 N ATOM 1905 CA GLU A 124 -4.301 11.246 2.988 1.00 0.00 C ATOM 1906 C GLU A 124 -3.548 9.904 2.996 1.00 0.00 C ATOM 1907 O GLU A 124 -2.687 9.676 3.845 1.00 0.00 O ATOM 1908 CB GLU A 124 -5.778 11.020 3.422 1.00 0.00 C ATOM 1909 CG GLU A 124 -5.981 10.113 4.659 1.00 0.00 C ATOM 1910 CD GLU A 124 -7.459 9.934 5.024 1.00 0.00 C ATOM 1911 OE1 GLU A 124 -8.130 9.023 4.467 1.00 0.00 O ATOM 1912 OE2 GLU A 124 -7.970 10.717 5.841 1.00 0.00 O ATOM 0 H GLU A 124 -5.198 12.174 1.334 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.797 11.909 3.691 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -6.230 11.990 3.627 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -6.322 10.586 2.583 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -5.538 9.136 4.465 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -5.450 10.541 5.509 1.00 0.00 H new ATOM 1919 N VAL A 125 -3.888 9.025 2.039 1.00 0.00 N ATOM 1920 CA VAL A 125 -3.352 7.652 1.987 1.00 0.00 C ATOM 1921 C VAL A 125 -1.945 7.623 1.384 1.00 0.00 C ATOM 1922 O VAL A 125 -1.198 6.689 1.629 1.00 0.00 O ATOM 1923 CB VAL A 125 -4.298 6.684 1.204 1.00 0.00 C ATOM 1924 CG1 VAL A 125 -5.681 6.606 1.870 1.00 0.00 C ATOM 1925 CG2 VAL A 125 -4.411 7.081 -0.280 1.00 0.00 C ATOM 0 H VAL A 125 -4.538 9.243 1.284 1.00 0.00 H new ATOM 0 HA VAL A 125 -3.293 7.301 3.017 1.00 0.00 H new ATOM 0 HB VAL A 125 -3.854 5.689 1.239 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -6.319 5.926 1.305 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -5.573 6.239 2.891 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -6.133 7.598 1.887 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -5.076 6.386 -0.793 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -4.812 8.091 -0.357 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -3.424 7.047 -0.742 1.00 0.00 H new ATOM 1935 N GLY A 126 -1.584 8.659 0.609 1.00 0.00 N ATOM 1936 CA GLY A 126 -0.191 8.851 0.191 1.00 0.00 C ATOM 1937 C GLY A 126 0.725 9.025 1.401 1.00 0.00 C ATOM 1938 O GLY A 126 1.840 8.508 1.434 1.00 0.00 O ATOM 0 H GLY A 126 -2.231 9.368 0.264 1.00 0.00 H new ATOM 0 HA2 GLY A 126 0.137 7.994 -0.398 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -0.118 9.727 -0.453 1.00 0.00 H new ATOM 1942 N VAL A 127 0.166 9.684 2.431 1.00 0.00 N ATOM 1943 CA VAL A 127 0.864 9.883 3.713 1.00 0.00 C ATOM 1944 C VAL A 127 0.806 8.589 4.554 1.00 0.00 C ATOM 1945 O VAL A 127 1.836 8.052 4.962 1.00 0.00 O ATOM 1946 CB VAL A 127 0.240 11.084 4.514 1.00 0.00 C ATOM 1947 CG1 VAL A 127 1.011 11.354 5.829 1.00 0.00 C ATOM 1948 CG2 VAL A 127 0.165 12.364 3.637 1.00 0.00 C ATOM 0 H VAL A 127 -0.770 10.089 2.400 1.00 0.00 H new ATOM 0 HA VAL A 127 1.906 10.123 3.502 1.00 0.00 H new ATOM 0 HB VAL A 127 -0.778 10.802 4.784 1.00 0.00 H new ATOM 0 HG11 VAL A 127 0.551 12.190 6.355 1.00 0.00 H new ATOM 0 HG12 VAL A 127 0.977 10.466 6.460 1.00 0.00 H new ATOM 0 HG13 VAL A 127 2.049 11.596 5.599 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -0.271 13.178 4.217 1.00 0.00 H new ATOM 0 HG22 VAL A 127 1.168 12.644 3.316 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -0.455 12.170 2.762 1.00 0.00 H new ATOM 1958 N GLY A 128 -0.425 8.080 4.755 1.00 0.00 N ATOM 1959 CA GLY A 128 -0.689 6.913 5.611 1.00 0.00 C ATOM 1960 C GLY A 128 0.017 5.633 5.164 1.00 0.00 C ATOM 1961 O GLY A 128 0.491 4.843 5.999 1.00 0.00 O ATOM 0 H GLY A 128 -1.265 8.469 4.326 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -0.381 7.147 6.630 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -1.763 6.731 5.637 1.00 