USER MOD reduce.3.24.130724 H: found=0, std=0, add=1183, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1185 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 15 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 176 THR OG1 : rot 180:sc= -0.584 USER MOD Set 1.3: A 178 HIS :FLIP no HE2:sc= -0.145 F(o=-1.3,f=-0.73) USER MOD Set 2.1: A 170 GLN :FLIP amide:sc= -0.545 F(o=-0.54,f=0.57) USER MOD Set 2.2: A 173 THR OG1 : rot 27:sc= 1.11 USER MOD Set 3.1: A 134 TYR OH : rot 143:sc= 0.187 USER MOD Set 3.2: A 136 THR OG1 : rot 25:sc= 0.0522 USER MOD Single : A 7 CYS SG : rot 180:sc= -0.152 USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -0.969 X(o=-0.97,f=-1.1) USER MOD Single : A 35 GLN : amide:sc= -1.48 K(o=-1.5,f=-2.5!) USER MOD Single : A 39 CYS SG : rot 38:sc= 0.632 USER MOD Single : A 40 HIS : no HD1:sc= -3.53 K(o=-3.5,f=-4.9!) USER MOD Single : A 43 THR OG1 : rot 144:sc= 0.658 USER MOD Single : A 45 GLN :FLIP amide:sc= -1.05 F(o=-1.9,f=-1) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 HIS : no HD1:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 HIS :FLIP no HE2:sc= -1.91! C(o=-2.5!,f=-1.9!) USER MOD Single : A 75 GLN : amide:sc=-0.00576 X(o=-0.0058,f=0) USER MOD Single : A 81 HIS : no HE2:sc= -1.03 K(o=-1,f=-3.1!) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= -0.106 X(o=-0.11,f=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -0.513 X(o=-0.51,f=-0.84) USER MOD Single : A 99 CYS SG : rot -130:sc= -1.19 USER MOD Single : A 100 GLN : amide:sc= -0.589 K(o=-0.59,f=-3!) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= -1.35 X(o=-1.4,f=-1.4) USER MOD Single : A 110 GLN : amide:sc= -0.64 K(o=-0.64,f=-4.4!) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0.056 USER MOD Single : A 125 HIS :FLIP no HE2:sc= -1.31 F(o=-2.4,f=-1.3) USER MOD Single : A 126 GLN : amide:sc= -0.933 X(o=-0.93,f=-1) USER MOD Single : A 133 GLN : amide:sc= -0.334 K(o=-0.33,f=-0.87) USER MOD Single : A 135 GLN : amide:sc= -0.0432 K(o=-0.043,f=-0.57) USER MOD Single : A 141 THR OG1 : rot 70:sc= 0.0914 USER MOD Single : A 143 ASN : amide:sc= -0.318 K(o=-0.32,f=-5.2!) USER MOD Single : A 144 GLN : amide:sc= 0.187 X(o=0.19,f=0) USER MOD Single : A 164 SER OG : rot 180:sc= 0 USER MOD Single : A 174 SER OG : rot -111:sc= -0.246 USER MOD ----------------------------------------------------------------- ATOM 63 N ARG A 5 3.217 15.870 -6.035 1.00 0.00 N ATOM 64 CA ARG A 5 4.240 16.077 -5.008 1.00 0.00 C ATOM 65 C ARG A 5 4.844 14.746 -4.561 1.00 0.00 C ATOM 66 O ARG A 5 4.220 13.982 -3.820 1.00 0.00 O ATOM 67 CB ARG A 5 3.661 16.832 -3.804 1.00 0.00 C ATOM 68 CG ARG A 5 2.373 16.236 -3.256 1.00 0.00 C ATOM 69 CD ARG A 5 1.845 17.027 -2.067 1.00 0.00 C ATOM 70 NE ARG A 5 0.754 17.929 -2.445 1.00 0.00 N ATOM 71 CZ ARG A 5 0.306 18.928 -1.678 1.00 0.00 C ATOM 72 NH1 ARG A 5 0.837 19.149 -0.479 1.00 0.00 N ATOM 73 NH2 ARG A 5 -0.680 19.706 -2.109 1.00 0.00 N ATOM 0 HA ARG A 5 5.033 16.683 -5.446 1.00 0.00 H new ATOM 0 HB2 ARG A 5 4.406 16.852 -3.009 1.00 0.00 H new ATOM 0 HB3 ARG A 5 3.476 17.867 -4.093 1.00 0.00 H new ATOM 0 HG2 ARG A 5 1.619 16.215 -4.043 1.00 0.00 H new ATOM 0 HG3 ARG A 5 2.549 15.203 -2.956 1.00 0.00 H new ATOM 0 HD2 ARG A 5 1.494 16.337 -1.300 1.00 0.00 H new ATOM 0 HD3 ARG A 5 2.657 17.606 -1.628 1.00 0.00 H new ATOM 0 HE ARG A 5 0.308 17.786 -3.351 1.00 0.00 H new ATOM 0 HH11 ARG A 5 1.592 18.554 -0.138 1.00 0.00 H new ATOM 0 HH12 ARG A 5 0.489 19.913 0.100 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -1.096 19.541 -3.026 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -1.021 20.468 -1.523 1.00 0.00 H new ATOM 87 N ASP A 6 6.061 14.474 -5.027 1.00 0.00 N ATOM 88 CA ASP A 6 6.763 13.237 -4.692 1.00 0.00 C ATOM 89 C ASP A 6 7.538 13.382 -3.377 1.00 0.00 C ATOM 90 O ASP A 6 8.208 14.392 -3.151 1.00 0.00 O ATOM 91 CB ASP A 6 7.720 12.849 -5.824 1.00 0.00 C ATOM 92 CG ASP A 6 7.003 12.571 -7.136 1.00 0.00 C ATOM 93 OD1 ASP A 6 6.524 13.536 -7.770 1.00 0.00 O ATOM 94 OD2 ASP A 6 6.924 11.389 -7.534 1.00 0.00 O ATOM 0 H ASP A 6 6.584 15.098 -5.641 1.00 0.00 H new ATOM 0 HA ASP A 6 6.020 12.450 -4.566 1.00 0.00 H new ATOM 0 HB2 ASP A 6 8.442 13.652 -5.973 1.00 0.00 H new ATOM 0 HB3 ASP A 6 8.284 11.964 -5.529 1.00 0.00 H new ATOM 99 N CYS A 7 7.438 12.369 -2.517 1.00 0.00 N ATOM 100 CA CYS A 7 8.123 12.379 -1.225 1.00 0.00 C ATOM 101 C CYS A 7 9.326 11.431 -1.233 1.00 0.00 C ATOM 102 O CYS A 7 9.253 10.332 -1.783 1.00 0.00 O ATOM 103 CB CYS A 7 7.152 11.986 -0.108 1.00 0.00 C ATOM 104 SG CYS A 7 5.956 13.273 0.315 1.00 0.00 S ATOM 0 H CYS A 7 6.887 11.529 -2.693 1.00 0.00 H new ATOM 0 HA CYS A 7 8.486 13.390 -1.042 1.00 0.00 H new ATOM 0 HB2 CYS A 7 6.612 11.088 -0.409 1.00 0.00 H new ATOM 0 HB3 CYS A 7 7.725 11.730 0.783 1.00 0.00 H new ATOM 0 HG CYS A 7 5.178 12.847 1.266 1.00 0.00 H new ATOM 110 N PRO A 8 10.453 11.851 -0.618 1.00 0.00 N ATOM 111 CA PRO A 8 11.674 11.039 -0.557 1.00 0.00 C ATOM 112 C PRO A 8 11.557 9.871 0.422 1.00 0.00 C ATOM 113 O PRO A 8 11.245 10.064 1.598 1.00 0.00 O ATOM 114 CB PRO A 8 12.734 12.035 -0.081 1.00 0.00 C ATOM 115 CG PRO A 8 11.974 13.042 0.713 1.00 0.00 C ATOM 116 CD PRO A 8 10.621 13.153 0.062 1.00 0.00 C ATOM 0 HA PRO A 8 11.902 10.575 -1.517 1.00 0.00 H new ATOM 0 HB2 PRO A 8 13.495 11.544 0.526 1.00 0.00 H new ATOM 0 HB3 PRO A 8 13.248 12.500 -0.923 1.00 0.00 H new ATOM 0 HG2 PRO A 8 11.881 12.729 1.753 1.00 0.00 H new ATOM 0 HG3 PRO A 8 12.486 14.004 0.714 1.00 0.00 H new ATOM 0 HD2 PRO A 8 9.835 13.325 0.798 1.00 0.00 H new ATOM 0 HD3 PRO A 8 10.583 13.982 -0.645 1.00 0.00 H new ATOM 124 N LEU A 9 11.810 8.660 -0.073 1.00 0.00 N ATOM 125 CA LEU A 9 11.737 7.459 0.757 1.00 0.00 C ATOM 126 C LEU A 9 13.122 6.843 0.934 1.00 0.00 C ATOM 127 O LEU A 9 13.773 6.471 -0.044 1.00 0.00 O ATOM 128 CB LEU A 9 10.778 6.438 0.138 1.00 0.00 C ATOM 129 CG LEU A 9 9.400 6.365 0.800 1.00 0.00 C ATOM 130 CD1 LEU A 9 8.414 7.283 0.087 1.00 0.00 C ATOM 131 CD2 LEU A 9 8.889 4.932 0.813 1.00 0.00 C ATOM 0 H LEU A 9 12.067 8.485 -1.044 1.00 0.00 H new ATOM 0 HA LEU A 9 11.357 7.744 1.738 1.00 0.00 H new ATOM 0 HB2 LEU A 9 10.646 6.678 -0.917 1.00 0.00 H new ATOM 0 HB3 LEU A 9 11.240 5.452 0.185 1.00 0.00 H new ATOM 0 HG LEU A 9 9.495 6.703 1.832 1.00 0.00 H new ATOM 0 HD11 LEU A 9 7.440 7.218 0.572 1.00 0.00 H new ATOM 0 HD12 LEU A 9 8.774 8.311 0.134 1.00 0.00 H new ATOM 0 HD13 LEU A 9 8.322 6.978 -0.955 1.00 0.00 H new ATOM 0 HD21 LEU A 9 7.908 4.900 1.287 1.00 0.00 H new ATOM 0 HD22 LEU A 9 8.809 4.565 -0.210 1.00 0.00 H new ATOM 0 HD23 LEU A 9 9.583 4.303 1.371 1.00 0.00 H new ATOM 143 N PHE A 10 13.567 6.748 2.190 1.00 0.00 N ATOM 144 CA PHE A 10 14.881 6.185 2.513 1.00 0.00 C ATOM 145 C PHE A 10 15.996 6.939 1.786 1.00 0.00 C ATOM 146 O PHE A 10 16.896 6.328 1.204 1.00 0.00 O ATOM 147 CB PHE A 10 14.933 4.694 2.160 1.00 0.00 C ATOM 148 CG PHE A 10 14.156 3.821 3.102 1.00 0.00 C ATOM 149 CD1 PHE A 10 14.652 3.524 4.361 1.00 0.00 C ATOM 150 CD2 PHE A 10 12.930 3.295 2.727 1.00 0.00 C ATOM 151 CE1 PHE A 10 13.941 2.720 5.228 1.00 0.00 C ATOM 152 CE2 PHE A 10 12.214 2.490 3.591 1.00 0.00 C ATOM 153 CZ PHE A 10 12.720 2.201 4.844 1.00 0.00 C ATOM 0 H PHE A 10 13.034 7.055 3.003 1.00 0.00 H new ATOM 0 HA PHE A 10 15.036 6.296 3.586 1.00 0.00 H new ATOM 0 HB2 PHE A 10 14.548 4.556 1.150 1.00 0.00 H new ATOM 0 HB3 PHE A 10 15.973 4.368 2.152 1.00 0.00 H new ATOM 0 HD1 PHE A 10 15.606 3.926 4.667 1.00 0.00 H new ATOM 0 HD2 PHE A 10 12.530 3.517 1.749 1.00 0.00 H new ATOM 0 HE1 PHE A 10 14.339 2.497 6.207 1.00 0.00 H new ATOM 0 HE2 PHE A 10 11.259 2.087 3.288 1.00 0.00 H new ATOM 0 HZ PHE A 10 12.162 1.571 5.521 1.00 0.00 H new ATOM 163 N GLY A 11 15.931 8.270 1.826 1.00 0.00 N ATOM 164 CA GLY A 11 16.942 9.088 1.174 1.00 0.00 C ATOM 165 C GLY A 11 16.574 9.506 -0.245 1.00 0.00 C ATOM 166 O GLY A 11 17.275 10.320 -0.847 1.00 0.00 O ATOM 0 H GLY A 11 15.196 8.796 2.299 1.00 0.00 H new ATOM 0 HA2 GLY A 11 17.114 9.982 1.773 1.00 0.00 H new ATOM 0 HA3 GLY A 11 17.881 8.536 1.148 1.00 0.00 H new ATOM 170 N GLY A 12 15.479 8.957 -0.780 1.00 0.00 N ATOM 171 CA GLY A 12 15.053 9.303 -2.128 1.00 0.00 C ATOM 172 C GLY A 12 15.081 8.121 -3.090 1.00 0.00 C ATOM 173 O GLY A 12 15.252 8.308 -4.295 1.00 0.00 O ATOM 0 H GLY A 12 14.882 8.281 -0.303 1.00 0.00 H new ATOM 0 HA2 GLY A 12 14.042 9.708 -2.090 1.00 0.00 H new ATOM 0 HA3 GLY A 12 15.698 10.092 -2.514 1.00 0.00 H new ATOM 177 N ALA A 13 14.901 6.906 -2.565 1.00 0.00 N ATOM 178 CA ALA A 13 14.899 5.701 -3.399 1.00 0.00 C ATOM 179 C ALA A 13 13.541 5.513 -4.070 1.00 0.00 C ATOM 180 O ALA A 13 13.454 5.023 -5.196 1.00 0.00 O ATOM 181 CB ALA A 13 15.257 4.476 -2.567 1.00 0.00 C ATOM 0 H ALA A 13 14.755 6.731 -1.571 1.00 0.00 H new ATOM 0 HA ALA A 13 15.652 5.822 -4.178 1.00 0.00 H new ATOM 0 HB1 ALA A 13 15.251 3.590 -3.202 1.00 0.00 H new ATOM 0 HB2 ALA A 13 16.250 4.606 -2.136 1.00 0.00 H new ATOM 0 HB3 ALA A 13 14.527 4.354 -1.767 1.00 0.00 H new ATOM 187 N PHE A 14 12.483 5.915 -3.365 1.00 0.00 N ATOM 188 CA PHE A 14 11.125 5.810 -3.879 1.00 0.00 C ATOM 189 C PHE A 14 10.427 7.161 -3.816 1.00 0.00 C ATOM 190 O PHE A 14 10.612 7.918 -2.860 1.00 0.00 O ATOM 191 CB PHE A 14 10.331 4.774 -3.081 1.00 0.00 C ATOM 192 CG PHE A 14 10.585 3.360 -3.516 1.00 0.00 C ATOM 193 CD1 PHE A 14 10.258 2.944 -4.797 1.00 0.00 C ATOM 194 CD2 PHE A 14 11.150 2.447 -2.641 1.00 0.00 C ATOM 195 CE1 PHE A 14 10.489 1.643 -5.196 1.00 0.00 C ATOM 196 CE2 PHE A 14 11.384 1.144 -3.037 1.00 0.00 C ATOM 197 CZ PHE A 14 11.051 0.741 -4.316 1.00 0.00 C ATOM 0 H PHE A 14 12.546 6.319 -2.430 1.00 0.00 H new ATOM 0 HA PHE A 14 11.176 5.489 -4.919 1.00 0.00 H new ATOM 0 HB2 PHE A 14 10.581 4.871 -2.025 1.00 0.00 H new ATOM 0 HB3 PHE A 14 9.267 4.990 -3.178 1.00 0.00 H new ATOM 0 HD1 PHE A 14 9.818 3.645 -5.490 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.410 2.756 -1.640 1.00 0.00 H new ATOM 0 HE1 PHE A 14 10.230 1.331 -6.197 1.00 0.00 H new ATOM 0 HE2 PHE A 14 11.827 0.441 -2.347 1.00 0.00 H new ATOM 0 HZ PHE A 14 11.230 -0.278 -4.626 1.00 0.00 H new ATOM 207 N SER A 15 9.626 7.462 -4.836 1.00 0.00 N ATOM 208 CA SER A 15 8.903 8.724 -4.889 1.00 0.00 C ATOM 209 C SER A 15 7.413 8.494 -4.676 1.00 0.00 C ATOM 210 O SER A 15 6.743 7.879 -5.508 1.00 0.00 O ATOM 211 CB SER A 15 9.156 9.425 -6.222 1.00 0.00 C ATOM 212 OG SER A 15 10.279 10.284 -6.140 1.00 0.00 O ATOM 0 H SER A 15 9.463 6.848 -5.634 1.00 0.00 H new ATOM 0 HA SER A 15 9.267 9.367 -4.088 1.00 0.00 H new ATOM 0 HB2 SER A 15 9.319 8.682 -7.002 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.275 9.999 -6.508 1.00 0.00 H new ATOM 0 HG SER A 15 10.421 10.720 -7.006 1.00 0.00 H new ATOM 218 N ALA A 16 6.908 8.980 -3.544 1.00 0.00 N ATOM 219 CA ALA A 16 5.500 8.816 -3.193 1.00 0.00 C ATOM 220 C ALA A 16 4.702 10.098 -3.408 1.00 0.00 C ATOM 221 O ALA A 16 5.068 11.165 -2.912 1.00 0.00 O ATOM 222 CB ALA A 16 5.371 8.347 -1.751 1.00 0.00 C ATOM 0 H ALA A 16 7.456 9.492 -2.852 1.00 0.00 H new ATOM 0 HA ALA A 16 5.082 8.060 -3.857 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.317 8.228 -1.500 1.00 0.00 H new ATOM 0 HB2 ALA A 16 5.882 7.392 -1.632 1.00 0.00 H new ATOM 0 HB3 ALA A 16 5.821 9.085 -1.087 1.00 0.00 H new ATOM 228 N ILE A 17 3.600 9.976 -4.139 1.00 0.00 N ATOM 229 CA ILE A 17 2.728 11.107 -4.417 1.00 0.00 C ATOM 230 C ILE A 17 1.735 11.309 -3.272 1.00 0.00 C ATOM 231 O ILE A 17 1.129 10.347 -2.794 1.00 0.00 O ATOM 232 CB ILE A 17 1.944 10.908 -5.731 1.00 0.00 C ATOM 233 CG1 ILE A 17 2.881 10.483 -6.871 1.00 0.00 C ATOM 234 CG2 ILE A 17 1.193 12.177 -6.096 1.00 0.00 C ATOM 235 CD1 ILE A 17 3.872 11.551 -7.285 1.00 0.00 C ATOM 0 H ILE A 17 3.289 9.097 -4.552 1.00 0.00 H new ATOM 0 HA ILE A 17 3.363 11.987 -4.517 1.00 0.00 H new ATOM 0 HB ILE A 17 1.219 10.109 -5.579 1.00 0.00 H new ATOM 0 HG12 ILE A 17 3.429 9.593 -6.564 1.00 0.00 H new ATOM 0 HG13 ILE A 17 2.280 10.204 -7.737 1.00 0.00 H new ATOM 0 HG21 ILE A 17 0.645 12.021 -7.025 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.493 12.427 -5.299 1.00 0.00 H new ATOM 0 HG23 ILE A 17 1.902 12.995 -6.226 1.00 0.00 H new ATOM 0 HD11 ILE A 17 4.497 11.173 -8.094 1.00 0.00 H new ATOM 0 HD12 ILE A 17 3.333 12.435 -7.625 1.00 0.00 H new ATOM 0 HD13 ILE A 17 4.500 11.814 -6.434 1.00 0.00 H new ATOM 247 N LEU A 18 1.573 12.556 -2.832 1.00 0.00 N ATOM 248 CA LEU A 18 0.654 12.871 -1.734 1.00 0.00 C ATOM 249 C LEU A 18 -0.367 13.934 -2.152 1.00 0.00 C ATOM 250 O LEU A 18 -0.042 14.855 -2.898 1.00 0.00 O ATOM 251 CB LEU A 18 1.442 13.358 -0.513 1.00 0.00 C ATOM 252 CG LEU A 18 1.942 12.258 0.431 1.00 0.00 C ATOM 253 CD1 LEU A 18 0.771 11.517 1.055 1.00 0.00 C ATOM 254 CD2 LEU A 18 2.861 11.288 -0.300 1.00 0.00 C ATOM 0 H LEU A 18 2.063 13.364 -3.216 1.00 0.00 H new ATOM 0 HA LEU A 18 0.112 11.961 -1.477 1.00 0.00 H new ATOM 0 HB2 LEU A 18 2.301 13.932 -0.862 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.812 14.042 0.056 1.00 0.00 H new ATOM 0 HG LEU A 18 2.516 12.731 1.228 1.00 0.00 H new ATOM 0 HD11 LEU A 18 1.146 10.740 1.722 1.00 0.00 H new ATOM 0 HD12 LEU A 18 0.158 12.217 1.622 1.00 0.00 H new ATOM 0 HD13 LEU A 18 0.169 11.061 0.269 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.202 10.518 0.392 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.318 10.822 -1.123 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.722 11.829 -0.693 1.00 0.00 H new ATOM 266 N PRO A 19 -1.622 13.822 -1.670 1.00 0.00 N ATOM 267 CA PRO A 19 -2.686 14.785 -1.996 1.00 0.00 C ATOM 268 C PRO A 19 -2.528 16.109 -1.243 1.00 0.00 C ATOM 269 O PRO A 19 -1.590 16.279 -0.460 1.00 0.00 O ATOM 270 CB PRO A 19 -3.955 14.064 -1.541 1.00 0.00 C ATOM 271 CG PRO A 19 -3.506 13.184 -0.427 1.00 0.00 C ATOM 272 CD PRO A 19 -2.104 12.753 -0.771 1.00 0.00 C ATOM 0 HA PRO A 19 -2.682 15.058 -3.051 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -4.715 14.771 -1.207 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -4.394 13.484 -2.353 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -3.527 13.718 0.523 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -4.164 12.321 -0.323 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -1.481 12.667 0.119 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -2.093 11.780 -1.263 1.00 0.00 H new ATOM 280 N MET A 20 -3.453 17.043 -1.475 1.00 0.00 N ATOM 281 CA MET A 20 -3.414 18.348 -0.808 1.00 0.00 C ATOM 282 C MET A 20 -3.825 18.240 0.663 1.00 0.00 C ATOM 283 O MET A 20 -3.337 18.995 1.503 1.00 0.00 O ATOM 284 CB MET A 20 -4.308 19.365 -1.531 1.00 0.00 C ATOM 285 CG MET A 20 -5.776 18.968 -1.608 1.00 0.00 C ATOM 286 SD MET A 20 -6.793 19.822 -0.384 1.00 0.00 S ATOM 287 CE MET A 20 -8.220 20.275 -1.369 1.00 0.00 C ATOM 0 H MET A 20 -4.236 16.922 -2.117 1.00 0.00 H new ATOM 0 HA MET A 20 -2.383 18.698 -0.849 1.00 0.00 H new ATOM 0 HB2 MET A 20 -4.230 20.326 -1.022 1.00 0.00 H new ATOM 0 HB3 MET A 20 -3.929 19.509 -2.543 1.00 0.00 H new ATOM 0 HG2 MET A 20 -6.156 19.187 -2.606 1.00 0.00 H new ATOM 0 HG3 MET A 20 -5.865 17.892 -1.462 1.00 0.00 H new ATOM 0 HE1 MET A 20 -8.937 20.811 -0.746 1.00 0.00 H new ATOM 0 HE2 MET A 20 -7.905 20.916 -2.193 1.00 0.00 H new ATOM 0 HE3 MET A 20 -8.687 19.375 -1.768 1.00 0.00 H new ATOM 297 N GLY A 21 -4.724 17.299 0.967 1.00 0.00 N ATOM 298 CA GLY A 21 -5.179 17.115 2.338 1.00 0.00 C ATOM 299 C GLY A 21 -4.385 16.063 3.105 1.00 0.00 C ATOM 300 O GLY A 21 -4.783 15.667 4.201 1.00 0.00 O ATOM 0 H GLY A 21 -5.143 16.663 0.289 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -5.112 18.066 2.866 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -6.231 16.830 2.328 1.00 0.00 H new ATOM 304 N ALA A 22 -3.265 15.608 2.534 1.00 0.00 N ATOM 305 CA ALA A 22 -2.427 14.595 3.178 1.00 0.00 C ATOM 306 C ALA A 22 -1.667 15.168 4.371 1.00 0.00 C ATOM 307 O ALA A 22 -1.396 16.370 4.431 1.00 0.00 O ATOM 308 CB ALA A 22 -1.449 14.002 2.173 1.00 0.00 C ATOM 0 H ALA A 22 -2.919 15.925 1.628 1.00 0.00 H new ATOM 0 HA ALA A 22 -3.086 13.809 3.547 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -0.832 13.250 2.666 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -2.003 13.539 1.356 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -0.811 14.792 1.777 1.00 0.00 H new ATOM 314 N ILE A 23 -1.320 14.292 5.313 1.00 0.00 N ATOM 315 CA ILE A 23 -0.582 14.689 6.509 1.00 0.00 C ATOM 316 C ILE A 23 -0.088 13.457 7.277 1.00 0.00 C ATOM 317 O ILE A 23 -0.884 12.657 7.774 1.00 0.00 O ATOM 318 CB ILE A 23 -1.436 15.590 7.441 1.00 0.00 C ATOM 319 CG1 ILE A 23 -0.626 16.030 8.669 1.00 0.00 C ATOM 320 CG2 ILE A 23 -2.709 14.875 7.873 1.00 0.00 C ATOM 321 CD1 ILE A 23 0.721 16.638 8.337 1.00 0.00 C ATOM 0 H ILE A 23 -1.540 13.297 5.269 1.00 0.00 H new ATOM 0 HA ILE A 23 0.279 15.270 6.178 1.00 0.00 H new ATOM 0 HB ILE A 23 -1.718 16.480 6.878 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -1.210 16.755 9.235 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -0.473 15.168 9.318 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -3.289 15.528 8.525 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.301 14.622 6.993 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -2.450 13.963 8.410 1.00 0.00 H new ATOM 0 HD11 ILE A 23 1.229 16.922 9.259 1.00 0.00 H new ATOM 0 HD12 ILE A 23 1.327 15.909 7.799 1.00 0.00 H new ATOM 0 HD13 ILE A 23 0.578 17.521 7.715 1.00 0.00 H new ATOM 333 N ASP A 24 1.236 13.315 7.360 1.00 0.00 N ATOM 334 CA ASP A 24 1.852 12.190 8.059 1.00 0.00 C ATOM 335 C ASP A 24 1.548 12.254 9.552 1.00 0.00 C ATOM 336 O ASP A 24 1.854 13.251 10.210 1.00 0.00 O ATOM 337 CB ASP A 24 3.367 12.197 7.825 1.00 0.00 C ATOM 