USER MOD reduce.3.24.130724 H: found=0, std=0, add=1092, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1092 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 75 GLN : amide:sc= -1.93! C(o=-2.1!,f=-7.9!) USER MOD Set 1.2: A 109 SER OG : rot 170:sc= -0.153 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0103 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 GLN : amide:sc= -0.287 K(o=-0.29,f=-3.1!) USER MOD Single : A 24 LYS NZ :NH3+ 151:sc= -0.211 (180deg=-0.786) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 MET CE :methyl 156:sc= -0.357 (180deg=-1.91!) USER MOD Single : A 54 THR OG1 : rot 73:sc= 0.275 USER MOD Single : A 59 THR OG1 : rot -170:sc= 0 USER MOD Single : A 61 SER OG : rot 180:sc= -2.84! USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.0707 USER MOD Single : A 73 SER OG : rot 180:sc= -0.0798 USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 THR OG1 : rot -72:sc= 0.889 USER MOD Single : A 80 GLN : amide:sc= 0.217 K(o=0.22,f=-6.8!) USER MOD Single : A 82 SER OG : rot -114:sc= -1.47! USER MOD Single : A 87 GLN : amide:sc=-0.00352 K(o=-0.0035,f=-1.1) USER MOD Single : A 91 ASN : amide:sc= -0.341! C(o=-0.34!,f=-12!) USER MOD Single : A 106 CYS SG : rot 60:sc= -3.25! USER MOD Single : A 111 ASN : amide:sc= -0.139 K(o=-0.14,f=-1.8!) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 MET CE :methyl -118:sc= -1.4 (180deg=-3.46!) USER MOD Single : A 120 GLN : amide:sc= -1.56 K(o=-1.6,f=0) USER MOD Single : A 122 GLN : amide:sc= -0.0529 X(o=-0.053,f=-0.21) USER MOD Single : A 125 MET CE :methyl -156:sc= -2.37! (180deg=-4.17!) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot 59:sc= 1.29 USER MOD Single : A 138 HIS : no HD1:sc= -0.44 K(o=-0.44,f=-1!) USER MOD Single : A 139 SER OG : rot 170:sc= -0.266 USER MOD Single : A 140 SER OG : rot 180:sc=-0.00646 USER MOD Single : A 147 THR OG1 : rot -14:sc= 0.343 USER MOD Single : A 150 TYR OH : rot 79:sc= -2.95! USER MOD Single : A 165 ASN : amide:sc= -0.235 K(o=-0.23,f=-4.8!) USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 86 N ASP A 8 -12.299 10.767 11.596 1.00 0.00 N ATOM 87 CA ASP A 8 -11.185 9.976 12.106 1.00 0.00 C ATOM 88 C ASP A 8 -10.517 9.188 10.983 1.00 0.00 C ATOM 89 O ASP A 8 -11.047 8.177 10.521 1.00 0.00 O ATOM 90 CB ASP A 8 -11.670 9.021 13.200 1.00 0.00 C ATOM 91 CG ASP A 8 -11.200 9.436 14.580 1.00 0.00 C ATOM 92 OD1 ASP A 8 -9.971 9.489 14.797 1.00 0.00 O ATOM 93 OD2 ASP A 8 -12.060 9.711 15.442 1.00 0.00 O ATOM 0 HA ASP A 8 -10.450 10.660 12.530 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -12.759 8.981 13.187 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -11.312 8.014 12.985 1.00 0.00 H new ATOM 98 N THR A 9 -9.351 9.656 10.548 1.00 0.00 N ATOM 99 CA THR A 9 -8.616 8.992 9.479 1.00 0.00 C ATOM 100 C THR A 9 -8.139 7.613 9.921 1.00 0.00 C ATOM 101 O THR A 9 -8.032 6.696 9.109 1.00 0.00 O ATOM 102 CB THR A 9 -7.417 9.839 9.048 1.00 0.00 C ATOM 103 OG1 THR A 9 -7.741 11.218 9.070 1.00 0.00 O ATOM 104 CG2 THR A 9 -6.918 9.505 7.659 1.00 0.00 C ATOM 0 H THR A 9 -8.896 10.490 10.919 1.00 0.00 H new ATOM 0 HA THR A 9 -9.292 8.872 8.632 1.00 0.00 H new ATOM 0 HB THR A 9 -6.629 9.609 9.765 1.00 0.00 H new ATOM 0 HG1 THR A 9 -6.961 11.742 8.793 1.00 0.00 H new ATOM 0 HG21 THR A 9 -6.067 10.141 7.415 1.00 0.00 H new ATOM 0 HG22 THR A 9 -6.611 8.460 7.624 1.00 0.00 H new ATOM 0 HG23 THR A 9 -7.716 9.673 6.936 1.00 0.00 H new ATOM 112 N ARG A 10 -7.859 7.472 11.213 1.00 0.00 N ATOM 113 CA ARG A 10 -7.395 6.204 11.764 1.00 0.00 C ATOM 114 C ARG A 10 -8.416 5.096 11.525 1.00 0.00 C ATOM 115 O ARG A 10 -8.067 4.005 11.074 1.00 0.00 O ATOM 116 CB ARG A 10 -7.127 6.350 13.265 1.00 0.00 C ATOM 117 CG ARG A 10 -5.940 5.537 13.758 1.00 0.00 C ATOM 118 CD ARG A 10 -5.630 5.832 15.218 1.00 0.00 C ATOM 119 NE ARG A 10 -5.668 4.623 16.041 1.00 0.00 N ATOM 120 CZ ARG A 10 -4.592 3.910 16.374 1.00 0.00 C ATOM 121 NH1 ARG A 10 -3.383 4.273 15.960 1.00 0.00 N ATOM 122 NH2 ARG A 10 -4.727 2.823 17.123 1.00 0.00 N ATOM 0 H ARG A 10 -7.946 8.222 11.899 1.00 0.00 H new ATOM 0 HA ARG A 10 -6.469 5.932 11.257 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -6.955 7.402 13.493 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -8.018 6.046 13.815 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -6.150 4.474 13.637 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.066 5.761 13.147 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -4.644 6.291 15.294 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -6.349 6.555 15.602 1.00 0.00 H new ATOM 0 HE ARG A 10 -6.575 4.305 16.382 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -3.271 5.105 15.381 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -2.567 3.720 16.221 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -5.652 2.535 17.442 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -3.906 2.275 17.380 1.00 0.00 H new ATOM 136 N ALA A 11 -9.678 5.384 11.831 1.00 0.00 N ATOM 137 CA ALA A 11 -10.751 4.412 11.649 1.00 0.00 C ATOM 138 C ALA A 11 -10.777 3.878 10.222 1.00 0.00 C ATOM 139 O ALA A 11 -10.615 2.679 9.994 1.00 0.00 O ATOM 140 CB ALA A 11 -12.092 5.033 12.005 1.00 0.00 C ATOM 0 H ALA A 11 -9.982 6.282 12.206 1.00 0.00 H new ATOM 0 HA ALA A 11 -10.561 3.573 12.318 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -12.883 4.296 11.864 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -12.078 5.357 13.046 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -12.278 5.892 11.360 1.00 0.00 H new ATOM 146 N LEU A 12 -10.979 4.778 9.262 1.00 0.00 N ATOM 147 CA LEU A 12 -11.024 4.397 7.853 1.00 0.00 C ATOM 148 C LEU A 12 -9.828 3.526 7.488 1.00 0.00 C ATOM 149 O LEU A 12 -9.942 2.607 6.677 1.00 0.00 O ATOM 150 CB LEU A 12 -11.049 5.641 6.968 1.00 0.00 C ATOM 151 CG LEU A 12 -12.436 6.244 6.741 1.00 0.00 C ATOM 152 CD1 LEU A 12 -12.330 7.740 6.486 1.00 0.00 C ATOM 153 CD2 LEU A 12 -13.138 5.549 5.582 1.00 0.00 C ATOM 0 H LEU A 12 -11.114 5.774 9.434 1.00 0.00 H new ATOM 0 HA LEU A 12 -11.935 3.822 7.687 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -10.408 6.400 7.416 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -10.616 5.389 6.000 1.00 0.00 H new ATOM 0 HG LEU A 12 -13.031 6.091 7.641 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -13.326 8.153 6.326 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -11.870 8.224 7.347 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -11.718 7.916 5.601 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -14.123 5.991 5.435 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -12.547 5.670 4.674 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -13.246 4.488 5.806 1.00 0.00 H new ATOM 165 N VAL A 13 -8.685 3.813 8.099 1.00 0.00 N ATOM 166 CA VAL A 13 -7.479 3.044 7.839 1.00 0.00 C ATOM 167 C VAL A 13 -7.655 1.607 8.318 1.00 0.00 C ATOM 168 O VAL A 13 -7.553 0.667 7.532 1.00 0.00 O ATOM 169 CB VAL A 13 -6.242 3.672 8.519 1.00 0.00 C ATOM 170 CG1 VAL A 13 -4.996 2.838 8.252 1.00 0.00 C ATOM 171 CG2 VAL A 13 -6.036 5.104 8.043 1.00 0.00 C ATOM 0 H VAL A 13 -8.570 4.569 8.774 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.312 3.052 6.762 1.00 0.00 H new ATOM 0 HB VAL A 13 -6.419 3.688 9.594 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -4.138 3.299 8.740 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -5.140 1.832 8.646 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -4.817 2.785 7.178 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -5.160 5.528 8.534 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -5.886 5.111 6.963 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -6.915 5.700 8.291 1.00 0.00 H new ATOM 181 N ALA A 14 -7.935 1.442 9.609 1.00 0.00 N ATOM 182 CA ALA A 14 -8.136 0.117 10.190 1.00 0.00 C ATOM 183 C ALA A 14 -9.224 -0.665 9.455 1.00 0.00 C ATOM 184 O ALA A 14 -9.271 -1.893 9.528 1.00 0.00 O ATOM 185 CB ALA A 14 -8.482 0.237 11.667 1.00 0.00 C ATOM 0 H ALA A 14 -8.028 2.211 10.273 1.00 0.00 H new ATOM 0 HA ALA A 14 -7.202 -0.435 10.083 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -8.629 -0.757 12.088 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -7.668 0.736 12.192 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -9.397 0.818 11.780 1.00 0.00 H new ATOM 191 N ASP A 15 -10.100 0.047 8.751 1.00 0.00 N ATOM 192 CA ASP A 15 -11.178 -0.597 8.012 1.00 0.00 C ATOM 193 C ASP A 15 -10.647 -1.237 6.734 1.00 0.00 C ATOM 194 O ASP A 15 -10.812 -2.437 6.517 1.00 0.00 O ATOM 195 CB ASP A 15 -12.278 0.412 7.674 1.00 0.00 C ATOM 196 CG ASP A 15 -13.246 0.618 8.823 1.00 0.00 C ATOM 197 OD1 ASP A 15 -12.920 0.203 9.955 1.00 0.00 O ATOM 198 OD2 ASP A 15 -14.329 1.193 8.590 1.00 0.00 O ATOM 0 H ASP A 15 -10.084 1.064 8.678 1.00 0.00 H new ATOM 0 HA ASP A 15 -11.601 -1.378 8.644 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -11.823 1.367 7.410 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -12.827 0.067 6.798 1.00 0.00 H new ATOM 203 N PHE A 16 -10.007 -0.431 5.894 1.00 0.00 N ATOM 204 CA PHE A 16 -9.449 -0.922 4.639 1.00 0.00 C ATOM 205 C PHE A 16 -8.514 -2.102 4.879 1.00 0.00 C ATOM 206 O PHE A 16 -8.491 -3.048 4.098 1.00 0.00 O ATOM 207 CB PHE A 16 -8.699 0.198 3.913 1.00 0.00 C ATOM 208 CG PHE