0.00 H new ATOM 1965 N TRP A 129 0.147 5.472 3.841 1.00 0.00 N ATOM 1966 CA TRP A 129 0.781 4.284 3.250 1.00 0.00 C ATOM 1967 C TRP A 129 2.298 4.479 3.190 1.00 0.00 C ATOM 1968 O TRP A 129 3.021 3.526 3.403 1.00 0.00 O ATOM 1969 CB TRP A 129 0.227 3.919 1.848 1.00 0.00 C ATOM 1970 CG TRP A 129 -1.171 3.335 1.830 1.00 0.00 C ATOM 1971 CD1 TRP A 129 -2.242 3.793 1.128 1.00 0.00 C ATOM 1972 CD2 TRP A 129 -1.625 2.156 2.513 1.00 0.00 C ATOM 1973 NE1 TRP A 129 -3.327 2.998 1.344 1.00 0.00 N ATOM 1974 CE2 TRP A 129 -2.979 1.986 2.183 1.00 0.00 C ATOM 1975 CE3 TRP A 129 -1.022 1.232 3.373 1.00 0.00 C ATOM 1976 CZ2 TRP A 129 -3.741 0.936 2.675 1.00 0.00 C ATOM 1977 CZ3 TRP A 129 -1.779 0.184 3.861 1.00 0.00 C ATOM 1978 CH2 TRP A 129 -3.126 0.044 3.509 1.00 0.00 C ATOM 0 H TRP A 129 -0.180 6.153 3.155 1.00 0.00 H new ATOM 0 HA TRP A 129 0.538 3.444 3.900 1.00 0.00 H new ATOM 0 HB2 TRP A 129 0.235 4.816 1.229 1.00 0.00 H new ATOM 0 HB3 TRP A 129 0.906 3.205 1.383 1.00 0.00 H new ATOM 0 HD1 TRP A 129 -2.234 4.664 0.489 1.00 0.00 H new ATOM 0 HE1 TRP A 129 -4.253 3.139 0.941 1.00 0.00 H new ATOM 0 HE3 TRP A 129 0.017 1.336 3.651 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 -4.782 0.827 2.409 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 -1.324 -0.537 4.524 1.00 0.00 H new ATOM 0 HH2 TRP A 129 -3.692 -0.786 3.905 1.00 0.00 H new ATOM 1989 N GLU A 130 2.796 5.715 2.918 1.00 0.00 N ATOM 1990 CA GLU A 130 4.257 5.947 2.835 1.00 0.00 C ATOM 1991 C GLU A 130 4.894 5.831 4.226 1.00 0.00 C ATOM 1992 O GLU A 130 6.058 5.448 4.345 1.00 0.00 O ATOM 1993 CB GLU A 130 4.594 7.317 2.188 1.00 0.00 C ATOM 1994 CG GLU A 130 6.046 7.413 1.683 1.00 0.00 C ATOM 1995 CD GLU A 130 6.417 8.787 1.116 1.00 0.00 C ATOM 1996 OE1 GLU A 130 5.808 9.213 0.116 1.00 0.00 O ATOM 1997 OE2 GLU A 130 7.317 9.445 1.671 1.00 0.00 O ATOM 0 H GLU A 130 2.223 6.543 2.757 1.00 0.00 H new ATOM 0 HA GLU A 130 4.676 5.176 2.188 1.00 0.00 H new ATOM 0 HB2 GLU A 130 3.915 7.494 1.354 1.00 0.00 H new ATOM 0 HB3 GLU A 130 4.417 8.108 2.917 1.00 0.00 H new ATOM 0 HG2 GLU A 130 6.722 7.175 2.504 1.00 0.00 H new ATOM 0 HG3 GLU A 130 6.203 6.658 0.912 1.00 0.00 H new ATOM 2004 N MET A 131 4.111 6.156 5.273 1.00 0.00 N ATOM 2005 CA MET A 131 4.513 5.922 6.672 1.00 0.00 C ATOM 2006 C MET A 131 4.471 4.415 6.983 1.00 0.00 C ATOM 2007 O MET A 131 5.336 3.914 7.694 1.00 0.00 O ATOM 2008 CB MET A 131 3.623 6.723 7.658 1.00 0.00 C ATOM 2009 CG MET A 131 3.763 8.253 7.551 1.00 0.00 C ATOM 2010 SD MET A 131 2.814 9.143 8.808 1.00 0.00 S ATOM 2011 CE MET A 131 1.137 8.570 8.513 1.00 0.00 C ATOM 0 H MET A 131 3.191 6.584 5.174 1.00 0.00 H new ATOM 0 HA MET A 131 5.535 6.277 6.802 1.00 0.00 H new ATOM 0 HB2 MET A 131 2.581 6.454 7.487 1.00 0.00 H new ATOM 0 HB3 MET A 131 3.867 6.419 8.676 1.00 0.00 H new ATOM 0 HG2 MET A 131 4.815 8.523 7.641 1.00 0.00 H new ATOM 0 HG3 MET A 131 3.435 8.573 6.562 1.00 0.00 H new ATOM 0 HE1 MET A 131 0.430 9.265 8.966 1.00 0.00 H new ATOM 0 HE2 MET A 131 0.955 8.515 7.440 1.00 0.00 H new ATOM 0 HE3 MET A 131 1.007 7.582 8.954 1.00 0.00 H new ATOM 2021 N ALA A 132 3.474 3.697 6.427 1.00 0.00 N ATOM 2022 CA ALA A 132 3.391 2.226 6.547 1.00 0.00 C ATOM 2023 C ALA A 132 4.582 1.535 5.831 1.00 0.00 C ATOM 2024 O ALA A 132 5.096 0.536 6.312 1.00 0.00 O ATOM 2025 CB ALA A 132 2.049 1.718 5.989 1.00 0.00 C ATOM 0 H ALA A 132 2.713 4.113 5.889 1.00 0.00 H new ATOM 0 HA ALA A 132 3.447 1.969 7.605 1.00 0.00 H new ATOM 0 HB1 ALA A 132 2.003 0.633 6.084 1.00 0.00 H new ATOM 0 HB2 ALA A 132 1.229 2.167 6.549 