338 CG ASP A 24 4.068 10.952 8.348 1.00 0.00 C ATOM 339 OD1 ASP A 24 3.387 9.934 8.604 1.00 0.00 O ATOM 340 OD2 ASP A 24 5.305 10.997 8.503 1.00 0.00 O ATOM 0 H ASP A 24 1.903 13.969 6.950 1.00 0.00 H new ATOM 0 HA ASP A 24 1.435 11.263 7.664 1.00 0.00 H new ATOM 0 HB2 ASP A 24 3.561 12.292 6.757 1.00 0.00 H new ATOM 0 HB3 ASP A 24 3.797 13.075 8.306 1.00 0.00 H new ATOM 345 N VAL A 25 0.942 11.188 10.083 1.00 0.00 N ATOM 346 CA VAL A 25 0.594 11.132 11.498 1.00 0.00 C ATOM 347 C VAL A 25 1.806 10.839 12.393 1.00 0.00 C ATOM 348 O VAL A 25 1.644 10.604 13.590 1.00 0.00 O ATOM 349 CB VAL A 25 -0.504 10.084 11.777 1.00 0.00 C ATOM 350 CG1 VAL A 25 -1.868 10.609 11.349 1.00 0.00 C ATOM 351 CG2 VAL A 25 -0.193 8.762 11.092 1.00 0.00 C ATOM 0 H VAL A 25 0.684 10.356 9.552 1.00 0.00 H new ATOM 0 HA VAL A 25 0.216 12.124 11.744 1.00 0.00 H new ATOM 0 HB VAL A 25 -0.528 9.902 12.851 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -2.629 9.856 11.554 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -2.099 11.518 11.905 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -1.854 10.830 10.282 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -0.985 8.045 11.308 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -0.127 8.917 10.015 1.00 0.00 H new ATOM 0 HG23 VAL A 25 0.757 8.375 11.461 1.00 0.00 H new ATOM 361 N SER A 26 3.017 10.873 11.824 1.00 0.00 N ATOM 362 CA SER A 26 4.234 10.629 12.598 1.00 0.00 C ATOM 363 C SER A 26 4.341 11.621 13.759 1.00 0.00 C ATOM 364 O SER A 26 4.898 11.302 14.812 1.00 0.00 O ATOM 365 CB SER A 26 5.472 10.734 11.703 1.00 0.00 C ATOM 366 OG SER A 26 6.645 10.364 12.407 1.00 0.00 O ATOM 0 H SER A 26 3.177 11.066 10.835 1.00 0.00 H new ATOM 0 HA SER A 26 4.181 9.619 13.004 1.00 0.00 H new ATOM 0 HB2 SER A 26 5.350 10.091 10.831 1.00 0.00 H new ATOM 0 HB3 SER A 26 5.572 11.755 11.335 1.00 0.00 H new ATOM 0 HG SER A 26 7.421 10.438 11.812 1.00 0.00 H new ATOM 372 N ASP A 27 3.797 12.826 13.561 1.00 0.00 N ATOM 373 CA ASP A 27 3.820 13.859 14.595 1.00 0.00 C ATOM 374 C ASP A 27 2.883 13.506 15.753 1.00 0.00 C ATOM 375 O ASP A 27 3.122 13.900 16.895 1.00 0.00 O ATOM 376 CB ASP A 27 3.429 15.218 14.001 1.00 0.00 C ATOM 377 CG ASP A 27 4.251 16.358 14.570 1.00 0.00 C ATOM 378 OD1 ASP A 27 5.332 16.646 14.013 1.00 0.00 O ATOM 379 OD2 ASP A 27 3.815 16.962 15.571 1.00 0.00 O ATOM 0 H ASP A 27 3.337 13.107 12.695 1.00 0.00 H new ATOM 0 HA ASP A 27 4.836 13.918 14.984 1.00 0.00 H new ATOM 0 HB2 ASP A 27 3.555 15.188 12.919 1.00 0.00 H new ATOM 0 HB3 ASP A 27 2.372 15.405 14.193 1.00 0.00 H new ATOM 384 N LEU A 28 1.816 12.765 15.449 1.00 0.00 N ATOM 385 CA LEU A 28 0.841 12.361 16.458 1.00 0.00 C ATOM 386 C LEU A 28 1.149 10.968 17.028 1.00 0.00 C ATOM 387 O LEU A 28 0.820 10.682 18.181 1.00 0.00 O ATOM 388 CB LEU A 28 -0.565 12.374 15.849 1.00 0.00 C ATOM 389 CG LEU A 28 -1.716 12.482 16.854 1.00 0.00 C ATOM 390 CD1 LEU A 28 -1.796 13.888 17.433 1.00 0.00 C ATOM 391 CD2 LEU A 28 -3.036 12.099 16.193 1.00 0.00 C ATOM 0 H LEU A 28 1.607 12.432 14.508 1.00 0.00 H new ATOM 0 HA LEU A 28 0.898 13.074 17.281 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -0.633 13.210 15.153 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -0.698 11.463 15.266 1.00 0.00 H new ATOM 0 HG LEU A 28 -1.524 11.788 17.672 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -2.620 13.942 18.144 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -0.862 14.126 17.941 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -1.963 14.604 16.628 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -3.844 12.181 16.920 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -3.232 12.769 15.356 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -2.977 11.073 15.830 1.00 0.00 H new ATOM 403 N ARG A 29 1.768 10.101 16.217 1.00 0.00 N ATOM 404 CA ARG A 29 2.101 8.738 16.653 1.00 0.00 C ATOM 405 C ARG A 29 3.376 8.222 15.972 1.00 0.00 C ATOM 406 O ARG A 29 3.798 8.755 14.949 1.00 0.00 O ATOM 407 CB ARG A 29 0.937 7.787 16.355 1.00 0.00 C ATOM 408 CG ARG A 29 0.020 7.541 17.545 1.00 0.00 C ATOM 409 CD ARG A 29 -0.900 6.353 17.299 1.00 0.00 C ATOM 410 NE ARG A 29 -1.051 5.515 18.488 1.00 0.00 N ATOM 411 CZ ARG A 29 -1.852 5.814 19.517 1.00 0.00 C ATOM 412 NH1 ARG A 29 -2.576 6.931 19.508 1.00 0.00 N ATOM 413 NH2 ARG A 29 -1.928 4.991 20.557 1.00 0.00 N ATOM 0 H ARG A 29 2.047 10.317 15.260 1.00 0.00 H new ATOM 0 HA ARG A 29 2.280 8.771 17.728 1.00 0.00 H new ATOM 0 HB2 ARG A 29 0.348 8.196 15.534 1.00 0.00 H new ATOM 0 HB3 ARG A 29 1.339 6.832 16.015 1.00 0.00 H new ATOM 0 HG2 ARG A 29 0.619 7.361 18.437 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -0.577 8.432 17.737 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -1.879 6.713 16.984 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -0.503 5.752 16.481 1.00 0.00 H new ATOM 0 HE ARG A 29 -0.513 4.650 18.536 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -2.523 7.567 18.712 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -3.184 7.151 20.297 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -1.376 4.133 20.570 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -2.538 5.217 21.343 1.00 0.00 H new ATOM 427 N PRO A 30 4.008 7.172 16.542 1.00 0.00 N ATOM 428 CA PRO A 30 5.245 6.582 15.996 1.00 0.00 C ATOM 429 C PRO A 30 5.066 6.004 14.589 1.00 0.00 C ATOM 430 O PRO A 30 4.158 5.202 14.348 1.00 0.00 O ATOM 431 CB PRO A 30 5.584 5.457 16.986 1.00 0.00 C ATOM 432 CG PRO A 30 4.813 5.775 18.223 1.00 0.00 C ATOM 433 CD PRO A 30 3.569 6.479 17.767 1.00 0.00 C ATOM 0 HA PRO A 30 6.026 7.336 15.894 1.00 0.00 H new ATOM 0 HB2 PRO A 30 5.302 4.483 16.586 1.00 0.00 H new ATOM 0 HB3 PRO A 30 6.654 5.420 17.188 1.00 0.00 H new ATOM 0 HG2 PRO A 30 4.568 4.867 18.774 1.00 0.00 H new ATOM 0 HG3 PRO A 30 5.395 6.407 18.894 1.00 0.00 H new ATOM 0 HD2 PRO A 30 2.760 5.777 17.565 1.00 0.00 H new ATOM 0 HD3 PRO A 30 3.204 7.180 18.518 1.00 0.00 H new ATOM 441 N VAL A 31 5.941 6.410 13.663 1.00 0.00 N ATOM 442 CA VAL A 31 5.887 5.930 12.279 1.00 0.00 C ATOM 443 C VAL A 31 7.295 5.765 11.693 1.00 0.00 C ATOM 444 O VAL A 31 7.928 6.747 11.300 1.00 0.00 O ATOM 445 CB VAL A 31 5.077 6.887 11.373 1.00 0.00 C ATOM 446 CG1 VAL A 31 4.918 6.304 9.976 1.00 0.00 C ATOM 447 CG2 VAL A 31 3.716 7.192 11.984 1.00 0.00 C ATOM 0 H VAL A 31 6.696 7.071 13.848 1.00 0.00 H new ATOM 0 HA VAL A 31 5.389 4.961 12.306 1.00 0.00 H new ATOM 0 HB VAL A 31 5.631 7.822 11.292 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.345 6.994 9.357 1.00 0.00 H new ATOM 0 HG12 VAL A 31 5.901 6.149 9.532 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.393 5.351 10.037 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.166 7.867 11.328 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.155 6.265 12.104 1.00 0.00 H new ATOM 0 HG23 VAL A 31 3.852 7.663 12.958 1.00 0.00 H new ATOM 457 N PRO A 32 7.806 4.516 11.628 1.00 0.00 N ATOM 458 CA PRO A 32 9.146 4.230 11.086 1.00 0.00 C ATOM 459 C PRO A 32 9.230 4.441 9.571 1.00 0.00 C ATOM 460 O PRO A 32 8.209 4.444 8.883 1.00 0.00 O ATOM 461 CB PRO A 32 9.363 2.754 11.430 1.00 0.00 C ATOM 462 CG PRO A 32 7.992 2.184 11.550 1.00 0.00 C ATOM 463 CD PRO A 32 7.123 3.289 12.083 1.00 0.00 C ATOM 0 HA PRO A 32 9.899 4.898 11.505 1.00 0.00 H new ATOM 0 HB2 PRO A 32 9.935 2.247 10.653 1.00 0.00 H new ATOM 0 HB3 PRO A 32 9.920 2.643 12.360 1.00 0.00 H new ATOM 0 HG2 PRO A 32 7.629 1.836 10.583 1.00 0.00 H new ATOM 0 HG3 PRO A 32 7.985 1.325 12.221 1.00 0.00 H new ATOM 0 HD2 PRO A 32 6.108 3.226 11.691 1.00 0.00 H new ATOM 0 HD3 PRO A 32 7.048 3.251 13.170 1.00 0.00 H new ATOM 471 N ASP A 33 10.454 4.614 9.060 1.00 0.00 N ATOM 472 CA ASP A 33 10.677 4.826 7.625 1.00 0.00 C ATOM 473 C ASP A 33 10.092 3.687 6.788 1.00 0.00 C ATOM 474 O ASP A 33 9.478 3.927 5.750 1.00 0.00 O ATOM 475 CB ASP A 33 12.171 4.965 7.327 1.00 0.00 C ATOM 476 CG ASP A 33 12.567 6.392 7.002 1.00 0.00 C ATOM 477 OD1 ASP A 33 12.664 7.209 7.942 1.00 0.00 O ATOM 478 OD2 ASP A 33 12.780 6.691 5.809 1.00 0.00 O ATOM 0 H ASP A 33 11.307 4.611 9.620 1.00 0.00 H new ATOM 0 HA ASP A 33 10.166 5.749 7.352 1.00 0.00 H new ATOM 0 HB2 ASP A 33 12.744 4.619 8.188 1.00 0.00 H new ATOM 0 HB3 ASP A 33 12.433 4.319 6.489 1.00 0.00 H new ATOM 483 N ASN A 34 10.290 2.450 7.248 1.00 0.00 N ATOM 484 CA ASN A 34 9.777 1.276 6.538 1.00 0.00 C ATOM 485 C ASN A 34 8.252 1.333 6.399 1.00 0.00 C ATOM 486 O ASN A 34 7.689 0.778 5.454 1.00 0.00 O ATOM 487 CB ASN A 34 10.199 -0.017 7.247 1.00 0.00 C ATOM 488 CG ASN A 34 9.918 0.014 8.736 1.00 0.00 C ATOM 489 OD1 ASN A 34 10.806 0.293 9.541 1.00 0.00 O ATOM 490 ND2 ASN A 34 8.679 -0.273 9.107 1.00 0.00 N ATOM 0 H ASN A 34 10.800 2.235 8.105 1.00 0.00 H new ATOM 0 HA ASN A 34 10.209 1.281 5.537 1.00 0.00 H new ATOM 0 HB2 ASN A 34 9.673 -0.860 6.800 1.00 0.00 H new ATOM 0 HB3 ASN A 34 11.264 -0.184 7.086 1.00 0.00 H new ATOM 0 HD21 ASN A 34 8.429 -0.268 10.096 1.00 0.00 H new ATOM 0 HD22 ASN A 34 7.975 -0.499 8.404 1.00 0.00 H new ATOM 497 N GLN A 35 7.591 2.014 7.341 1.00 0.00 N ATOM 498 CA GLN A 35 6.138 2.152 7.317 1.00 0.00 C ATOM 499 C GLN A 35 5.735 3.563 6.886 1.00 0.00 C ATOM 500 O GLN A 35 6.590 4.425 6.670 1.00 0.00 O ATOM 501 CB GLN A 35 5.545 1.847 8.698 1.00 0.00 C ATOM 502 CG GLN A 35 5.523 0.365 9.049 1.00 0.00 C ATOM 503 CD GLN A 35 4.198 -0.078 9.647 1.00 0.00 C ATOM 504 OE1 GLN A 35 3.371 0.745 10.037 1.00 0.00 O ATOM 505 NE2 GLN A 35 3.988 -1.389 9.724 1.00 0.00 N ATOM 0 H GLN A 35 8.043 2.477 8.129 1.00 0.00 H new ATOM 0 HA GLN A 35 5.745 1.436 6.595 1.00 0.00 H new ATOM 0 HB2 GLN A 35 6.120 2.381 9.455 1.00 0.00 H new ATOM 0 HB3 GLN A 35 4.527 2.235 8.739 1.00 0.00 H new ATOM 0 HG2 GLN A 35 5.725 -0.219 8.151 1.00 0.00 H new ATOM 0 HG3 GLN A 35 6.325 0.152 9.756 1.00 0.00 H new ATOM 0 HE21 GLN A 35 4.699 -2.040 9.390 1.00 0.00 H new ATOM 0 HE22 GLN A 35 3.116 -1.744 10.117 1.00 0.00 H new ATOM 514 N GLU A 36 4.428 3.792 6.766 1.00 0.00 N ATOM 515 CA GLU A 36 3.905 5.096 6.365 1.00 0.00 C ATOM 516 C GLU A 36 2.428 5.214 6.719 1.00 0.00 C ATOM 517 O GLU A 36 1.623 4.370 6.325 1.00 0.00 O ATOM 518 CB GLU A 36 4.096 5.312 4.863 1.00 0.00 C ATOM 519 CG GLU A 36 5.080 6.423 4.526 1.00 0.00 C ATOM 520 CD GLU A 36 5.163 6.712 3.036 1.00 0.00 C ATOM 521 OE1 GLU A 36 4.139 6.562 2.336 1.00 0.00 O ATOM 522 OE2 GLU A 36 6.257 7.092 2.570 1.00 0.00 O ATOM 0 H GLU A 36 3.710 3.089 6.942 1.00 0.00 H new ATOM 0 HA GLU A 36 4.459 5.863 6.906 1.00 0.00 H new ATOM 0 HB2 GLU A 36 4.443 4.382 4.412 1.00 0.00 H new ATOM 0 HB3 GLU A 36 3.131 5.544 4.412 1.00 0.00 H new ATOM 0 HG2 GLU A 36 4.787 7.332 5.051 1.00 0.00 H new ATOM 0 HG3 GLU A 36 6.069 6.148 4.893 1.00 0.00 H new ATOM 529 N VAL A 37 2.075 6.258 7.461 1.00 0.00 N ATOM 530 CA VAL A 37 0.688 6.473 7.859 1.00 0.00 C ATOM 531 C VAL A 37 0.262 7.914 7.607 1.00 0.00 C ATOM 532 O VAL A 37 0.699 8.836 8.299 1.00 0.00 O ATOM 533 CB VAL A 37 0.457 6.121 9.343 1.00 0.00 C ATOM 534 CG1 VAL A 37 -1.031 6.124 9.665 1.00 0.00 C ATOM 535 CG2 VAL A 37 1.079 4.774 9.684 1.00 0.00 C ATOM 0 H VAL A 37 2.727 6.966 7.798 1.00 0.00 H new ATOM 0 HA VAL A 37 0.079 5.807 7.247 1.00 0.00 H new ATOM 0 HB VAL A 37 0.944 6.881 9.954 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -1.176 5.874 10.716 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -1.444 7.113 9.467 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.539 5.387 9.043 1.00 0.00 H new ATOM 0 HG21 VAL A 37 0.903 4.548 10.736 1.00 0.00 H new ATOM 0 HG22 VAL A 37 0.628 3.998 9.065 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.152 4.810 9.495 1.00 0.00 H new ATOM 545 N PHE A 38 -0.595 8.098 6.609 1.00 0.00 N ATOM 546 CA PHE A 38 -1.094 9.421 6.255 1.00 0.00 C ATOM 547 C PHE A 38 -2.580 9.540 6.579 1.00 0.00 C ATOM 548 O PHE A 38 -3.266 8.534 6.770 1.00 0.00 O ATOM 549 CB PHE A 38 -0.855 9.691 4.768 1.00 0.00 C ATOM 550 CG PHE A 38 0.584 9.963 4.433 1.00 0.00 C ATOM 551 CD1 PHE A 38 1.493 8.923 4.329 1.00 0.00 C ATOM 552 CD2 PHE A 38 1.026 11.258 4.226 1.00 0.00 C ATOM 553 CE1 PHE A 38 2.816 9.171 4.021 1.00 0.00 C ATOM 554 CE2 PHE A 38 2.349 11.512 3.918 1.00 0.00 C ATOM 555 CZ PHE A 38 3.244 10.466 3.815 1.00 0.00 C ATOM 0 H PHE A 38 -0.960 7.343 6.028 1.00 0.00 H new ATOM 0 HA PHE A 38 -0.554 10.163 6.842 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.198 8.832 4.191 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.459 10.544 4.460 1.00 0.00 H new ATOM 0 HD1 PHE A 38 1.163 7.907 4.491 1.00 0.00 H new ATOM 0 HD2 PHE A 38 0.329 12.079 4.306 1.00 0.00 H new ATOM 0 HE1 PHE A 38 3.515 8.352 3.941 1.00 0.00 H new ATOM 0 HE2 PHE A 38 2.682 12.527 3.758 1.00 0.00 H new ATOM 0 HZ PHE A 38 4.278 10.661 3.573 1.00 0.00 H new ATOM 565 N CYS A 39 -3.073 10.773 6.646 1.00 0.00 N ATOM 566 CA CYS A 39 -4.477 11.022 6.953 1.00 0.00 C ATOM 567 C CYS A 39 -4.985 12.277 6.243 1.00 0.00 C ATOM 568 O CYS A 39 -4.208 13.172 5.913 1.00 0.00 O ATOM 569 CB CYS A 39 -4.656 11.157 8.470 1.00 0.00 C ATOM 570 SG CYS A 39 -6.353 11.501 8.997 1.00 0.00 S ATOM 0 H CYS A 39 -2.520 11.616 6.492 1.00 0.00 H new ATOM 0 HA CYS A 39 -5.065 10.177 6.593 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -4.321 10.236 8.946 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -4.008 11.956 8.830 1.00 0.00 H new ATOM 0 HG CYS A 39 -7.182 10.829 8.255 1.00 0.00 H new ATOM 576 N HIS A 40 -6.296 12.331 6.014 1.00 0.00 N ATOM 577 CA HIS A 40 -6.918 13.474 5.347 1.00 0.00 C ATOM 578 C HIS A 40 -7.975 14.100 6.252 1.00 0.00 C ATOM 579 O HIS A 40 -9.122 13.657 6.269 1.00 0.00 O ATOM 580 CB HIS A 40 -7.559 13.055 4.018 1.00 0.00 C ATOM 581 CG HIS A 40 -6.728 12.101 3.214 1.00 0.00 C ATOM 582 ND1 HIS A 40 -7.265 11.038 2.517 1.00 0.00 N ATOM 583 CD2 HIS A 40 -5.392 12.048 3.004 1.00 0.00 C ATOM 584 CE1 HIS A 40 -6.296 10.373 1.917 1.00 0.00 C ATOM 585 NE2 HIS A 40 -5.152 10.965 2.196 1.00 0.00 N ATOM 0 H HIS A 40 -6.950 11.595 6.281 1.00 0.00 H new ATOM 0 HA HIS A 40 -6.139 14.207 5.139 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -8.526 12.595 4.222 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -7.749 13.947 3.421 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -4.653 12.730 3.398 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -6.419 9.494 1.302 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -4.235 10.666 1.864 1.00 0.00 H new ATOM 594 N PRO A 41 -7.597 15.136 7.026 1.00 0.00 N ATOM 595 CA PRO A 41 -8.518 15.822 7.948 1.00 0.00 C ATOM 596 C PRO A 41 -9.822 16.272 7.285 1.00 0.00 C ATOM 597 O PRO A 41 -10.839 16.434 7.960 1.00 0.00 O ATOM 598 CB PRO A 41 -7.714 17.038 8.410 1.00 0.00 C ATOM 599 CG PRO A 41 -6.290 16.630 8.266 1.00 0.00 C ATOM 600 CD PRO A 41 -6.240 15.717 7.071 1.00 0.00 C ATOM 0 HA PRO A 41 -8.836 15.159 8.753 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -7.938 17.914 7.802 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -7.948 17.298 9.442 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -5.648 17.499 8.121 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -5.938 16.120 9.162 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -6.007 16.264 6.157 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -5.477 14.947 7.185 1.00 0.00 H new ATOM 608 N VAL A 42 -9.787 16.482 5.968 1.00 0.00 N ATOM 609 CA VAL A 42 -10.966 16.923 5.226 1.00 0.00 C ATOM 610 C VAL A 42 -11.985 15.792 5.069 1.00 0.00 C ATOM 611 O VAL A 42 -13.123 15.900 5.529 1.00 0.00 O ATOM 612 CB VAL A 42 -10.585 17.451 3.823 1.00 0.00 C ATOM 613 CG1 VAL A 42 -11.800 18.041 3.119 1.00 0.00 C ATOM 614 CG2 VAL A 42 -9.463 18.478 3.920 1.00 0.00 C ATOM 0 H VAL A 42 -8.954 16.353 5.394 1.00 0.00 H new ATOM 0 HA VAL A 42 -11.413 17.731 5.805 1.00 0.00 H new ATOM 0 HB VAL A 42 -10.226 16.611 3.229 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -11.508 18.406 2.134 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -12.565 17.273 3.009 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -12.197 18.867 3.709 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -9.211 18.836 2.922 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -9.790 19.317 4.535 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -8.585 18.016 4.373 1.00 0.00 H new ATOM 624 N THR A 43 -11.568 14.716 4.404 1.00 0.00 N ATOM 625 CA THR A 43 -12.436 13.562 4.159 1.00 0.00 C ATOM 626 C THR A 43 -12.427 12.566 5.329 1.00 0.00 C ATOM 627 O THR A 43 -13.147 11.566 5.298 1.00 0.00 O ATOM 628 CB THR A 43 -11.995 12.854 2.874 1.00 0.00 C ATOM 629 OG1 THR A 43 -11.818 13.786 1.821 1.00 0.00 O ATOM 630 CG2 THR A 43 -12.975 11.802 2.393 1.00 0.00 C ATOM 0 H THR A 43 -10.627 14.618 4.022 1.00 0.00 H new ATOM 0 HA THR A 43 -13.456 13.933 4.056 1.00 0.00 H new ATOM 0 HB THR A 43 -11.057 12.361 3.131 1.00 0.00 H new ATOM 0 HG1 THR A 43 -11.058 13.512 1.266 1.00 0.00 H new ATOM 0 HG21 THR A 43 -12.597 11.343 1.479 1.00 0.00 H new ATOM 0 HG22 THR A 43 -13.094 11.037 3.161 1.00 0.00 H new ATOM 0 HG23 THR A 43 -13.940 12.268 2.192 1.00 0.00 H new ATOM 638 N ASP A 44 -11.604 12.830 6.351 1.00 0.00 N ATOM 639 CA ASP A 44 -11.495 11.946 7.512 1.00 0.00 C ATOM 640 C ASP A 44 -11.037 10.543 7.098 1.00 0.00 C ATOM 641 O ASP A 44 -11.416 9.542 7.715 1.00 0.00 O ATOM 642 CB ASP A 44 -12.832 11.871 8.259 1.00 0.00 C ATOM 643 CG ASP A 44 -12.657 11.926 9.765 1.00 0.00 C ATOM 644 OD1 ASP A 44 -12.022 11.008 10.324 1.00 0.00 O ATOM 645 OD2 ASP A 44 -13.154 12.889 10.383 1.00 0.00 O ATOM 0 H ASP A 44 -11.003 13.653 6.395 1.00 0.00 H new ATOM 0 HA ASP A 44 -10.743 12.364 8.181 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -13.470 12.695 7.940 