A 16 -8.315 -0.151 2.502 1.00 0.00 C ATOM 209 CD1 PHE A 16 -9.216 0.021 1.462 1.00 0.00 C ATOM 210 CD2 PHE A 16 -7.055 -0.651 2.215 1.00 0.00 C ATOM 211 CE1 PHE A 16 -8.866 -0.298 0.164 1.00 0.00 C ATOM 212 CE2 PHE A 16 -6.699 -0.973 0.919 1.00 0.00 C ATOM 213 CZ PHE A 16 -7.606 -0.795 -0.108 1.00 0.00 C ATOM 0 H PHE A 16 -9.862 0.565 6.059 1.00 0.00 H new ATOM 0 HA PHE A 16 -10.276 -1.260 4.015 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -9.322 1.092 3.900 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -7.798 0.445 4.475 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -10.203 0.409 1.669 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.342 -0.791 3.014 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.577 -0.159 -0.637 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.714 -1.363 0.709 1.00 0.00 H new ATOM 0 HZ PHE A 16 -7.330 -1.044 -1.122 1.00 0.00 H new ATOM 223 N VAL A 17 -7.744 -2.043 5.962 1.00 0.00 N ATOM 224 CA VAL A 17 -6.808 -3.116 6.291 1.00 0.00 C ATOM 225 C VAL A 17 -7.540 -4.335 6.846 1.00 0.00 C ATOM 226 O VAL A 17 -7.442 -5.433 6.298 1.00 0.00 O ATOM 227 CB VAL A 17 -5.747 -2.663 7.317 1.00 0.00 C ATOM 228 CG1 VAL A 17 -4.543 -3.591 7.283 1.00 0.00 C ATOM 229 CG2 VAL A 17 -5.321 -1.225 7.061 1.00 0.00 C ATOM 0 H VAL A 17 -7.749 -1.268 6.625 1.00 0.00 H new ATOM 0 HA VAL A 17 -6.306 -3.381 5.360 1.00 0.00 H new ATOM 0 HB VAL A 17 -6.194 -2.711 8.310 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -3.805 -3.257 8.012 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.859 -4.606 7.525 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -4.101 -3.577 6.287 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -4.573 -0.930 7.797 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -4.897 -1.144 6.060 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -6.188 -0.569 7.142 1.00 0.00 H new ATOM 239 N GLY A 18 -8.272 -4.134 7.939 1.00 0.00 N ATOM 240 CA GLY A 18 -9.008 -5.226 8.555 1.00 0.00 C ATOM 241 C GLY A 18 -9.875 -5.984 7.567 1.00 0.00 C ATOM 242 O GLY A 18 -9.857 -7.215 7.532 1.00 0.00 O ATOM 0 H GLY A 18 -8.369 -3.234 8.409 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.303 -5.917 9.018 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -9.636 -4.830 9.353 1.00 0.00 H new ATOM 246 N TYR A 19 -10.636 -5.250 6.762 1.00 0.00 N ATOM 247 CA TYR A 19 -11.511 -5.865 5.772 1.00 0.00 C ATOM 248 C TYR A 19 -10.694 -6.578 4.699 1.00 0.00 C ATOM 249 O TYR A 19 -10.974 -7.727 4.354 1.00 0.00 O ATOM 250 CB TYR A 19 -12.417 -4.811 5.131 1.00 0.00 C ATOM 251 CG TYR A 19 -13.885 -5.012 5.433 1.00 0.00 C ATOM 252 CD1 TYR A 19 -14.468 -4.433 6.554 1.00 0.00 C ATOM 253 CD2 TYR A 19 -14.687 -5.778 4.598 1.00 0.00 C ATOM 254 CE1 TYR A 19 -15.809 -4.614 6.833 1.00 0.00 C ATOM 255 CE2 TYR A 19 -16.030 -5.963 4.870 1.00 0.00 C ATOM 256 CZ TYR A 19 -16.585 -5.379 5.989 1.00 0.00 C ATOM 257 OH TYR A 19 -17.921 -5.561 6.264 1.00 0.00 O ATOM 0 H TYR A 19 -10.664 -4.230 6.776 1.00 0.00 H new ATOM 0 HA TYR A 19 -12.134 -6.602 6.279 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -12.115 -3.823 5.479 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -12.271 -4.827 4.051 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -13.863 -3.832 7.217 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -14.255 -6.237 3.721 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -16.247 -4.158 7.709 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -16.641 -6.561 4.210 1.00 0.00 H new ATOM 0 HH TYR A 19 -18.324 -6.124 5.571 1.00 0.00 H new ATOM 267 N LYS A 20 -9.682 -5.892 4.174 1.00 0.00 N ATOM 268 CA LYS A 20 -8.823 -6.465 3.142 1.00 0.00 C ATOM 269 C LYS A 20 -8.238 -7.795 3.602 1.00 0.00 C ATOM 270 O LYS A 20 -8.022 -8.700 2.802 1.00 0.00 O ATOM 271 CB LYS A 20 -7.696 -5.494 2.783 1.00 0.00 C ATOM 272 CG LYS A 20 -7.094 -5.732 1.407 1.00 0.00 C ATOM 273 CD LYS A 20 -7.466 -4.617 0.440 1.00 0.00 C ATOM 274 CE LYS A 20 -7.045 -4.945 -0.984 1.00 0.00 C ATOM 275 NZ LYS A 20 -7.868 -4.213 -1.987 1.00 0.00 N ATOM 0 H LYS A 20 -9.437 -4.940 4.446 1.00 0.00 H new ATOM 0 HA LYS A 20 -9.432 -6.642 2.256 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -8.079 -4.475 2.830 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.908 -5.574 3.532 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.009 -5.798 1.489 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -7.443 -6.687 1.015 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -8.543 -4.451 0.472 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -6.991 -3.688 0.755 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -5.994 -4.690 -1.120 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -7.137 -6.018 -1.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -7.551 -4.463 -2.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.868 -4.476 -1.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -7.761 -3.189 -1.843 1.00 0.00 H new ATOM 289 N LEU A 21 -7.987 -7.914 4.898 1.00 0.00 N ATOM 290 CA LEU A 21 -7.433 -9.143 5.450 1.00 0.00 C ATOM 291 C LEU A 21 -8.528 -10.190 5.631 1.00 0.00 C ATOM 292 O LEU A 21 -8.304 -11.382 5.419 1.00 0.00 O ATOM 293 CB LEU A 21 -6.744 -8.863 6.788 1.00 0.00 C ATOM 294 CG LEU A 21 -6.349 -10.105 7.588 1.00 0.00 C ATOM 295 CD1 LEU A 21 -5.351 -10.947 6.806 1.00 0.00 C ATOM 296 CD2 LEU A 21 -5.774 -9.709 8.938 1.00 0.00 C ATOM 0 H LEU A 21 -8.157 -7.179 5.584 1.00 0.00 H new ATOM 0 HA LEU A 21 -6.694 -9.531 4.750 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -5.848 -8.271 6.601 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -7.408 -8.252 7.400 1.00 0.00 H new ATOM 0 HG LEU A 21 -7.243 -10.704 7.759 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -5.081 -11.827 7.390 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -5.800 -11.261 5.863 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -4.457 -10.357 6.604 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -5.499 -10.606 9.493 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -4.890 -9.089 8.789 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -6.520 -9.148 9.501 1.00 0.00 H new ATOM 308 N ARG A 22 -9.711 -9.736 6.026 1.00 0.00 N ATOM 309 CA ARG A 22 -10.844 -10.628 6.242 1.00 0.00 C ATOM 310 C ARG A 22 -11.243 -11.340 4.953 1.00 0.00 C ATOM 311 O ARG A 22 -11.175 -12.566 4.864 1.00 0.00 O ATOM 312 CB ARG A 22 -12.034 -9.844 6.794 1.00 0.00 C ATOM 313 CG ARG A 22 -11.994 -9.669 8.304 1.00 0.00 C ATOM 314 CD ARG A 22 -12.337 -10.963 9.028 1.00 0.00 C ATOM 315 NE ARG A 22 -11.240 -11.436 9.874 1.00 0.00 N ATOM 316 CZ ARG A 22 -10.670 -10.717 10.840 1.00 0.00 C ATOM 317 NH1 ARG A 22 -11.094 -9.489 11.112 1.00 0.00 N ATOM 318 NH2 ARG A 22 -9.677 -11.237 11.548 1.00 0.00 N ATOM 0 H ARG A 22 -9.911 -8.752 6.204 1.00 0.00 H new ATOM 0 HA ARG A 22 -10.542 -11.383 6.967 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -12.063 -8.862 6.322 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -12.956 -10.356 6.519 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -11.001 -9.335 8.606 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -12.696 -8.889 8.599 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -13.225 -10.809 9.641 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -12.585 -11.731 8.296 1.00 0.00 H new ATOM 0 HE ARG A 22 -10.888 -12.380 9.713 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -11.864 -9.086 10.579 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -10.649 -8.949 11.854 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -9.352 -12.184 11.352 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -9.238 -10.690 12.288 1.00 0.00 H new ATOM 332 N GLN A 23 -11.661 -10.565 3.956 1.00 0.00 N ATOM 333 CA GLN A 23 -12.074 -11.126 2.673 1.00 0.00 C ATOM 334 C GLN A 23 -10.958 -11.965 2.060 1.00 0.00 C ATOM 335 O GLN A 23 -11.208 -13.023 1.481 1.00 0.00 O ATOM 336 CB GLN A 23 -12.472 -10.007 1.709 1.00 0.00 C ATOM 337 CG GLN A 23 -13.510 -10.430 0.681 1.00 0.00 C ATOM 338 CD GLN A 23 -14.854 -9.764 0.898 1.00 0.00 C ATOM 339 OE1 GLN A 23 -15.002 -8.900 1.761 1.00 0.00 O ATOM 340 NE2 GLN A 23 -15.846 -10.165 0.110 1.00 0.00 N ATOM 0 H GLN A 23 -11.723 -9.548 4.012 1.00 0.00 H new ATOM 0 HA GLN A 23 -12.935 -11.771 2.848 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -12.862 -9.166 2.283 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -11.582 -9.652 1.190 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -13.146 -10.188 -0.317 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -13.635 -11.512 0.721 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -15.680 -10.885 -0.593 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -16.774 -9.753 0.208 1.00 0.00 H new ATOM 349 N LYS A 24 -9.726 -11.487 2.194 1.00 0.00 N ATOM 350 CA LYS A 24 -8.569 -12.191 1.655 1.00 0.00 C ATOM 351 C LYS A 24 -7.908 -13.057 2.726 1.00 0.00 C ATOM 352 O LYS A 24 -6.724 -13.379 2.633 1.00 0.00 O ATOM 353 CB LYS A 24 -7.557 -11.190 1.088 1.00 0.00 C ATOM 354 CG LYS A 24 -8.206 -10.028 0.350 1.00 0.00 C ATOM 355 CD LYS A 24 -7.372 -9.578 -0.836 1.00 0.00 C ATOM 356 CE LYS A 24 -7.819 -10.254 -2.121 1.00 0.00 C ATOM 357 NZ LYS A 24 -9.232 -9.926 -2.465 1.00 0.00 N ATOM 0 H LYS A 24 -9.503 -10.614 2.672 1.00 0.00 H new ATOM 0 HA LYS A 24 -8.912 -12.843 0.852 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -6.948 -10.799 1.903 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -6.883 -11.711 0.409 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -9.197 -10.324 0.006 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -8.343 -9.192 1.036 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -7.450 -8.496 -0.947 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -6.322 -9.805 -0.651 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.167 -9.946 -2.938 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.713 -11.334 -2.