1.00 0.00 H new ATOM 0 HB3 ALA A 132 1.964 1.994 4.938 1.00 0.00 H new ATOM 2031 N LEU A 133 5.037 2.122 4.696 1.00 0.00 N ATOM 2032 CA LEU A 133 6.182 1.602 3.896 1.00 0.00 C ATOM 2033 C LEU A 133 7.521 2.044 4.511 1.00 0.00 C ATOM 2034 O LEU A 133 8.567 1.440 4.249 1.00 0.00 O ATOM 2035 CB LEU A 133 6.092 2.062 2.404 1.00 0.00 C ATOM 2036 CG LEU A 133 5.317 1.117 1.432 1.00 0.00 C ATOM 2037 CD1 LEU A 133 5.868 -0.320 1.503 1.00 0.00 C ATOM 2038 CD2 LEU A 133 3.795 1.137 1.665 1.00 0.00 C ATOM 0 H LEU A 133 4.623 2.969 4.307 1.00 0.00 H new ATOM 0 HA LEU A 133 6.130 0.513 3.916 1.00 0.00 H new ATOM 0 HB2 LEU A 133 5.618 3.043 2.377 1.00 0.00 H new ATOM 0 HB3 LEU A 133 7.106 2.187 2.023 1.00 0.00 H new ATOM 0 HG LEU A 133 5.482 1.503 0.426 1.00 0.00 H new ATOM 0 HD11 LEU A 133 5.311 -0.958 0.817 1.00 0.00 H new ATOM 0 HD12 LEU A 133 6.922 -0.320 1.224 1.00 0.00 H new ATOM 0 HD13 LEU A 133 5.762 -0.701 2.519 1.00 0.00 H new ATOM 0 HD21 LEU A 133 3.310 0.461 0.960 1.00 0.00 H new ATOM 0 HD22 LEU A 133 3.579 0.815 2.684 1.00 0.00 H new ATOM 0 HD23 LEU A 133 3.417 2.149 1.516 1.00 0.00 H new ATOM 2050 N ASP A 134 7.464 3.140 5.275 1.00 0.00 N ATOM 2051 CA ASP A 134 8.599 3.629 6.073 1.00 0.00 C ATOM 2052 C ASP A 134 8.872 2.641 7.217 1.00 0.00 C ATOM 2053 O ASP A 134 9.999 2.184 7.391 1.00 0.00 O ATOM 2054 CB ASP A 134 8.296 5.047 6.627 1.00 0.00 C ATOM 2055 CG ASP A 134 9.360 5.560 7.611 1.00 0.00 C ATOM 2056 OD1 ASP A 134 10.371 6.153 7.172 1.00 0.00 O ATOM 2057 OD2 ASP A 134 9.192 5.370 8.834 1.00 0.00 O ATOM 0 H ASP A 134 6.627 3.717 5.359 1.00 0.00 H new ATOM 0 HA ASP A 134 9.486 3.699 5.444 1.00 0.00 H new ATOM 0 HB2 ASP A 134 8.216 5.745 5.794 1.00 0.00 H new ATOM 0 HB3 ASP A 134 7.327 5.034 7.126 1.00 0.00 H new ATOM 2062 N PHE A 135 7.807 2.311 7.975 1.00 0.00 N ATOM 2063 CA PHE A 135 7.871 1.368 9.110 1.00 0.00 C ATOM 2064 C PHE A 135 8.061 -0.084 8.626 1.00 0.00 C ATOM 2065 O PHE A 135 8.572 -0.917 9.374 1.00 0.00 O ATOM 2066 CB PHE A 135 6.604 1.492 10.006 1.00 0.00 C ATOM 2067 CG PHE A 135 6.477 2.830 10.746 1.00 0.00 C ATOM 2068 CD1 PHE A 135 7.560 3.358 11.455 1.00 0.00 C ATOM 2069 CD2 PHE A 135 5.281 3.554 10.745 1.00 0.00 C ATOM 2070 CE1 PHE A 135 7.452 4.560 12.135 1.00 0.00 C ATOM 2071 CE2 PHE A 135 5.173 4.756 11.426 1.00 0.00 C ATOM 2072 CZ PHE A 135 6.256 5.260 12.118 1.00 0.00 C ATOM 0 H PHE A 135 6.874 2.693 7.816 1.00 0.00 H new ATOM 0 HA PHE A 135 8.741 1.633 9.711 1.00 0.00 H new ATOM 0 HB2 PHE A 135 5.720 1.349 9.385 1.00 0.00 H new ATOM 0 HB3 PHE A 135 6.612 0.685 10.739 1.00 0.00 H new ATOM 0 HD1 PHE A 135 8.496 2.820 11.473 1.00 0.00 H new ATOM 0 HD2 PHE A 135 4.428 3.170 10.205 1.00 0.00 H new ATOM 0 HE1 PHE A 135 8.299 4.951 12.678 1.00 0.00 H new ATOM 0 HE2 PHE A 135 4.240 5.300 11.415 1.00 0.00 H new ATOM 0 HZ PHE A 135 6.171 6.199 12.645 1.00 0.00 H new ATOM 2082 N LEU A 136 7.643 -0.378 7.374 1.00 0.00 N ATOM 2083 CA LEU A 136 7.915 -1.680 6.723 1.00 0.00 C ATOM 2084 C LEU A 136 9.369 -1.718 6.215 1.00 0.00 C ATOM 2085 O LEU A 136 9.997 -2.778 6.179 1.00 0.00 O ATOM 2086 CB LEU A 136 6.917 -1.943 5.561 1.00 0.00 C ATOM 2087 CG LEU A 136 7.000 -3.343 4.864 1.00 0.00 C ATOM 2088 CD1 LEU A 136 6.981 -4.500 5.884 1.00 0.00 C ATOM 2089 CD2 LEU A 136 5.873 -3.510 3.824 1.00 0.00 C ATOM 0 H LEU A 136 7.114 0.272 6.792 1.00 0.00 H new ATOM 0 HA LEU A 136 7.779 -2.472 7.460 1.00 0.00 H new ATOM 0 HB2 LEU A 136 5.905 -1.814 5.946 1.00 0.00 H new ATOM 0 HB3 LEU A 136 7.069 -1.176 4.802 1.00 0.00 H new ATOM 0 HG LEU A 136 7.957 -3.386 4.344 1.00 0.00 