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -13.345 10.948 7.989 1.00 0.00 H new ATOM 650 N GLN A 45 -10.210 10.477 6.051 1.00 0.00 N ATOM 651 CA GLN A 45 -9.691 9.207 5.553 1.00 0.00 C ATOM 652 C GLN A 45 -8.350 8.882 6.209 1.00 0.00 C ATOM 653 O GLN A 45 -7.806 9.695 6.957 1.00 0.00 O ATOM 654 CB GLN A 45 -9.522 9.272 4.033 1.00 0.00 C ATOM 655 CG GLN A 45 -9.944 8.005 3.310 1.00 0.00 C ATOM 656 CD GLN A 45 -10.359 8.271 1.877 1.00 0.00 C ATOM 657 OE1 GLN A 45 -11.626 8.615 1.681 1.00 0.00 O flip ATOM 658 NE2 GLN A 45 -9.549 8.173 0.957 1.00 0.00 N flip ATOM 0 H GLN A 45 -9.886 11.293 5.532 1.00 0.00 H new ATOM 0 HA GLN A 45 -10.402 8.420 5.803 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -10.105 10.109 3.648 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.477 9.479 3.802 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -9.120 7.292 3.321 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -10.773 7.542 3.846 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -8.584 7.906 1.153 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -9.842 8.359 -0.002 1.00 0.00 H new ATOM 667 N SER A 46 -7.816 7.695 5.917 1.00 0.00 N ATOM 668 CA SER A 46 -6.534 7.277 6.478 1.00 0.00 C ATOM 669 C SER A 46 -5.813 6.312 5.538 1.00 0.00 C ATOM 670 O SER A 46 -6.376 5.295 5.126 1.00 0.00 O ATOM 671 CB SER A 46 -6.731 6.628 7.851 1.00 0.00 C ATOM 672 OG SER A 46 -5.672 6.970 8.731 1.00 0.00 O ATOM 0 H SER A 46 -8.250 7.010 5.298 1.00 0.00 H new ATOM 0 HA SER A 46 -5.916 8.167 6.597 1.00 0.00 H new ATOM 0 HB2 SER A 46 -7.681 6.951 8.277 1.00 0.00 H new ATOM 0 HB3 SER A 46 -6.782 5.545 7.741 1.00 0.00 H new ATOM 0 HG SER A 46 -5.820 6.546 9.602 1.00 0.00 H new ATOM 678 N LEU A 47 -4.566 6.643 5.205 1.00 0.00 N ATOM 679 CA LEU A 47 -3.759 5.816 4.313 1.00 0.00 C ATOM 680 C LEU A 47 -2.558 5.230 5.048 1.00 0.00 C ATOM 681 O LEU A 47 -1.919 5.913 5.850 1.00 0.00 O ATOM 682 CB LEU A 47 -3.283 6.635 3.112 1.00 0.00 C ATOM 683 CG LEU A 47 -4.064 6.397 1.817 1.00 0.00 C ATOM 684 CD1 LEU A 47 -5.498 6.888 1.955 1.00 0.00 C ATOM 685 CD2 LEU A 47 -3.368 7.081 0.649 1.00 0.00 C ATOM 0 H LEU A 47 -4.093 7.481 5.542 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.383 4.995 3.961 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.343 7.693 3.366 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.232 6.410 2.931 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.093 5.325 1.621 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -6.035 6.709 1.023 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -5.990 6.351 2.766 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -5.497 7.956 2.174 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -3.934 6.904 -0.266 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.309 8.153 0.838 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.362 6.677 0.538 1.00 0.00 H new ATOM 697 N ILE A 48 -2.257 3.962 4.772 1.00 0.00 N ATOM 698 CA ILE A 48 -1.134 3.283 5.411 1.00 0.00 C ATOM 699 C ILE A 48 -0.348 2.444 4.401 1.00 0.00 C ATOM 700 O ILE A 48 -0.928 1.668 3.641 1.00 0.00 O ATOM 701 CB ILE A 48 -1.603 2.374 6.574 1.00 0.00 C ATOM 702 CG1 ILE A 48 -2.575 3.123 7.495 1.00 0.00 C ATOM 703 CG2 ILE A 48 -0.408 1.856 7.368 1.00 0.00 C ATOM 704 CD1 ILE A 48 -4.026 2.983 7.086 1.00 0.00 C ATOM 0 H ILE A 48 -2.776 3.385 4.110 1.00 0.00 H new ATOM 0 HA ILE A 48 -0.485 4.061 5.814 1.00 0.00 H new ATOM 0 HB ILE A 48 -2.128 1.521 6.145 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -2.456 2.753 8.513 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -2.310 4.180 7.507 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -0.759 1.220 8.180 1.00 0.00 H new ATOM 0 HG22 ILE A 48 0.243 1.280 6.711 1.00 0.00 H new ATOM 0 HG23 ILE A 48 0.147 2.698 7.781 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -4.655 3.538 7.782 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -4.160 3.380 6.080 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -4.309 1.930 7.102 1.00 0.00 H new ATOM 716 N VAL A 49 0.975 2.605 4.411 1.00 0.00 N ATOM 717 CA VAL A 49 1.858 1.867 3.511 1.00 0.00 C ATOM 718 C VAL A 49 2.867 1.046 4.310 1.00 0.00 C ATOM 719 O VAL A 49 3.588 1.588 5.151 1.00 0.00 O ATOM 720 CB VAL A 49 2.622 2.813 2.559 1.00 0.00 C ATOM 721 CG1 VAL A 49 3.386 2.018 1.510 1.00 0.00 C ATOM 722 CG2 VAL A 49 1.671 3.805 1.903 1.00 0.00 C ATOM 0 H VAL A 49 1.461 3.246 5.038 1.00 0.00 H new ATOM 0 HA VAL A 49 1.229 1.206 2.915 1.00 0.00 H new ATOM 0 HB VAL A 49 3.344 3.379 3.148 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.917 2.703 0.850 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.102 1.360 2.002 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.686 1.420 0.926 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.232 4.461 1.237 1.00 0.00 H new ATOM 0 HG22 VAL A 49 0.919 3.263 1.330 1.00 0.00 H new ATOM 0 HG23 VAL A 49 1.181 4.402 2.672 1.00 0.00 H new ATOM 732 N GLU A 50 2.913 -0.262 4.050 1.00 0.00 N ATOM 733 CA GLU A 50 3.834 -1.150 4.757 1.00 0.00 C ATOM 734 C GLU A 50 4.851 -1.780 3.807 1.00 0.00 C ATOM 735 O GLU A 50 4.506 -2.203 2.701 1.00 0.00 O ATOM 736 CB GLU A 50 3.058 -2.248 5.489 1.00 0.00 C ATOM 737 CG GLU A 50 3.767 -2.760 6.736 1.00 0.00 C ATOM 738 CD GLU A 50 3.548 -4.242 6.986 1.00 0.00 C ATOM 739 OE1 GLU A 50 3.544 -5.024 6.011 1.00 0.00 O ATOM 740 OE2 GLU A 50 3.384 -4.624 8.164 1.00 0.00 O ATOM 0 H GLU A 50 2.325 -0.727 3.358 1.00 0.00 H new ATOM 0 HA GLU A 50 4.379 -0.546 5.483 1.00 0.00 H new ATOM 0 HB2 GLU A 50 2.077 -1.864 5.769 1.00 0.00 H new ATOM 0 HB3 GLU A 50 2.891 -3.081 4.807 1.00 0.00 H new ATOM 0 HG2 GLU A 50 4.836 -2.569 6.642 1.00 0.00 H new ATOM 0 HG3 GLU A 50 3.417 -2.197 7.601 1.00 0.00 H new ATOM 747 N LEU A 51 6.104 -1.843 4.256 1.00 0.00 N ATOM 748 CA LEU A 51 7.183 -2.428 3.465 1.00 0.00 C ATOM 749 C LEU A 51 7.764 -3.655 4.168 1.00 0.00 C ATOM 750 O LEU A 51 8.196 -3.574 5.320 1.00 0.00 O ATOM 751 CB LEU A 51 8.286 -1.395 3.222 1.00 0.00 C ATOM 752 CG LEU A 51 9.444 -1.883 2.347 1.00 0.00 C ATOM 753 CD1 LEU A 51 9.182 -1.556 0.884 1.00 0.00 C ATOM 754 CD2 LEU A 51 10.756 -1.270 2.808 1.00 0.00 C ATOM 0 H LEU A 51 6.397 -1.494 5.169 1.00 0.00 H new ATOM 0 HA LEU A 51 6.771 -2.739 2.505 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.843 -0.515 2.756 1.00 0.00 H new ATOM 0 HB3 LEU A 51 8.686 -1.078 4.185 1.00 0.00 H new ATOM 0 HG LEU A 51 9.519 -2.966 2.447 1.00 0.00 H new ATOM 0 HD11 LEU A 51 10.015 -1.910 0.277 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.264 -2.046 0.561 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.079 -0.477 0.765 1.00 0.00 H new ATOM 0 HD21 LEU A 51 11.567 -1.628 2.175 1.00 0.00 H new ATOM 0 HD22 LEU A 51 10.694 -0.184 2.739 1.00 0.00 H new ATOM 0 HD23 LEU A 51 10.949 -1.558 3.842 1.00 0.00 H new ATOM 766 N LEU A 52 7.766 -4.789 3.468 1.00 0.00 N ATOM 767 CA LEU A 52 8.291 -6.034 4.025 1.00 0.00 C ATOM 768 C LEU A 52 9.017 -6.862 2.966 1.00 0.00 C ATOM 769 O LEU A 52 8.988 -6.536 1.777 1.00 0.00 O ATOM 770 CB LEU A 52 7.154 -6.862 4.635 1.00 0.00 C ATOM 771 CG LEU A 52 7.450 -7.453 6.016 1.00 0.00 C ATOM 772 CD1 LEU A 52 7.483 -6.356 7.071 1.00 0.00 C ATOM 773 CD2 LEU A 52 6.417 -8.514 6.375 1.00 0.00 C ATOM 0 H LEU A 52 7.410 -4.871 2.516 1.00 0.00 H new ATOM 0 HA LEU A 52 9.009 -5.770 4.801 1.00 0.00 H new ATOM 0 HB2 LEU A 52 6.267 -6.233 4.709 1.00 0.00 H new ATOM 0 HB3 LEU A 52 6.912 -7.677 3.952 1.00 0.00 H new ATOM 0 HG LEU A 52 8.431 -7.927 5.985 1.00 0.00 H new ATOM 0 HD11 LEU A 52 7.695 -6.795 8.046 1.00 0.00 H new ATOM 0 HD12 LEU A 52 8.261 -5.634 6.821 1.00 0.00 H new ATOM 0 HD13 LEU A 52 6.517 -5.852 7.102 1.00 0.00 H new ATOM 0 HD21 LEU A 52 6.643 -8.923 7.360 1.00 0.00 H new ATOM 0 HD22 LEU A 52 5.424 -8.065 6.388 1.00 0.00 H new ATOM 0 HD23 LEU A 52 6.444 -9.314 5.635 1.00 0.00 H new ATOM 785 N GLU A 53 9.664 -7.939 3.410 1.00 0.00 N ATOM 786 CA GLU A 53 10.395 -8.825 2.511 1.00 0.00 C ATOM 787 C GLU A 53 9.675 -10.166 2.370 1.00 0.00 C ATOM 788 O GLU A 53 9.117 -10.685 3.340 1.00 0.00 O ATOM 789 CB GLU A 53 11.824 -9.039 3.022 1.00 0.00 C ATOM 790 CG GLU A 53 12.785 -7.921 2.635 1.00 0.00 C ATOM 791 CD GLU A 53 12.432 -6.587 3.272 1.00 0.00 C ATOM 792 OE1 GLU A 53 12.234 -6.548 4.505 1.00 0.00 O ATOM 793 OE2 GLU A 53 12.355 -5.581 2.533 1.00 0.00 O ATOM 0 H GLU A 53 9.695 -8.218 4.391 1.00 0.00 H new ATOM 0 HA GLU A 53 10.441 -8.356 1.528 1.00 0.00 H new ATOM 0 HB2 GLU A 53 11.803 -9.129 4.108 1.00 0.00 H new ATOM 0 HB3 GLU A 53 12.203 -9.984 2.632 1.00 0.00 H new ATOM 0 HG2 GLU A 53 13.797 -8.201 2.929 1.00 0.00 H new ATOM 0 HG3 GLU A 53 12.787 -7.810 1.551 1.00 0.00 H new ATOM 800 N LEU A 54 9.690 -10.714 1.152 1.00 0.00 N ATOM 801 CA LEU A 54 9.041 -11.995 0.859 1.00 0.00 C ATOM 802 C LEU A 54 9.424 -13.060 1.890 1.00 0.00 C ATOM 803 O LEU A 54 10.587 -13.458 1.981 1.00 0.00 O ATOM 804 CB LEU A 54 9.419 -12.464 -0.552 1.00 0.00 C ATOM 805 CG LEU A 54 8.257 -12.967 -1.414 1.00 0.00 C ATOM 806 CD1 LEU A 54 8.503 -12.638 -2.881 1.00 0.00 C ATOM 807 CD2 LEU A 54 8.066 -14.466 -1.226 1.00 0.00 C ATOM 0 H LEU A 54 10.148 -10.287 0.347 1.00 0.00 H new ATOM 0 HA LEU A 54 7.962 -11.849 0.912 1.00 0.00 H new ATOM 0 HB2 LEU A 54 9.904 -11.638 -1.073 1.00 0.00 H new ATOM 0 HB3 LEU A 54 10.156 -13.262 -0.465 1.00 0.00 H new ATOM 0 HG LEU A 54 7.345 -12.462 -1.096 1.00 0.00 H new ATOM 0 HD11 LEU A 54 7.668 -13.002 -3.480 1.00 0.00 H new ATOM 0 HD12 LEU A 54 8.593 -11.558 -3.002 1.00 0.00 H new ATOM 0 HD13 LEU A 54 9.424 -13.118 -3.212 1.00 0.00 H new ATOM 0 HD21 LEU A 54 7.237 -14.808 -1.845 1.00 0.00 H new ATOM 0 HD22 LEU A 54 8.977 -14.988 -1.519 1.00 0.00 H new ATOM 0 HD23 LEU A 54 7.848 -14.676 -0.179 1.00 0.00 H new ATOM 819 N GLN A 55 8.438 -13.513 2.667 1.00 0.00 N ATOM 820 CA GLN A 55 8.667 -14.527 3.696 1.00 0.00 C ATOM 821 C GLN A 55 8.388 -15.929 3.148 1.00 0.00 C ATOM 822 O GLN A 55 7.242 -16.266 2.848 1.00 0.00 O ATOM 823 CB GLN A 55 7.780 -14.248 4.914 1.00 0.00 C ATOM 824 CG GLN A 55 7.977 -15.229 6.062 1.00 0.00 C ATOM 825 CD GLN A 55 8.992 -14.742 7.081 1.00 0.00 C ATOM 826 OE1 GLN A 55 8.741 -13.786 7.814 1.00 0.00 O ATOM 827 NE2 GLN A 55 10.148 -15.398 7.134 1.00 0.00 N ATOM 0 H GLN A 55 7.472 -13.192 2.602 1.00 0.00 H new ATOM 0 HA GLN A 55 9.713 -14.481 4.000 1.00 0.00 H new ATOM 0 HB2 GLN A 55 7.981 -13.239 5.274 1.00 0.00 H new ATOM 0 HB3 GLN A 55 6.736 -14.273 4.603 1.00 0.00 H new ATOM 0 HG2 GLN A 55 7.021 -15.397 6.559 1.00 0.00 H new ATOM 0 HG3 GLN A 55 8.302 -16.190 5.662 1.00 0.00 H new ATOM 0 HE21 GLN A 55 10.316 -16.186 6.508 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.866 -15.113 7.800 1.00 0.00 H new ATOM 836 N ALA A 56 9.450 -16.735 3.023 1.00 0.00 N ATOM 837 CA ALA A 56 9.344 -18.104 2.507 1.00 0.00 C ATOM 838 C ALA A 56 8.832 -18.118 1.063 1.00 0.00 C ATOM 839 O ALA A 56 9.622 -18.221 0.124 1.00 0.00 O ATOM 840 CB ALA A 56 8.462 -18.959 3.410 1.00 0.00 C ATOM 0 H ALA A 56 10.399 -16.459 3.275 1.00 0.00 H new ATOM 0 HA ALA A 56 10.344 -18.537 2.505 1.00 0.00 H new ATOM 0 HB1 ALA A 56 8.399 -19.969 3.006 1.00 0.00 H new ATOM 0 HB2 ALA A 56 8.892 -18.994 4.411 1.00 0.00 H new ATOM 0 HB3 ALA A 56 7.463 -18.525 3.459 1.00 0.00 H new ATOM 846 N HIS A 57 7.513 -18.010 0.891 1.00 0.00 N ATOM 847 CA HIS A 57 6.906 -18.002 -0.442 1.00 0.00 C ATOM 848 C HIS A 57 5.601 -17.196 -0.453 1.00 0.00 C ATOM 849 O HIS A 57 4.696 -17.472 -1.245 1.00 0.00 O ATOM 850 CB HIS A 57 6.643 -19.441 -0.910 1.00 0.00 C ATOM 851 CG HIS A 57 5.726 -20.212 -0.009 1.00 0.00 C ATOM 852 ND1 HIS A 57 6.141 -20.794 1.170 1.00 0.00 N ATOM 853 CD2 HIS A 57 4.408 -20.498 -0.125 1.00 0.00 C ATOM 854 CE1 HIS A 57 5.119 -21.406 1.740 1.00 0.00 C ATOM 855 NE2 HIS A 57 4.055 -21.240 0.976 1.00 0.00 N ATOM 0 H HIS A 57 6.845 -17.927 1.657 1.00 0.00 H new ATOM 0 HA HIS A 57 7.604 -17.523 -1.129 1.00 0.00 H new ATOM 0 HB2 HIS A 57 6.215 -19.415 -1.912 1.00 0.00 H new ATOM 0 HB3 HIS A 57 7.594 -19.969 -0.983 1.00 0.00 H new ATOM 0 HD2 HIS A 57 3.756 -20.199 -0.932 1.00 0.00 H new ATOM 0 HE1 HIS A 57 5.148 -21.950 2.673 1.00 0.00 H new ATOM 0 HE2 HIS A 57 3.122 -21.604 1.172 1.00 0.00 H new ATOM 864 N VAL A 58 5.513 -16.200 0.430 1.00 0.00 N ATOM 865 CA VAL A 58 4.325 -15.359 0.525 1.00 0.00 C ATOM 866 C VAL A 58 4.364 -14.235 -0.508 1.00 0.00 C ATOM 867 O VAL A 58 5.027 -13.216 -0.303 1.00 0.00 O ATOM 868 CB VAL A 58 4.179 -14.751 1.940 1.00 0.00 C ATOM 869 CG1 VAL A 58 2.887 -13.953 2.051 1.00 0.00 C ATOM 870 CG2 VAL A 58 4.237 -15.839 3.007 1.00 0.00 C ATOM 0 H VAL A 58 6.253 -15.958 1.089 1.00 0.00 H new ATOM 0 HA VAL A 58 3.464 -15.997 0.325 1.00 0.00 H new ATOM 0 HB VAL A 58 5.015 -14.071 2.106 1.00 0.00 H new ATOM 0 HG11 VAL A 58 2.803 -13.534 3.054 1.00 0.00 H new ATOM 0 HG12 VAL A 58 2.894 -13.145 1.319 1.00 0.00 H new ATOM 0 HG13 VAL A 58 2.037 -14.608 1.860 1.00 0.00 H new ATOM 0 HG21 VAL A 58 4.132 -15.387 3.993 1.00 0.00 H new ATOM 0 HG22 VAL A 58 3.427 -16.550 2.846 1.00 0.00 H new ATOM 0 HG23 VAL A 58 5.193 -16.358 2.946 1.00 0.00 H new ATOM 880 N ARG A 59 3.648 -14.424 -1.619 1.00 0.00 N ATOM 881 CA ARG A 59 3.596 -13.423 -2.684 1.00 0.00 C ATOM 882 C ARG A 59 2.508 -13.749 -3.702 1.00 0.00 C ATOM 883 O ARG A 59 2.274 -14.915 -4.027 1.00 0.00 O ATOM 884 CB ARG A 59 4.954 -13.299 -3.390 1.00 0.00 C ATOM 885 CG ARG A 59 5.494 -14.614 -3.933 1.00 0.00 C ATOM 886 CD ARG A 59 6.546 -14.386 -5.007 1.00 0.00 C ATOM 887 NE ARG A 59 6.639 -15.512 -5.936 1.00 0.00 N ATOM 888 CZ ARG A 59 7.276 -15.466 -7.112 1.00 0.00 C ATOM 889 NH1 ARG A 59 7.886 -14.351 -7.511 1.00 0.00 N ATOM 890 NH2 ARG A 59 7.306 -16.542 -7.891 1.00 0.00 N ATOM 0 H ARG A 59 3.096 -15.262 -1.803 1.00 0.00 H new ATOM 0 HA ARG A 59 3.355 -12.468 -2.218 1.00 0.00 H new ATOM 0 HB2 ARG A 59 4.861 -12.590 -4.212 1.00 0.00 H new ATOM 0 HB3 ARG A 59 5.679 -12.882 -2.690 1.00 0.00 H new ATOM 0 HG2 ARG A 59 5.925 -15.195 -3.118 1.00 0.00 H new ATOM 0 HG3 ARG A 59 4.674 -15.202 -4.345 1.00 0.00 H new ATOM 0 HD2 ARG A 59 6.306 -13.479 -5.561 1.00 0.00 H new ATOM 0 HD3 ARG A 59 7.515 -14.225 -4.535 1.00 0.00 H new ATOM 0 HE ARG A 59 6.190 -16.388 -5.670 1.00 0.00 H new ATOM 0 HH11 ARG A 59 7.871 -13.521 -6.918 1.00 0.00 H new ATOM 0 HH12 ARG A 59 8.369 -14.327 -8.409 1.00 0.00 H new ATOM 0 HH21 ARG A 59 6.844 -17.401 -7.592 1.00 0.00 H new ATOM 0 HH22 ARG A 59 7.791 -16.509 -8.788 1.00 0.00 H new ATOM 904 N GLY A 60 1.846 -12.706 -4.202 1.00 0.00 N ATOM 905 CA GLY A 60 0.787 -12.889 -5.178 1.00 0.00 C ATOM 906 C GLY A 60 -0.594 -12.802 -4.561 1.00 0.00 C ATOM 907 O GLY A 60 -0.881 -11.884 -3.788 1.00 0.00 O ATOM 0 H GLY A 60 2.027 -11.735 -3.946 1.00 0.00 H new ATOM 0 HA2 GLY A 60 0.881 -12.133 -5.957 1.00 0.00 H new ATOM 0 HA3 GLY A 60 0.905 -13.860 -5.660 1.00 0.00 H new ATOM 911 N GLU A 61 -1.452 -13.761 -4.905 1.00 0.00 N ATOM 912 CA GLU A 61 -2.817 -13.804 -4.384 1.00 0.00 C ATOM 913 C GLU A 61 -2.855 -14.367 -2.961 1.00 0.00 C ATOM 914 O GLU A 61 -3.744 -14.023 -2.176 1.00 0.00 O ATOM 915 CB GLU A 61 -3.705 -14.647 -5.307 1.00 0.00 C ATOM 916 CG GLU A 61 -5.130 -14.816 -4.799 1.00 0.00 C ATOM 917 CD GLU A 61 -6.047 -15.482 -5.810 1.00 0.00 C ATOM 918 OE1 GLU A 61 -5.597 -16.429 -6.491 1.00 0.00 O ATOM 919 OE2 GLU A 61 -7.216 -15.060 -5.916 1.00 0.00 O ATOM 0 H GLU A 61 -1.224 -14.522 -5.545 1.00 0.00 H new ATOM 0 HA GLU A 61 -3.196 -12.783 -4.351 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -3.733 -14.183 -6.293 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -3.254 -15.631 -5.431 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -5.116 -15.409 -3.884 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -5.535 -13.838 -4.539 1.00 0.00 H new ATOM 926 N ALA A 62 -1.887 -15.224 -2.627 1.00 0.00 N ATOM 927 CA ALA A 62 -1.816 -15.823 -1.294 1.00 0.00 C ATOM 928 C ALA A 62 -1.206 -14.850 -0.290 1.00 0.00 C ATOM 929 O ALA A 62 -1.500 -14.916 0.906 1.00 0.00 O ATOM 930 CB ALA A 62 -1.015 -17.118 -1.330 1.00 0.00 C ATOM 0 H ALA A 62 -1.143 -15.518 -3.261 1.00 0.00 H new ATOM 0 HA ALA A 62 -2.833 -16.051 -0.974 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -0.974 -17.548 -0.329 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -1.494 -17.824 -2.009 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -0.003 -16.910 -1.678 1.00 0.00 H new ATOM 936 N ALA A 63 -0.353 -13.948 -0.779 1.00 0.00 N ATOM 937 CA ALA A 63 0.293 -12.960 0.079 1.00 0.00 C ATOM 938 C ALA A 63 -0.728 -11.979 0.650 1.00 0.00 C ATOM 939 O ALA A 63 -0.660 -11.620 1.828 1.00 0.00 O ATOM 940 CB ALA A 63 1.377 -12.214 -0.685 1.00 0.00 C ATOM 0 H ALA A 63 -0.095 -13.883 -1.764 1.00 0.00 H new ATOM 0 HA ALA A 63 0.757 -13.490 0.911 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.847 -11.482 -0.028 1.00 0.00 H new ATOM 0 HB2 ALA A 63 2.128 -12.922 -1.035 1.00 0.00 H new ATOM 0 HB3 ALA A 63 0.934 -11.703 -1.540 1.00 0.00 H new ATOM 946 N ALA A 64 -1.675 -11.552 -0.189 1.00 0.00 N ATOM 947 CA ALA A 64 -2.714 -10.615 0.238 1.00 0.00 C ATOM 948 C ALA A 64 -3.527 -11.190 1.393 1.00 0.00 C ATOM 949 O ALA A 64 -3.652 -10.557 2.440 1.00 0.00 O ATOM 950 CB ALA A 64 -3.628 -10.258 -0.927 1.00 0.00 C ATOM 0 H ALA A 64 -1.743 -11.840 -1.165 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.223 -9.706 0.585 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -4.394 -9.560 -0.588 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -3.042 -9.796 -1.721 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -4.104 -11.162 -1.307 1.00 0.00 H new ATOM 956 N ARG A 65 -4.075 -12.394 1.202 1.00 0.00 N ATOM 957 CA ARG A 65 -4.870 -13.044 2.242 1.00 0.00 C ATOM 958 C ARG A 65 -4.026 -13.329 3.487 1.00 0.00 C