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -9.355 -9.962 -3.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -9.868 -10.616 -2.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -9.460 -8.971 -2.122 1.00 0.00 H new ATOM 589 N GLN A 43 -15.036 3.778 -2.022 1.00 0.00 N ATOM 590 CA GLN A 43 -14.807 4.072 -3.431 1.00 0.00 C ATOM 591 C GLN A 43 -13.360 4.488 -3.666 1.00 0.00 C ATOM 592 O GLN A 43 -12.641 3.872 -4.450 1.00 0.00 O ATOM 593 CB GLN A 43 -15.746 5.187 -3.899 1.00 0.00 C ATOM 594 CG GLN A 43 -16.369 4.925 -5.258 1.00 0.00 C ATOM 595 CD GLN A 43 -17.746 4.303 -5.153 1.00 0.00 C ATOM 596 OE1 GLN A 43 -17.881 3.093 -4.972 1.00 0.00 O ATOM 597 NE2 GLN A 43 -18.778 5.130 -5.267 1.00 0.00 N ATOM 0 HA GLN A 43 -15.010 3.167 -4.004 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -16.540 5.315 -3.163 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -15.192 6.125 -3.937 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -16.438 5.863 -5.810 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -15.718 4.265 -5.832 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -18.619 6.126 -5.416 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -19.730 4.769 -5.205 1.00 0.00 H new ATOM 606 N ALA A 44 -12.950 5.542 -2.975 1.00 0.00 N ATOM 607 CA ALA A 44 -11.597 6.069 -3.088 1.00 0.00 C ATOM 608 C ALA A 44 -10.557 5.048 -2.635 1.00 0.00 C ATOM 609 O ALA A 44 -9.576 4.785 -3.331 1.00 0.00 O ATOM 610 CB ALA A 44 -11.486 7.339 -2.260 1.00 0.00 C ATOM 0 H ALA A 44 -13.543 6.055 -2.322 1.00 0.00 H new ATOM 0 HA ALA A 44 -11.398 6.292 -4.136 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -10.475 7.739 -2.340 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -12.198 8.077 -2.629 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -11.705 7.113 -1.216 1.00 0.00 H new ATOM 616 N MET A 45 -10.784 4.491 -1.455 1.00 0.00 N ATOM 617 CA MET A 45 -9.883 3.503 -0.867 1.00 0.00 C ATOM 618 C MET A 45 -9.675 2.310 -1.798 1.00 0.00 C ATOM 619 O MET A 45 -8.546 1.993 -2.173 1.00 0.00 O ATOM 620 CB MET A 45 -10.446 3.023 0.475 1.00 0.00 C ATOM 621 CG MET A 45 -9.589 3.412 1.668 1.00 0.00 C ATOM 622 SD MET A 45 -9.583 5.190 1.970 1.00 0.00 S ATOM 623 CE MET A 45 -11.338 5.518 2.116 1.00 0.00 C ATOM 0 H MET A 45 -11.595 4.708 -0.877 1.00 0.00 H new ATOM 0 HA MET A 45 -8.915 3.980 -0.711 1.00 0.00 H new ATOM 0 HB2 MET A 45 -11.447 3.434 0.608 1.00 0.00 H new ATOM 0 HB3 MET A 45 -10.548 1.938 0.450 1.00 0.00 H new ATOM 0 HG2 MET A 45 -9.955 2.898 2.557 1.00 0.00 H new ATOM 0 HG3 MET A 45 -8.567 3.072 1.502 1.00 0.00 H new ATOM 0 HE1 MET A 45 -11.491 6.424 2.702 1.00 0.00 H new ATOM 0 HE2 MET A 45 -11.767 5.652 1.123 1.00 0.00 H new ATOM 0 HE3 MET A 45 -11.825 4.678 2.612 1.00 0.00 H new ATOM 633 N ARG A 46 -10.769 1.649 -2.160 1.00 0.00 N ATOM 634 CA ARG A 46 -10.706 0.489 -3.040 1.00 0.00 C ATOM 635 C ARG A 46 -10.154 0.868 -4.402 1.00 0.00 C ATOM 636 O ARG A 46 -9.191 0.272 -4.886 1.00 0.00 O ATOM 637 CB ARG A 46 -12.094 -0.123 -3.213 1.00 0.00 C ATOM 638 CG ARG A 46 -12.097 -1.638 -3.195 1.00 0.00 C ATOM 639 CD ARG A 46 -13.025 -2.169 -2.121 1.00 0.00 C ATOM 640 NE ARG A 46 -12.633 -3.496 -1.665 1.00 0.00 N ATOM 641 CZ ARG A 46 -13.365 -4.238 -0.842 1.00 0.00 C ATOM 642 NH1 ARG A 46 -14.527 -3.785 -0.387 1.00 0.00 N ATOM 643 NH2 ARG A 46 -12.937 -5.437 -0.474 1.00 0.00 N ATOM 0 H ARG A 46 -11.711 1.897 -1.857 1.00 0.00 H new ATOM 0 HA ARG A 46 -10.040 -0.241 -2.580 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -12.744 0.242 -2.418 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -12.519 0.221 -4.156 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -12.409 -2.016 -4.169 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -11.086 -2.005 -3.020 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -13.030 -1.482 -1.275 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -14.043 -2.205 -2.508 1.00 0.00 H new ATOM 0 HE ARG A 46 -11.747 -3.877 -1.996 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -14.861 -2.864 -0.669 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -15.086 -4.358 0.245 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -12.046 -5.790 -0.823 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -13.499 -6.007 0.158 1.00 0.00 H new ATOM 657 N ALA A 47 -10.777 1.863 -5.018 1.00 0.00 N ATOM 658 CA ALA A 47 -10.361 2.328 -6.330 1.00 0.00 C ATOM 659 C ALA A 47 -8.858 2.577 -6.374 1.00 0.00 C ATOM 660 O ALA A 47 -8.182 2.114 -7.285 1.00 0.00 O ATOM 661 CB ALA A 47 -11.133 3.577 -6.712 1.00 0.00 C ATOM 0 H ALA A 47 -11.575 2.364 -4.627 1.00 0.00 H new ATOM 0 HA ALA A 47 -10.584 1.548 -7.058 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -10.812 3.916 -7.697 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -12.199 3.353 -6.735 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -10.943 4.361 -5.979 1.00 0.00 H new ATOM 667 N ALA A 48 -8.335 3.293 -5.377 1.00 0.00 N ATOM 668 CA ALA A 48 -6.901 3.573 -5.308 1.00 0.00 C ATOM 669 C ALA A 48 -6.108 2.275 -5.312 1.00 0.00 C ATOM 670 O ALA A 48 -5.299 2.024 -6.208 1.00 0.00 O ATOM 671 CB ALA A 48 -6.567 4.372 -4.057 1.00 0.00 C ATOM 0 H ALA A 48 -8.880 3.687 -4.610 1.00 0.00 H new ATOM 0 HA ALA A 48 -6.629 4.162 -6.184 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -5.495 4.569 -4.026 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -7.109 5.317 -4.074 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -6.857 3.803 -3.174 1.00 0.00 H new ATOM 677 N GLY A 49 -6.350 1.454 -4.294 1.00 0.00 N ATOM 678 CA GLY A 49 -5.663 0.184 -4.176 1.00 0.00 C ATOM 679 C GLY A 49 -5.661 -0.598 -5.472 1.00 0.00 C ATOM 680 O GLY A 49 -4.608 -0.981 -5.989 1.00 0.00 O ATOM 0 H GLY A 49 -7.014 1.649 -3.545 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -4.635 0.359 -3.860 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -6.139 -0.412 -3.397 1.00 0.00 H new ATOM 684 N ASP A 50 -6.855 -0.830 -5.992 1.00 0.00 N ATOM 685 CA ASP A 50 -7.028 -1.566 -7.231 1.00 0.00 C ATOM 686 C ASP A 50 -6.529 -0.761 -8.430 1.00 0.00 C ATOM 687 O ASP A 50 -6.370 -1.303 -9.518 1.00 0.00 O ATOM 688 CB ASP A 50 -8.504 -1.923 -7.411 1.00 0.00 C ATOM 689 CG ASP A 50 -8.742 -2.856 -8.579 1.00 0.00 C ATOM 690 OD1 ASP A 50 -8.251 -4.005 -8.532 1.00 0.00 O ATOM 691 OD2 ASP A 50 -9.420 -2.441 -9.542 1.00 0.00 O ATOM 0 H ASP A 50 -7.728 -0.514 -5.568 1.00 0.00 H new ATOM 0 HA ASP A 50 -6.435 -2.479 -7.175 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -8.875 -2.389 -6.498 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -9.079 -1.009 -7.559 1.00 0.00 H new ATOM 696 N GLU A 51 -6.283 0.533 -8.230 1.00 0.00 N ATOM 697 CA GLU A 51 -5.806 1.390 -9.311 1.00 0.00 C ATOM 698 C GLU A 51 -4.369 1.054 -9.676 1.00 0.00 C ATOM 699 O GLU A 51 -4.063 0.827 -10.840 1.00 0.00 O ATOM 700 CB GLU A 51 -5.912 2.871 -8.933 1.00 0.00 C ATOM 701 CG GLU A 51 -6.661 3.706 -9.962 1.00 0.00 C ATOM 702 CD GLU A 51 -8.094 3.250 -10.153 1.00 0.00 C ATOM 703 OE1 GLU A 51 -8.912 3.464 -9.235 1.00 0.00 O ATOM 704 OE2 GLU A 51 -8.397 2.679 -11.222 1.00 0.00 O ATOM 0 H GLU A 51 -6.405 1.007 -7.335 1.00 0.00 H new ATOM 0 HA GLU A 51 -6.442 1.206 -10.177 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -6.415 2.957 -7.970 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -4.909 3.279 -8.806 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -6.655 4.751 -9.651 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -6.137 3.655 -10.917 1.00 0.00 H new ATOM 711 N PHE A 52 -3.488 1.032 -8.678 1.00 0.00 N ATOM 712 CA PHE A 52 -2.079 0.732 -8.917 1.00 0.00 C ATOM 713 C PHE A 52 -1.860 -0.747 -9.194 1.00 0.00 C ATOM 714 O PHE A 52 -0.953 -1.120 -9.938 1.00 0.00 O ATOM 715 CB PHE A 52 -1.221 1.146 -7.721 1.00 0.00 C ATOM 716 CG PHE A 52 -1.694 0.594 -6.408 1.00 0.00 C ATOM 717 CD1 PHE A 52 -1.643 -0.768 -6.147 1.00 0.00 C ATOM 718 CD2 PHE A 52 -2.172 1.442 -5.424 1.00 0.00 C ATOM 719 CE1 PHE A 52 -2.065 -1.271 -4.932 1.00 0.00 C ATOM 720 CE2 PHE A 52 -2.590 0.943 -4.207 1.00 0.00 C ATOM 721 CZ PHE A 52 -2.538 -0.416 -3.962 1.00 0.00 C ATOM 0 H PHE A 52 -3.723 1.217 -7.703 1.00 0.00 H new ATOM 0 HA PHE A 52 -1.780 1.303 -9.796 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -0.196 0.819 -7.892 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -1.202 2.234 -7.660 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -1.269 -1.443 -6.903 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.218 2.505 -5.610 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -2.024 -2.334 -4.743 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -2.958 