H new ATOM 0 HD11 LEU A 136 7.040 -5.452 5.356 1.00 0.00 H new ATOM 0 HD12 LEU A 136 7.833 -4.405 6.558 1.00 0.00 H new ATOM 0 HD13 LEU A 136 6.057 -4.462 6.460 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.953 -4.490 3.355 1.00 0.00 H new ATOM 0 HD22 LEU A 136 4.906 -3.423 4.319 1.00 0.00 H new ATOM 0 HD23 LEU A 136 5.963 -2.735 3.063 1.00 0.00 H new ATOM 2101 N GLY A 137 9.888 -0.543 5.836 1.00 0.00 N ATOM 2102 CA GLY A 137 11.306 -0.390 5.511 1.00 0.00 C ATOM 2103 C GLY A 137 12.194 -0.558 6.736 1.00 0.00 C ATOM 2104 O GLY A 137 13.288 -1.090 6.625 1.00 0.00 O ATOM 0 H GLY A 137 9.343 0.315 5.748 1.00 0.00 H new ATOM 0 HA2 GLY A 137 11.586 -1.125 4.757 1.00 0.00 H new ATOM 0 HA3 GLY A 137 11.474 0.595 5.074 1.00 0.00 H new ATOM 2108 N MET A 138 11.694 -0.113 7.907 1.00 0.00 N ATOM 2109 CA MET A 138 12.330 -0.370 9.215 1.00 0.00 C ATOM 2110 C MET A 138 12.269 -1.880 9.529 1.00 0.00 C ATOM 2111 O MET A 138 13.285 -2.504 9.846 1.00 0.00 O ATOM 2112 CB MET A 138 11.601 0.426 10.337 1.00 0.00 C ATOM 2113 CG MET A 138 11.653 1.956 10.196 1.00 0.00 C ATOM 2114 SD MET A 138 13.284 2.644 10.537 1.00 0.00 S ATOM 2115 CE MET A 138 13.423 2.370 12.307 1.00 0.00 C ATOM 0 H MET A 138 10.837 0.436 7.972 1.00 0.00 H new ATOM 0 HA MET A 138 13.370 -0.045 9.172 1.00 0.00 H new ATOM 0 HB2 MET A 138 10.557 0.115 10.361 1.00 0.00 H new ATOM 0 HB3 MET A 138 12.037 0.151 11.297 1.00 0.00 H new ATOM 0 HG2 MET A 138 11.353 2.232 9.185 1.00 0.00 H new ATOM 0 HG3 MET A 138 10.928 2.402 10.876 1.00 0.00 H new ATOM 0 HE1 MET A 138 14.207 3.009 12.714 1.00 0.00 H new ATOM 0 HE2 MET A 138 12.474 2.608 12.788 1.00 0.00 H new ATOM 0 HE3 MET A 138 13.673 1.326 12.495 1.00 0.00 H new ATOM 2125 N PHE A 139 11.055 -2.444 9.374 1.00 0.00 N ATOM 2126 CA PHE A 139 10.723 -3.844 9.708 1.00 0.00 C ATOM 2127 C PHE A 139 11.644 -4.841 8.972 1.00 0.00 C ATOM 2128 O PHE A 139 12.321 -5.662 9.606 1.00 0.00 O ATOM 2129 CB PHE A 139 9.232 -4.104 9.354 1.00 0.00 C ATOM 2130 CG PHE A 139 8.723 -5.510 9.649 1.00 0.00 C ATOM 2131 CD1 PHE A 139 8.402 -5.892 10.948 1.00 0.00 C ATOM 2132 CD2 PHE A 139 8.556 -6.449 8.629 1.00 0.00 C ATOM 2133 CE1 PHE A 139 7.940 -7.165 11.211 1.00 0.00 C ATOM 2134 CE2 PHE A 139 8.093 -7.720 8.902 1.00 0.00 C ATOM 2135 CZ PHE A 139 7.785 -8.073 10.192 1.00 0.00 C ATOM 0 H PHE A 139 10.258 -1.926 9.004 1.00 0.00 H new ATOM 0 HA PHE A 139 10.881 -3.999 10.775 1.00 0.00 H new ATOM 0 HB2 PHE A 139 8.617 -3.391 9.903 1.00 0.00 H new ATOM 0 HB3 PHE A 139 9.088 -3.899 8.293 1.00 0.00 H new ATOM 0 HD1 PHE A 139 8.516 -5.186 11.757 1.00 0.00 H new ATOM 0 HD2 PHE A 139 8.793 -6.176 7.611 1.00 0.00 H new ATOM 0 HE1 PHE A 139 7.699 -7.449 12.225 1.00 0.00 H new ATOM 0 HE2 PHE A 139 7.973 -8.436 8.102 1.00 0.00 H new ATOM 0 HZ PHE A 139 7.420 -9.067 10.406 1.00 0.00 H new ATOM 2145 N ILE A 140 11.677 -4.726 7.639 1.00 0.00 N ATOM 2146 CA ILE A 140 12.436 -5.631 6.767 1.00 0.00 C ATOM 2147 C ILE A 140 13.939 -5.266 6.762 1.00 0.00 C ATOM 2148 O ILE A 140 14.791 -6.105 7.079 1.00 0.00 O ATOM 2149 CB ILE A 140 11.861 -5.623 5.293 1.00 0.00 C ATOM 2150 CG1 ILE A 140 10.367 -6.098 5.271 1.00 0.00 C ATOM 2151 CG2 ILE A 140 12.724 -6.485 4.342 1.00 0.00 C ATOM 2152 CD1 ILE A 140 9.726 -6.147 3.883 1.00 0.00 C ATOM 0 H ILE A 140 11.175 -3.998 7.132 1.00 0.00 H new ATOM 0 HA ILE A 140 12.329 -6.639 7.168 1.00 0.00 H new ATOM 0 HB ILE A 140 11.898 -4.595 4.933 1.00 0.00 H new ATOM 0 HG12 ILE A 140 10.310 -7.091 5.716 1.00 0.00 H new ATOM 0 HG13 ILE A 140 9.780 -5.431 5.903 1.00 0.00 H new ATOM 0 HG21 ILE A 