ATOM 959 O ARG A 65 -4.517 -13.219 4.610 1.00 0.00 O ATOM 960 CB ARG A 65 -5.501 -14.343 1.720 1.00 0.00 C ATOM 961 CG ARG A 65 -4.496 -15.416 1.328 1.00 0.00 C ATOM 962 CD ARG A 65 -5.160 -16.778 1.191 1.00 0.00 C ATOM 963 NE ARG A 65 -4.929 -17.622 2.364 1.00 0.00 N ATOM 964 CZ ARG A 65 -5.761 -17.707 3.410 1.00 0.00 C ATOM 965 NH1 ARG A 65 -6.897 -17.011 3.435 1.00 0.00 N ATOM 966 NH2 ARG A 65 -5.458 -18.497 4.434 1.00 0.00 N ATOM 0 H ARG A 65 -3.982 -12.934 0.341 1.00 0.00 H new ATOM 0 HA ARG A 65 -5.670 -12.358 2.520 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -6.163 -14.745 2.487 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -6.121 -14.109 0.855 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -4.022 -15.145 0.385 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -3.707 -15.468 2.078 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -6.232 -16.645 1.045 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -4.777 -17.280 0.302 1.00 0.00 H new ATOM 0 HE ARG A 65 -4.077 -18.183 2.386 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -7.141 -16.405 2.652 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -7.522 -17.084 4.237 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -4.593 -19.037 4.423 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -6.090 -18.563 5.232 1.00 0.00 H new ATOM 980 N TYR A 66 -2.756 -13.687 3.280 1.00 0.00 N ATOM 981 CA TYR A 66 -1.843 -13.976 4.387 1.00 0.00 C ATOM 982 C TYR A 66 -1.728 -12.771 5.320 1.00 0.00 C ATOM 983 O TYR A 66 -1.945 -12.888 6.526 1.00 0.00 O ATOM 984 CB TYR A 66 -0.462 -14.363 3.849 1.00 0.00 C ATOM 985 CG TYR A 66 0.539 -14.743 4.922 1.00 0.00 C ATOM 986 CD1 TYR A 66 0.409 -15.927 5.636 1.00 0.00 C ATOM 987 CD2 TYR A 66 1.619 -13.918 5.212 1.00 0.00 C ATOM 988 CE1 TYR A 66 1.325 -16.276 6.611 1.00 0.00 C ATOM 989 CE2 TYR A 66 2.539 -14.260 6.182 1.00 0.00 C ATOM 990 CZ TYR A 66 2.388 -15.441 6.879 1.00 0.00 C ATOM 991 OH TYR A 66 3.305 -15.789 7.846 1.00 0.00 O ATOM 0 H TYR A 66 -2.337 -13.783 2.355 1.00 0.00 H new ATOM 0 HA TYR A 66 -2.247 -14.814 4.955 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -0.574 -15.200 3.160 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -0.062 -13.528 3.274 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -0.421 -16.586 5.426 1.00 0.00 H new ATOM 0 HD2 TYR A 66 1.740 -12.993 4.669 1.00 0.00 H new ATOM 0 HE1 TYR A 66 1.208 -17.199 7.160 1.00 0.00 H new ATOM 0 HE2 TYR A 66 3.373 -13.607 6.394 1.00 0.00 H new ATOM 0 HH TYR A 66 3.992 -15.093 7.910 1.00 0.00 H new ATOM 1001 N HIS A 67 -1.387 -11.613 4.752 1.00 0.00 N ATOM 1002 CA HIS A 67 -1.246 -10.387 5.535 1.00 0.00 C ATOM 1003 C HIS A 67 -2.611 -9.869 5.995 1.00 0.00 C ATOM 1004 O HIS A 67 -2.747 -9.386 7.121 1.00 0.00 O ATOM 1005 CB HIS A 67 -0.516 -9.313 4.725 1.00 0.00 C ATOM 1006 CG HIS A 67 0.964 -9.538 4.635 1.00 0.00 C ATOM 1007 ND1 HIS A 67 1.682 -10.437 3.919 1.00 0.00 N flip ATOM 1008 CD2 HIS A 67 1.884 -8.795 5.344 1.00 0.00 C flip ATOM 1009 CE1 HIS A 67 3.007 -10.219 4.204 1.00 0.00 C flip ATOM 1010 NE2 HIS A 67 3.102 -9.224 5.066 1.00 0.00 N flip ATOM 0 H HIS A 67 -1.204 -11.500 3.755 1.00 0.00 H new ATOM 0 HA HIS A 67 -0.654 -10.620 6.420 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -0.933 -9.281 3.718 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -0.701 -8.339 5.177 1.00 0.00 H new ATOM 0 HD1 HIS A 67 1.308 -11.144 3.286 1.00 0.00 H new ATOM 0 HD2 HIS A 67 1.646 -7.988 6.021 1.00 0.00 H new ATOM 0 HE1 HIS A 67 3.837 -10.772 3.790 1.00 0.00 H new ATOM 1019 N PHE A 68 -3.618 -9.978 5.126 1.00 0.00 N ATOM 1020 CA PHE A 68 -4.973 -9.528 5.453 1.00 0.00 C ATOM 1021 C PHE A 68 -5.491 -10.228 6.709 1.00 0.00 C ATOM 1022 O PHE A 68 -6.021 -9.581 7.615 1.00 0.00 O ATOM 1023 CB PHE A 68 -5.920 -9.792 4.275 1.00 0.00 C ATOM 1024 CG PHE A 68 -7.279 -9.156 4.418 1.00 0.00 C ATOM 1025 CD1 PHE A 68 -7.416 -7.777 4.481 1.00 0.00 C ATOM 1026 CD2 PHE A 68 -8.421 -9.942 4.477 1.00 0.00 C ATOM 1027 CE1 PHE A 68 -8.664 -7.196 4.604 1.00 0.00 C ATOM 1028 CE2 PHE A 68 -9.670 -9.364 4.597 1.00 0.00 C ATOM 1029 CZ PHE A 68 -9.793 -7.990 4.659 1.00 0.00 C ATOM 0 H PHE A 68 -3.521 -10.374 4.191 1.00 0.00 H new ATOM 0 HA PHE A 68 -4.937 -8.456 5.647 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -5.454 -9.425 3.360 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -6.046 -10.868 4.159 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -6.538 -7.150 4.433 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -8.332 -11.017 4.429 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -8.756 -6.121 4.657 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -10.551 -9.987 4.642 1.00 0.00 H new ATOM 0 HZ PHE A 68 -10.769 -7.537 4.750 1.00 0.00 H new ATOM 1039 N GLU A 69 -5.330 -11.552 6.761 1.00 0.00 N ATOM 1040 CA GLU A 69 -5.777 -12.339 7.910 1.00 0.00 C ATOM 1041 C GLU A 69 -4.863 -12.126 9.118 1.00 0.00 C ATOM 1042 O GLU A 69 -5.311 -12.223 10.259 1.00 0.00 O ATOM 1043 CB GLU A 69 -5.839 -13.827 7.555 1.00 0.00 C ATOM 1044 CG GLU A 69 -7.121 -14.226 6.840 1.00 0.00 C ATOM 1045 CD GLU A 69 -7.580 -15.629 7.194 1.00 0.00 C ATOM 1046 OE1 GLU A 69 -8.038 -15.832 8.338 1.00 0.00 O ATOM 1047 OE2 GLU A 69 -7.482 -16.523 6.324 1.00 0.00 O ATOM 0 H GLU A 69 -4.893 -12.101 6.020 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.778 -11.997 8.174 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -4.987 -14.078 6.923 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -5.743 -14.415 8.468 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -7.909 -13.516 7.093 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -6.967 -14.160 5.763 1.00 0.00 H new ATOM 1054 N ASP A 70 -3.586 -11.833 8.865 1.00 0.00 N ATOM 1055 CA ASP A 70 -2.628 -11.602 9.946 1.00 0.00 C ATOM 1056 C ASP A 70 -2.921 -10.286 10.668 1.00 0.00 C ATOM 1057 O ASP A 70 -2.746 -10.182 11.882 1.00 0.00 O ATOM 1058 CB ASP A 70 -1.195 -11.597 9.406 1.00 0.00 C ATOM 1059 CG ASP A 70 -0.174 -11.905 10.484 1.00 0.00 C ATOM 1060 OD1 ASP A 70 -0.039 -13.090 10.854 1.00 0.00 O ATOM 1061 OD2 ASP A 70 0.491 -10.961 10.960 1.00 0.00 O ATOM 0 H ASP A 70 -3.194 -11.751 7.927 1.00 0.00 H new ATOM 0 HA ASP A 70 -2.731 -12.418 10.662 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -1.108 -12.332 8.605 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -0.977 -10.622 8.969 1.00 0.00 H new ATOM 1066 N VAL A 71 -3.375 -9.281 9.915 1.00 0.00 N ATOM 1067 CA VAL A 71 -3.697 -7.976 10.488 1.00 0.00 C ATOM 1068 C VAL A 71 -5.092 -7.981 11.104 1.00 0.00 C ATOM 1069 O VAL A 71 -5.266 -7.627 12.272 1.00 0.00 O ATOM 1070 CB VAL A 71 -3.627 -6.855 9.428 1.00 0.00 C ATOM 1071 CG1 VAL A 71 -3.831 -5.491 10.074 1.00 0.00 C ATOM 1072 CG2 VAL A 71 -2.307 -6.905 8.669 1.00 0.00 C ATOM 0 H VAL A 71 -3.527 -9.348 8.909 1.00 0.00 H new ATOM 0 HA VAL A 71 -2.953 -7.781 11.261 1.00 0.00 H new ATOM 0 HB VAL A 71 -4.432 -7.015 8.711 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -3.778 -4.715 9.310 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -4.808 -5.459 10.556 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -3.053 -5.321 10.818 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -2.283 -6.106 7.929 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -1.480 -6.778 9.368 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -2.212 -7.868 8.167 1.00 0.00 H new ATOM 1082 N GLY A 72 -6.083 -8.392 10.311 1.00 0.00 N ATOM 1083 CA GLY A 72 -7.454 -8.446 10.791 1.00 0.00 C ATOM 1084 C GLY A 72 -7.745 -9.682 11.631 1.00 0.00 C ATOM 1085 O GLY A 72 -8.895 -9.927 11.989 1.00 0.00 O ATOM 0 H GLY A 72 -5.958 -8.689 9.343 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -7.660 -7.555 11.383 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -8.132 -8.426 9.938 1.00 0.00 H new ATOM 1089 N GLY A 73 -6.706 -10.461 11.943 1.00 0.00 N ATOM 1090 CA GLY A 73 -6.882 -11.663 12.742 1.00 0.00 C ATOM 1091 C GLY A 73 -6.214 -11.565 14.101 1.00 0.00 C ATOM 1092 O GLY A 73 -6.678 -12.170 15.068 1.00 0.00 O ATOM 0 H GLY A 73 -5.745 -10.278 11.655 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -7.947 -11.852 12.878 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -6.474 -12.517 12.201 1.00 0.00 H new ATOM 1096 N VAL A 74 -5.119 -10.806 14.176 1.00 0.00 N ATOM 1097 CA VAL A 74 -4.385 -10.637 15.427 1.00 0.00 C ATOM 1098 C VAL A 74 -4.710 -9.293 16.097 1.00 0.00 C ATOM 1099 O VAL A 74 -3.898 -8.753 16.851 1.00 0.00 O ATOM 1100 CB VAL A 74 -2.860 -10.755 15.189 1.00 0.00 C ATOM 1101 CG1 VAL A 74 -2.105 -10.839 16.510 1.00 0.00 C ATOM 1102 CG2 VAL A 74 -2.551 -11.969 14.319 1.00 0.00 C ATOM 0 H VAL A 74 -4.723 -10.300 13.384 1.00 0.00 H new ATOM 0 HA VAL A 74 -4.702 -11.435 16.098 1.00 0.00 H new ATOM 0 HB VAL A 74 -2.527 -9.857 14.668 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.036 -10.921 16.314 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -2.298 -9.941 17.097 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -2.440 -11.715 17.066 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -1.475 -12.039 14.160 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.904 -12.872 14.817 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -3.053 -11.865 13.357 1.00 0.00 H new ATOM 1112 N GLN A 75 -5.907 -8.760 15.827 1.00 0.00 N ATOM 1113 CA GLN A 75 -6.333 -7.485 16.413 1.00 0.00 C ATOM 1114 C GLN A 75 -7.852 -7.448 16.617 1.00 0.00 C ATOM 1115 O GLN A 75 -8.335 -7.595 17.743 1.00 0.00 O ATOM 1116 CB GLN A 75 -5.887 -6.314 15.529 1.00 0.00 C ATOM 1117 CG GLN A 75 -4.410 -5.976 15.658 1.00 0.00 C ATOM 1118 CD GLN A 75 -3.962 -4.937 14.645 1.00 0.00 C ATOM 1119 OE1 GLN A 75 -4.208 -3.743 14.816 1.00 0.00 O ATOM 1120 NE2 GLN A 75 -3.302 -5.385 13.582 1.00 0.00 N ATOM 0 H GLN A 75 -6.595 -9.190 15.209 1.00 0.00 H new ATOM 0 HA GLN A 75 -5.859 -7.390 17.390 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -6.106 -6.553 14.488 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -6.476 -5.433 15.785 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -4.211 -5.607 16.664 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -3.820 -6.883 15.529 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -3.119 -6.383 13.479 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -2.979 -4.731 12.869 1.00 0.00 H new ATOM 1129 N GLY A 76 -8.598 -7.258 15.526 1.00 0.00 N ATOM 1130 CA GLY A 76 -10.053 -7.212 15.605 1.00 0.00 C ATOM 1131 C GLY A 76 -10.708 -7.889 14.415 1.00 0.00 C ATOM 1132 O GLY A 76 -10.305 -8.985 14.031 1.00 0.00 O ATOM 0 H GLY A 76 -8.219 -7.135 14.587 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -10.382 -7.697 16.524 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -10.381 -6.174 15.657 1.00 0.00 H new ATOM 1136 N ALA A 77 -11.712 -7.228 13.826 1.00 0.00 N ATOM 1137 CA ALA A 77 -12.417 -7.764 12.660 1.00 0.00 C ATOM 1138 C ALA A 77 -12.974 -9.163 12.925 1.00 0.00 C ATOM 1139 O ALA A 77 -12.278 -10.161 12.737 1.00 0.00 O ATOM 1140 CB ALA A 77 -11.486 -7.781 11.456 1.00 0.00 C ATOM 0 H ALA A 77 -12.053 -6.320 14.140 1.00 0.00 H new ATOM 0 HA ALA A 77 -13.265 -7.112 12.452 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -12.016 -8.181 10.592 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -11.153 -6.766 11.240 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -10.622 -8.408 11.673 1.00 0.00 H new ATOM 1146 N ARG A 78 -14.232 -9.234 13.363 1.00 0.00 N ATOM 1147 CA ARG A 78 -14.862 -10.521 13.654 1.00 0.00 C ATOM 1148 C ARG A 78 -15.626 -11.084 12.452 1.00 0.00 C ATOM 1149 O ARG A 78 -15.920 -12.281 12.411 1.00 0.00 O ATOM 1150 CB ARG A 78 -15.788 -10.407 14.871 1.00 0.00 C ATOM 1151 CG ARG A 78 -15.056 -10.518 16.200 1.00 0.00 C ATOM 1152 CD ARG A 78 -15.964 -10.179 17.375 1.00 0.00 C ATOM 1153 NE ARG A 78 -15.338 -10.494 18.660 1.00 0.00 N ATOM 1154 CZ ARG A 78 -15.232 -11.732 19.157 1.00 0.00 C ATOM 1155 NH1 ARG A 78 -15.705 -12.775 18.479 1.00 0.00 N ATOM 1156 NH2 ARG A 78 -14.645 -11.925 20.334 1.00 0.00 N ATOM 0 H ARG A 78 -14.830 -8.423 13.523 1.00 0.00 H new ATOM 0 HA ARG A 78 -14.059 -11.222 13.881 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -16.311 -9.452 14.832 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -16.546 -11.188 14.816 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -14.670 -11.530 16.319 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -14.197 -9.847 16.199 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -16.216 -9.119 17.345 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -16.899 -10.732 17.282 1.00 0.00 H new ATOM 0 HE ARG A 78 -14.960 -9.723 19.210 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -16.152 -12.634 17.573 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -15.620 -13.715 18.865 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -14.276 -11.130 20.857 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -14.563 -12.868 20.715 1.00 0.00 H new ATOM 1170 N ALA A 79 -15.933 -10.231 11.478 1.00 0.00 N ATOM 1171 CA ALA A 79 -16.649 -10.662 10.276 1.00 0.00 C ATOM 1172 C ALA A 79 -16.074 -9.980 9.043 1.00 0.00 C ATOM 1173 O ALA A 79 -16.283 -8.785 8.836 1.00 0.00 O ATOM 1174 CB ALA A 79 -18.136 -10.369 10.397 1.00 0.00 C ATOM 0 H ALA A 79 -15.698 -9.238 11.495 1.00 0.00 H new ATOM 0 HA ALA A 79 -16.521 -11.739 10.172 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -18.647 -10.698 9.492 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -18.543 -10.901 11.257 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -18.286 -9.297 10.529 1.00 0.00 H new ATOM 1180 N VAL A 80 -15.338 -10.739 8.235 1.00 0.00 N ATOM 1181 CA VAL A 80 -14.718 -10.192 7.031 1.00 0.00 C ATOM 1182 C VAL A 80 -15.068 -11.010 5.794 1.00 0.00 C ATOM 1183 O VAL A 80 -14.824 -12.219 5.747 1.00 0.00 O ATOM 1184 CB VAL A 80 -13.181 -10.136 7.163 1.00 0.00 C ATOM 1185 CG1 VAL A 80 -12.587 -9.223 6.104 1.00 0.00 C ATOM 1186 CG2 VAL A 80 -12.770 -9.685 8.557 1.00 0.00 C ATOM 0 H VAL A 80 -15.157 -11.731 8.391 1.00 0.00 H new ATOM 0 HA VAL A 80 -15.112 -9.182 6.918 1.00 0.00 H new ATOM 0 HB VAL A 80 -12.790 -11.142 7.007 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -11.503 -9.196 6.213 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -12.843 -9.600 5.114 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -12.989 -8.217 6.224 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -11.682 -9.654 8.624 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -13.174 -8.692 8.752 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -13.159 -10.386 9.296 1.00 0.00 H new ATOM 1196 N HIS A 81 -15.624 -10.340 4.788 1.00 0.00 N ATOM 1197 CA HIS A 81 -15.994 -10.994 3.539 1.00 0.00 C ATOM 1198 C HIS A 81 -15.103 -10.516 2.389 1.00 0.00 C ATOM 1199 O HIS A 81 -14.318 -9.576 2.551 1.00 0.00 O ATOM 1200 CB HIS A 81 -17.472 -10.731 3.223 1.00 0.00 C ATOM 1201 CG HIS A 81 -17.745 -9.375 2.647 1.00 0.00 C ATOM 1202 ND1 HIS A 81 -16.876 -8.310 2.762 1.00 0.00 N ATOM 1203 CD2 HIS A 81 -18.799 -8.920 1.940 1.00 0.00 C ATOM 1204 CE1 HIS A 81 -17.384 -7.263 2.148 1.00 0.00 C ATOM 1205 NE2 HIS A 81 -18.553 -7.604 1.638 1.00 0.00 N ATOM 0 H HIS A 81 -15.828 -9.341 4.815 1.00 0.00 H new ATOM 0 HA HIS A 81 -15.847 -12.068 3.654 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -17.822 -11.488 2.522 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -18.054 -10.849 4.137 1.00 0.00 H new ATOM 0 HD1 HIS A 81 -15.979 -8.331 3.247 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -19.675 -9.487 1.662 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -16.923 -6.289 2.074 1.00 0.00 H new ATOM 1214 N VAL A 82 -15.234 -11.157 1.228 1.00 0.00 N ATOM 1215 CA VAL A 82 -14.445 -10.785 0.055 1.00 0.00 C ATOM 1216 C VAL A 82 -15.341 -10.249 -1.058 1.00 0.00 C ATOM 1217 O VAL A 82 -16.210 -10.958 -1.566 1.00 0.00 O ATOM 1218 CB VAL A 82 -13.618 -11.973 -0.489 1.00 0.00 C ATOM 1219 CG1 VAL A 82 -12.497 -12.333 0.474 1.00 0.00 C ATOM 1220 CG2 VAL A 82 -14.504 -13.182 -0.764 1.00 0.00 C ATOM 0 H VAL A 82 -15.877 -11.934 1.075 1.00 0.00 H new ATOM 0 HA VAL A 82 -13.757 -10.004 0.379 1.00 0.00 H new ATOM 0 HB VAL A 82 -13.172 -11.665 -1.435 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -11.927 -13.171 0.072 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.838 -11.474 0.602 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.921 -12.612 1.438 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -13.894 -14.001 -1.145 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -14.992 -13.493 0.160 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -15.260 -12.918 -1.503 1.00 0.00 H new ATOM 1230 N GLU A 83 -15.122 -8.990 -1.430 1.00 0.00 N ATOM 1231 CA GLU A 83 -15.905 -8.353 -2.484 1.00 0.00 C ATOM 1232 C GLU A 83 -15.432 -8.810 -3.864 1.00 0.00 C ATOM 1233 O GLU A 83 -16.210 -9.361 -4.644 1.00 0.00 O ATOM 1234 CB GLU A 83 -15.802 -6.829 -2.367 1.00 0.00 C ATOM 1235 CG GLU A 83 -17.094 -6.098 -2.693 1.00 0.00 C ATOM 1236 CD GLU A 83 -17.515 -6.270 -4.141 1.00 0.00 C ATOM 1237 OE1 GLU A 83 -16.762 -5.827 -5.034 1.00 0.00 O ATOM 1238 OE2 GLU A 83 -18.595 -6.847 -4.380 1.00 0.00 O ATOM 0 H GLU A 83 -14.408 -8.391 -1.016 1.00 0.00 H new ATOM 0 HA GLU A 83 -16.947 -8.649 -2.365 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -15.497 -6.572 -1.353 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -15.017 -6.475 -3.036 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -17.888 -6.464 -2.042 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -16.970 -5.037 -2.479 1.00 0.00 H new ATOM 1245 N SER A 84 -14.150 -8.581 -4.151 1.00 0.00 N ATOM 1246 CA SER A 84 -13.557 -8.967 -5.431 