1.615 -3.446 1.00 0.00 H new ATOM 0 HZ PHE A 52 -2.868 -0.807 -3.011 1.00 0.00 H new ATOM 731 N GLU A 53 -2.676 -1.587 -8.575 1.00 0.00 N ATOM 732 CA GLU A 53 -2.545 -3.024 -8.742 1.00 0.00 C ATOM 733 C GLU A 53 -3.106 -3.471 -10.086 1.00 0.00 C ATOM 734 O GLU A 53 -2.612 -4.422 -10.693 1.00 0.00 O ATOM 735 CB GLU A 53 -3.250 -3.746 -7.594 1.00 0.00 C ATOM 736 CG GLU A 53 -2.295 -4.466 -6.658 1.00 0.00 C ATOM 737 CD GLU A 53 -3.016 -5.275 -5.600 1.00 0.00 C ATOM 738 OE1 GLU A 53 -3.661 -4.664 -4.722 1.00 0.00 O ATOM 739 OE2 GLU A 53 -2.935 -6.521 -5.648 1.00 0.00 O ATOM 0 H GLU A 53 -3.433 -1.298 -7.955 1.00 0.00 H new ATOM 0 HA GLU A 53 -1.486 -3.281 -8.723 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -3.831 -3.023 -7.022 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -3.955 -4.467 -8.007 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -1.651 -5.126 -7.239 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -1.648 -3.735 -6.173 1.00 0.00 H new ATOM 746 N THR A 54 -4.134 -2.769 -10.549 1.00 0.00 N ATOM 747 CA THR A 54 -4.761 -3.078 -11.828 1.00 0.00 C ATOM 748 C THR A 54 -4.058 -2.342 -12.955 1.00 0.00 C ATOM 749 O THR A 54 -3.835 -2.896 -14.031 1.00 0.00 O ATOM 750 CB THR A 54 -6.236 -2.680 -11.813 1.00 0.00 C ATOM 751 OG1 THR A 54 -6.938 -3.399 -10.819 1.00 0.00 O ATOM 752 CG2 THR A 54 -6.939 -2.914 -13.133 1.00 0.00 C ATOM 0 H THR A 54 -4.552 -1.980 -10.056 1.00 0.00 H new ATOM 0 HA THR A 54 -4.680 -4.153 -11.991 1.00 0.00 H new ATOM 0 HB THR A 54 -6.241 -1.610 -11.606 1.00 0.00 H new ATOM 0 HG1 THR A 54 -6.694 -3.057 -9.934 1.00 0.00 H new ATOM 0 HG21 THR A 54 -7.982 -2.609 -13.049 1.00 0.00 H new ATOM 0 HG22 THR A 54 -6.452 -2.329 -13.913 1.00 0.00 H new ATOM 0 HG23 THR A 54 -6.890 -3.972 -13.389 1.00 0.00 H new ATOM 760 N ARG A 55 -3.721 -1.083 -12.696 1.00 0.00 N ATOM 761 CA ARG A 55 -3.052 -0.253 -13.682 1.00 0.00 C ATOM 762 C ARG A 55 -1.930 -1.019 -14.382 1.00 0.00 C ATOM 763 O ARG A 55 -1.786 -0.947 -15.603 1.00 0.00 O ATOM 764 CB ARG A 55 -2.523 1.009 -13.004 1.00 0.00 C ATOM 765 CG ARG A 55 -3.423 2.215 -13.208 1.00 0.00 C ATOM 766 CD ARG A 55 -3.134 3.302 -12.194 1.00 0.00 C ATOM 767 NE ARG A 55 -4.249 4.232 -12.047 1.00 0.00 N ATOM 768 CZ ARG A 55 -4.177 5.355 -11.340 1.00 0.00 C ATOM 769 NH1 ARG A 55 -3.052 5.677 -10.721 1.00 0.00 N ATOM 770 NH2 ARG A 55 -5.228 6.157 -11.250 1.00 0.00 N ATOM 0 H ARG A 55 -3.903 -0.617 -11.807 1.00 0.00 H new ATOM 0 HA ARG A 55 -3.769 0.032 -14.452 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -2.413 0.822 -11.936 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -1.530 1.234 -13.392 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -3.283 2.609 -14.215 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -4.466 1.909 -13.128 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -2.914 2.846 -11.229 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -2.243 3.851 -12.497 1.00 0.00 H new ATOM 0 HE ARG A 55 -5.129 4.008 -12.511 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -2.240 5.063 -10.787 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -2.997 6.539 -10.178 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -6.097 5.914 -11.725 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -5.168 7.018 -10.706 1.00 0.00 H new ATOM 784 N PHE A 56 -1.149 -1.763 -13.606 1.00 0.00 N ATOM 785 CA PHE A 56 -0.059 -2.558 -14.157 1.00 0.00 C ATOM 786 C PHE A 56 -0.531 -3.971 -14.499 1.00 0.00 C ATOM 787 O PHE A 56 -1.632 -4.157 -15.018 1.00 0.00 O ATOM 788 CB PHE A 56 1.111 -2.598 -13.174 1.00 0.00 C ATOM 789 CG PHE A 56 2.426 -2.996 -13.794 1.00 0.00 C ATOM 790 CD1 PHE A 56 2.765 -2.610 -15.084 1.00 0.00 C ATOM 791 CD2 PHE A 56 3.324 -3.763 -13.075 1.00 0.00 C ATOM 792 CE1 PHE A 56 3.976 -2.987 -15.637 1.00 0.00 C ATOM 793 CE2 PHE A 56 4.532 -4.140 -13.620 1.00 0.00 C ATOM 794 CZ PHE A 56 4.861 -3.752 -14.902 1.00 0.00 C ATOM 0 H PHE A 56 -1.251 -1.832 -12.593 1.00 0.00 H new ATOM 0 HA PHE A 56 0.279 -2.089 -15.081 1.00 0.00 H new ATOM 0 HB2 PHE A 56 1.221 -1.615 -12.717 1.00 0.00 H new ATOM 0 HB3 PHE A 56 0.874 -3.297 -12.372 1.00 0.00 H new ATOM 0 HD1 PHE A 56 2.077 -2.010 -15.661 1.00 0.00 H new ATOM 0 HD2 PHE A 56 3.075 -4.071 -12.070 1.00 0.00 H new ATOM 0 HE1 PHE A 56 4.229 -2.684 -16.642 1.00 0.00 H new ATOM 0 HE2 PHE A 56 5.221 -4.739 -13.043 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.808 -4.045 -15.330 1.00 0.00 H new ATOM 804 N ARG A 57 0.312 -4.961 -14.209 1.00 0.00 N ATOM 805 CA ARG A 57 -0.005 -6.347 -14.483 1.00 0.00 C ATOM 806 C ARG A 57 0.477 -7.244 -13.346 1.00 0.00 C ATOM 807 O ARG A 57 -0.317 -7.703 -12.527 1.00 0.00 O ATOM 808 CB ARG A 57 0.638 -6.767 -15.806 1.00 0.00 C ATOM 809 CG ARG A 57 -0.212 -7.726 -16.610 1.00 0.00 C ATOM 810 CD ARG A 57 -0.900 -7.023 -17.771 1.00 0.00 C ATOM 811 NE ARG A 57 -2.311 -6.758 -17.499 1.00 0.00 N ATOM 812 CZ ARG A 57 -3.189 -7.688 -17.126 1.00 0.00 C ATOM 813 NH1 ARG A 57 -2.824 -8.962 -17.023 1.00 0.00 N ATOM 814 NH2 ARG A 57 -4.444 -7.345 -16.869 1.00 0.00 N ATOM 0 H ARG A 57 1.226 -4.818 -13.780 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.087 -6.455 -14.562 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.834 -5.877 -16.405 1.00 0.00 H new ATOM 0 HB3 ARG A 57 1.602 -7.232 -15.601 1.00 0.00 H new ATOM 0 HG2 ARG A 57 0.412 -8.535 -16.991 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -0.962 -8.180 -15.962 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -0.389 -6.083 -17.978 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -0.814 -7.637 -18.668 1.00 0.00 H new ATOM 0 HE ARG A 57 -2.645 -5.800 -17.601 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -1.864 -9.236 -17.230 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -3.504 -9.666 -16.737 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -4.735 -6.371 -16.957 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -5.118 -8.055 -16.583 1.00 0.00 H new ATOM 828 N ARG A 58 1.784 -7.486 -13.300 1.00 0.00 N ATOM 829 CA ARG A 58 2.366 -8.326 -12.261 1.00 0.00 C ATOM 830 C ARG A 58 3.514 -7.605 -11.559 1.00 0.00 C ATOM 831 O ARG A 58 4.638 -8.107 -11.507 1.00 0.00 O ATOM 832 CB ARG A 58 2.851 -9.649 -12.863 1.00 0.00 C ATOM 833 CG ARG A 58 2.700 -10.834 -11.922 1.00 0.00 C ATOM 834 CD ARG A 58 2.113 -12.048 -12.624 1.00 0.00 C ATOM 835 NE ARG A 58 1.858 -13.142 -11.690 1.00 0.00 N ATOM 836 CZ ARG A 58 2.650 -14.203 -11.542 1.00 0.00 C ATOM 837 NH1 ARG A 58 3.760 -14.327 -12.262 1.00 0.00 N ATOM 838 NH2 ARG A 58 2.331 -15.145 -10.666 1.00 0.00 N ATOM 0 H ARG A 58 2.458 -7.113 -13.969 1.00 0.00 H new ATOM 0 HA ARG A 58 1.597 -8.539 -11.519 1.00 0.00 H new ATOM 0 HB2 ARG A 58 2.294 -9.849 -13.778 1.00 0.00 H new ATOM 0 HB3 ARG A 58 3.900 -9.549 -13.143 1.00 0.00 H new ATOM 0 HG2 ARG A 58 3.673 -11.092 -11.505 1.00 0.00 H new ATOM 0 HG3 ARG A 58 2.059 -10.554 -11.086 1.00 0.00 H new ATOM 0 HD2 ARG A 58 1.183 -11.768 -13.119 1.00 0.00 H new ATOM 0 HD3 ARG A 58 2.798 -12.386 -13.401 1.00 0.00 H new ATOM 0 HE ARG A 58 1.018 -13.090 -11.113 1.00 0.00 H new ATOM 0 HH11 ARG A 58 4.014 -13.605 -12.937 1.00 0.00 H new ATOM 0 HH12 ARG A 58 4.359 -15.144 -12.140 1.00 0.00 H new ATOM 0 HH21 ARG A 58 1.482 -15.056 -10.108 1.00 0.00 H new ATOM 0 HH22 ARG A 58 2.935 -15.959 -10.550 1.00 0.00 H new ATOM 852 N THR A 59 3.224 -6.421 -11.020 1.00 0.00 N ATOM 853 CA THR A 59 4.234 -5.628 -10.320 1.00 0.00 C ATOM 854 C THR A 59 4.919 -6.445 -9.236 1.00 0.00 C ATOM 855 O THR A 59 6.085 -6.217 -8.920 1.00 0.00 O ATOM 856 CB THR A 59 3.608 -4.383 -9.681 1.00 0.00 C ATOM 857 OG1 THR A 59 4.595 -3.612 -9.013 1.00 0.00 O ATOM 858 CG2 THR A 59 2.527 -4.707 -8.673 1.00 0.00 C ATOM 0 H THR A 59 2.300 -5.991 -11.055 1.00 0.00 H new ATOM 0 HA THR A 59 4.972 -5.323 -11.062 1.00 0.00 H new ATOM 0 HB THR A 59 3.162 -3.829 -10.507 1.00 0.00 H new ATOM 0 HG1 THR A 59 4.160 -2.913 -8.482 1.00 0.00 H new ATOM 0 HG21 THR A 59 2.126 -3.782 -8.259 1.00 0.00 H new ATOM 0 HG22 THR A 59 1.727 -5.262 -9.163 1.00 0.00 H new ATOM 0 HG23 THR A 59 2.948 -5.311 -7.870 1.00 0.00 H new ATOM 866 N PHE A 60 4.186 -7.390 -8.659 1.00 0.00 N ATOM 867 CA PHE A 60 4.730 -8.224 -7.600 1.00 0.00 C ATOM 868 C PHE A 60 5.988 -8.948 -8.065 1.00 0.00 C ATOM 869 O PHE A 60 7.084 -8.632 -7.615 1.00 0.00 O ATOM 870 CB PHE A 60 3.680 -9.228 -7.122 1.00 0.00 C ATOM 871 CG PHE A 60 3.433 -9.175 -5.641 1.00 0.00 C ATOM 872 CD1 PHE A 60 4.475 -9.342 -4.745 1.00 0.00 C ATOM 873 CD2 PHE A 60 2.157 -8.954 -5.144 1.00 0.00 C ATOM 874 CE1 PHE A 60 4.252 -9.292 -3.382 1.00 0.00 C ATOM 875 CE2 PHE A 60 1.928 -8.902 -3.782 1.00 0.00 C ATOM 876 CZ PHE A 60 2.977 -9.071 -2.900 1.00 0.00 C ATOM 0 H PHE A 60 3.218 -7.595 -8.907 1.00 0.00 H new ATOM 0 HA PHE A 60 5.003 -7.578 -6.765 1.00 0.00 H new ATOM 0 HB2 PHE A 60 2.743 -9.039 -7.646 1.00 0.00 H new ATOM 0 HB3 PHE A 60 4.000 -10.234 -7.394 1.00 0.00 H new ATOM 0 HD1 PHE A 60 5.475 -9.514 -5.116 1.00 0.00 H new ATOM 0 HD2 PHE A 60 1.333 -8.821 -5.829 1.00 0.00 H new ATOM 0 HE1 PHE A 60 5.074 -9.426 -2.695 1.00 0.00 H new ATOM 0 HE2 PHE A 60 0.930 -8.729 -3.408 1.00 0.00 H new ATOM 0 HZ PHE A 60 2.801 -9.030 -1.835 1.00 0.00 H new ATOM 886 N SER A 61 5.825 -9.925 -8.955 1.00 0.00 N ATOM 