140 12.299 -6.456 3.339 1.00 0.00 H new ATOM 0 HG22 ILE A 140 13.741 -6.093 4.317 1.00 0.00 H new ATOM 0 HG23 ILE A 140 12.741 -7.515 4.699 1.00 0.00 H new ATOM 0 HD11 ILE A 140 8.694 -6.487 3.971 1.00 0.00 H new ATOM 0 HD12 ILE A 140 9.744 -5.152 3.439 1.00 0.00 H new ATOM 0 HD13 ILE A 140 10.283 -6.837 3.249 1.00 0.00 H new ATOM 2164 N ARG A 141 14.260 -4.004 6.423 1.00 0.00 N ATOM 2165 CA ARG A 141 15.658 -3.586 6.190 1.00 0.00 C ATOM 2166 C ARG A 141 16.298 -2.906 7.428 1.00 0.00 C ATOM 2167 O ARG A 141 17.104 -3.527 8.122 1.00 0.00 O ATOM 2168 CB ARG A 141 15.753 -2.662 4.939 1.00 0.00 C ATOM 2169 CG ARG A 141 17.162 -2.065 4.700 1.00 0.00 C ATOM 2170 CD ARG A 141 18.282 -3.129 4.651 1.00 0.00 C ATOM 2171 NE ARG A 141 19.624 -2.528 4.751 1.00 0.00 N ATOM 2172 CZ ARG A 141 20.753 -3.085 4.299 1.00 0.00 C ATOM 2173 NH1 ARG A 141 20.728 -4.139 3.496 1.00 0.00 N ATOM 2174 NH2 ARG A 141 21.915 -2.540 4.613 1.00 0.00 N ATOM 0 H ARG A 141 13.575 -3.258 6.304 1.00 0.00 H new ATOM 0 HA ARG A 141 16.231 -4.494 6.004 1.00 0.00 H new ATOM 0 HB2 ARG A 141 15.457 -3.230 4.057 1.00 0.00 H new ATOM 0 HB3 ARG A 141 15.038 -1.846 5.048 1.00 0.00 H new ATOM 0 HG2 ARG A 141 17.158 -1.509 3.762 1.00 0.00 H new ATOM 0 HG3 ARG A 141 17.385 -1.351 5.493 1.00 0.00 H new ATOM 0 HD2 ARG A 141 18.142 -3.839 5.466 1.00 0.00 H new ATOM 0 HD3 ARG A 141 18.206 -3.692 3.721 1.00 0.00 H new ATOM 0 HE ARG A 141 19.698 -1.615 5.200 1.00 0.00 H new ATOM 0 HH11 ARG A 141 19.835 -4.542 3.211 1.00 0.00 H new ATOM 0 HH12 ARG A 141 21.601 -4.548 3.163 1.00 0.00 H new ATOM 0 HH21 ARG A 141 21.945 -1.703 5.195 1.00 0.00 H new ATOM 0 HH22 ARG A 141 22.782 -2.957 4.274 1.00 0.00 H new ATOM 2522 N ILE A 166 8.265 16.816 8.145 1.00 0.00 N ATOM 2523 CA ILE A 166 8.017 15.439 7.632 1.00 0.00 C ATOM 2524 C ILE A 166 6.587 15.279 7.075 1.00 0.00 C ATOM 2525 O ILE A 166 6.407 14.785 5.960 1.00 0.00 O ATOM 2526 CB ILE A 166 8.260 14.335 8.745 1.00 0.00 C ATOM 2527 CG1 ILE A 166 9.725 14.390 9.282 1.00 0.00 C ATOM 2528 CG2 ILE A 166 7.917 12.908 8.225 1.00 0.00 C ATOM 2529 CD1 ILE A 166 10.044 13.412 10.413 1.00 0.00 C ATOM 0 HA ILE A 166 8.734 15.292 6.824 1.00 0.00 H new ATOM 0 HB ILE A 166 7.585 14.557 9.572 1.00 0.00 H new ATOM 0 HG12 ILE A 166 10.406 14.196 8.453 1.00 0.00 H new ATOM 0 HG13 ILE A 166 9.929 15.402 9.631 1.00 0.00 H new ATOM 0 HG21 ILE A 166 8.096 12.180 9.016 1.00 0.00 H new ATOM 0 HG22 ILE A 166 6.869 12.871 7.929 1.00 0.00 H new ATOM 0 HG23 ILE A 166 8.545 12.673 7.366 1.00 0.00 H new ATOM 0 HD11 ILE A 166 11.085 13.530 10.713 1.00 0.00 H new ATOM 0 HD12 ILE A 166 9.395 13.616 11.265 1.00 0.00 H new ATOM 0 HD13 ILE A 166 9.880 12.391 10.068 1.00 0.00 H new ATOM 2541 N SER A 167 5.593 15.764 7.837 1.00 0.00 N ATOM 2542 CA SER A 167 4.171 15.569 7.505 1.00 0.00 C ATOM 2543 C SER A 167 3.780 16.411 6.278 1.00 0.00 C ATOM 2544 O SER A 167 3.150 15.894 5.346 1.00 0.00 O ATOM 2545 CB SER A 167 3.292 15.930 8.722 1.00 0.00 C ATOM 2546 OG SER A 167 3.509 17.271 9.137 1.00 0.00 O ATOM 0 H SER A 167 5.749 16.297 8.692 1.00 0.00 H new ATOM 0 HA SER A 167 4.008 14.520 7.257 1.00 0.00 H new ATOM 0 HB2 SER A 167 2.241 15.791 8.468 1.00 0.00 H new ATOM 0 HB3 SER A 167 3.513 15.252 9.546 1.00 0.00 H new ATOM 0 HG SER A 167 2.938 17.471 9.908 1.00 0.00 H new ATOM 2552 N GLN A 168 4.126 17.717 6.325 1.00 0.00 N ATOM 2553 CA GLN A 168 3.852 18.623 5.186 1.00 0.00 C ATOM 2554 C GLN A 168 4.512 18.094 3.879 1.00 0.00 C ATOM 2555 O GLN A 168 3.847 18.015 2.856 1.00 0.00 O ATOM 2556 CB GLN A 168 4.248 20.108 5.501 1.00 