1.00 0.00 C ATOM 1247 C SER A 84 -12.077 -8.585 -5.482 1.00 0.00 C ATOM 1248 O SER A 84 -11.635 -7.682 -4.767 1.00 0.00 O ATOM 1249 CB SER A 84 -14.304 -8.304 -6.594 1.00 0.00 C ATOM 1250 OG SER A 84 -14.489 -9.215 -7.666 1.00 0.00 O ATOM 0 H SER A 84 -13.499 -8.127 -3.510 1.00 0.00 H new ATOM 0 HA SER A 84 -13.643 -10.049 -5.526 1.00 0.00 H new ATOM 0 HB2 SER A 84 -15.272 -7.942 -6.249 1.00 0.00 H new ATOM 0 HB3 SER A 84 -13.744 -7.436 -6.942 1.00 0.00 H new ATOM 0 HG SER A 84 -14.969 -8.769 -8.395 1.00 0.00 H new ATOM 1256 N VAL A 85 -11.318 -9.273 -6.335 1.00 0.00 N ATOM 1257 CA VAL A 85 -9.890 -9.001 -6.487 1.00 0.00 C ATOM 1258 C VAL A 85 -9.512 -8.864 -7.959 1.00 0.00 C ATOM 1259 O VAL A 85 -10.100 -9.518 -8.822 1.00 0.00 O ATOM 1260 CB VAL A 85 -9.017 -10.103 -5.849 1.00 0.00 C ATOM 1261 CG1 VAL A 85 -9.087 -10.037 -4.332 1.00 0.00 C ATOM 1262 CG2 VAL A 85 -9.428 -11.480 -6.352 1.00 0.00 C ATOM 0 H VAL A 85 -11.669 -10.023 -6.931 1.00 0.00 H new ATOM 0 HA VAL A 85 -9.700 -8.061 -5.968 1.00 0.00 H new ATOM 0 HB VAL A 85 -7.983 -9.930 -6.147 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -8.464 -10.823 -3.905 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -8.728 -9.065 -3.993 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -10.119 -10.176 -4.009 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -8.799 -12.240 -5.888 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -10.471 -11.665 -6.094 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -9.310 -11.522 -7.435 1.00 0.00 H new ATOM 1272 N GLN A 86 -8.528 -8.012 -8.238 1.00 0.00 N ATOM 1273 CA GLN A 86 -8.072 -7.791 -9.608 1.00 0.00 C ATOM 1274 C GLN A 86 -6.609 -7.350 -9.644 1.00 0.00 C ATOM 1275 O GLN A 86 -6.192 -6.497 -8.857 1.00 0.00 O ATOM 1276 CB GLN A 86 -8.952 -6.743 -10.302 1.00 0.00 C ATOM 1277 CG GLN A 86 -8.927 -5.375 -9.635 1.00 0.00 C ATOM 1278 CD GLN A 86 -8.342 -4.299 -10.534 1.00 0.00 C ATOM 1279 OE1 GLN A 86 -9.074 -3.574 -11.206 1.00 0.00 O ATOM 1280 NE2 GLN A 86 -7.017 -4.192 -10.553 1.00 0.00 N ATOM 0 H GLN A 86 -8.032 -7.464 -7.535 1.00 0.00 H new ATOM 0 HA GLN A 86 -8.155 -8.738 -10.141 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -8.626 -6.637 -11.337 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -9.980 -7.105 -10.327 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -9.941 -5.094 -9.351 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -8.343 -5.433 -8.716 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -6.447 -4.814 -9.980 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -6.571 -3.488 -11.141 1.00 0.00 H new ATOM 1289 N PRO A 87 -5.811 -7.924 -10.561 1.00 0.00 N ATOM 1290 CA PRO A 87 -4.395 -7.582 -10.699 1.00 0.00 C ATOM 1291 C PRO A 87 -4.186 -6.266 -11.450 1.00 0.00 C ATOM 1292 O PRO A 87 -4.968 -5.917 -12.338 1.00 0.00 O ATOM 1293 CB PRO A 87 -3.835 -8.758 -11.499 1.00 0.00 C ATOM 1294 CG PRO A 87 -4.978 -9.223 -12.334 1.00 0.00 C ATOM 1295 CD PRO A 87 -6.229 -8.949 -11.538 1.00 0.00 C ATOM 0 HA PRO A 87 -3.908 -7.433 -9.735 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -2.992 -8.451 -12.117 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -3.477 -9.550 -10.841 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -5.002 -8.696 -13.288 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -4.887 -10.285 -12.560 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -7.037 -8.588 -12.175 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -6.592 -9.849 -11.042 1.00 0.00 H new ATOM 1303 N LEU A 88 -3.131 -5.541 -11.086 1.00 0.00 N ATOM 1304 CA LEU A 88 -2.818 -4.261 -11.719 1.00 0.00 C ATOM 1305 C LEU A 88 -1.749 -4.431 -12.799 1.00 0.00 C ATOM 1306 O LEU A 88 -0.806 -5.209 -12.635 1.00 0.00 O ATOM 1307 CB LEU A 88 -2.353 -3.252 -10.664 1.00 0.00 C ATOM 1308 CG LEU A 88 -3.012 -1.871 -10.740 1.00 0.00 C ATOM 1309 CD1 LEU A 88 -4.528 -1.991 -10.667 1.00 0.00 C ATOM 1310 CD2 LEU A 88 -2.495 -0.976 -9.626 1.00 0.00 C ATOM 0 H LEU A 88 -2.477 -5.818 -10.354 1.00 0.00 H new ATOM 0 HA LEU A 88 -3.723 -3.884 -12.196 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -2.542 -3.672 -9.676 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.274 -3.127 -10.756 1.00 0.00 H new ATOM 0 HG LEU A 88 -2.752 -1.420 -11.698 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -4.975 -0.998 -10.723 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.886 -2.597 -11.499 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -4.811 -2.464 -9.726 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -2.972 0.002 -9.693 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -2.725 -1.427 -8.661 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -1.416 -0.860 -9.724 1.00 0.00 H new ATOM 1322 N SER A 89 -1.905 -3.699 -13.905 1.00 0.00 N ATOM 1323 CA SER A 89 -0.959 -3.767 -15.019 1.00 0.00 C ATOM 1324 C SER A 89 0.241 -2.844 -14.792 1.00 0.00 C ATOM 1325 O SER A 89 0.190 -1.942 -13.956 1.00 0.00 O ATOM 1326 CB SER A 89 -1.659 -3.395 -16.330 1.00 0.00 C ATOM 1327 OG SER A 89 -2.736 -4.274 -16.603 1.00 0.00 O ATOM 0 H SER A 89 -2.679 -3.052 -14.052 1.00 0.00 H new ATOM 0 HA SER A 89 -0.592 -4.791 -15.081 1.00 0.00 H new ATOM 0 HB2 SER A 89 -2.028 -2.371 -16.270 1.00 0.00 H new ATOM 0 HB3 SER A 89 -0.942 -3.428 -17.150 1.00 0.00 H new ATOM 0 HG SER A 89 -3.166 -4.013 -17.444 1.00 0.00 H new ATOM 1333 N LEU A 90 1.317 -3.075 -15.551 1.00 0.00 N ATOM 1334 CA LEU A 90 2.529 -2.261 -15.440 1.00 0.00 C ATOM 1335 C LEU A 90 2.243 -0.796 -15.788 1.00 0.00 C ATOM 1336 O LEU A 90 2.872 0.109 -15.241 1.00 0.00 O ATOM 1337 CB LEU A 90 3.634 -2.811 -16.351 1.00 0.00 C ATOM 1338 CG LEU A 90 4.897 -3.289 -15.625 1.00 0.00 C ATOM 1339 CD1 LEU A 90 5.489 -4.507 -16.320 1.00 0.00 C ATOM 1340 CD2 LEU A 90 5.925 -2.166 -15.542 1.00 0.00 C ATOM 0 H LEU A 90 1.372 -3.818 -16.248 1.00 0.00 H new ATOM 0 HA LEU A 90 2.868 -2.309 -14.405 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.228 -3.642 -16.927 1.00 0.00 H new ATOM 0 HB3 LEU A 90 3.915 -2.036 -17.064 1.00 0.00 H new ATOM 0 HG LEU A 90 4.620 -3.576 -14.611 1.00 0.00 H new ATOM 0 HD11 LEU A 90 6.384 -4.830 -15.789 1.00 0.00 H new ATOM 0 HD12 LEU A 90 4.758 -5.315 -16.323 1.00 0.00 H new ATOM 0 HD13 LEU A 90 5.749 -4.249 -17.347 1.00 0.00 H new ATOM 0 HD21 LEU A 90 6.814 -2.524 -15.023 1.00 0.00 H new ATOM 0 HD22 LEU A 90 6.196 -1.846 -16.548 1.00 0.00 H new ATOM 0 HD23 LEU A 90 5.501 -1.324 -14.995 1.00 0.00 H new ATOM 1352 N GLU A 91 1.287 -0.573 -16.697 1.00 0.00 N ATOM 1353 CA GLU A 91 0.913 0.782 -17.110 1.00 0.00 C ATOM 1354 C GLU A 91 0.490 1.635 -15.912 1.00 0.00 C ATOM 1355 O GLU A 91 0.688 2.851 -15.912 1.00 0.00 O ATOM 1356 CB GLU A 91 -0.221 0.737 -18.137 1.00 0.00 C ATOM 1357 CG GLU A 91 -0.131 1.832 -19.189 1.00 0.00 C ATOM 1358 CD GLU A 91 0.373 1.322 -20.524 1.00 0.00 C ATOM 1359 OE1 GLU A 91 1.563 0.948 -20.606 1.00 0.00 O ATOM 1360 OE2 GLU A 91 -0.420 1.298 -21.489 1.00 0.00 O ATOM 0 H GLU A 91 0.759 -1.313 -17.160 1.00 0.00 H new ATOM 0 HA GLU A 91 1.792 1.240 -17.564 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -0.213 -0.234 -18.633 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -1.175 0.821 -17.617 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -1.115 2.281 -19.325 1.00 0.00 H new ATOM 0 HG3 GLU A 91 0.533 2.619 -18.832 1.00 0.00 H new ATOM 1367 N ASN A 92 -0.092 0.993 -14.893 1.00 0.00 N ATOM 1368 CA ASN A 92 -0.538 1.699 -13.689 1.00 0.00 C ATOM 1369 C ASN A 92 0.623 2.430 -13.017 1.00 0.00 C ATOM 1370 O ASN A 92 0.425 3.480 -12.406 1.00 0.00 O ATOM 1371 CB ASN A 92 -1.191 0.725 -12.704 1.00 0.00 C ATOM 1372 CG ASN A 92 -2.571 1.182 -12.264 1.00 0.00 C ATOM 1373 OD1 ASN A 92 -2.705 1.979 -11.336 1.00 0.00 O ATOM 1374 ND2 ASN A 92 -3.608 0.677 -12.927 1.00 0.00 N ATOM 0 H ASN A 92 -0.264 -0.012 -14.879 1.00 0.00 H new ATOM 0 HA ASN A 92 -1.278 2.440 -13.992 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -1.268 -0.259 -13.167 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -0.551 0.615 -11.828 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -4.558 0.948 -12.672 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -3.453 0.019 -13.691 1.00 0.00 H new ATOM 1381 N LEU A 93 1.834 1.888 -13.145 1.00 0.00 N ATOM 1382 CA LEU A 93 3.005 2.516 -12.562 1.00 0.00 C ATOM 1383 C LEU A 93 3.527 3.597 -13.502 1.00 0.00 C ATOM 1384 O LEU A 93 4.136 3.299 -14.529 1.00 0.00 O ATOM 1385 CB LEU A 93 4.088 1.477 -12.279 1.00 0.00 C ATOM 1386 CG LEU A 93 3.782 0.521 -11.124 1.00 0.00 C ATOM 1387 CD1 LEU A 93 3.984 -0.925 -11.556 1.00 0.00 C ATOM 1388 CD2 LEU A 93 4.649 0.850 -9.915 1.00 0.00 C ATOM 0 H LEU A 93 2.023 1.020 -13.646 1.00 0.00 H new ATOM 0 HA LEU A 93 2.727 2.976 -11.614 1.00 0.00 H new ATOM 0 HB2 LEU A 93 4.252 0.890 -13.183 1.00 0.00 H new ATOM 0 HB3 LEU A 93 5.021 1.997 -12.063 1.00 0.00 H new ATOM 0 HG LEU A 93 2.737 0.647 -10.840 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.761 -1.589 -10.721 1.00 0.00 H new ATOM 0 HD12 LEU A 93 3.318 -1.153 -12.388 1.00 0.00 H new ATOM 0 HD13 LEU A 93 5.018 -1.070 -11.869 1.00 0.00 H new ATOM 0 HD21 LEU A 93 4.418 0.160 -9.103 1.00 0.00 H new ATOM 0 HD22 LEU A 93 5.701 0.754 -10.185 1.00 0.00 H new ATOM 0 HD23 LEU A 93 4.449 1.871 -9.591 1.00 0.00 H new ATOM 1400 N ALA A 94 3.260 4.849 -13.142 1.00 0.00 N ATOM 1401 CA ALA A 94 3.676 6.006 -13.942 1.00 0.00 C ATOM 1402 C ALA A 94 5.101 5.836 -14.461 1.00 0.00 C ATOM 1403 O ALA A 94 5.314 5.698 -15.666 1.00 0.00 O ATOM 1404 CB ALA A 94 3.554 7.289 -13.132 1.00 0.00 C ATOM 0 H ALA A 94 2.752 5.094 -12.292 1.00 0.00 H new ATOM 0 HA ALA A 94 3.011 6.073 -14.803 1.00 0.00 H new ATOM 0 HB1 ALA A 94 3.867 8.136 -13.743 1.00 0.00 H new ATOM 0 HB2 ALA A 94 2.518 7.427 -12.824 1.00 0.00 H new ATOM 0 HB3 ALA A 94 4.190 7.224 -12.249 1.00 0.00 H new ATOM 1410 N LEU A 95 6.073 5.819 -13.544 1.00 0.00 N ATOM 1411 CA LEU A 95 7.473 5.627 -13.917 1.00 0.00 C ATOM 1412 C LEU A 95 7.687 4.195 -14.409 1.00 0.00 C ATOM 1413 O LEU A 95 8.584 3.934 -15.214 1.00 0.00 O ATOM 1414 CB LEU A 95 8.403 5.918 -12.729 1.00 0.00 C ATOM 1415 CG LEU A 95 9.204 7.223 -12.816 1.00 0.00 C ATOM 1416 CD1 LEU A 95 10.262 7.135 -13.907 1.00 0.00 C ATOM 1417 CD2 LEU A 95 8.284 8.410 -13.061 1.00 0.00 C ATOM 0 H LEU A 95 5.915 5.936 -12.543 1.00 0.00 H new ATOM 0 HA LEU A 95 7.714 6.325 -14.718 1.00 0.00 H new ATOM 0 HB2 LEU A 95 7.803 5.941 -11.819 1.00 0.00 H new ATOM 0 HB3 LEU A 95 9.104 5.089 -12.628 1.00 0.00 H new ATOM 0 HG LEU A 95 9.707 7.373 -11.860 1.00 0.00 H new ATOM 0 HD11 LEU A 95 10.818 8.071 -13.951 1.00 0.00 H new ATOM 0 HD12 LEU A 95 10.947 6.317 -13.685 1.00 0.00 H new ATOM 0 HD13 LEU A 95 9.780 6.954 -14.868 1.00 0.00 H new ATOM 0 HD21 LEU A 95 8.876 9.323 -13.119 1.00 0.00 H new ATOM 0 HD22 LEU A 95 7.746 8.266 -13.998 1.00 0.00 H new ATOM 0 HD23 LEU A 95 7.570 8.492 -12.242 1.00 0.00 H new ATOM 1429 N ARG A 96 6.845 3.274 -13.917 1.00 0.00 N ATOM 1430 CA ARG A 96 6.906 1.860 -14.288 1.00 0.00 C ATOM 1431 C ARG A 96 8.137 1.184 -13.676 1.00 0.00 C ATOM 1432 O ARG A 96 8.006 0.323 -12.803 1.00 0.00 O ATOM 1433 CB ARG A 96 6.912 1.691 -15.815 1.00 0.00 C ATOM 1434 CG ARG A 96 5.586 1.204 -16.384 1.00 0.00 C ATOM 1435 CD ARG A 96 5.719 0.784 -17.840 1.00 0.00 C ATOM 1436 NE ARG A 96 5.137 1.767 -18.757 1.00 0.00 N ATOM 1437 CZ ARG A 96 5.441 1.855 -20.056 1.00 0.00 C ATOM 1438 NH1 ARG A 96 6.324 1.019 -20.602 1.00 0.00 N ATOM 1439 NH2 ARG A 96 4.859 2.778 -20.814 1.00 0.00 N ATOM 0 H ARG A 96 6.104 3.493 -13.251 1.00 0.00 H new ATOM 0 HA ARG A 96 6.014 1.376 -13.891 1.00 0.00 H new ATOM 0 HB2 ARG A 96 7.166 2.646 -16.276 1.00 0.00 H new ATOM 0 HB3 ARG A 96 7.696 0.985 -16.090 1.00 0.00 H new ATOM 0 HG2 ARG A 96 5.224 0.362 -15.794 1.00 0.00 H new ATOM 0 HG3 ARG A 96 4.841 1.996 -16.300 1.00 0.00 H new ATOM 0 HD2 ARG A 96 6.773 0.645 -18.081 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.229 -0.179 -17.984 1.00 0.00 H new ATOM 0 HE ARG A 96 4.456 2.427 -18.380 1.00 0.00 H new ATOM 0 HH11 ARG A 96 6.773 0.305 -20.028 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.550 1.093 -21.594 1.00 0.00 H new ATOM 0 HH21 ARG A 96 4.180 3.420 -20.405 1.00 0.00 H new ATOM 0 HH22 ARG A 96 5.091 2.845 -21.805 1.00 0.00 H new ATOM 1453 N GLY A 97 9.331 1.569 -14.148 1.00 0.00 N ATOM 1454 CA GLY A 97 10.565 0.985 -13.646 1.00 0.00 C ATOM 1455 C GLY A 97 10.591 -0.504 -13.879 1.00 0.00 C ATOM 1456 O GLY A 97 10.446 -0.957 -15.017 1.00 0.00 O ATOM 0 H GLY A 97 9.460 2.277 -14.871 1.00 0.00 H new ATOM 0 HA2 GLY A 97 11.419 1.449 -14.140 1.00 0.00 H new ATOM 0 HA3 GLY A 97 10.662 1.192 -12.580 1.00 0.00 H new ATOM 1460 N ARG A 98 10.735 -1.274 -12.807 1.00 0.00 N ATOM 1461 CA ARG A 98 10.725 -2.720 -12.930 1.00 0.00 C ATOM 1462 C ARG A 98 9.722 -3.305 -11.947 1.00 0.00 C ATOM 1463 O ARG A 98 9.979 -3.376 -10.742 1.00 0.00 O ATOM 1464 CB ARG A 98 12.122 -3.314 -12.675 1.00 0.00 C ATOM 1465 CG ARG A 98 13.255 -2.535 -13.327 1.00 0.00 C ATOM 1466 CD ARG A 98 13.804 -1.469 -12.390 1.00 0.00 C ATOM 1467 NE ARG A 98 14.712 -0.549 -13.073 1.00 0.00 N ATOM 1468 CZ ARG A 98 15.991 -0.826 -13.347 1.00 0.00 C ATOM 1469 NH1 ARG A 98 16.517 -2.005 -13.019 1.00 0.00 N ATOM 1470 NH2 ARG A 98 16.745 0.081 -13.957 1.00 0.00 N ATOM 0 H ARG A 98 10.858 -0.924 -11.857 1.00 0.00 H new ATOM 0 HA ARG A 98 10.435 -2.977 -13.949 1.00 0.00 H new ATOM 0 HB2 ARG A 98 12.296 -3.357 -11.600 1.00 0.00 H new ATOM 0 HB3 ARG A 98 12.142 -4.340 -13.043 1.00 0.00 H new ATOM 0 HG2 ARG A 98 14.054 -3.220 -13.610 1.00 0.00 H new ATOM 0 HG3 ARG A 98 12.897 -2.067 -14.244 1.00 0.00 H new ATOM 0 HD2 ARG A 98 12.977 -0.906 -11.958 1.00 0.00 H new ATOM 0 HD3 ARG A 98 14.329 -1.949 -11.564 1.00 0.00 H new ATOM 0 HE ARG A 98 14.347 0.360 -13.358 1.00 0.00 H new ATOM 0 HH11 ARG A 98 15.943 -2.708 -12.554 1.00 0.00 H new ATOM 0 HH12 ARG A 98 17.494 -2.205 -13.233 1.00 0.00 H new ATOM 0 HH21 ARG A 98 16.348 0.985 -14.214 1.00 0.00 H new ATOM 0 HH22 ARG A 98 17.721 -0.126 -14.168 1.00 0.00 H new ATOM 1484 N CYS A 99 8.577 -3.726 -12.474 1.00 0.00 N ATOM 1485 CA CYS A 99 7.524 -4.314 -11.650 1.00 0.00 C ATOM 1486 C CYS A 99 7.016 -5.614 -12.269 1.00 0.00 C ATOM 1487 O CYS A 99 6.540 -5.624 -13.405 1.00 0.00 O ATOM 1488 CB CYS A 99 6.368 -3.327 -11.473 1.00 0.00 C ATOM 1489 SG CYS A 99 6.487 -2.316 -9.977 1.00 0.00 S ATOM 0 H CYS A 99 8.353 -3.671 -13.468 1.00 0.00 H new ATOM 0 HA CYS A 99 7.945 -4.539 -10.670 1.00 0.00 H new ATOM 0 HB2 CYS A 99 6.329 -2.669 -12.341 1.00 0.00 H new ATOM 0 HB3 CYS A 99 5.430 -3.882 -11.451 1.00 0.00 H new ATOM 0 HG CYS A 99 5.359 -2.361 -9.332 1.00 0.00 H new ATOM 1495 N GLN A 100 7.120 -6.708 -11.515 1.00 0.00 N ATOM 1496 CA GLN A 100 6.674 -8.015 -11.994 1.00 0.00 C ATOM 1497 C GLN A 100 5.156 -8.047 -12.176 1.00 0.00 C ATOM 1498 O GLN A 100 4.663 -8.462 -13.225 1.00 0.00 O ATOM 1499 CB GLN A 100 7.106 -9.125 -11.027 1.00 0.00 C ATOM 1500 CG GLN A 100 8.448 -9.747 -11.378 1.00 0.00 C ATOM 1501 CD GLN A 100 8.389 -10.599 -12.636 1.00 0.00 C ATOM 1502 OE1 GLN A 100 8.203 -10.082 -13.736 1.00 0.00 O ATOM 1503 NE2 GLN A 100 8.547 -11.909 -12.480 1.00 0.00 N ATOM 0 H GLN A 100 7.508 -6.715 -10.572 1.00 0.00 H new ATOM 0 HA GLN A 100 7.143 -8.188 -12.963 1.00 0.00 H new ATOM 0 HB2 GLN A 100 7.157 -8.717 -10.017 1.00 0.00 H new ATOM 0 HB3 GLN A 100 6.344 -9.905 -11.018 1.00 0.00 H new ATOM 0 HG2 GLN A 100 9.186 -8.956 -11.514 1.00 0.00 H new ATOM 0 HG3 GLN A 100 8.789 -10.361 -10.544 1.00 0.00 H new ATOM 0 HE21 GLN A 100 8.699 -12.297 -11.549 1.00 0.00 H new ATOM 0 HE22 GLN A 100 8.516 -12.527 -13.291 1.00 0.00 H new ATOM 1512 N GLU A 101 4.426 -7.607 -11.151 1.00 0.00 N ATOM 1513 CA GLU A 101 2.965 -7.588 -11.201 1.00 0.00 C ATOM 1514 C GLU A 101 2.382 -6.807 -10.023 1.00 0.00 C ATOM 1515 O GLU A 101 3.118 -6.268 -9.193 1.00 0.00 O ATOM 1516 CB GLU A 101 2.417 -9.019 -11.199 1.00 0.00 C ATOM 1517 CG GLU A 101 1.315 -9.253 -12.222 1.00 0.00 C ATOM 1518 CD GLU A 101 1.519 -10.532 -13.011 1.00 0.00 C ATOM 1519 OE1 GLU A 101 2.327 -10.519 -13.964 1.00 0.00 O ATOM 1520 OE2 GLU A 101 0.871 -11.545 -12.676 1.00 0.00 O ATOM 0 H GLU A 101 4.822 -7.260 -10.278 1.00 0.00 H new ATOM 0 HA GLU A 101 2.667 -7.089 -12.123 1.00 0.00 H new ATOM 0 HB2 GLU A 101 3.235 -9.712 -11.394 1.00 0.00 H new ATOM 0 HB3 GLU A 101 2.033 -9.250 -10.205 1.00 0.00 H new ATOM 0 HG2 GLU A 101 0.353 -9.294 -11.712 1.00 0.00 H new ATOM 0 HG3 GLU A 101 1.276 -8.408 -12.909 1.00 0.00 H new ATOM 1527 N ALA A 102 1.051 -6.754 -9.956 1.00 0.00 N ATOM 1528 CA ALA A 102 0.360 -6.050 -8.882 1.00 0.00 C ATOM 1529 C ALA A 102 -0.955 -6.739 -8.530 1.00 0.00 C ATOM 1530 O ALA A 102 -1.652 -7.251 -9.407 1.00 0.00 O ATOM 1531 CB ALA A 102 0.119 -4.601 -9.273 1.00 0.00 C ATOM 0 H ALA A 102 0.431 -7.193 -10.637 1.00 0.00 H new ATOM 0 HA ALA A 102 0.995 -6.072 -7.996 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -0.398 -4.087 -8.463 1.00 0.00 H new ATOM 0 HB2 ALA A 102 1.074 -4.112 -9.463 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -0.493 -4.564 -10.174 1.00 0.00 H new ATOM 1537 N TRP A 103 -1.288 -6.749 -7.240 1.00 0.00 N ATOM 1538 CA TRP A 103 -2.519 -7.377 -6.762 1.00 0.00 C ATOM 1539 C TRP A 103 -3.384 -6.368 -6.009 1.00 0.00 C ATOM 1540 O TRP A 103 -2.865 -5.454 -5.369 1.00 0.00 O ATOM 1541 CB TRP A 103 -2.180 -8.567 -5.855 1.00 0.00 C ATOM 1542 CG TRP A 103 -3.377 -9.194 -5.203 1.00 0.00 C ATOM 1543 CD1 TRP A 103 -3.850 -8.940 -3.948 1.00 0.00 C ATOM 1544 CD2 TRP A 103 -4.251 -10.179 -5.769 1.00 0.00 C ATOM 1545 NE1 TRP A 103 -4.962 -9.706 -3.699 1.00 0.00 N ATOM 1546 CE2 TRP A 103 -5.228 -10.474 -4.801 1.00 0.00 C ATOM 1547 CE3 TRP A 103 -4.306 -10.841 -7.000 1.00 0.00 C ATOM 1548 CZ2 TRP A 103 -6.242 -11.401 -5.025 1.00 0.00 C ATOM 1549 CZ3 TRP A 103 -5.313 -11.759 -7.221 1.00 0.00 C ATOM 1550 CH2 TRP A 103 -6.269 -12.031 -6.238 1.00 0.00 C ATOM 0 H TRP A 103 -0.720 -6.328 -6.505 1.00 0.00 H new ATOM 0 HA TRP A 103 -3.084 -7.734 -7.623 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -1.661 -9.324 -6.443 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -1.488 -8.236 -5.080 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -3.413 -8.239 -3.252 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -5.502 -9.703 -2.834 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -3.572 -10.637 -7.766 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -6.981 -11.615 -4.267 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -5.363 -12.275 -8.168 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -7.045 -12.754 -6.441 1.00 0.00 H new ATOM 1561 N VAL A 104 -4.702 -6.541 -6.087 1.00 0.00 N ATOM 1562 CA VAL A 104 -5.633 -5.644 -5.408 1.00 0.00 C ATOM 1563 C VAL A 104 -6.753 -6.430 -4.724 1.00 0.00 C ATOM 1564 O VAL A 104 -7.344 -7.334 -5.318 1.00 0.00 O ATOM 1565 CB VAL A 104 -6.260 -4.619 -6.379 1.00 0.00 C ATOM 1566 CG1 VAL A 104 -7.061 -3.577 -5.611 1.00 0.00 C ATOM 1567 CG2 VAL A 104 -5.189 -3.952 -7.233 1.00 0.00 C ATOM 0 H VAL A 104 -5.148 -7.293 -6.613 1.00 0.00 H new ATOM 0 HA VAL A 104 -5.053 -5.105 -4.659 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.938 -5.153 -7.045 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -7.495 -2.863 -6.311 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -7.858 -4.069 -5.053 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -6.404 -3.051 -4.918 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -5.656 -3.235 -7.908 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.480 -3.434 -6.588 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -4.664 -4.709 -7.815 1.00 0.00 H new ATOM 1577 N LEU A 105 -7.038 -6.070 -3.472 1.00 0.00 N ATOM 1578 CA LEU A 105 -8.086 -6.726 -2.696 1.00 0.00 C ATOM 1579 C LEU A 105 -8.958 -5.697 -1.979 1.00 0.00 C ATOM 1580 O LEU A 105 -8.451 -4.835 -1.260 1.00 0.00 O ATOM 1581 CB LEU A 105 -7.472 -7.688 -1.674 1.00 0.00 C ATOM 1582 CG LEU A 105 -8.397 -8.811 -1.198 1.00 0.00 C ATOM 1583 CD1 LEU A 105 -7.605 -10.090 -0.965 1.00 0.00 C ATOM 1584 CD2 LEU A 105 -9.137 -8.399 0.068 1.00 0.00 C ATOM 0 H LEU A 105 -6.554 -5.324 -2.973 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.712 -7.291 -3.387 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -6.579 -8.135 -2.111 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -7.149 -7.113 -0.806 1.00 0.00 H new ATOM 0 HG LEU A 105 -9.136 -9.001 -1.977 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -8.278 -10.878 -0.627 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -7.126 -10.396 -1.895 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -6.843 -9.913 -0.206 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -9.789 -9.211 0.389 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -8.416 -8.179 0.856 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -9.736 -7.511 -0.133 1.00 0.00 H new ATOM 1596 N SER A 106 -10.271 -5.798 -2.177 1.00 0.00 N ATOM 1597 CA SER A 106 -11.217 -4.880 -1.545 1.00 0.00 C ATOM 1598 C SER A 106 -12.303 -5.652 -0.799 1.00 0.00 C ATOM 1599 O SER A 106 -12.829 -6.644 -1.306 1.00 0.00 O ATOM 1600 CB SER A 106 -11.847 -3.957 -2.589 1.00 0.00 C ATOM 1601 OG SER A 106 -12.763 -4.659 -3.415 1.00 0.00 O ATOM 0 H SER A 106 -10.704 -6.506 -2.770 1.00 0.00 H new ATOM 0 HA SER A 106 -10.670 -4.271 -0.825 1.00 0.00 H new ATOM 0 HB2 SER A 106 -12.361 -3.136 -2.089 1.00 0.00 H new ATOM 0 HB3 SER A 106 -11.064 -3.514 -3.205 1.00 0.00 H new ATOM 0 HG SER A 106 -13.151 -4.043 -4.071 1.00 0.00 H new ATOM 1607 N GLY A 107 -12.631 -5.190 0.405 1.00 0.00 N ATOM 1608 CA GLY A 107 -13.649 -5.850 1.201 1.00 0.00 C ATOM 1609 C GLY A 107 -14.032 -5.067 2.443 1.00 0.00 C ATOM 1610 O GLY A 107 -13.810 -3.856 2.517 1.00 0.00 O ATOM 0 H GLY A 107 -12.210 -4.371 0.842 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -14.537 -6.006 0.588 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -13.289 -6.835 1.496 1.00 0.00 H new ATOM 1614 N LYS A 108 -14.613 -5.764 3.419 1.00 0.00 N ATOM 1615 CA LYS A 108 -15.039 -5.142 4.673 1.00 0.00 C ATOM 1616 C LYS A 108 -14.923 -6.129 5.835 1.00 0.00 C ATOM 1617 O LYS A 108 -15.078 -7.338 5.648 1.00 0.00 O ATOM 1618 CB LYS A 108 -16.485 -4.646 4.560 1.00 0.00 C ATOM 1619 CG LYS A 108 -16.751 -3.782 3.335 1.00 0.00 C ATOM 1620 CD LYS A 108 -18.218 -3.398 3.232 1.00 0.00 C ATOM 1621 CE LYS A 108 -18.825 -3.849 1.912 1.00 0.00 C ATOM 1622 NZ LYS A 108 -20.135 -3.190 1.643 1.00 0.00 N ATOM 0 H LYS A 108 -14.800 -6.765 3.365 1.00 0.00 H new ATOM 0 HA LYS A 108 -14.384 -4.293 4.867 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -17.153 -5.507 4.536 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -16.733 -4.075 5.455 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -16.140 -2.880 3.385 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -16.451 -4.321 2.436 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -18.770 -3.845 4.058 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -18.319 -2.317 3.329 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -18.133 -3.625 1.100 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -18.960 -4.931 1.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -20.513 -3.526 0.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -20.804 -3.424 2.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -20.003 -2.159 1.603 1.00 0.00 H new ATOM 1636 N GLN A 109 -14.654 -5.607 7.033 1.00 0.00 N ATOM 1637 CA GLN A 109 -14.518 -6.436 8.229 1.00 0.00 C ATOM 1638 C GLN A 109 -15.354 -5.870 9.375 1.00 0.00 C ATOM 1639 O GLN A 109 -15.735 -4.698 9.347 1.00 0.00 O ATOM 1640 CB GLN A 109 -13.046 -6.539 8.647 1.00 0.00 C ATOM 1641 CG GLN A 109 -12.365 -5.194 8.874 1.00 0.00 C ATOM 1642 CD GLN A 109 -12.044 -4.465 7.580 1.00 0.00 C ATOM 1643 OE1 GLN A 109 -12.471 -3.328 7.374 1.00 0.00 O ATOM 1644 NE2 GLN A 109 -11.289 -5.114 6.700 1.00 0.00 N ATOM 0 H GLN A 109 -14.526 -4.609 7.200 1.00 0.00 H new ATOM 0 HA GLN A 109 -14.885 -7.435 7.994 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -12.980 -7.126 9.563 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -12.499 -7.085 7.879 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -13.010 -4.566 9.488 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -11.444 -5.350 9.435 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -10.956 -6.055 6.910 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -11.043 -4.671 5.815 1.00 0.00 H new ATOM 1653 N GLN A 110 -15.635 -6.697 10.390 1.00 0.00 N ATOM 1654 CA GLN A 110 -16.426 -6.243 11.528 1.00 0.00 C ATOM 1655 C GLN A 110 -15.521 -5.985 12.724 1.00 0.00 C ATOM 1656 O GLN A 110 -15.317 -6.859 13.568 1.00 0.00 O ATOM 1657 CB GLN A 110 -17.506 -7.273 11.877 1.00 0.00 C ATOM 1658 CG GLN A 110 -18.234 -6.985 13.181 1.00 0.00 C ATOM 1659 CD GLN A 110 -19.205 -8.088 13.567 1.00 0.00 C ATOM 1660 OE1 GLN A 110 -20.392 -7.838 13.777 1.00 0.00 O ATOM 1661 NE2 GLN A 110 -18.710 -9.319 13.662 1.00 0.00 N ATOM 0 H GLN A 110 -15.329 -7.669 10.442 1.00 0.00 H new ATOM 0 HA GLN A 110 -16.922 -5.310 11.261 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -18.234 -7.310 11.067 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -17.047 -8.260 11.939 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -17.503 -6.854 13.979 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -18.777 -6.044 13.089 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -17.720 -9.486 13.480 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -19.320 -10.096 13.917 1.00 0.00 H new ATOM 1670 N ILE A 111 -14.973 -4.775 12.787 1.00 0.00 N ATOM 1671 CA ILE A 111 -14.081 -4.409 13.878 1.00 0.00 C ATOM 1672 C ILE A 111 -14.868 -4.042 15.130 1.00 0.00 C ATOM 1673 O ILE A 111 -15.354 -2.917 15.284 1.00 0.00 O ATOM 1674 CB ILE A 111 -13.117 -3.269 13.481 1.00 0.00 C ATOM 1675 CG1 ILE A 111 -12.229 -2.875 14.665 1.00 0.00 C ATOM 1676 CG2 ILE A 111 -13.877 -2.061 12.946 1.00 0.00 C ATOM 1677 CD1 ILE A 111 -10.922 -2.233 14.253 1.00 0.00 C ATOM 0 H ILE A 111 -15.130 -4.037 12.100 1.00 0.00 H new ATOM 0 HA ILE A 111 -13.472 -5.285 14.100 1.00 0.00 H new ATOM 0 HB ILE A 111 -12.476 -3.637 12.680 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -12.777 -2.185 15.306 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -12.017 -3.763 15.261 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -13.170 -1.277 12.676 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -14.450 -2.352 12.066 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -14.556 -1.689 13.714 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -10.345 -1.980 15.142 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -10.353 -2.929 13.637 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -11.126 -1.327 13.683 1.00 0.00 H new ATOM 1689 N ALA A 112 -14.992 -5.026 16.015 1.00 0.00 N ATOM 1690 CA ALA A 112 -15.722 -4.865 17.271 1.00 0.00 C ATOM 1691 C ALA A 112 -15.029 -3.869 18.200 1.00 0.00 C ATOM 1692 O ALA A 112 -13.812 -3.929 18.393 1.00 0.00 O ATOM 1693 CB ALA A 112 -15.870 -6.210 17.964 1.00 0.00 C ATOM 0 H ALA A 112 -14.591 -5.955 15.884 1.00 0.00 H new ATOM 0 HA ALA A 112 -16.710 -4.469 17.035 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -16.415 -6.080 18.899 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -16.418 -6.894 17.317 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -14.883 -6.622 18.174 1.00 0.00 H new ATOM 1800 N ALA A 119 -20.579 -3.155 16.096 1.00 0.00 N ATOM 1801 CA ALA A 119 -19.984 -3.752 14.898 1.00 0.00 C ATOM 1802 C ALA A 119 -19.816 -2.719 13.782 1.00 0.00 C ATOM 1803 O ALA A 119 -20.430 -1.651 13.817 1.00 0.00 O ATOM 1804 CB ALA A 119 -20.837 -4.915 14.416 1.00 0.00 C ATOM 0 HA ALA A 119 -18.993 -4.120 15.162 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -20.386 -5.352 13.525 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -20.898 -5.670 15.199 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -21.839 -4.557 14.178 1.00 0.00 H new ATOM 1810 N LYS A 120 -18.980 -3.047 12.791 1.00 0.00 N ATOM 1811 CA LYS A 120 -18.725 -2.147 11.662 1.00 0.00 C ATOM 1812 C LYS A 120 -18.568 -2.920 10.349 1.00 0.00 C ATOM 1813 O LYS A 120 -18.470 -4.149 10.348 1.00 0.00 O ATOM 1814 CB LYS A 120 -17.461 -1.323 11.921 1.00 0.00 C ATOM 1815 CG LYS A 120 -17.625 -0.278 13.012 1.00 0.00 C ATOM 1816 CD LYS A 120 -16.287 0.097 13.627 1.00 0.00 C ATOM 1817 CE LYS A 120 -16.396 1.354 14.476 1.00 0.00 C ATOM 1818 NZ LYS A 120 -16.157 2.592 13.680 1.00 0.00 N ATOM 0 H LYS A 120 -18.469 -3.929 12.748 1.00 0.00 H new ATOM 0 HA LYS A 120 -19.586 -1.485 11.568 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -16.649 -1.997 12.195 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -17.166 -0.827 10.996 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -18.099 0.612 12.597 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -18.289 -0.660 13.787 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -15.924 -0.727 14.241 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -15.553 0.253 12.836 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -17.387 1.400 14.929 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -15.675 1.303 15.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -16.241 3.424 14.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -15.202 2.561 13.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -16.861 2.655 12.917 1.00 0.00 H new ATOM 1832 N ASP A 121 -18.540 -2.186 9.234 1.00 0.00 N ATOM 1833 CA ASP A 121 -18.388 -2.790 7.906 1.00 0.00 C ATOM 1834 C ASP A 121 -17.795 -1.779 6.916 1.00 0.00 C ATOM 1835 O ASP A 121 -18.297 -1.610 5.802 1.00 0.00 O ATOM 1836 CB ASP A 121 -19.736 -3.320 7.395 1.00 0.00 C ATOM 1837 CG ASP A 121 -20.814 -2.252 7.342 1.00 0.00 C ATOM 1838 OD1 ASP A 121 -21.291 -1.833 8.417 1.00 0.00 O ATOM 1839 OD2 ASP A 121 -21.186 -1.839 6.223 1.00 0.00 O ATOM 0 H ASP A 121 -18.621 -1.169 9.224 1.00 0.00 H new ATOM 0 HA ASP A 121 -17.699 -3.631 7.990 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -19.600 -3.741 6.399 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -20.069 -4.132 8.041 1.00 0.00 H new ATOM 1844 N VAL A 122 -16.719 -1.113 7.336 1.00 0.00 N ATOM 1845 CA VAL A 122 -16.047 -0.115 6.501 1.00 0.00 C ATOM 1846 C VAL A 122 -15.352 -0.760 5.301 1.00 0.00 C ATOM 1847 O VAL A 122 -14.921 -1.913 5.366 1.00 0.00 O ATOM 1848 CB VAL A 122 -15.005 0.688 7.312 1.00 0.00 C ATOM 1849 CG1 VAL A 122 -14.478 1.864 6.498 1.00 0.00 C ATOM 1850 CG2 VAL A 122 -15.600 1.169 8.630 1.00 0.00 C ATOM 0 H VAL A 122 -16.292 -1.247 8.253 1.00 0.00 H new ATOM 0 HA VAL A 122 -16.823 0.561 6.142 1.00 0.00 H new ATOM 0 HB VAL A 122 -14.168 0.027 7.538 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -13.746 2.416 7.088 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -14.006 1.494 5.588 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -15.305 2.524 6.236 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -14.849 1.732 9.184 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -16.459 1.810 8.429 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -15.919 0.310 9.220 1.00 0.00 H new ATOM 1860 N THR A 123 -15.244 -0.003 4.205 1.00 0.00 N ATOM 1861 CA THR A 123 -14.603 -0.492 2.985 1.00 0.00 C ATOM 1862 C THR A 123 -13.086 -0.322 3.066 1.00 0.00 C ATOM 1863 O THR A 123 -12.587 0.790 3.250 1.00 0.00 O ATOM 1864 CB THR A 123 -15.141 0.245 1.750 1.00 0.00 C ATOM 1865 OG1 THR A 123 -16.085 1.244 2.111 1.00 0.00 O ATOM 1866 CG2 THR A 123 -15.803 -0.672 0.743 1.00 0.00 C ATOM 0 H THR A 123 -15.594 0.953 4.140 1.00 0.00 H new ATOM 0 HA THR A 123 -14.836 -1.552 2.890 1.00 0.00 H new ATOM 0 HB THR A 123 -14.261 0.693 1.289 1.00 0.00 H new ATOM 0 HG1 THR A 123 -16.408 1.696 1.304 1.00 0.00 H new ATOM 0 HG21 THR A 123 -16.160 -0.086 -0.104 1.00 0.00 H new ATOM 0 HG22 THR A 123 -15.081 -1.411 0.394 1.00 0.00 H new ATOM 0 HG23 THR A 123 -16.645 -1.181 1.213 1.00 0.00 H new ATOM 1874 N LEU A 124 -12.360 -1.433 2.924 1.00 0.00 N ATOM 1875 CA LEU A 124 -10.901 -1.411 2.974 1.00 0.00 C ATOM 1876 C LEU A 124 -10.303 -1.862 1.643 1.00 0.00 C ATOM 1877 O LEU A 124 -10.408 -3.032 1.268 1.00 0.00 O ATOM 1878 CB LEU A 124 -10.388 -2.308 4.104 1.00 0.00 C ATOM 1879 CG LEU A 124 -8.902 -2.146 4.440 1.00 0.00 C ATOM 1880 CD1 LEU A 124 -8.693 -0.989 5.407 1.00 0.00 C ATOM 1881 CD2 LEU A 124 -8.340 -3.439 5.018 1.00 0.00 C ATOM 0 H LEU A 124 -12.761 -2.359 2.773 1.00 0.00 H new ATOM 0 HA LEU A 124 -10.589 -0.385 3.166 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -10.972 -2.104 5.002 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -10.572 -3.348 3.833 1.00 0.00 H new ATOM 0 HG LEU A 124 -8.365 -1.921 3.519 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -7.631 -0.891 5.633 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -9.054 -0.066 4.954 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -9.244 -1.181 6.328 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -7.284 -3.305 5.250 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -8.882 -3.697 5.928 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -8.452 -4.242 4.290 1.00 0.00 H new ATOM 1893 N HIS A 125 -9.664 -0.929 0.939 1.00 0.00 N ATOM 1894 CA HIS A 125 -9.033 -1.224 -0.345 1.00 0.00 C ATOM 1895 C HIS A 125 -7.521 -1.346 -0.167 1.00 0.00 C ATOM 1896 O HIS A 125 -6.874 -0.422 0.326 1.00 0.00 O ATOM 1897 CB HIS A 125 -9.357 -0.130 -1.366 1.00 0.00 C ATOM 1898 CG HIS A 125 -9.590 -0.647 -2.753 1.00 0.00 C ATOM 1899 ND1 HIS A 125 -8.722 -0.901 -3.763 1.00 0.00 N flip ATOM 1900 CD2 HIS A 125 -10.842 -0.957 -3.242 1.00 0.00 C flip ATOM 1901 CE1 HIS A 125 -9.460 -1.354 -4.829 1.00 0.00 C flip ATOM 1902 NE2 HIS A 125 -10.735 -1.380 -4.488 1.00 0.00 N flip ATOM 0 H HIS A 125 -9.570 0.041 1.238 1.00 0.00 H new ATOM 0 HA HIS A 125 -9.425 -2.171 -0.717 1.00 0.00 H new ATOM 0 HB2 HIS A 125 -10.244 0.411 -1.036 1.00 0.00 H new ATOM 0 HB3 HIS A 125 -8.537 0.587 -1.389 1.00 0.00 H new ATOM 0 HD1 HIS A 125 -7.710 -0.779 -3.736 1.00 0.00 H new ATOM 0 HD2 HIS A 125 -11.767 -0.868 -2.691 1.00 0.00 H new ATOM 0 HE1 HIS A 125 -9.062 -1.642 -5.791 1.00 0.00 H new ATOM 1911 N GLN A 126 -6.967 -2.494 -0.554 1.00 0.00 N ATOM 1912 CA GLN A 126 -5.532 -2.725 -0.416 1.00 0.00 C ATOM 1913 C GLN A 126 -4.902 -3.198 -1.724 1.00 0.00 C ATOM 1914 O GLN A 126 -5.563 -3.813 -2.563 1.00 0.00 O ATOM 1915 CB GLN A 126 -5.265 -3.744 0.696 1.00 0.00 C ATOM 1916 CG GLN A 126 -5.798 -5.141 0.400 1.00 0.00 C ATOM 1917 CD GLN A 126 -5.407 -6.154 1.460 1.00 0.00 C ATOM 1918 OE1 GLN A 126 -6.253 -6.880 1.981 1.00 0.00 O ATOM 1919 NE2 GLN A 126 -4.120 -6.212 1.785 1.00 0.00 N ATOM 0 H GLN A 126 -7.486 -3.272 -0.962 1.00 0.00 H new ATOM 0 HA GLN A 126 -5.071 -1.773 -0.154 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -4.190 -3.805 0.868 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -5.715 -3.383 1.621 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -6.885 -5.102 0.324 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -5.422 -5.471 -0.568 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -3.450 -5.592 1.329 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -3.802 -6.876 2.490 1.00 0.00 H new ATOM 1928 N ALA A 127 -3.609 -2.909 -1.874 1.00 0.00 N ATOM 1929 CA ALA A 127 -2.856 -3.302 -3.061 1.00 0.00 C ATOM 1930 C ALA A 127 -1.555 -3.998 -2.671 1.00 0.00 