887 CA SER A 61 6.962 -10.696 -9.460 1.00 0.00 C ATOM 888 C SER A 61 7.965 -9.812 -10.197 1.00 0.00 C ATOM 889 O SER A 61 9.167 -9.887 -9.942 1.00 0.00 O ATOM 890 CB SER A 61 6.489 -11.820 -10.385 1.00 0.00 C ATOM 891 OG SER A 61 5.631 -11.335 -11.401 1.00 0.00 O ATOM 0 H SER A 61 4.922 -10.201 -9.340 1.00 0.00 H new ATOM 0 HA SER A 61 7.462 -11.129 -8.594 1.00 0.00 H new ATOM 0 HB2 SER A 61 7.353 -12.305 -10.839 1.00 0.00 H new ATOM 0 HB3 SER A 61 5.968 -12.578 -9.800 1.00 0.00 H new ATOM 0 HG SER A 61 5.349 -12.079 -11.974 1.00 0.00 H new ATOM 897 N ASP A 62 7.474 -8.977 -11.109 1.00 0.00 N ATOM 898 CA ASP A 62 8.346 -8.090 -11.868 1.00 0.00 C ATOM 899 C ASP A 62 9.179 -7.243 -10.910 1.00 0.00 C ATOM 900 O ASP A 62 10.375 -7.486 -10.727 1.00 0.00 O ATOM 901 CB ASP A 62 7.514 -7.218 -12.826 1.00 0.00 C ATOM 902 CG ASP A 62 8.046 -5.802 -12.975 1.00 0.00 C ATOM 903 OD1 ASP A 62 9.220 -5.648 -13.370 1.00 0.00 O ATOM 904 OD2 ASP A 62 7.289 -4.851 -12.697 1.00 0.00 O ATOM 0 H ASP A 62 6.483 -8.897 -11.338 1.00 0.00 H new ATOM 0 HA ASP A 62 9.031 -8.682 -12.476 1.00 0.00 H new ATOM 0 HB2 ASP A 62 7.488 -7.693 -13.807 1.00 0.00 H new ATOM 0 HB3 ASP A 62 6.486 -7.175 -12.465 1.00 0.00 H new ATOM 909 N LEU A 63 8.543 -6.258 -10.291 1.00 0.00 N ATOM 910 CA LEU A 63 9.224 -5.391 -9.349 1.00 0.00 C ATOM 911 C LEU A 63 9.965 -6.212 -8.288 1.00 0.00 C ATOM 912 O LEU A 63 10.907 -5.724 -7.675 1.00 0.00 O ATOM 913 CB LEU A 63 8.219 -4.435 -8.696 1.00 0.00 C ATOM 914 CG LEU A 63 8.827 -3.214 -7.995 1.00 0.00 C ATOM 915 CD1 LEU A 63 8.350 -1.919 -8.646 1.00 0.00 C ATOM 916 CD2 LEU A 63 8.475 -3.226 -6.515 1.00 0.00 C ATOM 0 H LEU A 63 7.555 -6.042 -10.427 1.00 0.00 H new ATOM 0 HA LEU A 63 9.965 -4.802 -9.890 1.00 0.00 H new ATOM 0 HB2 LEU A 63 7.527 -4.085 -9.462 1.00 0.00 H new ATOM 0 HB3 LEU A 63 7.632 -4.995 -7.968 1.00 0.00 H new ATOM 0 HG LEU A 63 9.911 -3.265 -8.098 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.795 -1.068 -8.131 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.650 -1.907 -9.694 1.00 0.00 H new ATOM 0 HD13 LEU A 63 7.264 -1.857 -8.579 1.00 0.00 H new ATOM 0 HD21 LEU A 63 8.913 -2.354 -6.030 1.00 0.00 H new ATOM 0 HD22 LEU A 63 7.392 -3.200 -6.398 1.00 0.00 H new ATOM 0 HD23 LEU A 63 8.868 -4.133 -6.055 1.00 0.00 H new ATOM 928 N ALA A 64 9.552 -7.470 -8.081 1.00 0.00 N ATOM 929 CA ALA A 64 10.207 -8.331 -7.096 1.00 0.00 C ATOM 930 C ALA A 64 11.688 -8.481 -7.405 1.00 0.00 C ATOM 931 O ALA A 64 12.536 -7.976 -6.675 1.00 0.00 O ATOM 932 CB ALA A 64 9.557 -9.711 -7.036 1.00 0.00 C ATOM 0 H ALA A 64 8.776 -7.907 -8.578 1.00 0.00 H new ATOM 0 HA ALA A 64 10.090 -7.850 -6.125 1.00 0.00 H new ATOM 0 HB1 ALA A 64 10.070 -10.323 -6.294 1.00 0.00 H new ATOM 0 HB2 ALA A 64 8.508 -9.607 -6.759 1.00 0.00 H new ATOM 0 HB3 ALA A 64 9.628 -10.190 -8.013 1.00 0.00 H new ATOM 938 N ALA A 65 11.991 -9.186 -8.489 1.00 0.00 N ATOM 939 CA ALA A 65 13.375 -9.414 -8.892 1.00 0.00 C ATOM 940 C ALA A 65 14.125 -8.098 -9.068 1.00 0.00 C ATOM 941 O ALA A 65 15.240 -7.935 -8.564 1.00 0.00 O ATOM 942 CB ALA A 65 13.422 -10.235 -10.173 1.00 0.00 C ATOM 0 H ALA A 65 11.297 -9.610 -9.105 1.00 0.00 H new ATOM 0 HA ALA A 65 13.871 -9.973 -8.099 1.00 0.00 H new ATOM 0 HB1 ALA A 65 14.460 -10.398 -10.463 1.00 0.00 H new ATOM 0 HB2 ALA A 65 12.936 -11.197 -10.007 1.00 0.00 H new ATOM 0 HB3 ALA A 65 12.903 -9.699 -10.968 1.00 0.00 H new ATOM 948 N GLN A 66 13.510 -7.159 -9.782 1.00 0.00 N ATOM 949 CA GLN A 66 14.126 -5.859 -10.017 1.00 0.00 C ATOM 950 C GLN A 66 14.482 -5.185 -8.690 1.00 0.00 C ATOM 951 O GLN A 66 15.648 -4.884 -8.434 1.00 0.00 O ATOM 952 CB GLN A 66 13.198 -4.967 -10.855 1.00 0.00 C ATOM 953 CG GLN A 66 13.661 -4.794 -12.293 1.00 0.00 C ATOM 954 CD GLN A 66 13.878 -3.341 -12.668 1.00 0.00 C ATOM 955 OE1 GLN A 66 14.944 -2.778 -12.425 1.00 0.00 O ATOM 956 NE2 GLN A 66 12.861 -2.725 -13.263 1.00 0.00 N ATOM 0 H GLN A 66 12.589 -7.274 -10.206 1.00 0.00 H new ATOM 0 HA GLN A 66 15.049 -6.009 -10.578 1.00 0.00 H new ATOM 0 HB2 GLN A 66 12.196 -5.396 -10.853 1.00 0.00 H new ATOM 0 HB3 GLN A 66 13.126 -3.987 -10.384 1.00 0.00 H new ATOM 0 HG2 GLN A 66 14.590 -5.345 -12.440 1.00 0.00 H new ATOM 0 HG3 GLN A 66 12.921 -5.231 -12.964 1.00 0.00 H new ATOM 0 HE21 GLN A 66 11.994 -3.231 -13.445 1.00 0.00 H new ATOM 0 HE22 GLN A 66 12.947 -1.746 -13.537 1.00 0.00 H new ATOM 965 N LEU A 67 13.477 -4.952 -7.847 1.00 0.00 N ATOM 966 CA LEU A 67 13.703 -4.315 -6.552 1.00 0.00 C ATOM 967 C LEU A 67 14.636 -5.155 -5.681 1.00 0.00 C ATOM 968 O LEU A 67 15.393 -4.615 -4.874 1.00 0.00 O ATOM 969 CB LEU A 67 12.376 -4.077 -5.818 1.00 0.00 C ATOM 970 CG LEU A 67 11.903 -2.620 -5.763 1.00 0.00 C ATOM 971 CD1 LEU A 67 12.622 -1.863 -4.661 1.00 0.00 C ATOM 972 CD2 LEU A 67 12.104 -1.932 -7.106 1.00 0.00 C ATOM 0 H LEU A 67 12.504 -5.193 -8.036 1.00 0.00 H new ATOM 0 HA LEU A 67 14.177 -3.351 -6.740 1.00 0.00 H new ATOM 0 HB2 LEU A 67 11.602 -4.674 -6.301 1.00 0.00 H new ATOM 0 HB3 LEU A 67 12.474 -4.447 -4.798 1.00 0.00 H new ATOM 0 HG LEU A 67 10.836 -2.620 -5.539 1.00 0.00 H new ATOM 0 HD11 LEU A 67 12.271 -0.831 -4.640 1.00 0.00 H new ATOM 0 HD12 LEU A 67 12.416 -2.336 -3.701 1.00 0.00 H new ATOM 0 HD13 LEU A 67 13.695 -1.877 -4.850 1.00 0.00 H new ATOM 0 HD21 LEU A 67 11.761 -0.900 -7.041 1.00 0.00 H new ATOM 0 HD22 LEU A 67 13.162 -1.947 -7.368 1.00 0.00 H new ATOM 0 HD23 LEU A 67 11.533 -2.456 -7.872 1.00 0.00 H new ATOM 984 N HIS A 68 14.579 -6.478 -5.847 1.00 0.00 N ATOM 985 CA HIS A 68 15.424 -7.381 -5.069 1.00 0.00 C ATOM 986 C HIS A 68 16.886 -6.962 -5.164 1.00 0.00 C ATOM 987 O HIS A 68 17.438 -6.422 -4.207 1.00 0.00 O ATOM 988 CB HIS A 68 15.247 -8.832 -5.534 1.00 0.00 C ATOM 989 CG HIS A 68 15.464 -9.831 -4.442 1.00 0.00 C ATOM 990 ND1 HIS A 68 16.628 -10.555 -4.305 1.00 0.00 N ATOM 991 CD2 HIS A 68 14.661 -10.221 -3.421 1.00 0.00 C ATOM 992 CE1 HIS A 68 16.536 -11.346 -3.251 1.00 0.00 C ATOM 993 NE2 HIS A 68 15.353 -11.161 -2.696 1.00 0.00 N ATOM 0 H HIS A 68 13.960 -6.944 -6.510 1.00 0.00 H new ATOM 0 HA HIS A 68 15.115 -7.319 -4.025 1.00 0.00 H new ATOM 0 HB2 HIS A 68 14.242 -8.957 -5.938 1.00 0.00 H new ATOM 0 HB3 HIS A 68 15.945 -9.034 -6.347 1.00 0.00 H new ATOM 0 HD2 HIS A 68 13.664 -9.860 -3.216 1.00 0.00 H new ATOM 0 HE1 HIS A 68 17.298 -12.027 -2.903 1.00 0.00 H new ATOM 0 HE2 HIS A 68 15.008 -11.639 -1.863 1.00 0.00 H new ATOM 1001 N VAL A 69 17.509 -7.203 -6.322 1.00 0.00 N ATOM 1002 CA VAL A 69 18.918 -6.833 -6.538 1.00 0.00 C ATOM 1003 C VAL A 69 19.303 -5.563 -5.748 1.00 0.00 C ATOM 1004 O VAL A 69 20.123 -5.622 -4.832 1.00 0.00 O ATOM 1005 CB VAL A 69 19.215 -6.647 -8.056 1.00 0.00 C ATOM 1006 CG1 VAL A 69 20.393 -5.706 -8.310 1.00 0.00 C ATOM 1007 CG2 VAL A 69 19.471 -7.999 -8.713 1.00 0.00 C ATOM 0 H VAL A 69 17.065 -7.651 -7.124 1.00 0.00 H new ATOM 0 HA VAL A 69 19.531 -7.652 -6.163 1.00 0.00 H new ATOM 0 HB VAL A 69 18.333 -6.186 -8.501 1.00 0.00 H new ATOM 0 HG11 VAL A 69 20.558 -5.611 -9.383 1.00 0.00 H new ATOM 0 HG12 VAL A 69 20.173 -4.725 -7.888 1.00 0.00 H new ATOM 0 HG13 VAL A 69 21.289 -6.110 -7.840 1.00 0.00 H new ATOM 0 HG21 VAL A 69 19.677 -7.855 -9.774 1.00 0.00 H new ATOM 0 HG22 VAL A 69 20.328 -8.478 -8.239 1.00 0.00 H new ATOM 0 HG23 VAL A 69 18.591 -8.632 -8.597 1.00 0.00 H new ATOM 1017 N THR A 70 18.711 -4.424 -6.106 1.00 0.00 N ATOM 1018 CA THR A 70 18.998 -3.164 -5.429 1.00 0.00 C ATOM 1019 C THR A 70 18.773 -3.297 -3.919 1.00 0.00 C ATOM 1020 O THR A 70 17.634 -3.387 -3.461 1.00 0.00 O ATOM 1021 CB THR A 70 18.126 -2.028 -5.988 1.00 0.00 C ATOM 1022 OG1 THR A 70 17.625 -2.325 -7.287 1.00 0.00 O ATOM 1023 CG2 THR A 70 18.866 -0.714 -6.092 1.00 0.00 C ATOM 0 H THR A 70 18.030 -4.350 -6.862 1.00 0.00 H new ATOM 0 HA THR A 70 20.045 -2.921 -5.610 1.00 0.00 H new ATOM 0 HB THR A 70 17.309 -1.937 -5.272 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.075 -1.578 -7.604 1.00 0.00 H new ATOM 0 HG21 THR A 70 18.198 0.049 -6.493 1.00 0.00 H new ATOM 0 HG22 THR A 70 19.211 -0.411 -5.103 1.00 0.00 H new ATOM 0 HG23 THR A 70 19.723 -0.831 -6.755 1.00 0.00 H new ATOM 1031 N PRO A 71 19.861 -3.314 -3.123 1.00 0.00 N ATOM 1032 CA PRO A 71 19.772 -3.441 -1.663 1.00 0.00 C ATOM 1033 C PRO A 71 18.774 -2.460 -1.054 1.00 0.00 C ATOM 1034 O PRO A 71 19.071 -1.275 -0.896 1.00 0.00 O ATOM 1035 CB PRO A 71 21.193 -3.121 -1.194 1.00 0.00 C ATOM 1036 CG PRO A 71 22.062 -3.499 -2.343 1.00 0.00 C ATOM 1037 CD PRO A 71 21.260 -3.215 -3.583 1.00 0.00 C ATOM 0 HA PRO A 71 19.420 -4.427 -1.360 1.00 0.00 H new ATOM 0 HB2 PRO A 71 21.300 -2.065 -0.946 1.00 0.00 H new ATOM 0 HB3 PRO A 71 21.452 -3.686 -0.299 1.00 0.00 H new ATOM 0 HG2 PRO A 71 22.988 -2.924 -2.337 1.00 0.00 H new ATOM 0 HG3 PRO A 71 22.340 -4.552 -2.291 1.00 0.00 H new ATOM 0 HD2 PRO A 71 21.481 -2.226 -3.985 1.00 0.00 H new ATOM 0 HD3 PRO A 71 21.474 -3.935 -4.373 1.00 0.00 H new ATOM 1045 N GLY A 72 17.591 -2.962 -0.711 1.00 0.00 N ATOM 1046 CA GLY A 72 16.566 -2.121 -0.121 1.00 0.00 C ATOM 1047 C GLY A 72 16.152 -2.602 1.255 1.00 0.00 C ATOM 1048 O GLY A 72 16.041 -3.805 1.490 1.00 0.00 O ATOM 0 H GLY A 72 17.324 -3.939 -0.832 1.00 0.00 H new ATOM 0 HA2 GLY A 72 16.934 -1.098 -0.050 1.00 0.00 H new ATOM 0 HA3 GLY A 72 15.694 -2.101 -0.775 1.00 0.00 H new ATOM 1052 N SER A 73 15.918 -1.664 2.168 1.00 0.00 N ATOM 1053 CA SER A 73 15.509 -2.012 3.521 1.00 0.00 C ATOM 1054 C SER A 73 14.043 -2.437 3.548 1.00 0.00 C ATOM 1055 O SER A 73 13.406 -2.567 2.502 1.00 0.00 O ATOM 1056 CB SER A 73 15.753 -0.842 4.481 1.00 0.00 C ATOM 1057 OG SER A 73 15.370 -1.180 5.801 1.00 0.00 O ATOM 0 H SER A 73 16.005 -0.662 1.995 1.00 0.00 H new ATOM 0 HA SER A 73 16.115 -2.855 3.854 1.00 0.00 H new ATOM 0 HB2 SER A 73 16.808 -0.567 4.464 1.00 0.00 H new ATOM 0 HB3 SER A 73 15.191 0.030 4.147 1.00 0.00 H new ATOM 0 HG SER A 73 15.537 -0.419 6.395 1.00 0.00 H new ATOM 1063 N ALA A 74 13.520 -2.668 4.745 1.00 0.00 N ATOM 1064 CA ALA A 74 12.138 -3.101 4.913 1.00 0.00 C ATOM 1065 C ALA A 74 11.143 -1.978 4.599 1.00 0.00 C ATOM 1066 O ALA A 74 11.440 -1.077 3.817 1.00 0.00 O ATOM 1067 CB ALA A 74 11.941 -3.637 6.322 1.00 0.00 C ATOM 0 H ALA A 74 14.035 -2.562 5.619 1.00 0.00 H new ATOM 0 HA ALA A 74 11.939 -3.899 4.198 1.00 0.00 H new ATOM 0 HB1 ALA A 74 10.908 -3.961 6.447 1.00 0.00 H new ATOM 0 HB2 ALA A 74 12.608 -4.483 6.486 1.00 0.00 H new ATOM 0 HB3 ALA A 74 12.165 -2.852 7.044 1.00 0.00 H new ATOM 1073 N GLN A 75 9.951 -2.053 5.198 1.00 0.00 N ATOM 1074 CA GLN A 75 8.904 -1.062 4.969 1.00 0.00 C ATOM 1075 C GLN A 75 9.452 0.358 4.982 1.00 0.00 C ATOM 1076 O GLN A 75 9.255 1.134 4.040 1.00 0.00 O ATOM 1077 CB GLN A 75 7.807 -1.206 6.024 1.00 0.00 C ATOM 1078 CG GLN A 75 6.851 -2.345 5.742 1.00 0.00 C ATOM 1079 CD GLN A 75 6.563 -3.192 6.962 1.00 0.00 C ATOM 1080 OE1 GLN A 75 6.213 -2.676 8.024 1.00 0.00 O ATOM 1081 NE2 GLN A 75 6.704 -4.502 6.813 1.00 0.00 N ATOM 0 H GLN A 75 9.690 -2.795 5.848 1.00 0.00 H new ATOM 0 HA GLN A 75 8.488 -1.247 3.979 1.00 0.00 H new ATOM 0 HB2 GLN A 75 8.269 -1.361 6.999 1.00 0.00 H new ATOM 0 HB3 GLN A 75 7.244 -0.274 6.082 1.00 0.00 H new ATOM 0 HG2 GLN A 75 5.915 -1.939 5.359 1.00 0.00 H new ATOM 0 HG3 GLN A 75 7.269 -2.977 4.958 1.00 0.00 H new ATOM 0 HE21 GLN A 75 6.996 -4.884 5.914 1.00 0.00 H new ATOM 0 HE22 GLN A 75 6.520 -5.127 7.598 1.00 0.00 H new ATOM 1090 N GLN A 76 10.132 0.683 6.064 1.00 0.00 N ATOM 1091 CA GLN A 76 10.722 2.003 6.245 1.00 0.00 C ATOM 1092 C GLN A 76 11.442 2.463 4.974 1.00 0.00 C ATOM 1093 O GLN A 76 11.533 3.660 4.701 1.00 0.00 O ATOM 1094 CB GLN A 76 11.697 1.988 7.431 1.00 0.00 C ATOM 1095 CG GLN A 76 11.296 1.040 8.555 1.00 0.00 C ATOM 1096 CD GLN A 76 12.406 0.818 9.558 1.00 0.00 C ATOM 1097 OE1 GLN A 76 13.298 -0.003 9.343 1.00 0.00 O ATOM 1098 NE2 GLN A 76 12.355 1.545 10.666 1.00 0.00 N ATOM 0 H GLN A 76 10.293 0.044 6.843 1.00 0.00 H new ATOM 0 HA GLN A 76 9.918 2.709 6.454 1.00 0.00 H new ATOM 0 HB2 GLN A 76 12.687 1.708 7.070 1.00 0.00 H new ATOM 0 HB3 GLN A 76 11.778 2.998 7.834 1.00 0.00 H new ATOM 0 HG2 GLN A 76 10.423 1.442 9.069 1.00 0.00 H new ATOM 0 HG3 GLN A 76 11.001 0.081 8.128 1.00 0.00 H new ATOM 0 HE21 GLN A 76 11.597 2.214 10.803 1.00 0.00 H new ATOM 0 HE22 GLN A 76 13.074 1.435 11.382 1.00 0.00 H new ATOM 1107 N ARG A 77 11.945 1.501 4.199 1.00 0.00 N ATOM 1108 CA ARG A 77 12.653 1.800 2.954 1.00 0.00 C ATOM 1109 C ARG A 77 11.703 2.308 1.887 1.00 0.00 C ATOM 1110 O ARG A 77 11.996 3.276 1.185 1.00 0.00 O ATOM 1111 CB ARG A 77 13.347 0.551 2.418 1.00 0.00 C ATOM 1112 CG ARG A 77 14.111 0.784 1.125 1.00 0.00 C ATOM 1113 CD ARG A 77 15.292 1.717 1.328 1.00 0.00 C ATOM 1114 NE ARG A 77 15.549 2.524 0.139 1.00 0.00 N ATOM 1115 CZ ARG A 77 15.900 3.807 0.167 1.00 0.00 C ATOM 1116 NH1 ARG A 77 16.082 4.433 1.323 1.00 0.00 N ATOM 1117 NH2 ARG A 77 16.078 4.465 -0.969 1.00 0.00 N ATOM 0 H ARG A 77 11.875 0.506 4.412 1.00 0.00 H new ATOM 0 HA ARG A 77 13.388 2.571 3.183 1.00 0.00 H new ATOM 0 HB2 ARG A 77 14.036 0.176 3.175 1.00 0.00 H new ATOM 0 HB3 ARG A 77 12.601 -0.226 2.254 1.00 0.00 H new ATOM 0 HG2 ARG A 77 14.465 -0.170 0.735 1.00 0.00 H new ATOM 0 HG3 ARG A 77 13.439 1.205 0.377 1.00 0.00 H new ATOM 0 HD2 ARG A 77 15.098 2.371 2.178 1.00 0.00 H new ATOM 0 HD3 ARG A 77 16.180 1.134 1.571 1.00 0.00 H new ATOM 0 HE ARG A 77 15.453 2.075 -0.772 1.00 0.00 H new ATOM 0 HH11 ARG A 77 15.953 3.930 2.201 1.00 0.00 H new ATOM 0 HH12 ARG A 77 16.351 5.417 1.333 1.00 0.00 H new ATOM 0 HH21 ARG A 77 15.946 3.988 -1.861 1.00 0.00 H new ATOM 0 HH22 ARG A 77 16.347 5.449 -0.952 1.00 0.00 H new ATOM 1131 N PHE A 78 10.569 1.636 1.759 1.00 0.00 N ATOM 1132 CA PHE A 78 9.572 2.002 0.770 1.00 0.00 C ATOM 1133 C PHE A 78 9.132 3.450 0.954 1.00 0.00 C ATOM 1134 O PHE A 78 9.163 4.239 0.009 1.00 0.00 O ATOM 1135 CB PHE A 78 8.370 1.071 0.884 1.00 0.00 C ATOM 1136 CG PHE A 78 8.281 0.036 -0.204 1.00 0.00 C ATOM 1137 CD1 PHE A 78 8.169 0.416 -1.531 1.00 0.00 C ATOM 1138 CD2 PHE A 78 8.295 -1.316 0.104 1.00 0.00 C ATOM 1139 CE1 PHE A 78 8.074 -0.533 -2.532 1.00 0.00 C ATOM 1140 CE2 PHE A 78 8.201 -2.269 -0.892 1.00 0.00 C ATOM 1141 CZ PHE A 78 8.090 -1.877 -2.212 1.00 0.00 C ATOM 0 H PHE A 78 10.317 0.830 2.332 1.00 0.00 H new ATOM 0 HA PHE A 78 10.013 1.904 -0.222 1.00 0.00 H new ATOM 0 HB2 PHE A 78 8.408 0.565 1.848 1.00 0.00 H new ATOM 0 HB3 PHE A 78 7.459 1.670 0.874 1.00 0.00 H new ATOM 0 HD1 PHE A 78 8.156 1.465 -1.787 1.00 0.00 H new ATOM 0 HD2 PHE A 78 8.380 -1.628 1.135 1.00 0.00 H new ATOM 0 HE1 PHE A 78 7.987 -0.224 -3.563 1.00 0.00 H new ATOM 0 HE2 PHE A 78 8.214 -3.319 -0.639 1.00 0.00 H new ATOM 0 HZ PHE A 78 8.016 -2.620 -2.992 1.00 0.00 H new ATOM 1151 N THR A 79 8.726 3.803 2.174 1.00 0.00 N ATOM 1152 CA THR A 79 8.290 5.170 2.452 1.00 0.00 C ATOM 1153 C THR A 79 9.365 6.166 2.064 1.00 0.00 C ATOM 1154 O THR A 79 9.157 7.028 1.212 1.00 0.00 O ATOM 1155 CB THR A 79 7.961 5.370 3.930 1.00 0.00 C ATOM 1156 OG1 THR A 79 7.996 4.139 4.632 1.00 0.00 O ATOM 1157 CG2 THR A 79 6.612 6.020 4.148 1.00 0.00 C ATOM 0 H THR A 79 8.690 3.171 2.974 1.00 0.00 H new ATOM 0 HA THR A 79 7.390 5.337 1.860 1.00 0.00 H new ATOM 0 HB THR A 79 8.728 6.041 4.317 1.00 0.00 H new ATOM 0 HG1 THR A 79 7.221 3.596 4.379 1.00 0.00 H new ATOM 0 HG21 THR A 79 6.433 6.137 5.217 1.00 0.00 H new ATOM 0 HG22 THR A 79 6.598 6.999 3.669 1.00 0.00 H new ATOM 0 HG23 THR A 79 5.832 5.393 3.716 1.00 0.00 H new ATOM 1165 N GLN A 80 10.515 6.038 2.717 1.00 0.00 N ATOM 1166 CA GLN A 80 11.647 6.921 2.475 1.00 0.00 C ATOM 1167 C GLN A 80 11.819 7.210 0.987 1.00 0.00 C ATOM 1168 O GLN A 80 12.130 8.336 0.597 1.00 0.00 O ATOM 1169 CB GLN A 80 12.918 6.298 3.046 1.00 0.00 C ATOM 1170 CG GLN A 80 13.852 7.311 3.681 1.00 0.00 C ATOM 1171 CD GLN A 80 14.955 7.748 2.741 1.00 0.00 C ATOM 1172 OE1 GLN A 80 15.530 6.934 2.018 1.00 0.00 O ATOM 1173 NE2 GLN A 80 15.256 9.040 2.743 1.00 0.00 N ATOM 0 H GLN A 80 10.687 5.324 3.424 1.00 0.00 H new ATOM 0 HA GLN A 80 11.454 7.870 2.975 1.00 0.00 H new ATOM 0 HB2 GLN A 80 12.645 5.550 3.790 1.00 0.00 H new ATOM 0 HB3 GLN A 80 13.448 5.776 2.249 1.00 0.00 H new ATOM 0 HG2 GLN A 80 13.279 8.183 3.994 1.00 0.00 H new ATOM 0 HG3 GLN A 80 14.294 6.880 4.580 1.00 0.00 H new ATOM 0 HE21 GLN A 80 14.754 9.680 3.359 1.00 0.00 H new ATOM 0 HE22 GLN A 80 15.990 9.394 2.129 1.00 0.00 H new ATOM 1182 N VAL A 81 11.607 6.193 0.162 1.00 0.00 N ATOM 1183 CA VAL A 81 11.732 6.343 -1.281 1.00 0.00 C ATOM 1184 C VAL A 81 10.644 7.267 -1.824 1.00 0.00 C ATOM 1185 O VAL A 81 10.911 8.134 -2.657 1.00 0.00 O ATOM 1186 CB VAL A 81 11.645 4.982 -1.996 1.00 0.00 C ATOM 1187 CG1 VAL A 81 11.864 5.142 -3.494 1.00 0.00 C ATOM 1188 CG2 VAL A 81 12.653 4.005 -1.405 1.00 0.00 C ATOM 0 H VAL A 81 11.348 5.255 0.468 1.00 0.00 H new ATOM 0 HA VAL A 81 12.711 6.780 -1.477 1.00 0.00 H new ATOM 0 HB VAL A 81 10.644 4.579 -1.843 1.00 0.00 H new ATOM 0 HG11 VAL A 81 11.798 4.167 -3.978 1.00 0.00 H new ATOM 0 HG12 VAL A 81 11.101 5.803 -3.905 1.00 0.00 H new ATOM 0 HG13 VAL A 81 12.850 5.570 -3.674 1.00 0.00 H new ATOM 0 HG21 VAL A 81 12.578 3.048 -1.922 1.00 0.00 H new ATOM 0 HG22 VAL A 81 13.660 4.404 -1.525 1.00 0.00 H new ATOM 0 HG23 VAL A 81 12.443 3.862 -0.345 1.00 0.00 H new ATOM 1198 N SER A 82 9.418 7.079 -1.345 1.00 0.00 N ATOM 1199 CA SER A 82 8.292 7.897 -1.781 1.00 0.00 C ATOM 1200 C SER A 82 8.574 9.379 -1.553 1.00 0.00 C ATOM 1201 O SER A 82 8.582 10.171 -2.496 1.00 0.00 O ATOM 1202 CB SER A 82 7.017 7.492 -1.038 1.00 0.00 C ATOM 1203 OG SER A 82 6.211 8.624 -0.756 1.00 0.00 O ATOM 0 H SER A 82 9.179 6.367 -0.655 1.00 0.00 H new ATOM 0 HA SER A 82 8.151 7.730 -2.849 1.00 0.00 H new ATOM 0 HB2 SER A 82 6.452 6.780 -1.640 1.00 0.00 H new ATOM 0 HB3 SER A 82 7.279 6.987 -0.108 1.00 0.00 H new ATOM 0 HG SER A 82 6.169 8.762 0.213 1.00 0.00 H new ATOM 1209 N ASP A 83 8.803 9.745 -0.297 1.00 0.00 N ATOM 1210 CA ASP A 83 9.085 11.132 0.053 1.00 0.00 C ATOM 1211 C ASP A 83 10.268 11.658 -0.751 1.00 0.00 C ATOM 1212 O ASP A 83 10.327 12.840 -1.093 1.00 0.00 O ATOM 1213 CB ASP A 83 9.365 11.257 1.552 1.00 0.00 C ATOM 1214 CG ASP A 83 8.095 11.236 2.382 1.00 0.00 C ATOM 1215 OD1 ASP A 83 7.300 12.192 2.273 1.00 0.00 O ATOM 1216 OD2 ASP A 83 7.898 10.262 3.139 1.00 0.00 O ATOM 0 H ASP A 83 8.799 9.102 0.495 1.00 0.00 H new ATOM 0 HA ASP A 83 8.208 11.732 -0.190 1.00 0.00 H new ATOM 0 HB2 ASP A 83 10.015 10.440 1.867 1.00 0.00 H new ATOM 0 HB3 ASP A 83 9.904 12.185 1.742 1.00 0.00 H new ATOM 1221 N GLU A 84 