0.00 C ATOM 2557 CG GLN A 168 5.759 20.451 5.455 1.00 0.00 C ATOM 2558 CD GLN A 168 6.122 21.867 5.932 1.00 0.00 C ATOM 2559 OE1 GLN A 168 5.415 22.375 6.937 1.00 0.00 O flip ATOM 2560 NE2 GLN A 168 7.066 22.482 5.429 1.00 0.00 N flip ATOM 0 H GLN A 168 4.585 18.160 7.120 1.00 0.00 H new ATOM 0 HA GLN A 168 2.774 18.629 5.023 1.00 0.00 H new ATOM 0 HB2 GLN A 168 3.731 20.755 4.793 1.00 0.00 H new ATOM 0 HB3 GLN A 168 3.873 20.357 6.494 1.00 0.00 H new ATOM 0 HG2 GLN A 168 6.298 19.729 6.068 1.00 0.00 H new ATOM 0 HG3 GLN A 168 6.113 20.328 4.431 1.00 0.00 H new ATOM 0 HE21 GLN A 168 7.592 22.069 4.659 1.00 0.00 H new ATOM 0 HE22 GLN A 168 7.321 23.404 5.783 1.00 0.00 H new ATOM 2569 N GLU A 169 5.823 17.727 3.955 1.00 0.00 N ATOM 2570 CA GLU A 169 6.570 17.038 2.859 1.00 0.00 C ATOM 2571 C GLU A 169 5.755 15.897 2.220 1.00 0.00 C ATOM 2572 O GLU A 169 5.644 15.826 0.992 1.00 0.00 O ATOM 2573 CB GLU A 169 7.920 16.466 3.385 1.00 0.00 C ATOM 2574 CG GLU A 169 9.032 17.504 3.654 1.00 0.00 C ATOM 2575 CD GLU A 169 9.585 18.154 2.380 1.00 0.00 C ATOM 2576 OE1 GLU A 169 10.409 17.525 1.685 1.00 0.00 O ATOM 2577 OE2 GLU A 169 9.210 19.294 2.060 1.00 0.00 O ATOM 0 H GLU A 169 6.395 17.901 4.782 1.00 0.00 H new ATOM 0 HA GLU A 169 6.759 17.791 2.094 1.00 0.00 H new ATOM 0 HB2 GLU A 169 7.726 15.921 4.309 1.00 0.00 H new ATOM 0 HB3 GLU A 169 8.293 15.742 2.661 1.00 0.00 H new ATOM 0 HG2 GLU A 169 8.640 18.283 4.309 1.00 0.00 H new ATOM 0 HG3 GLU A 169 9.849 17.019 4.189 1.00 0.00 H new ATOM 2584 N ARG A 170 5.166 15.030 3.070 1.00 0.00 N ATOM 2585 CA ARG A 170 4.319 13.904 2.603 1.00 0.00 C ATOM 2586 C ARG A 170 3.105 14.406 1.805 1.00 0.00 C ATOM 2587 O ARG A 170 2.907 14.022 0.649 1.00 0.00 O ATOM 2588 CB ARG A 170 3.827 13.027 3.787 1.00 0.00 C ATOM 2589 CG ARG A 170 4.920 12.328 4.622 1.00 0.00 C ATOM 2590 CD ARG A 170 5.838 11.391 3.815 1.00 0.00 C ATOM 2591 NE ARG A 170 6.820 12.123 2.991 1.00 0.00 N ATOM 2592 CZ ARG A 170 8.018 12.556 3.420 1.00 0.00 C ATOM 2593 NH1 ARG A 170 8.469 12.253 4.636 1.00 0.00 N ATOM 2594 NH2 ARG A 170 8.779 13.278 2.615 1.00 0.00 N ATOM 0 H ARG A 170 5.259 15.085 4.084 1.00 0.00 H new ATOM 0 HA ARG A 170 4.946 13.295 1.951 1.00 0.00 H new ATOM 0 HB2 ARG A 170 3.236 13.654 4.454 1.00 0.00 H new ATOM 0 HB3 ARG A 170 3.158 12.263 3.391 1.00 0.00 H new ATOM 0 HG2 ARG A 170 5.533 13.089 5.105 1.00 0.00 H new ATOM 0 HG3 ARG A 170 4.442 11.753 5.415 1.00 0.00 H new ATOM 0 HD2 ARG A 170 6.367 10.729 4.501 1.00 0.00 H new ATOM 0 HD3 ARG A 170 5.228 10.759 3.169 1.00 0.00 H new ATOM 0 HE ARG A 170 6.570 12.315 2.021 1.00 0.00 H new ATOM 0 HH11 ARG A 170 7.902 11.682 5.262 1.00 0.00 H new ATOM 0 HH12 ARG A 170 9.381 12.592 4.941 1.00 0.00 H new ATOM 0 HH21 ARG A 170 8.456 13.504 1.674 1.00 0.00 H new ATOM 0 HH22 ARG A 170 9.689 13.609 2.935 1.00 0.00 H new ATOM 2608 N GLY A 171 2.364 15.344 2.405 1.00 0.00 N ATOM 2609 CA GLY A 171 1.068 15.757 1.885 1.00 0.00 C ATOM 2610 C GLY A 171 1.167 16.593 0.621 1.00 0.00 C ATOM 2611 O GLY A 171 0.354 16.440 -0.281 1.00 0.00 O ATOM 0 H GLY A 171 2.647 15.830 3.256 1.00 0.00 H new ATOM 0 HA2 GLY A 171 0.467 14.871 1.680 1.00 0.00 H new ATOM 0 HA3 GLY A 171 0.543 16.328 2.650 1.00 0.00 H new ATOM 2615 N GLU A 172 2.187 17.471 0.559 1.00 0.00 N ATOM 2616 CA GLU A 172 2.373 18.412 -0.558 1.00 0.00 C ATOM 2617 C GLU A 172 2.979 17.706 -1.775 1.00 0.00 C ATOM 2618 O GLU A 172 2.763 18.147 -2.918 1.00 0.00 O ATOM 2619 CB GLU A 172 3.258 19.614 -0.130 1.00 0.00 C ATOM 2620 CG GLU A 172 4.747 19.289 0.126 1.00 0.00 C ATOM 2621 