C ATOM 1931 O ALA A 127 -1.030 -3.783 -1.575 1.00 0.00 O ATOM 1932 CB ALA A 127 -2.569 -2.091 -3.934 1.00 0.00 C ATOM 0 H ALA A 127 -3.060 -2.400 -1.181 1.00 0.00 H new ATOM 0 HA ALA A 127 -3.462 -4.006 -3.632 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -2.007 -2.402 -4.815 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -3.509 -1.636 -4.246 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -1.985 -1.365 -3.369 1.00 0.00 H new ATOM 1938 N LEU A 128 -1.040 -4.834 -3.571 1.00 0.00 N ATOM 1939 CA LEU A 128 0.194 -5.567 -3.323 1.00 0.00 C ATOM 1940 C LEU A 128 1.141 -5.470 -4.515 1.00 0.00 C ATOM 1941 O LEU A 128 0.767 -5.790 -5.644 1.00 0.00 O ATOM 1942 CB LEU A 128 -0.110 -7.036 -3.022 1.00 0.00 C ATOM 1943 CG LEU A 128 0.633 -7.622 -1.821 1.00 0.00 C ATOM 1944 CD1 LEU A 128 0.061 -7.077 -0.521 1.00 0.00 C ATOM 1945 CD2 LEU A 128 0.563 -9.142 -1.847 1.00 0.00 C ATOM 0 H LEU A 128 -1.462 -5.019 -4.481 1.00 0.00 H new ATOM 0 HA LEU A 128 0.681 -5.116 -2.458 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -1.182 -7.141 -2.853 1.00 0.00 H new ATOM 0 HB3 LEU A 128 0.133 -7.629 -3.904 1.00 0.00 H new ATOM 0 HG LEU A 128 1.680 -7.325 -1.881 1.00 0.00 H new ATOM 0 HD11 LEU A 128 0.602 -7.505 0.323 1.00 0.00 H new ATOM 0 HD12 LEU A 128 0.164 -5.992 -0.505 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -0.994 -7.343 -0.448 1.00 0.00 H new ATOM 0 HD21 LEU A 128 1.096 -9.546 -0.986 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -0.479 -9.459 -1.810 1.00 0.00 H new ATOM 0 HD23 LEU A 128 1.022 -9.512 -2.764 1.00 0.00 H new ATOM 1957 N LEU A 129 2.372 -5.041 -4.250 1.00 0.00 N ATOM 1958 CA LEU A 129 3.385 -4.914 -5.292 1.00 0.00 C ATOM 1959 C LEU A 129 4.584 -5.802 -4.971 1.00 0.00 C ATOM 1960 O LEU A 129 5.405 -5.467 -4.114 1.00 0.00 O ATOM 1961 CB LEU A 129 3.825 -3.453 -5.441 1.00 0.00 C ATOM 1962 CG LEU A 129 2.685 -2.438 -5.595 1.00 0.00 C ATOM 1963 CD1 LEU A 129 3.171 -1.032 -5.279 1.00 0.00 C ATOM 1964 CD2 LEU A 129 2.100 -2.502 -6.999 1.00 0.00 C ATOM 0 H LEU A 129 2.692 -4.775 -3.319 1.00 0.00 H new ATOM 0 HA LEU A 129 2.952 -5.239 -6.238 1.00 0.00 H new ATOM 0 HB2 LEU A 129 4.418 -3.179 -4.569 1.00 0.00 H new ATOM 0 HB3 LEU A 129 4.479 -3.374 -6.309 1.00 0.00 H new ATOM 0 HG LEU A 129 1.899 -2.694 -4.884 1.00 0.00 H new ATOM 0 HD11 LEU A 129 2.347 -0.328 -5.394 1.00 0.00 H new ATOM 0 HD12 LEU A 129 3.538 -0.996 -4.253 1.00 0.00 H new ATOM 0 HD13 LEU A 129 3.976 -0.763 -5.963 1.00 0.00 H new ATOM 0 HD21 LEU A 129 1.293 -1.775 -7.090 1.00 0.00 H new ATOM 0 HD22 LEU A 129 2.878 -2.274 -7.728 1.00 0.00 H new ATOM 0 HD23 LEU A 129 1.710 -3.503 -7.185 1.00 0.00 H new ATOM 1976 N ARG A 130 4.670 -6.944 -5.655 1.00 0.00 N ATOM 1977 CA ARG A 130 5.761 -7.893 -5.439 1.00 0.00 C ATOM 1978 C ARG A 130 6.863 -7.710 -6.482 1.00 0.00 C ATOM 1979 O ARG A 130 6.630 -7.869 -7.681 1.00 0.00 O ATOM 1980 CB ARG A 130 5.241 -9.339 -5.463 1.00 0.00 C ATOM 1981 CG ARG A 130 4.335 -9.658 -6.647 1.00 0.00 C ATOM 1982 CD ARG A 130 4.179 -11.160 -6.847 1.00 0.00 C ATOM 1983 NE ARG A 130 2.912 -11.499 -7.498 1.00 0.00 N ATOM 1984 CZ ARG A 130 2.674 -12.657 -8.122 1.00 0.00 C ATOM 1985 NH1 ARG A 130 3.605 -13.607 -8.168 1.00 0.00 N ATOM 1986 NH2 ARG A 130 1.495 -12.866 -8.698 1.00 0.00 N ATOM 0 H ARG A 130 3.996 -7.234 -6.364 1.00 0.00 H new ATOM 0 HA ARG A 130 6.184 -7.693 -4.455 1.00 0.00 H new ATOM 0 HB2 ARG A 130 6.093 -10.019 -5.478 1.00 0.00 H new ATOM 0 HB3 ARG A 130 4.695 -9.532 -4.540 1.00 0.00 H new ATOM 0 HG2 ARG A 130 3.355 -9.208 -6.487 1.00 0.00 H new ATOM 0 HG3 ARG A 130 4.747 -9.211 -7.552 1.00 0.00 H new ATOM 0 HD2 ARG A 130 5.007 -11.533 -7.449 1.00 0.00 H new ATOM 0 HD3 ARG A 130 4.236 -11.662 -5.881 1.00 0.00 H new ATOM 0 HE ARG A 130 2.163 -10.807 -7.474 1.00 0.00 H new ATOM 0 HH11 ARG A 130 4.511 -13.455 -7.724 1.00 0.00 H new ATOM 0 HH12 ARG A 130 3.413 -14.487 -8.647 1.00 0.00 H new ATOM 0 HH21 ARG A 130 0.775 -12.144 -8.663 1.00 0.00 H new ATOM 0 HH22 ARG A 130 1.310 -13.748 -9.175 1.00 0.00 H new ATOM 2000 N LEU A 131 8.064 -7.378 -6.013 1.00 0.00 N ATOM 2001 CA LEU A 131 9.210 -7.176 -6.897 1.00 0.00 C ATOM 2002 C LEU A 131 10.274 -8.241 -6.642 1.00 0.00 C ATOM 2003 O LEU A 131 10.597 -8.540 -5.490 1.00 0.00 O ATOM 2004 CB LEU A 131 9.808 -5.780 -6.690 1.00 0.00 C ATOM 2005 CG LEU A 131 8.817 -4.617 -6.828 1.00 0.00 C ATOM 2006 CD1 LEU A 131 8.015 -4.437 -5.546 1.00 0.00 C ATOM 2007 CD2 LEU A 131 9.547 -3.329 -7.185 1.00 0.00 C ATOM 0 H LEU A 131 8.269 -7.243 -5.023 1.00 0.00 H new ATOM 0 HA LEU A 131 8.866 -7.261 -7.928 1.00 0.00 H new ATOM 0 HB2 LEU A 131 10.257 -5.738 -5.697 1.00 0.00 H new ATOM 0 HB3 LEU A 131 10.614 -5.637 -7.410 1.00 0.00 H new ATOM 0 HG LEU A 131 8.124 -4.855 -7.635 1.00 0.00 H new ATOM 0 HD11 LEU A 131 7.319 -3.607 -5.666 1.00 0.00 H new ATOM 0 HD12 LEU A 131 7.459 -5.350 -5.334 1.00 0.00 H new ATOM 0 HD13 LEU A 131 8.693 -4.225 -4.719 1.00 0.00 H new ATOM 0 HD21 LEU A 131 8.827 -2.516 -7.278 1.00 0.00 H new ATOM 0 HD22 LEU A 131 10.265 -3.089 -6.401 1.00 0.00 H new ATOM 0 HD23 LEU A 131 10.072 -3.459 -8.131 1.00 0.00 H new ATOM 2019 N PRO A 132 10.829 -8.840 -7.715 1.00 0.00 N ATOM 2020 CA PRO A 132 11.854 -9.884 -7.598 1.00 0.00 C ATOM 2021 C PRO A 132 13.271 -9.332 -7.390 1.00 0.00 C ATOM 2022 O PRO A 132 14.244 -10.085 -7.445 1.00 0.00 O ATOM 2023 CB PRO A 132 11.754 -10.596 -8.942 1.00 0.00 C ATOM 2024 CG PRO A 132 11.375 -9.516 -9.899 1.00 0.00 C ATOM 2025 CD PRO A 132 10.498 -8.560 -9.128 1.00 0.00 C ATOM 0 HA PRO A 132 11.686 -10.520 -6.729 1.00 0.00 H new ATOM 0 HB2 PRO A 132 12.701 -11.060 -9.219 1.00 0.00 H new ATOM 0 HB3 PRO A 132 11.006 -11.388 -8.919 1.00 0.00 H new ATOM 0 HG2 PRO A 132 12.260 -9.009 -10.284 1.00 0.00 H new ATOM 0 HG3 PRO A 132 10.843 -9.926 -10.758 1.00 0.00 H new ATOM 0 HD2 PRO A 132 10.709 -7.523 -9.390 1.00 0.00 H new ATOM 0 HD3 PRO A 132 9.441 -8.732 -9.333 1.00 0.00 H new ATOM 2033 N GLN A 133 13.386 -8.020 -7.147 1.00 0.00 N ATOM 2034 CA GLN A 133 14.688 -7.388 -6.928 1.00 0.00 C ATOM 2035 C GLN A 133 15.447 -8.086 -5.795 1.00 0.00 C ATOM 2036 O GLN A 133 16.667 -8.247 -5.860 1.00 0.00 O ATOM 2037 CB GLN A 133 14.518 -5.896 -6.611 1.00 0.00 C ATOM 2038 CG GLN A 133 14.031 -5.072 -7.797 1.00 0.00 C ATOM 2039 CD GLN A 133 15.018 -5.056 -8.952 1.00 0.00 C ATOM 2040 OE1 GLN A 133 15.090 -6.005 -9.732 1.00 0.00 O ATOM 2041 NE2 GLN A 133 15.786 -3.977 -9.069 1.00 0.00 N ATOM 0 H GLN A 133 12.594 -7.379 -7.098 1.00 0.00 H new ATOM 0 HA GLN A 133 15.269 -7.486 -7.845 1.00 0.00 H new ATOM 0 HB2 GLN A 133 13.811 -5.786 -5.788 1.00 0.00 H new ATOM 0 HB3 GLN A 133 15.472 -5.495 -6.268 1.00 0.00 H new ATOM 0 HG2 GLN A 133 13.079 -5.473 -8.145 1.00 0.00 H new ATOM 0 HG3 GLN A 133 13.846 -4.049 -7.470 1.00 0.00 H new ATOM 0 HE21 GLN A 133 15.695 -3.211 -8.401 1.00 0.00 H new ATOM 0 HE22 GLN A 133 16.466 -3.915 -9.827 1.00 0.00 H new ATOM 2050 N TYR A 134 14.706 -8.504 -4.766 1.00 0.00 N ATOM 2051 CA TYR A 134 15.285 -9.198 -3.616 1.00 0.00 C ATOM 2052 C TYR A 134 14.181 -9.773 -2.719 1.00 0.00 C ATOM 2053 O TYR A 134 14.304 -9.778 -1.491 1.00 0.00 O ATOM 2054 CB TYR A 134 16.187 -8.248 -2.815 1.00 0.00 C ATOM 2055 CG TYR A 134 15.427 -7.161 -2.089 1.00 0.00 C ATOM 2056 CD1 TYR A 134 14.628 -6.269 -2.787 1.00 0.00 C ATOM 2057 CD2 TYR A 134 15.505 -7.034 -0.710 1.00 0.00 C ATOM 2058 CE1 TYR A 134 13.926 -5.281 -2.133 1.00 0.00 C ATOM 2059 CE2 TYR A 134 14.806 -6.049 -0.048 1.00 0.00 C ATOM 2060 CZ TYR A 134 14.016 -5.172 -0.761 1.00 0.00 C ATOM 2061 OH TYR A 134 13.313 -4.187 -0.103 1.00 0.00 O ATOM 0 H TYR A 134 13.696 -8.372 -4.707 1.00 0.00 H new ATOM 0 HA TYR A 134 15.893 -10.025 -3.984 1.00 0.00 H new ATOM 0 HB2 TYR A 134 16.758 -8.828 -2.089 1.00 0.00 H new ATOM 0 HB3 TYR A 134 16.907 -7.787 -3.491 1.00 0.00 H new ATOM 0 HD1 TYR A 134 14.555 -6.350 -3.861 1.00 0.00 H new ATOM 0 HD2 TYR A 134 16.123 -7.718 -0.147 1.00 0.00 H new ATOM 0 HE1 TYR A 134 13.308 -4.594 -2.692 1.00 0.00 H new ATOM 0 HE2 TYR A 134 14.876 -5.964 1.026 1.00 0.00 H new ATOM 0 HH TYR A 134 12.984 -4.535 0.752 1.00 0.00 H new ATOM 2071 N GLN A 135 13.096 -10.252 -3.343 1.00 0.00 N ATOM 2072 CA GLN A 135 11.966 -10.815 -2.608 1.00 0.00 C ATOM 2073 C GLN A 135 11.355 -9.756 -1.685 1.00 0.00 C ATOM 2074 O GLN A 135 11.615 -9.740 -0.481 1.00 0.00 O ATOM 2075 CB GLN A 135 12.405 -12.046 -1.804 1.00 0.00 C ATOM 2076 CG GLN A 135 12.031 -13.367 -2.458 1.00 0.00 C ATOM 2077 CD GLN A 135 13.047 -13.827 -3.489 1.00 0.00 C ATOM 2078 OE1 GLN A 135 14.255 -13.731 -3.271 1.00 0.00 O ATOM 2079 NE2 GLN A 135 12.562 -14.334 -4.618 1.00 0.00 N ATOM 0 H GLN A 135 12.982 -10.259 -4.357 1.00 0.00 H new ATOM 0 HA GLN A 135 11.207 -11.130 -3.324 1.00 0.00 H new ATOM 0 HB2 GLN A 135 13.486 -12.012 -1.665 1.00 0.00 H new ATOM 0 HB3 GLN A 135 11.955 -12.001 -0.812 1.00 0.00 H new ATOM 0 HG2 GLN A 135 11.931 -14.132 -1.688 1.00 0.00 H new ATOM 0 HG3 GLN A 135 11.057 -13.267 -2.936 1.00 0.00 H new ATOM 0 HE21 GLN A 135 11.553 -14.395 -4.758 1.00 0.00 H new ATOM 0 HE22 GLN A 135 13.198 -14.662 -5.345 1.00 0.00 H new ATOM 2088 N THR A 136 10.553 -8.862 -2.264 1.00 0.00 N ATOM 2089 CA THR A 136 9.916 -7.791 -1.498 1.00 0.00 C ATOM 2090 C THR A 136 8.397 -7.797 -1.685 1.00 0.00 C ATOM 2091 O THR A 136 7.892 -8.177 -2.745 1.00 0.00 O ATOM 2092 CB THR A 136 10.495 -6.436 -1.916 1.00 0.00 C ATOM 2093 OG1 THR A 136 9.989 -5.393 -1.099 1.00 0.00 O ATOM 2094 CG2 THR A 136 10.203 -6.074 -3.357 1.00 0.00 C ATOM 0 H THR A 136 10.329 -8.858 -3.259 1.00 0.00 H new ATOM 0 HA THR A 136 10.122 -7.962 -0.441 1.00 0.00 H new ATOM 0 HB THR A 136 11.573 -6.540 -1.797 1.00 0.00 H new ATOM 0 HG1 THR A 136 9.708 -5.761 -0.235 1.00 0.00 H new ATOM 0 HG21 THR A 136 10.642 -5.103 -3.584 1.00 0.00 H new ATOM 0 HG22 THR A 136 10.631 -6.829 -4.016 1.00 0.00 H new ATOM 0 HG23 THR A 136 9.125 -6.029 -3.510 1.00 0.00 H new ATOM 2102 N ASP A 137 7.677 -7.365 -0.647 1.00 0.00 N ATOM 2103 CA ASP A 137 6.216 -7.309 -0.684 1.00 0.00 C ATOM 2104 C ASP A 137 5.705 -5.990 -0.091 1.00 0.00 C ATOM 2105 O ASP A 137 5.785 -5.775 1.121 1.00 0.00 O ATOM 2106 CB ASP A 137 5.621 -8.492 0.093 1.00 0.00 C ATOM 2107 CG ASP A 137 4.968 -9.536 -0.801 1.00 0.00 C ATOM 2108 OD1 ASP A 137 5.488 -9.793 -1.908 1.00 0.00 O ATOM 2109 OD2 ASP A 137 3.937 -10.108 -0.386 1.00 0.00 O ATOM 0 H ASP A 137 8.085 -7.048 0.232 1.00 0.00 H new ATOM 0 HA ASP A 137 5.900 -7.367 -1.726 1.00 0.00 H new ATOM 0 HB2 ASP A 137 6.409 -8.967 0.677 1.00 0.00 H new ATOM 0 HB3 ASP A 137 4.882 -8.117 0.801 1.00 0.00 H new ATOM 2114 N LEU A 138 5.179 -5.113 -0.951 1.00 0.00 N ATOM 2115 CA LEU A 138 4.651 -3.818 -0.511 1.00 0.00 C ATOM 2116 C LEU A 138 3.141 -3.891 -0.287 1.00 0.00 C ATOM 2117 O LEU A 138 2.400 -4.355 -1.157 1.00 0.00 O ATOM 2118 CB LEU A 138 4.972 -2.730 -1.542 1.00 0.00 C ATOM 2119 CG LEU A 138 6.308 -2.011 -1.333 1.00 0.00 C ATOM 2120 CD1 LEU A 138 6.824 -1.448 -2.649 1.00 0.00 C ATOM 2121 CD2 LEU A 138 6.163 -0.908 -0.294 1.00 0.00 C ATOM 0 H LEU A 138 5.107 -5.276 -1.955 1.00 0.00 H new ATOM 0 HA LEU A 138 5.130 -3.565 0.435 1.00 0.00 H new ATOM 0 HB2 LEU A 138 4.971 -3.180 -2.535 1.00 0.00 H new ATOM 0 HB3 LEU A 138 4.172 -1.990 -1.527 1.00 0.00 H new ATOM 0 HG LEU A 138 7.035 -2.734 -0.964 1.00 0.00 H new ATOM 0 HD11 LEU A 138 7.774 -0.941 -2.480 1.00 0.00 H new ATOM 0 HD12 LEU A 138 6.968 -2.261 -3.361 1.00 0.00 H new ATOM 0 HD13 LEU A 138 6.100 -0.738 -3.050 1.00 0.00 H new ATOM 0 HD21 LEU A 138 7.122 -0.408 -0.158 1.00 0.00 H new ATOM 0 HD22 LEU A 138 5.421 -0.185 -0.632 1.00 0.00 H new ATOM 0 HD23 LEU A 138 5.842 -1.341 0.654 1.00 0.00 H new ATOM 2133 N LEU A 139 2.696 -3.433 0.883 1.00 0.00 N ATOM 2134 CA LEU A 139 1.275 -3.448 1.231 1.00 0.00 C ATOM 2135 C LEU A 139 0.686 -2.040 1.247 1.00 0.00 C ATOM 2136 O LEU A 139 1.359 -1.073 1.613 1.00 0.00 O ATOM 2137 CB LEU A 139 1.068 -4.109 2.597 1.00 0.00 C ATOM 2138 CG LEU A 139 1.319 -5.620 2.633 1.00 0.00 C ATOM 2139 CD1 LEU A 139 2.772 -5.916 2.982 1.00 0.00 C ATOM 2140 CD2 LEU A 139 0.378 -6.294 3.625 1.00 0.00 C ATOM 0 H LEU A 139 3.301 -3.046 1.608 1.00 0.00 H new ATOM 0 HA LEU A 139 0.756 -4.025 0.466 1.00 0.00 H new ATOM 0 HB2 LEU A 139 1.729 -3.629 3.319 1.00 0.00 H new ATOM 0 HB3 LEU A 139 0.046 -3.918 2.924 1.00 0.00 H new ATOM 0 HG LEU A 139 1.119 -6.025 1.641 1.00 0.00 H new ATOM 0 HD11 LEU A 139 2.929 -6.994 3.002 1.00 0.00 H new ATOM 0 HD12 LEU A 139 3.425 -5.468 2.232 1.00 0.00 H new ATOM 0 HD13 LEU A 139 3.004 -5.497 3.961 1.00 0.00 H new ATOM 0 HD21 LEU A 139 0.570 -7.367 3.638 1.00 0.00 H new ATOM 0 HD22 LEU A 139 0.545 -5.884 4.621 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -0.655 -6.114 3.327 1.00 0.00 H new ATOM 2152 N LEU A 140 -0.584 -1.940 0.851 1.00 0.00 N ATOM 2153 CA LEU A 140 -1.296 -0.664 0.817 1.00 0.00 C ATOM 2154 C LEU A 140 -2.608 -0.760 1.593 1.00 0.00 C ATOM 2155 O LEU A 140 -3.351 -1.731 1.444 1.00 0.00 O ATOM 2156 CB LEU A 140 -1.589 -0.260 -0.631 1.00 0.00 C ATOM 2157 CG LEU A 140 -0.767 0.914 -1.163 1.00 0.00 C ATOM 2158 CD1 LEU A 140 0.579 0.432 -1.683 1.00 0.00 C ATOM 2159 CD2 LEU A 140 -1.538 1.646 -2.254 1.00 0.00 C ATOM 0 H LEU A 140 -1.144 -2.736 0.547 1.00 0.00 H new ATOM 0 HA LEU A 140 -0.663 0.091 1.282 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -1.416 -1.123 -1.273 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -2.646 -0.008 -0.713 1.00 0.00 H new ATOM 0 HG LEU A 140 -0.584 1.610 -0.345 1.00 0.00 H new ATOM 0 HD11 LEU A 140 1.150 1.282 -2.058 1.00 0.00 H new ATOM 0 HD12 LEU A 140 1.131 -0.048 -0.875 1.00 0.00 H new ATOM 0 HD13 LEU A 140 0.422 -0.284 -2.490 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -0.941 2.480 -2.624 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -1.750 0.959 -3.073 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -2.476 2.024 -1.846 1.00 0.00 H new ATOM 2171 N THR A 141 -2.889 0.248 2.419 1.00 0.00 N ATOM 2172 CA THR A 141 -4.115 0.267 3.215 1.00 0.00 C ATOM 2173 C THR A 141 -4.924 1.537 2.944 1.00 0.00 C ATOM 2174 O THR A 141 -4.545 2.631 3.365 1.00 0.00 O ATOM 2175 CB THR A 141 -3.797 0.157 4.710 1.00 0.00 C ATOM 2176 OG1 THR A 141 -2.567 -0.519 4.921 1.00 0.00 O ATOM 2177 CG2 THR A 141 -4.862 -0.579 5.494 1.00 0.00 C ATOM 0 H THR A 141 -2.286 1.059 2.554 1.00 0.00 H new ATOM 0 HA THR A 141 -4.714 -0.595 2.921 1.00 0.00 H new ATOM 0 HB THR A 141 -3.746 1.186 5.067 1.00 0.00 H new ATOM 0 HG1 THR A 141 -1.826 0.050 4.625 1.00 0.00 H new ATOM 0 HG21 THR A 141 -4.576 -0.622 6.545 1.00 0.00 H new ATOM 0 HG22 THR A 141 -5.813 -0.054 5.398 1.00 0.00 H new ATOM 0 HG23 THR A 141 -4.966 -1.592 5.105 1.00 0.00 H new ATOM 2185 N PHE A 142 -6.039 1.375 2.232 1.00 0.00 N ATOM 2186 CA PHE A 142 -6.918 2.491 1.886 1.00 0.00 C ATOM 2187 C PHE A 142 -8.294 2.314 2.531 1.00 0.00 C ATOM 2188 O PHE A 142 -9.159 1.629 1.980 1.00 0.00 O ATOM 2189 CB PHE A 142 -7.069 2.579 0.366 1.00 0.00 C ATOM 2190 CG PHE A 142 -6.739 3.922 -0.219 1.00 0.00 C ATOM 2191 CD1 PHE A 142 -7.684 4.936 -0.244 1.00 0.00 C ATOM 2192 CD2 PHE A 142 -5.489 4.164 -0.766 1.00 0.00 C ATOM 2193 CE1 PHE A 142 -7.388 6.165 -0.802 1.00 0.00 C ATOM 2194 CE2 PHE A 142 -5.188 5.389 -1.328 1.00 0.00 C ATOM 2195 CZ PHE A 142 -6.138 6.390 -1.347 1.00 0.00 C ATOM 0 H PHE A 142 -6.357 0.472 1.881 1.00 0.00 H new ATOM 0 HA PHE A 142 -6.473 3.412 2.262 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -6.425 1.829 -0.094 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -8.095 2.324 0.101 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -8.663 4.763 0.178 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -4.741 3.385 -0.753 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -8.132 6.948 -0.812 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -4.210 5.564 -1.752 1.00 0.00 H new ATOM 0 HZ PHE A 142 -5.905 7.348 -1.787 1.00 0.00 H new ATOM 2205 N ASN A 143 -8.497 2.934 3.693 1.00 0.00 N ATOM 2206 CA ASN A 143 -9.779 2.836 4.392 1.00 0.00 C ATOM 2207 C ASN A 143 -10.578 4.128 4.245 1.00 0.00 C ATOM 2208 O ASN A 143 -10.041 5.222 4.422 1.00 0.00 O ATOM 2209 CB ASN A 143 -9.575 2.511 5.879 1.00 0.00 C ATOM 2210 CG ASN A 143 -8.559 3.415 6.554 1.00 0.00 C ATOM 2211 OD1 ASN A 143 -8.847 4.573 6.858 1.00 0.00 O ATOM 2212 ND2 ASN A 143 -7.363 2.888 6.797 1.00 0.00 N ATOM 0 H ASN A 143 -7.797 3.505 4.167 1.00 0.00 H new ATOM 0 HA ASN A 143 -10.342 2.022 3.935 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -10.530 2.597 6.398 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -9.252 1.475 5.977 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -6.642 3.448 7.252 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -7.166 1.924 6.528 1.00 0.00 H new ATOM 2219 N GLN A 144 -11.863 3.996 3.916 1.00 0.00 N ATOM 2220 CA GLN A 144 -12.731 5.157 3.746 1.00 0.00 C ATOM 2221 C GLN A 144 -14.163 4.844 4.182 1.00 0.00 C ATOM 2222 O GLN A 144 -14.900 4.158 3.474 1.00 0.00 O ATOM 2223 CB GLN A 144 -12.714 5.637 2.290 1.00 0.00 C ATOM 2224 CG GLN A 144 -12.847 4.522 1.263 1.00 0.00 C ATOM 2225 CD GLN A 144 -13.139 5.050 -0.130 1.00 0.00 C ATOM 2226 OE1 GLN A 144 -12.315 4.931 -1.036 1.00 0.00 O ATOM 2227 NE2 GLN A 144 -14.318 5.639 -0.308 1.00 0.00 N ATOM 0 H GLN A 144 -12.323 3.099 3.763 1.00 0.00 H new ATOM 0 HA GLN A 144 -12.347 5.955 4.382 1.00 0.00 H new ATOM 0 HB2 GLN A 144 -13.527 6.348 2.144 1.00 0.00 H new ATOM 0 HB3 GLN A 144 -11.783 6.175 2.107 1.00 0.00 H new ATOM 0 HG2 GLN A 144 -11.926 3.939 1.242 1.00 0.00 H new ATOM 0 HG3 GLN A 144 -13.646 3.845 1.567 1.00 0.00 H new ATOM 0 HE21 GLN A 144 -14.972 5.717 0.471 1.00 0.00 H new ATOM 0 HE22 GLN A 144 -14.568 6.013 -1.223 1.00 0.00 H