11.207 10.767 -1.057 1.00 0.00 N ATOM 1222 CA GLU A 84 12.390 11.135 -1.827 1.00 0.00 C ATOM 1223 C GLU A 84 11.991 11.776 -3.152 1.00 0.00 C ATOM 1224 O GLU A 84 12.408 12.890 -3.462 1.00 0.00 O ATOM 1225 CB GLU A 84 13.266 9.906 -2.076 1.00 0.00 C ATOM 1226 CG GLU A 84 14.710 10.092 -1.635 1.00 0.00 C ATOM 1227 CD GLU A 84 15.666 10.256 -2.801 1.00 0.00 C ATOM 1228 OE1 GLU A 84 15.189 10.376 -3.950 1.00 0.00 O ATOM 1229 OE2 GLU A 84 16.893 10.264 -2.566 1.00 0.00 O ATOM 0 H GLU A 84 11.171 9.785 -0.783 1.00 0.00 H new ATOM 0 HA GLU A 84 12.962 11.862 -1.251 1.00 0.00 H new ATOM 0 HB2 GLU A 84 12.840 9.053 -1.548 1.00 0.00 H new ATOM 0 HB3 GLU A 84 13.247 9.665 -3.139 1.00 0.00 H new ATOM 0 HG2 GLU A 84 14.778 10.968 -0.990 1.00 0.00 H new ATOM 0 HG3 GLU A 84 15.016 9.233 -1.039 1.00 0.00 H new ATOM 1236 N LEU A 85 11.179 11.070 -3.932 1.00 0.00 N ATOM 1237 CA LEU A 85 10.726 11.589 -5.214 1.00 0.00 C ATOM 1238 C LEU A 85 9.647 12.647 -5.009 1.00 0.00 C ATOM 1239 O LEU A 85 9.732 13.743 -5.561 1.00 0.00 O ATOM 1240 CB LEU A 85 10.209 10.457 -6.103 1.00 0.00 C ATOM 1241 CG LEU A 85 11.278 9.447 -6.537 1.00 0.00 C ATOM 1242 CD1 LEU A 85 11.031 8.092 -5.894 1.00 0.00 C ATOM 1243 CD2 LEU A 85 11.317 9.322 -8.053 1.00 0.00 C ATOM 0 H LEU A 85 10.824 10.143 -3.699 1.00 0.00 H new ATOM 0 HA LEU A 85 11.574 12.055 -5.715 1.00 0.00 H new ATOM 0 HB2 LEU A 85 9.421 9.925 -5.570 1.00 0.00 H new ATOM 0 HB3 LEU A 85 9.755 10.891 -6.994 1.00 0.00 H new ATOM 0 HG LEU A 85 12.248 9.813 -6.200 1.00 0.00 H new ATOM 0 HD11 LEU A 85 11.801 7.391 -6.216 1.00 0.00 H new ATOM 0 HD12 LEU A 85 11.062 8.193 -4.809 1.00 0.00 H new ATOM 0 HD13 LEU A 85 10.052 7.719 -6.195 1.00 0.00 H new ATOM 0 HD21 LEU A 85 12.082 8.600 -8.339 1.00 0.00 H new ATOM 0 HD22 LEU A 85 10.346 8.984 -8.415 1.00 0.00 H new ATOM 0 HD23 LEU A 85 11.551 10.292 -8.492 1.00 0.00 H new ATOM 1255 N PHE A 86 8.631 12.320 -4.208 1.00 0.00 N ATOM 1256 CA PHE A 86 7.537 13.250 -3.929 1.00 0.00 C ATOM 1257 C PHE A 86 8.044 14.586 -3.373 1.00 0.00 C ATOM 1258 O PHE A 86 7.274 15.538 -3.260 1.00 0.00 O ATOM 1259 CB PHE A 86 6.555 12.615 -2.941 1.00 0.00 C ATOM 1260 CG PHE A 86 5.441 13.531 -2.517 1.00 0.00 C ATOM 1261 CD1 PHE A 86 5.599 14.375 -1.433 1.00 0.00 C ATOM 1262 CD2 PHE A 86 4.237 13.546 -3.200 1.00 0.00 C ATOM 1263 CE1 PHE A 86 4.578 15.215 -1.042 1.00 0.00 C ATOM 1264 CE2 PHE A 86 3.213 14.382 -2.815 1.00 0.00 C ATOM 1265 CZ PHE A 86 3.382 15.219 -1.735 1.00 0.00 C ATOM 0 H PHE A 86 8.544 11.417 -3.741 1.00 0.00 H new ATOM 0 HA PHE A 86 7.032 13.457 -4.873 1.00 0.00 H new ATOM 0 HB2 PHE A 86 6.125 11.722 -3.394 1.00 0.00 H new ATOM 0 HB3 PHE A 86 7.103 12.291 -2.056 1.00 0.00 H new ATOM 0 HD1 PHE A 86 6.531 14.376 -0.887 1.00 0.00 H new ATOM 0 HD2 PHE A 86 4.099 12.892 -4.048 1.00 0.00 H new ATOM 0 HE1 PHE A 86 4.713 15.870 -0.194 1.00 0.00 H new ATOM 0 HE2 PHE A 86 2.280 14.381 -3.359 1.00 0.00 H new ATOM 0 HZ PHE A 86 2.582 15.877 -1.430 1.00 0.00 H new ATOM 1275 N GLN A 87 9.332 14.651 -3.026 1.00 0.00 N ATOM 1276 CA GLN A 87 9.938 15.870 -2.485 1.00 0.00 C ATOM 1277 C GLN A 87 9.568 17.108 -3.308 1.00 0.00 C ATOM 1278 O GLN A 87 10.334 17.549 -4.165 1.00 0.00 O ATOM 1279 CB GLN A 87 11.460 15.718 -2.422 1.00 0.00 C ATOM 1280 CG GLN A 87 12.044 16.013 -1.051 1.00 0.00 C ATOM 1281 CD GLN A 87 11.991 17.486 -0.700 1.00 0.00 C ATOM 1282 OE1 GLN A 87 11.981 18.346 -1.581 1.00 0.00 O ATOM 1283 NE2 GLN A 87 11.955 17.787 0.594 1.00 0.00 N ATOM 0 H GLN A 87 9.979 13.867 -3.111 1.00 0.00 H new ATOM 0 HA GLN A 87 9.544 16.013 -1.479 1.00 0.00 H new ATOM 0 HB2 GLN A 87 11.728 14.702 -2.711 1.00 0.00 H new ATOM 0 HB3 GLN A 87 11.914 16.387 -3.153 1.00 0.00 H new ATOM 0 HG2 GLN A 87 11.499 15.444 -0.298 1.00 0.00 H new ATOM 0 HG3 GLN A 87 13.079 15.673 -1.020 1.00 0.00 H new ATOM 0 HE21 GLN A 87 11.965 17.043 1.291 1.00 0.00 H new ATOM 0 HE22 GLN A 87 11.917 18.762 0.890 1.00 0.00 H new ATOM 1292 N GLY A 88 8.386 17.655 -3.045 1.00 0.00 N ATOM 1293 CA GLY A 88 7.923 18.827 -3.771 1.00 0.00 C ATOM 1294 C GLY A 88 7.116 18.467 -5.000 1.00 0.00 C ATOM 1295 O GLY A 88 7.069 19.223 -5.971 1.00 0.00 O ATOM 0 H GLY A 88 7.737 17.307 -2.339 1.00 0.00 H new ATOM 0 HA2 GLY A 88 7.315 19.444 -3.109 1.00 0.00 H new ATOM 0 HA3 GLY A 88 8.782 19.429 -4.068 1.00 0.00 H new ATOM 1299 N GLY A 89 6.473 17.309 -4.945 1.00 0.00 N ATOM 1300 CA GLY A 89 5.658 16.856 -6.051 1.00 0.00 C ATOM 1301 C GLY A 89 4.226 16.606 -5.626 1.00 0.00 C ATOM 1302 O GLY A 89 3.839 15.464 -5.390 1.00 0.00 O ATOM 0 H GLY A 89 6.503 16.673 -4.148 1.00 0.00 H new ATOM 0 HA2 GLY A 89 5.677 17.601 -6.846 1.00 0.00 H new ATOM 0 HA3 GLY A 89 6.081 15.940 -6.463 1.00 0.00 H new ATOM 1306 N PRO A 90 3.404 17.659 -5.520 1.00 0.00 N ATOM 1307 CA PRO A 90 2.000 17.525 -5.116 1.00 0.00 C ATOM 1308 C PRO A 90 1.138 16.888 -6.207 1.00 0.00 C ATOM 1309 O PRO A 90 -0.007 17.289 -6.418 1.00 0.00 O ATOM 1310 CB PRO A 90 1.569 18.973 -4.873 1.00 0.00 C ATOM 1311 CG PRO A 90 2.465 19.788 -5.742 1.00 0.00 C ATOM 1312 CD PRO A 90 3.780 19.061 -5.780 1.00 0.00 C ATOM 0 HA PRO A 90 1.883 16.876 -4.248 1.00 0.00 H new ATOM 0 HB2 PRO A 90 0.521 19.123 -5.134 1.00 0.00 H new ATOM 0 HB3 PRO A 90 1.679 19.248 -3.824 1.00 0.00 H new ATOM 0 HG2 PRO A 90 2.048 19.892 -6.744 1.00 0.00 H new ATOM 0 HG3 PRO A 90 2.587 20.794 -5.341 1.00 0.00 H new ATOM 0 HD2 PRO A 90 4.273 19.172 -6.746 1.00 0.00 H new ATOM 0 HD3 PRO A 90 4.470 19.439 -5.025 1.00 0.00 H new ATOM 1320 N ASN A 91 1.694 15.892 -6.895 1.00 0.00 N ATOM 1321 CA ASN A 91 0.970 15.201 -7.963 1.00 0.00 C ATOM 1322 C ASN A 91 0.220 13.986 -7.427 1.00 0.00 C ATOM 1323 O ASN A 91 0.505 13.497 -6.332 1.00 0.00 O ATOM 1324 CB ASN A 91 1.921 14.772 -9.095 1.00 0.00 C ATOM 1325 CG ASN A 91 1.181 14.410 -10.370 1.00 0.00 C ATOM 1326 OD1 ASN A 91 0.465 13.411 -10.425 1.00 0.00 O ATOM 1327 ND2 ASN A 91 1.355 15.222 -11.406 1.00 0.00 N ATOM 0 H ASN A 91 2.640 15.546 -6.734 1.00 0.00 H new ATOM 0 HA ASN A 91 0.244 15.906 -8.367 1.00 0.00 H new ATOM 0 HB2 ASN A 91 2.622 15.581 -9.303 1.00 0.00 H new ATOM 0 HB3 ASN A 91 2.510 13.916 -8.765 1.00 0.00 H new ATOM 0 HD21 ASN A 91 0.886 15.028 -12.291 1.00 0.00 H new ATOM 0 HD22 ASN A 91 1.958 16.040 -11.317 1.00 0.00 H new ATOM 1334 N TRP A 92 -0.730 13.500 -8.212 1.00 0.00 N ATOM 1335 CA TRP A 92 -1.522 12.329 -7.834 1.00 0.00 C ATOM 1336 C TRP A 92 -0.700 11.046 -7.997 1.00 0.00 C ATOM 1337 O TRP A 92 -0.952 10.043 -7.330 1.00 0.00 O ATOM 1338 CB TRP A 92 -2.813 12.245 -8.666 1.00 0.00 C ATOM 1339 CG TRP A 92 -3.035 13.428 -9.566 1.00 0.00 C ATOM 1340 CD1 TRP A 92 -3.440 14.681 -9.196 1.00 0.00 C ATOM 1341 CD2 TRP A 92 -2.844 13.471 -10.984 1.00 0.00 C ATOM 1342 NE1 TRP A 92 -3.521 15.494 -10.303 1.00 0.00 N ATOM 1343 CE2 TRP A 92 -3.162 14.773 -11.410 1.00 0.00 C ATOM 1344 CE3 TRP A 92 -2.440 12.531 -11.939 1.00 0.00 C ATOM 1345 CZ2 TRP A 92 -3.086 15.160 -12.746 1.00 0.00 C ATOM 1346 CZ3 TRP A 92 -2.364 12.917 -13.264 1.00 0.00 C ATOM 1347 CH2 TRP A 92 -2.685 14.221 -13.657 1.00 0.00 C ATOM 0 H TRP A 92 -0.975 13.897 -9.119 1.00 0.00 H new ATOM 0 HA TRP A 92 -1.798 12.435 -6.785 1.00 0.00 H new ATOM 0 HB2 TRP A 92 -2.785 11.340 -9.272 1.00 0.00 H new ATOM 0 HB3 TRP A 92 -3.663 12.150 -7.991 1.00 0.00 H new ATOM 0 HD1 TRP A 92 -3.663 14.987 -8.185 1.00 0.00 H new ATOM 0 HE1 TRP A 92 -3.803 16.474 -10.299 1.00 0.00 H new ATOM 0 HE3 TRP A 92 -2.192 11.522 -11.646 1.00 0.00 H new ATOM 0 HZ2 TRP A 92 -3.335 16.165 -13.052 1.00 0.00 H new ATOM 0 HZ3 TRP A 92 -2.052 12.200 -14.009 1.00 0.00 H new ATOM 0 HH2 TRP A 92 -2.615 14.492 -14.700 1.00 0.00 H new ATOM 1358 N GLY A 93 0.286 11.085 -8.894 1.00 0.00 N ATOM 1359 CA GLY A 93 1.130 9.923 -9.126 1.00 0.00 C ATOM 1360 C GLY A 93 1.639 9.314 -7.832 1.00 0.00 C ATOM 1361 O GLY A 93 1.596 8.097 -7.645 1.00 0.00 O ATOM 0 H GLY A 93 0.515 11.900 -9.463 1.00 0.00 H new ATOM 0 HA2 GLY A 93 0.567 9.173 -9.681 1.00 0.00 H new ATOM 0 HA3 GLY A 93 1.978 10.211 -9.748 1.00 0.00 H new ATOM 1365 N ARG A 94 2.118 10.168 -6.937 1.00 0.00 N ATOM 1366 CA ARG A 94 2.638 9.725 -5.651 1.00 0.00 C ATOM 1367 C ARG A 94 1.514 9.274 -4.717 1.00 0.00 C ATOM 1368 O ARG A 94 1.766 8.636 -3.695 1.00 0.00 O ATOM 1369 CB ARG A 94 3.438 10.852 -5.007 1.00 0.00 C ATOM 1370 CG ARG A 94 4.566 11.366 -5.889 1.00 0.00 C ATOM 1371 CD ARG A 94 4.268 12.753 -6.438 1.00 0.00 C ATOM 1372 NE ARG A 94 5.438 13.349 -7.074 1.00 0.00 N ATOM 1373 CZ ARG A 94 5.792 13.116 -8.333 1.00 0.00 C ATOM 1374 NH1 ARG A 94 5.073 12.296 -9.087 1.00 0.00 N ATOM 1375 NH2 ARG A 94 6.870 13.695 -8.839 1.00 0.00 N ATOM 0 H ARG A 94 2.157 11.177 -7.080 1.00 0.00 H new ATOM 0 HA ARG A 94 3.288 8.867 -5.823 1.00 0.00 H new ATOM 0 HB2 ARG A 94 2.766 11.677 -4.770 1.00 0.00 H new ATOM 0 HB3 ARG A 94 3.855 10.500 -4.063 1.00 0.00 H new ATOM 0 HG2 ARG A 94 5.492 11.394 -5.315 1.00 0.00 H new ATOM 0 HG3 ARG A 94 4.724 10.674 -6.716 1.00 0.00 H new ATOM 0 HD2 ARG A 94 3.454 12.690 -7.161 1.00 0.00 H new ATOM 0 HD3 ARG A 94 3.927 13.398 -5.629 1.00 0.00 H new ATOM 0 HE ARG A 94 6.017 13.980 -6.520 1.00 0.00 H new ATOM 0 HH11 ARG A 94 4.245 11.842 -8.701 1.00 0.00 H new ATOM 0 HH12 ARG A 94 5.348 12.119 -10.053 1.00 0.00 H new ATOM 0 HH21 ARG A 94 7.431 14.322 -8.262 1.00 