CD GLU A 172 5.511 20.463 0.761 1.00 0.00 C ATOM 2622 OE1 GLU A 172 5.921 21.392 0.033 1.00 0.00 O ATOM 2623 OE2 GLU A 172 5.687 20.478 1.987 1.00 0.00 O ATOM 0 H GLU A 172 2.903 17.546 1.282 1.00 0.00 H new ATOM 0 HA GLU A 172 1.391 18.793 -0.839 1.00 0.00 H new ATOM 0 HB2 GLU A 172 3.200 20.379 -0.904 1.00 0.00 H new ATOM 0 HB3 GLU A 172 2.838 20.047 0.778 1.00 0.00 H new ATOM 0 HG2 GLU A 172 4.818 18.419 0.779 1.00 0.00 H new ATOM 0 HG3 GLU A 172 5.223 19.019 -0.817 1.00 0.00 H new ATOM 2630 N ALA A 173 3.718 16.595 -1.540 1.00 0.00 N ATOM 2631 CA ALA A 173 4.274 15.761 -2.605 1.00 0.00 C ATOM 2632 C ALA A 173 3.134 15.059 -3.344 1.00 0.00 C ATOM 2633 O ALA A 173 2.993 15.180 -4.563 1.00 0.00 O ATOM 2634 CB ALA A 173 5.270 14.741 -2.021 1.00 0.00 C ATOM 0 H ALA A 173 3.939 16.261 -0.602 1.00 0.00 H new ATOM 0 HA ALA A 173 4.818 16.386 -3.313 1.00 0.00 H new ATOM 0 HB1 ALA A 173 5.676 14.127 -2.825 1.00 0.00 H new ATOM 0 HB2 ALA A 173 6.083 15.270 -1.523 1.00 0.00 H new ATOM 0 HB3 ALA A 173 4.757 14.103 -1.301 1.00 0.00 H new ATOM 2640 N TRP A 174 2.290 14.375 -2.557 1.00 0.00 N ATOM 2641 CA TRP A 174 1.149 13.608 -3.068 1.00 0.00 C ATOM 2642 C TRP A 174 0.025 14.506 -3.585 1.00 0.00 C ATOM 2643 O TRP A 174 -0.737 14.077 -4.447 1.00 0.00 O ATOM 2644 CB TRP A 174 0.632 12.629 -1.992 1.00 0.00 C ATOM 2645 CG TRP A 174 1.613 11.506 -1.731 1.00 0.00 C ATOM 2646 CD1 TRP A 174 2.418 11.325 -0.640 1.00 0.00 C ATOM 2647 CD2 TRP A 174 1.916 10.427 -2.624 1.00 0.00 C ATOM 2648 NE1 TRP A 174 3.171 10.193 -0.796 1.00 0.00 N ATOM 2649 CE2 TRP A 174 2.886 9.631 -2.006 1.00 0.00 C ATOM 2650 CE3 TRP A 174 1.446 10.055 -3.887 1.00 0.00 C ATOM 2651 CZ2 TRP A 174 3.400 8.489 -2.599 1.00 0.00 C ATOM 2652 CZ3 TRP A 174 1.963 8.926 -4.478 1.00 0.00 C ATOM 2653 CH2 TRP A 174 2.928 8.147 -3.836 1.00 0.00 C ATOM 0 H TRP A 174 2.382 14.340 -1.542 1.00 0.00 H new ATOM 0 HA TRP A 174 1.502 13.032 -3.923 1.00 0.00 H new ATOM 0 HB2 TRP A 174 0.448 13.173 -1.065 1.00 0.00 H new ATOM 0 HB3 TRP A 174 -0.322 12.210 -2.311 1.00 0.00 H new ATOM 0 HD1 TRP A 174 2.454 11.979 0.218 1.00 0.00 H new ATOM 0 HE1 TRP A 174 3.838 9.828 -0.116 1.00 0.00 H new ATOM 0 HE3 TRP A 174 0.692 10.643 -4.389 1.00 0.00 H new ATOM 0 HZ2 TRP A 174 4.148 7.890 -2.101 1.00 0.00 H new ATOM 0 HZ3 TRP A 174 1.616 8.636 -5.459 1.00 0.00 H new ATOM 0 HH2 TRP A 174 3.307 7.261 -4.324 1.00 0.00 H new ATOM 2664 N ALA A 175 -0.067 15.751 -3.067 1.00 0.00 N ATOM 2665 CA ALA A 175 -1.032 16.744 -3.574 1.00 0.00 C ATOM 2666 C ALA A 175 -0.684 17.103 -5.023 1.00 0.00 C ATOM 2667 O ALA A 175 -1.476 16.856 -5.931 1.00 0.00 O ATOM 2668 CB ALA A 175 -1.067 17.993 -2.684 1.00 0.00 C ATOM 0 H ALA A 175 0.515 16.089 -2.300 1.00 0.00 H new ATOM 0 HA ALA A 175 -2.031 16.308 -3.549 1.00 0.00 H new ATOM 0 HB1 ALA A 175 -1.788 18.705 -3.085 1.00 0.00 H new ATOM 0 HB2 ALA A 175 -1.360 17.711 -1.673 1.00 0.00 H new ATOM 0 HB3 ALA A 175 -0.078 18.451 -2.661 1.00 0.00 H new ATOM 2674 N ALA A 176 0.541 17.627 -5.234 1.00 0.00 N ATOM 2675 CA ALA A 176 1.107 17.944 -6.567 1.00 0.00 C ATOM 2676 C ALA A 176 0.995 16.774 -7.561 1.00 0.00 C ATOM 2677 O ALA A 176 0.721 16.983 -8.755 1.00 0.00 O ATOM 2678 CB ALA A 176 2.575 18.372 -6.416 1.00 0.00 C ATOM 0 H ALA A 176 1.179 17.847 -4.469 1.00 0.00 H new ATOM 0 HA ALA A 176 0.518 18.762 -6.981 1.00 0.00 H new ATOM 0 HB1 ALA A 176 2.989 18.605 -7.397 1.00 0.00 H new ATOM 0 HB2 ALA A 176 2.633 19.255 -5.779 1.00 0.00 H new ATOM 0 HB3 ALA A 176 3.146 17.561 -5.964 1.00 0.00 H new ATOM 2684 N LEU A 177 1.203 15.544 -7.052 