new ATOM 2236 N PRO A 145 -14.571 5.346 5.365 1.00 0.00 N ATOM 2237 CA PRO A 145 -15.921 5.121 5.903 1.00 0.00 C ATOM 2238 C PRO A 145 -17.015 5.673 4.984 1.00 0.00 C ATOM 2239 O PRO A 145 -16.824 6.703 4.332 1.00 0.00 O ATOM 2240 CB PRO A 145 -15.911 5.879 7.239 1.00 0.00 C ATOM 2241 CG PRO A 145 -14.471 6.045 7.581 1.00 0.00 C ATOM 2242 CD PRO A 145 -13.751 6.167 6.271 1.00 0.00 C ATOM 0 HA PRO A 145 -16.143 4.059 6.004 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -16.408 6.845 7.148 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -16.438 5.321 8.013 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -14.315 6.931 8.197 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -14.104 5.192 8.151 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -13.694 7.203 5.937 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -12.728 5.797 6.337 1.00 0.00 H new ATOM 2473 N PRO A 162 -17.126 12.273 -2.013 1.00 0.00 N ATOM 2474 CA PRO A 162 -16.171 11.357 -1.363 1.00 0.00 C ATOM 2475 C PRO A 162 -15.153 10.771 -2.342 1.00 0.00 C ATOM 2476 O PRO A 162 -15.430 10.642 -3.537 1.00 0.00 O ATOM 2477 CB PRO A 162 -17.069 10.252 -0.796 1.00 0.00 C ATOM 2478 CG PRO A 162 -18.396 10.901 -0.608 1.00 0.00 C ATOM 2479 CD PRO A 162 -18.525 11.914 -1.709 1.00 0.00 C ATOM 0 HA PRO A 162 -15.570 11.868 -0.611 1.00 0.00 H new ATOM 0 HB2 PRO A 162 -17.136 9.406 -1.480 1.00 0.00 H new ATOM 0 HB3 PRO A 162 -16.678 9.869 0.147 1.00 0.00 H new ATOM 0 HG2 PRO A 162 -19.200 10.166 -0.659 1.00 0.00 H new ATOM 0 HG3 PRO A 162 -18.461 11.378 0.370 1.00 0.00 H new ATOM 0 HD2 PRO A 162 -19.031 11.498 -2.580 1.00 0.00 H new ATOM 0 HD3 PRO A 162 -19.102 12.782 -1.390 1.00 0.00 H new ATOM 2487 N TRP A 163 -13.974 10.420 -1.827 1.00 0.00 N ATOM 2488 CA TRP A 163 -12.912 9.852 -2.656 1.00 0.00 C ATOM 2489 C TRP A 163 -13.279 8.452 -3.145 1.00 0.00 C ATOM 2490 O TRP A 163 -13.927 7.683 -2.431 1.00 0.00 O ATOM 2491 CB TRP A 163 -11.586 9.810 -1.887 1.00 0.00 C ATOM 2492 CG TRP A 163 -10.654 10.920 -2.261 1.00 0.00 C ATOM 2493 CD1 TRP A 163 -10.361 11.351 -3.523 1.00 0.00 C ATOM 2494 CD2 TRP A 163 -9.893 11.743 -1.369 1.00 0.00 C ATOM 2495 NE1 TRP A 163 -9.468 12.392 -3.472 1.00 0.00 N ATOM 2496 CE2 TRP A 163 -9.164 12.651 -2.160 1.00 0.00 C ATOM 2497 CE3 TRP A 163 -9.757 11.802 0.021 1.00 0.00 C ATOM 2498 CZ2 TRP A 163 -8.314 13.606 -1.608 1.00 0.00 C ATOM 2499 CZ3 TRP A 163 -8.913 12.750 0.567 1.00 0.00 C ATOM 2500 CH2 TRP A 163 -8.202 13.640 -0.246 1.00 0.00 C ATOM 0 H TRP A 163 -13.731 10.519 -0.841 1.00 0.00 H new ATOM 0 HA TRP A 163 -12.794 10.498 -3.526 1.00 0.00 H new ATOM 0 HB2 TRP A 163 -11.791 9.861 -0.818 1.00 0.00 H new ATOM 0 HB3 TRP A 163 -11.096 8.854 -2.072 1.00 0.00 H new ATOM 0 HD1 TRP A 163 -10.772 10.933 -4.430 1.00 0.00 H new ATOM 0 HE1 TRP A 163 -9.092 12.891 -4.278 1.00 0.00 H new ATOM 0 HE3 TRP A 163 -10.302 11.119 0.656 1.00 0.00 H new ATOM 0 HZ2 TRP A 163 -7.764 14.294 -2.233 1.00 0.00 H new ATOM 0 HZ3 TRP A 163 -8.800 12.805 1.640 1.00 0.00 H new ATOM 0 HH2 TRP A 163 -7.551 14.369 0.213 1.00 0.00 H new ATOM 2511 N SER A 164 -12.863 8.134 -4.371 1.00 0.00 N ATOM 2512 CA SER A 164 -13.145 6.832 -4.972 1.00 0.00 C ATOM 2513 C SER A 164 -11.850 6.161 -5.446 1.00 0.00 C ATOM 2514 O SER A 164 -10.763 6.501 -4.972 1.00 0.00 O ATOM 2515 CB SER A 164 -14.130 6.997 -6.137 1.00 0.00 C ATOM 2516 OG SER A 164 -15.043 8.057 -5.897 1.00 0.00 O ATOM 0 H SER A 164 -12.328 8.764 -4.969 1.00 0.00 H new ATOM 0 HA SER A 164 -13.599 6.189 -4.218 1.00 0.00 H new ATOM 0 HB2 SER A 164 -13.579 7.191 -7.057 1.00 0.00 H new ATOM 0 HB3 SER A 164 -14.680 6.068 -6.285 1.00 0.00 H new ATOM 0 HG SER A 164 -15.656 8.139 -6.657 1.00 0.00 H new ATOM 2522 N LEU A 165 -11.970 5.211 -6.381 1.00 0.00 N ATOM 2523 CA LEU A 165 -10.804 4.499 -6.916 1.00 0.00 C ATOM 2524 C LEU A 165 -9.754 5.468 -7.466 1.00 0.00 C ATOM 2525 O LEU A 165 -8.559 5.167 -7.447 1.00 0.00 O ATOM 2526 CB LEU A 165 -11.227 3.520 -8.017 1.00 0.00 C ATOM 2527 CG LEU A 165 -10.803 2.063 -7.799 1.00 0.00 C ATOM 2528 CD1 LEU A 165 -9.286 1.937 -7.815 1.00 0.00 C ATOM 2529 CD2 LEU A 165 -11.373 1.526 -6.492 1.00 0.00 C ATOM 0 H LEU A 165 -12.861 4.918 -6.782 1.00 0.00 H new ATOM 0 HA LEU A 165 -10.358 3.944 -6.091 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -12.312 3.554 -8.113 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -10.812 3.864 -8.965 1.00 0.00 H new ATOM 0 HG LEU A 165 -11.204 1.465 -8.617 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -9.006 0.895 -7.659 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -8.903 2.275 -8.778 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -8.862 2.550 -7.020 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -11.060 0.491 -6.357 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -11.006 2.128 -5.661 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -12.461 1.575 -6.522 1.00 0.00 H new ATOM 2541 N GLY A 166 -10.206 6.630 -7.948 1.00 0.00 N ATOM 2542 CA GLY A 166 -9.295 7.626 -8.491 1.00 0.00 C ATOM 2543 C GLY A 166 -8.170 7.973 -7.531 1.00 0.00 C ATOM 2544 O GLY A 166 -7.014 8.095 -7.942 1.00 0.00 O ATOM 0 H GLY A 166 -11.190 6.897 -7.971 1.00 0.00 H new ATOM 0 HA2 GLY A 166 -8.870 7.255 -9.424 1.00 0.00 H new ATOM 0 HA3 GLY A 166 -9.853 8.530 -8.733 1.00 0.00 H new ATOM 2548 N ASP A 167 -8.508 8.123 -6.248 1.00 0.00 N ATOM 2549 CA ASP A 167 -7.515 8.447 -5.224 1.00 0.00 C ATOM 2550 C ASP A 167 -6.580 7.264 -4.991 1.00 0.00 C ATOM 2551 O ASP A 167 -5.361 7.434 -4.920 1.00 0.00 O ATOM 2552 CB ASP A 167 -8.197 8.850 -3.912 1.00 0.00 C ATOM 2553 CG ASP A 167 -7.363 9.824 -3.101 1.00 0.00 C ATOM 2554 OD1 ASP A 167 -6.868 10.814 -3.683 1.00 0.00 O ATOM 2555 OD2 ASP A 167 -7.205 9.600 -1.882 1.00 0.00 O ATOM 0 H ASP A 167 -9.460 8.025 -5.895 1.00 0.00 H new ATOM 0 HA ASP A 167 -6.926 9.293 -5.580 1.00 0.00 H new ATOM 0 HB2 ASP A 167 -9.165 9.301 -4.132 1.00 0.00 H new ATOM 0 HB3 ASP A 167 -8.389 7.957 -3.317 1.00 0.00 H new ATOM 2560 N PHE A 168 -7.155 6.066 -4.888 1.00 0.00 N ATOM 2561 CA PHE A 168 -6.368 4.852 -4.681 1.00 0.00 C ATOM 2562 C PHE A 168 -5.367 4.665 -5.821 1.00 0.00 C ATOM 2563 O PHE A 168 -4.206 4.326 -5.589 1.00 0.00 O ATOM 2564 CB PHE A 168 -7.282 3.626 -4.580 1.00 0.00 C ATOM 2565 CG PHE A 168 -6.553 2.355 -4.242 1.00 0.00 C ATOM 2566 CD1 PHE A 168 -5.865 1.651 -5.219 1.00 0.00 C ATOM 2567 CD2 PHE A 168 -6.554 1.866 -2.947 1.00 0.00 C ATOM 2568 CE1 PHE A 168 -5.192 0.485 -4.908 1.00 0.00 C ATOM 2569 CE2 PHE A 168 -5.883 0.700 -2.630 1.00 0.00 C ATOM 2570 CZ PHE A 168 -5.201 0.010 -3.613 1.00 0.00 C ATOM 0 H PHE A 168 -8.162 5.911 -4.945 1.00 0.00 H new ATOM 0 HA PHE A 168 -5.821 4.957 -3.744 1.00 0.00 H new ATOM 0 HB2 PHE A 168 -8.042 3.812 -3.821 1.00 0.00 H new ATOM 0 HB3 PHE A 168 -7.804 3.494 -5.528 1.00 0.00 H new ATOM 0 HD1 PHE A 168 -5.855 2.018 -6.235 1.00 0.00 H new ATOM 0 HD2 PHE A 168 -7.086 2.402 -2.175 1.00 0.00 H new ATOM 0 HE1 PHE A 168 -4.660 -0.054 -5.678 1.00 0.00 H new ATOM 0 HE2 PHE A 168 -5.892 0.329 -1.616 1.00 0.00 H new ATOM 0 HZ PHE A 168 -4.675 -0.901 -3.368 1.00 0.00 H new ATOM 2580 N GLU A 169 -5.828 4.896 -7.054 1.00 0.00 N ATOM 2581 CA GLU A 169 -4.977 4.762 -8.236 1.00 0.00 C ATOM 2582 C GLU A 169 -3.729 5.636 -8.114 1.00 0.00 C ATOM 2583 O GLU A 169 -2.640 5.232 -8.519 1.00 0.00 O ATOM 2584 CB GLU A 169 -5.757 5.132 -9.500 1.00 0.00 C ATOM 2585 CG GLU A 169 -6.566 3.979 -10.075 1.00 0.00 C ATOM 2586 CD GLU A 169 -7.447 4.403 -11.236 1.00 0.00 C ATOM 2587 OE1 GLU A 169 -8.562 4.904 -10.982 1.00 0.00 O ATOM 2588 OE2 GLU A 169 -7.021 4.231 -12.397 1.00 0.00 O ATOM 0 H GLU A 169 -6.787 5.177 -7.258 1.00 0.00 H new ATOM 0 HA GLU A 169 -4.661 3.721 -8.307 1.00 0.00 H new ATOM 0 HB2 GLU A 169 -6.430 5.959 -9.273 1.00 0.00 H new ATOM 0 HB3 GLU A 169 -5.058 5.488 -10.257 1.00 0.00 H new ATOM 0 HG2 GLU A 169 -5.887 3.194 -10.408 1.00 0.00 H new ATOM 0 HG3 GLU A 169 -7.188 3.550 -9.290 1.00 0.00 H new ATOM 2595 N GLN A 170 -3.893 6.832 -7.542 1.00 0.00 N ATOM 2596 CA GLN A 170 -2.773 7.756 -7.358 1.00 0.00 C ATOM 2597 C GLN A 170 -1.711 7.147 -6.436 1.00 0.00 C ATOM 2598 O GLN A 170 -0.512 7.368 -6.628 1.00 0.00 O ATOM 2599 CB GLN A 170 -3.272 9.090 -6.791 1.00 0.00 C ATOM 2600 CG GLN A 170 -2.197 10.162 -6.691 1.00 0.00 C ATOM 2601 CD GLN A 170 -1.580 10.506 -8.034 1.00 0.00 C ATOM 2602 OE1 GLN A 170 -0.296 10.207 -8.192 1.00 0.00 O flip ATOM 2603 NE2 GLN A 170 -2.251 11.033 -8.922 1.00 0.00 N flip ATOM 0 H GLN A 170 -4.788 7.181 -7.200 1.00 0.00 H new ATOM 0 HA GLN A 170 -2.316 7.938 -8.330 1.00 0.00 H new ATOM 0 HB2 GLN A 170 -4.082 9.460 -7.420 1.00 0.00 H new ATOM 0 HB3 GLN A 170 -3.692 8.917 -5.800 1.00 0.00 H new ATOM 0 HG2 GLN A 170 -2.628 11.062 -6.254 1.00 0.00 H new ATOM 0 HG3 GLN A 170 -1.414 9.822 -6.013 1.00 0.00 H new ATOM 0 HE21 GLN A 170 -3.235 11.246 -8.759 1.00 0.00 H new ATOM 0 HE22 GLN A 170 -1.823 11.256 -9.820 1.00 0.00 H new ATOM 2612 N LEU A 171 -2.152 6.363 -5.444 1.00 0.00 N ATOM 2613 CA LEU A 171 -1.222 5.716 -4.522 1.00 0.00 C ATOM 2614 C LEU A 171 -0.382 4.669 -5.252 1.00 0.00 C ATOM 2615 O LEU A 171 0.745 4.381 -4.850 1.00 0.00 O ATOM 2616 CB LEU A 171 -1.967 5.075 -3.343 1.00 0.00 C ATOM 2617 CG LEU A 171 -1.383 5.387 -1.959 1.00 0.00 C ATOM 2618 CD1 LEU A 171 -0.023 4.724 -1.784 1.00 0.00 C ATOM 2619 CD2 LEU A 171 -1.271 6.891 -1.751 1.00 0.00 C ATOM 0 H LEU A 171 -3.136 6.165 -5.264 1.00 0.00 H new ATOM 0 HA LEU A 171 -0.557 6.483 -4.126 1.00 0.00 H new ATOM 0 HB2 LEU A 171 -3.005 5.406 -3.366 1.00 0.00 H new ATOM 0 HB3 LEU A 171 -1.974 3.994 -3.482 1.00 0.00 H new ATOM 0 HG LEU A 171 -2.060 4.983 -1.207 1.00 0.00 H new ATOM 0 HD11 LEU A 171 0.372 4.959 -0.796 1.00 0.00 H new ATOM 0 HD12 LEU A 171 -0.129 3.644 -1.885 1.00 0.00 H new ATOM 0 HD13 LEU A 171 0.663 5.094 -2.546 1.00 0.00 H new ATOM 0 HD21 LEU A 171 -0.855 7.092 -0.764 1.00 0.00 H new ATOM 0 HD22 LEU A 171 -0.618 7.316 -2.513 1.00 0.00 H new ATOM 0 HD23 LEU A 171 -2.260 7.343 -1.827 1.00 0.00 H new ATOM 2631 N VAL A 172 -0.922 4.115 -6.341 1.00 0.00 N ATOM 2632 CA VAL A 172 -0.195 3.124 -7.130 1.00 0.00 C ATOM 2633 C VAL A 172 1.013 3.779 -7.796 1.00 0.00 C ATOM 2634 O VAL A 172 2.098 3.196 -7.846 1.00 0.00 O ATOM 2635 CB VAL A 172 -1.085 2.470 -8.209 1.00 0.00 C ATOM 2636 CG1 VAL A 172 -0.315 1.385 -8.952 1.00 0.00 C ATOM 2637 CG2 VAL A 172 -2.361 1.902 -7.594 1.00 0.00 C ATOM 0 H VAL A 172 -1.854 4.336 -6.692 1.00 0.00 H new ATOM 0 HA VAL A 172 0.130 2.339 -6.447 1.00 0.00 H new ATOM 0 HB VAL A 172 -1.371 3.240 -8.925 1.00 0.00 H new ATOM 0 HG11 VAL A 172 -0.958 0.935 -9.708 1.00 0.00 H new ATOM 0 HG12 VAL A 172 0.559 1.824 -9.433 1.00 0.00 H new ATOM 0 HG13 VAL A 172 0.006 0.619 -8.247 1.00 0.00 H new ATOM 0 HG21 VAL A 172 -2.970 1.447 -8.375 1.00 0.00 H new ATOM 0 HG22 VAL A 172 -2.102 1.148 -6.850 1.00 0.00 H new ATOM 0 HG23 VAL A 172 -2.923 2.704 -7.117 1.00 0.00 H new ATOM 2647 N THR A 173 0.825 5.010 -8.280 1.00 0.00 N ATOM 2648 CA THR A 173 1.907 5.759 -8.912 1.00 0.00 C ATOM 2649 C THR A 173 2.834 6.378 -7.861 1.00 0.00 C ATOM 2650 O THR A 173 3.852 6.985 -8.201 1.00 0.00 O ATOM 2651 CB THR A 173 1.356 6.861 -9.813 1.00 0.00 C ATOM 2652 OG1 THR A 173 0.225 7.481 -9.228 1.00 0.00 O ATOM 2653 CG2 THR A 173 0.950 6.364 -11.183 1.00 0.00 C ATOM 0 H THR A 173 -0.066 5.506 -8.245 1.00 0.00 H new ATOM 0 HA THR A 173 2.477 5.056 -9.519 1.00 0.00 H new ATOM 0 HB THR A 173 2.175 7.572 -9.926 1.00 0.00 H new ATOM 0 HG1 THR A 173 0.281 7.410 -8.252 1.00 0.00 H new ATOM 0 HG21 THR A 173 0.567 7.196 -11.773 1.00 0.00 H new ATOM 0 HG22 THR A 173 1.816 5.932 -11.684 1.00 0.00 H new ATOM 0 HG23 THR A 173 0.174 5.605 -11.080 1.00 0.00 H new ATOM 2661 N SER A 174 2.484 6.214 -6.583 1.00 0.00 N ATOM 2662 CA SER A 174 3.287 6.749 -5.485 1.00 0.00 C ATOM 2663 C SER A 174 4.575 5.931 -5.248 1.00 0.00 C ATOM 2664 O SER A 174 5.223 6.077 -4.210 1.00 0.00 O ATOM 2665 CB SER A 174 2.455 6.803 -4.199 1.00 0.00 C ATOM 2666 OG SER A 174 1.392 7.736 -4.319 1.00 0.00 O ATOM 0 H SER A 174 1.647 5.713 -6.284 1.00 0.00 H new ATOM 0 HA SER A 174 3.589 7.757 -5.768 1.00 0.00 H new ATOM 0 HB2 SER A 174 2.052 5.814 -3.980 1.00 0.00 H new ATOM 0 HB3 SER A 174 3.093 7.080 -3.360 1.00 0.00 H new ATOM 0 HG SER A 174 1.558 8.499 -3.727 1.00 0.00 H new ATOM 2672 N LEU A 175 4.954 5.085 -6.211 1.00 0.00 N ATOM 2673 CA LEU A 175 6.172 4.286 -6.095 1.00 0.00 C ATOM 2674 C LEU A 175 7.021 4.418 -7.367 1.00 0.00 C ATOM 2675 O LEU A 175 7.693 3.470 -7.781 1.00 0.00 O ATOM 2676 CB LEU A 175 5.820 2.816 -5.839 1.00 0.00 C ATOM 2677 CG LEU A 175 6.875 2.016 -5.065 1.00 0.00 C ATOM 2678 CD1 LEU A 175 6.392 1.724 -3.649 1.00 0.00 C ATOM 2679 CD2 LEU A 175 7.209 0.724 -5.798 1.00 0.00 C ATOM 0 H LEU A 175 4.435 4.938 -7.076 1.00 0.00 H new ATOM 0 HA LEU A 175 6.753 4.657 -5.251 1.00 0.00 H new ATOM 0 HB2 LEU A 175 4.880 2.775 -5.288 1.00 0.00 H new ATOM 0 HB3 LEU A 175 5.649 2.328 -6.798 1.00 0.00 H new ATOM 0 HG LEU A 175 7.783 2.615 -4.999 1.00 0.00 H new ATOM 0 HD11 LEU A 175 7.153 1.156 -3.115 1.00 0.00 H new ATOM 0 HD12 LEU A 175 6.207 2.663 -3.127 1.00 0.00 H new ATOM 0 HD13 LEU A 175 5.470 1.144 -3.691 1.00 0.00 H new ATOM 0 HD21 LEU A 175 7.959 0.169 -5.234 1.00 0.00 H new ATOM 0 HD22 LEU A 175 6.308 0.118 -5.897 1.00 0.00 H new ATOM 0 HD23 LEU A 175 7.599 0.958 -6.788 1.00 0.00 H new ATOM 2691 N THR A 176 6.978 5.605 -7.982 1.00 0.00 N ATOM 2692 CA THR A 176 7.730 5.877 -9.210 1.00 0.00 C ATOM 2693 C THR A 176 9.228 5.648 -9.009 1.00 0.00 C ATOM 2694 O THR A 176 9.867 6.324 -8.198 1.00 0.00 O ATOM 2695 CB THR A 176 7.475 7.311 -9.685 1.00 0.00 C ATOM 2696 OG1 THR A 176 7.769 8.243 -8.663 1.00 0.00 O ATOM 2697 CG2 THR A 176 6.047 7.544 -10.124 1.00 0.00 C ATOM 0 H THR A 176 6.427 6.395 -7.647 1.00 0.00 H new ATOM 0 HA THR A 176 7.382 5.181 -9.974 1.00 0.00 H new ATOM 0 HB THR A 176 8.133 7.453 -10.542 1.00 0.00 H new ATOM 0 HG1 THR A 176 7.600 9.151 -8.990 1.00 0.00 H new ATOM 0 HG21 THR A 176 5.930 8.578 -10.449 1.00 0.00 H new ATOM 0 HG22 THR A 176 5.806 6.875 -10.950 1.00 0.00 H new ATOM 0 HG23 THR A 176 5.373 7.348 -9.290 1.00 0.00 H new ATOM 2705 N LEU A 177 9.778 4.683 -9.752 1.00 0.00 N ATOM 2706 CA LEU A 177 11.198 4.353 -9.660 1.00 0.00 C ATOM 2707 C LEU A 177 12.057 5.425 -10.323 1.00 0.00 C ATOM 2708 O LEU A 177 11.747 5.890 -11.421 1.00 0.00 O ATOM 2709 CB LEU A 177 11.472 2.990 -10.304 1.00 0.00 C ATOM 2710 CG LEU A 177 12.388 2.063 -9.499 1.00 0.00 C ATOM 2711 CD1 LEU A 177 11.885 1.924 -8.069 1.00 0.00 C ATOM 2712 CD2 LEU A 177 12.486 0.701 -10.168 1.00 0.00 C ATOM 0 H LEU A 177 9.258 4.118 -10.424 1.00 0.00 H new ATOM 0 HA LEU A 177 11.463 4.308 -8.604 1.00 0.00 H new ATOM 0 HB2 LEU A 177 10.520 2.484 -10.465 1.00 0.00 H new ATOM 0 HB3 LEU A 177 11.917 3.152 -11.286 1.00 0.00 H new ATOM 0 HG LEU A 177 13.385 2.503 -9.469 1.00 0.00 H new ATOM 0 HD11 LEU A 177 12.548 1.262 -7.513 1.00 0.00 H new ATOM 0 HD12 LEU A 177 11.868 2.904 -7.593 1.00 0.00 H new ATOM 0 HD13 LEU A 177 10.878 1.506 -8.076 1.00 0.00 H new ATOM 0 HD21 LEU A 177 13.141 0.055 -9.583 1.00 0.00 H new ATOM 0 HD22 LEU A 177 11.494 0.253 -10.229 1.00 0.00 H new ATOM 0 HD23 LEU A 177 12.894 0.817 -11.172 1.00 0.00 H new ATOM 2724 N HIS A 178 13.139 5.807 -9.647 1.00 0.00 N ATOM 2725 CA HIS A 178 14.054 6.823 -10.165 1.00 0.00 C ATOM 2726 C HIS A 178 15.508 6.388 -9.986 1.00 0.00 C ATOM 2727 O HIS A 178 16.272 6.346 -10.952 1.00 0.00 O ATOM 2728 CB HIS A 178 13.812 8.165 -9.467 1.00 0.00 C ATOM 2729 CG HIS A 178 12.526 8.826 -9.859 1.00 0.00 C ATOM 2730 ND1 HIS A 178 11.521 9.328 -9.103 1.00 0.00 N flip ATOM 2731 CD2 HIS A 178 12.156 9.035 -11.171 1.00 0.00 C flip ATOM 2732 CE1 HIS A 178 10.573 9.827 -9.963 1.00 0.00 C flip ATOM 2733 NE2 HIS A 178 10.981 9.637 -11.204 1.00 0.00 N flip ATOM 0 H HIS A 178 13.404 5.428 -8.738 1.00 0.00 H new ATOM 0 HA HIS A 178 13.861 6.942 -11.231 1.00 0.00 H new ATOM 0 HB2 HIS A 178 13.816 8.009 -8.388 1.00 0.00 H new ATOM 0 HB3 HIS A 178 14.639 8.837 -9.695 1.00 0.00 H new ATOM 0 HD1 HIS A 178 11.476 9.334 -8.084 1.00 0.00 H new ATOM 0 HD2 HIS A 178 12.736 8.751 -12.036 1.00 0.00 H new ATOM 0 HE1 HIS A 178 9.646 10.298 -9.672 1.00 0.00 H new ATOM 2742 N ASP A 179 15.882 6.064 -8.748 1.00 0.00 N ATOM 2743 CA ASP A 179 17.244 5.629 -8.444 1.00 0.00 C ATOM 2744 C ASP A 179 17.231 4.319 -7.657 1.00 0.00 C ATOM 2745 O ASP A 179 16.884 4.302 -6.474 1.00 0.00 O ATOM 2746 CB ASP A 179 17.983 6.712 -7.648 1.00 0.00 C ATOM 2747 CG ASP A 179 18.868 7.577 -8.525 1.00 0.00 C ATOM 2748 OD1 ASP A 179 18.324 8.298 -9.390 1.00 0.00 O ATOM 2749 OD2 ASP A 179 20.103 7.536 -8.347 1.00 0.00 O ATOM 0 H ASP A 179 15.260 6.095 -7.940 1.00 0.00 H new ATOM 0 HA ASP A 179 17.767 5.462 -9.386 1.00 0.00 H new ATOM 0 HB2 ASP A 179 17.255 7.343 -7.138 1.00 0.00 H new ATOM 0 HB3 ASP A 179 18.592 6.240 -6.877 1.00 0.00 H new ATOM 2754 N PRO A 180 17.614 3.196 -8.303 1.00 0.00 N ATOM 2755 CA PRO A 180 17.645 1.878 -7.655 1.00 0.00 C ATOM 2756 C PRO A 180 18.885 1.690 -6.775 1.00 0.00 C ATOM 2757 O PRO A 180 19.636 0.726 -6.939 1.00 0.00 O ATOM 2758 CB PRO A 180 17.674 0.918 -8.847 1.00 0.00 C ATOM 2759 CG PRO A 180 18.399 1.669 -9.908 1.00 0.00 C ATOM 2760 CD PRO A 180 18.045 3.122 -9.715 1.00 0.00 C ATOM 0 HA PRO A 180 16.802 1.724 -6.981 1.00 0.00 H new ATOM 0 HB2 PRO A 180 18.186 -0.011 -8.597 1.00 0.00 H new ATOM 0 HB3 PRO A 180 16.667 0.651 -9.167 1.00 0.00 H new ATOM 0 HG2 PRO A 180 19.475 1.517 -9.826 1.00 0.00 H new ATOM 0 HG3 PRO A 180 18.103 1.325 -10.899 1.00 0.00 H new ATOM 0 HD2 PRO A 180 18.900 3.771 -9.907 1.00 0.00 H new ATOM 0 HD3 PRO A 180 17.250 3.433 -10.393 1.00 0.00 H new