1.00 0.00 N ATOM 2685 CA LEU A 177 1.120 14.328 -7.868 1.00 0.00 C ATOM 2686 C LEU A 177 -0.315 14.068 -8.352 1.00 0.00 C ATOM 2687 O LEU A 177 -0.534 13.867 -9.555 1.00 0.00 O ATOM 2688 CB LEU A 177 1.682 13.090 -7.106 1.00 0.00 C ATOM 2689 CG LEU A 177 3.234 13.035 -6.929 1.00 0.00 C ATOM 2690 CD1 LEU A 177 3.665 11.772 -6.160 1.00 0.00 C ATOM 2691 CD2 LEU A 177 3.962 13.136 -8.286 1.00 0.00 C ATOM 0 H LEU A 177 1.431 15.371 -6.073 1.00 0.00 H new ATOM 0 HA LEU A 177 1.743 14.490 -8.748 1.00 0.00 H new ATOM 0 HB2 LEU A 177 1.223 13.059 -6.118 1.00 0.00 H new ATOM 0 HB3 LEU A 177 1.365 12.190 -7.633 1.00 0.00 H new ATOM 0 HG LEU A 177 3.525 13.901 -6.335 1.00 0.00 H new ATOM 0 HD11 LEU A 177 4.750 11.763 -6.053 1.00 0.00 H new ATOM 0 HD12 LEU A 177 3.203 11.772 -5.173 1.00 0.00 H new ATOM 0 HD13 LEU A 177 3.347 10.886 -6.709 1.00 0.00 H new ATOM 0 HD21 LEU A 177 5.039 13.094 -8.125 1.00 0.00 H new ATOM 0 HD22 LEU A 177 3.658 12.306 -8.924 1.00 0.00 H new ATOM 0 HD23 LEU A 177 3.703 14.079 -8.768 1.00 0.00 H new ATOM 2703 N VAL A 178 -1.308 14.119 -7.438 1.00 0.00 N ATOM 2704 CA VAL A 178 -2.661 13.600 -7.696 1.00 0.00 C ATOM 2705 C VAL A 178 -3.512 14.623 -8.479 1.00 0.00 C ATOM 2706 O VAL A 178 -4.367 14.228 -9.278 1.00 0.00 O ATOM 2707 CB VAL A 178 -3.388 13.167 -6.368 1.00 0.00 C ATOM 2708 CG1 VAL A 178 -3.710 14.373 -5.447 1.00 0.00 C ATOM 2709 CG2 VAL A 178 -4.659 12.348 -6.687 1.00 0.00 C ATOM 0 H VAL A 178 -1.192 14.519 -6.507 1.00 0.00 H new ATOM 0 HA VAL A 178 -2.548 12.708 -8.312 1.00 0.00 H new ATOM 0 HB VAL A 178 -2.697 12.532 -5.814 1.00 0.00 H new ATOM 0 HG11 VAL A 178 -4.211 14.019 -4.546 1.00 0.00 H new ATOM 0 HG12 VAL A 178 -2.784 14.879 -5.173 1.00 0.00 H new ATOM 0 HG13 VAL A 178 -4.362 15.070 -5.974 1.00 0.00 H new ATOM 0 HG21 VAL A 178 -5.148 12.058 -5.757 1.00 0.00 H new ATOM 0 HG22 VAL A 178 -5.342 12.954 -7.282 1.00 0.00 H new ATOM 0 HG23 VAL A 178 -4.385 11.454 -7.247 1.00 0.00 H new ATOM 2719 N HIS A 179 -3.229 15.934 -8.273 1.00 0.00 N ATOM 2720 CA HIS A 179 -3.916 17.042 -8.976 1.00 0.00 C ATOM 2721 C HIS A 179 -3.768 16.900 -10.506 1.00 0.00 C ATOM 2722 O HIS A 179 -4.660 17.291 -11.265 1.00 0.00 O ATOM 2723 CB HIS A 179 -3.348 18.422 -8.518 1.00 0.00 C ATOM 2724 CG HIS A 179 -3.587 18.785 -7.070 1.00 0.00 C ATOM 2725 ND1 HIS A 179 -3.056 19.904 -6.471 1.00 0.00 N ATOM 2726 CD2 HIS A 179 -4.299 18.159 -6.098 1.00 0.00 C ATOM 2727 CE1 HIS A 179 -3.441 19.920 -5.191 1.00 0.00 C ATOM 2728 NE2 HIS A 179 -4.202 18.881 -4.913 1.00 0.00 N ATOM 0 H HIS A 179 -2.518 16.250 -7.614 1.00 0.00 H new ATOM 0 HA HIS A 179 -4.974 16.992 -8.720 1.00 0.00 H new ATOM 0 HB2 HIS A 179 -2.274 18.431 -8.702 1.00 0.00 H new ATOM 0 HB3 HIS A 179 -3.785 19.199 -9.145 1.00 0.00 H new ATOM 0 HD2 HIS A 179 -4.855 17.242 -6.225 1.00 0.00 H new ATOM 0 HE1 HIS A 179 -3.165 20.684 -4.479 1.00 0.00 H new ATOM 0 HE2 HIS A 179 -4.631 18.653 -4.016 1.00 0.00 H new ATOM 2736 N SER A 180 -2.637 16.295 -10.926 1.00 0.00 N ATOM 2737 CA SER A 180 -2.302 16.050 -12.343 1.00 0.00 C ATOM 2738 C SER A 180 -3.319 15.111 -13.033 1.00 0.00 C ATOM 2739 O SER A 180 -3.515 15.189 -14.252 1.00 0.00 O ATOM 2740 CB SER A 180 -0.880 15.457 -12.427 1.00 0.00 C ATOM 2741 OG SER A 180 0.048 16.274 -11.730 1.00 0.00 O ATOM 0 H SER A 180 -1.922 15.959 -10.281 1.00 0.00 H new ATOM 0 HA SER A 180 -2.345 17.002 -12.872 1.00 0.00 H new ATOM 0 HB2 SER A 180 -0.875 14.452 -12.006 1.00 0.00 H new ATOM 0 HB3 SER A 180 -0.580 15.367 -13.471 1.00 0.00 H new ATOM 0 HG SER A 180 0.943 15.880 -11.794 1.00 0.00 H new