0.00 H new ATOM 0 HH22 ARG A 94 7.140 13.514 -9.806 1.00 0.00 H new ATOM 1389 N LEU A 95 0.274 9.608 -5.072 1.00 0.00 N ATOM 1390 CA LEU A 95 -0.881 9.230 -4.262 1.00 0.00 C ATOM 1391 C LEU A 95 -1.193 7.743 -4.420 1.00 0.00 C ATOM 1392 O LEU A 95 -1.221 6.996 -3.441 1.00 0.00 O ATOM 1393 CB LEU A 95 -2.108 10.069 -4.653 1.00 0.00 C ATOM 1394 CG LEU A 95 -2.517 11.132 -3.639 1.00 0.00 C ATOM 1395 CD1 LEU A 95 -2.878 10.489 -2.311 1.00 0.00 C ATOM 1396 CD2 LEU A 95 -1.404 12.154 -3.460 1.00 0.00 C ATOM 0 H LEU A 95 0.045 10.138 -5.913 1.00 0.00 H new ATOM 0 HA LEU A 95 -0.639 9.423 -3.217 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -1.905 10.558 -5.606 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -2.952 9.398 -4.812 1.00 0.00 H new ATOM 0 HG LEU A 95 -3.398 11.651 -4.017 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -3.167 11.262 -1.599 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -3.709 9.799 -2.455 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -2.017 9.944 -1.925 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -1.713 12.905 -2.733 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -0.504 11.653 -3.104 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -1.197 12.637 -4.415 1.00 0.00 H new ATOM 1408 N VAL A 96 -1.423 7.321 -5.661 1.00 0.00 N ATOM 1409 CA VAL A 96 -1.734 5.929 -5.955 1.00 0.00 C ATOM 1410 C VAL A 96 -0.546 5.033 -5.617 1.00 0.00 C ATOM 1411 O VAL A 96 -0.712 3.945 -5.069 1.00 0.00 O ATOM 1412 CB VAL A 96 -2.115 5.767 -7.438 1.00 0.00 C ATOM 1413 CG1 VAL A 96 -2.480 4.330 -7.775 1.00 0.00 C ATOM 1414 CG2 VAL A 96 -3.246 6.715 -7.795 1.00 0.00 C ATOM 0 H VAL A 96 -1.399 7.928 -6.481 1.00 0.00 H new ATOM 0 HA VAL A 96 -2.582 5.629 -5.340 1.00 0.00 H new ATOM 0 HB VAL A 96 -1.241 6.022 -8.038 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -2.742 4.259 -8.831 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -1.629 3.680 -7.568 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -3.330 4.019 -7.168 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -3.506 6.591 -8.846 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -4.116 6.493 -7.177 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -2.929 7.743 -7.619 1.00 0.00 H new ATOM 1424 N ALA A 97 0.653 5.510 -5.931 1.00 0.00 N ATOM 1425 CA ALA A 97 1.869 4.764 -5.646 1.00 0.00 C ATOM 1426 C ALA A 97 2.046 4.583 -4.141 1.00 0.00 C ATOM 1427 O ALA A 97 1.936 3.476 -3.620 1.00 0.00 O ATOM 1428 CB ALA A 97 3.073 5.483 -6.234 1.00 0.00 C ATOM 0 H ALA A 97 0.807 6.411 -6.383 1.00 0.00 H new ATOM 0 HA ALA A 97 1.787 3.779 -6.105 1.00 0.00 H new ATOM 0 HB1 ALA A 97 3.978 4.916 -6.015 1.00 0.00 H new ATOM 0 HB2 ALA A 97 2.953 5.571 -7.314 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.153 6.478 -5.795 1.00 0.00 H new ATOM 1434 N PHE A 98 2.317 5.678 -3.441 1.00 0.00 N ATOM 1435 CA PHE A 98 2.502 5.636 -1.992 1.00 0.00 C ATOM 1436 C PHE A 98 1.443 4.753 -1.331 1.00 0.00 C ATOM 1437 O PHE A 98 1.696 4.122 -0.307 1.00 0.00 O ATOM 1438 CB PHE A 98 2.435 7.048 -1.415 1.00 0.00 C ATOM 1439 CG PHE A 98 2.596 7.094 0.075 1.00 0.00 C ATOM 1440 CD1 PHE A 98 1.562 6.709 0.912 1.00 0.00 C ATOM 1441 CD2 PHE A 98 3.782 7.524 0.637 1.00 0.00 C ATOM 1442 CE1 PHE A 98 1.714 6.754 2.283 1.00 0.00 C ATOM 1443 CE2 PHE A 98 3.941 7.571 2.004 1.00 0.00 C ATOM 1444 CZ PHE A 98 2.907 7.187 2.828 1.00 0.00 C ATOM 0 H PHE A 98 2.414 6.607 -3.851 1.00 0.00 H new ATOM 0 HA PHE A 98 3.483 5.208 -1.786 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.213 7.657 -1.875 1.00 0.00 H new ATOM 0 HB3 PHE A 98 1.478 7.496 -1.683 1.00 0.00 H new ATOM 0 HD1 PHE A 98 0.628 6.370 0.488 1.00 0.00 H new ATOM 0 HD2 PHE A 98 4.596 7.828 -0.005 1.00 0.00 H new ATOM 0 HE1 PHE A 98 0.902 6.451 2.928 1.00 0.00 H new ATOM 0 HE2 PHE A 98 4.875 7.908 2.429 1.00 0.00 H new ATOM 0 HZ PHE A 98 3.029 7.224 3.900 1.00 0.00 H new ATOM 1454 N PHE A 99 0.259 4.710 -1.926 1.00 0.00 N ATOM 1455 CA PHE A 99 -0.826 3.899 -1.389 1.00 0.00 C ATOM 1456 C PHE A 99 -0.454 2.417 -1.413 1.00 0.00 C ATOM 1457 O PHE A 99 -0.469 1.749 -0.379 1.00 0.00 O ATOM 1458 CB PHE A 99 -2.113 4.143 -2.179 1.00 0.00 C ATOM 1459 CG PHE A 99 -3.303 4.426 -1.306 1.00 0.00 C ATOM 1460 CD1 PHE A 99 -4.021 3.388 -0.734 1.00 0.00 C ATOM 1461 CD2 PHE A 99 -3.704 5.730 -1.055 1.00 0.00 C ATOM 1462 CE1 PHE A 99 -5.114 3.644 0.072 1.00 0.00 C ATOM 1463 CE2 PHE A 99 -4.796 5.992 -0.250 1.00 0.00 C ATOM 1464 CZ PHE A 99 -5.502 4.948 0.314 1.00 0.00 C ATOM 0 H PHE A 99 0.026 5.224 -2.776 1.00 0.00 H new ATOM 0 HA PHE A 99 -0.995 4.191 -0.352 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -1.961 4.983 -2.857 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -2.323 3.269 -2.796 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -3.723 2.367 -0.920 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.156 6.550 -1.494 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -5.664 2.826 0.512 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -5.097 7.012 -0.062 1.00 0.00 H new ATOM 0 HZ PHE A 99 -6.356 5.150 0.943 1.00 0.00 H new ATOM 1474 N VAL A 100 -0.119 1.906 -2.599 1.00 0.00 N ATOM 1475 CA VAL A 100 0.259 0.497 -2.745 1.00 0.00 C ATOM 1476 C VAL A 100 1.366 0.130 -1.773 1.00 0.00 C ATOM 1477 O VAL A 100 1.431 -0.995 -1.285 1.00 0.00 O ATOM 1478 CB VAL A 100 0.725 0.156 -4.180 1.00 0.00 C ATOM 1479 CG1 VAL A 100 1.940 0.973 -4.579 1.00 0.00 C ATOM 1480 CG2 VAL A 100 1.017 -1.332 -4.319 1.00 0.00 C ATOM 0 H VAL A 100 -0.101 2.441 -3.467 1.00 0.00 H new ATOM 0 HA VAL A 100 -0.638 -0.082 -2.527 1.00 0.00 H new ATOM 0 HB VAL A 100 -0.090 0.414 -4.856 1.00 0.00 H new ATOM 0 HG11 VAL A 100 2.240 0.708 -5.593 1.00 0.00 H new ATOM 0 HG12 VAL A 100 1.694 2.034 -4.539 1.00 0.00 H new ATOM 0 HG13 VAL A 100 2.760 0.765 -3.892 1.00 0.00 H new ATOM 0 HG21 VAL A 100 1.343 -1.545 -5.337 1.00 0.00 H new ATOM 0 HG22 VAL A 100 1.803 -1.615 -3.619 1.00 0.00 H new ATOM 0 HG23 VAL A 100 0.114 -1.902 -4.100 1.00 0.00 H new ATOM 1490 N PHE A 101 2.233 1.087 -1.490 1.00 0.00 N ATOM 1491 CA PHE A 101 3.330 0.854 -0.574 1.00 0.00 C ATOM 1492 C PHE A 101 2.799 0.534 0.832 1.00 0.00 C ATOM 1493 O PHE A 101 2.886 -0.604 1.292 1.00 0.00 O ATOM 1494 CB PHE A 101 4.270 2.074 -0.557 1.00 0.00 C ATOM 1495 CG PHE A 101 4.602 2.543 0.823 1.00 0.00 C ATOM 1496 CD1 PHE A 101 5.371 1.758 1.648 1.00 0.00 C ATOM 1497 CD2 PHE A 101 4.108 3.739 1.305 1.00 0.00 C ATOM 1498 CE1 PHE A 101 5.648 2.148 2.939 1.00 0.00 C ATOM 1499 CE2 PHE A 101 4.383 4.141 2.592 1.00 0.00 C ATOM 1500 CZ PHE A 101 5.151 3.344 3.412 1.00 0.00 C ATOM 0 H PHE A 101 2.197 2.028 -1.881 1.00 0.00 H new ATOM 0 HA PHE A 101 3.901 -0.010 -0.914 1.00 0.00 H new ATOM 0 HB2 PHE A 101 5.193 1.821 -1.079 1.00 0.00 H new ATOM 0 HB3 PHE A 101 3.805 2.891 -1.109 1.00 0.00 H new ATOM 0 HD1 PHE A 101 5.764 0.822 1.279 1.00 0.00 H new ATOM 0 HD2 PHE A 101 3.501 4.364 0.667 1.00 0.00 H new ATOM 0 HE1 PHE A 101 6.251 1.520 3.578 1.00 0.00 H new ATOM 0 HE2 PHE A 101 3.997 5.081 2.959 1.00 0.00 H new ATOM 0 HZ PHE A 101 5.364 3.655 4.424 1.00 0.00 H new ATOM 1510 N GLY A 102 2.265 1.549 1.515 1.00 0.00 N ATOM 1511 CA GLY A 102 1.753 1.352 2.860 1.00 0.00 C ATOM 1512 C GLY A 102 0.838 0.151 2.963 1.00 0.00 C ATOM 1513 O GLY A 102 0.997 -0.679 3.851 1.00 0.00 O ATOM 0 H GLY A 102 2.179 2.501 1.159 1.00 0.00 H new ATOM 0 HA2 GLY A 102 2.589 1.228 3.549 1.00 0.00 H new ATOM 0 HA3 GLY A 102 1.212 2.245 3.173 1.00 0.00 H new ATOM 1517 N ALA A 103 -0.119 0.060 2.048 1.00 0.00 N ATOM 1518 CA ALA A 103 -1.068 -1.048 2.035 1.00 0.00 C ATOM 1519 C ALA A 103 -0.367 -2.401 1.909 1.00 0.00 C ATOM 1520 O ALA A 103 -0.445 -3.233 2.813 1.00 0.00 O ATOM 1521 CB ALA A 103 -2.067 -0.863 0.904 1.00 0.00 C ATOM 0 H ALA A 103 -0.259 0.742 1.303 1.00 0.00 H new ATOM 0 HA ALA A 103 -1.595 -1.044 2.989 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -2.772 -1.694 0.901 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -2.609 0.072 1.047 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.537 -0.833 -0.048 1.00 0.00 H new ATOM 1527 N ALA A 104 0.306 -2.622 0.781 1.00 0.00 N ATOM 1528 CA ALA A 104 1.009 -3.885 0.540 1.00 0.00 C ATOM 1529 C ALA A 104 1.900 -4.247 1.716 1.00 0.00 C ATOM 1530 O ALA A 104 1.792 -5.332 2.289 1.00 0.00 O ATOM 1531 CB ALA A 104 1.841 -3.805 -0.731 1.00 0.00 C ATOM 0 H ALA A 104 0.380 -1.946 0.020 1.00 0.00 H new ATOM 0 HA ALA A 104 0.256 -4.664 0.421 1.00 0.00 H new ATOM 0 HB1 ALA A 104 2.354 -4.753 -0.890 1.00 0.00 H new ATOM 0 HB2 ALA A 104 1.189 -3.598 -1.580 1.00 0.00 H new ATOM 0 HB3 ALA A 104 2.576 -3.006 -0.635 1.00 0.00 H new ATOM 1537 N LEU A 105 2.780 -3.325 2.064 1.00 0.00 N ATOM 1538 CA LEU A 105 3.700 -3.518 3.168 1.00 0.00 C ATOM 1539 C LEU A 105 2.948 -3.841 4.448 1.00 0.00 C ATOM 1540 O LEU A 105 3.111 -4.918 5.022 1.00 0.00 O ATOM 1541 CB LEU A 105 4.529 -2.262 3.351 1.00 0.00 C ATOM 1542 CG LEU A 105 5.757 -2.178 2.453 1.00 0.00 C ATOM 1543 CD1 LEU A 105 6.517 -0.899 2.724 1.00 0.00 C ATOM 1544 CD2 LEU A 105 6.648 -3.398 2.652 1.00 0.00 C ATOM 0 H LEU A 105 2.876 -2.426 1.591 1.00 0.00 H new ATOM 0 HA LEU A 105 4.355 -4.360 2.941 1.00 0.00 H new ATOM 0 HB2 LEU A 105 3.897 -1.394 3.163 1.00 0.00 H new ATOM 0 HB3 LEU A 105 4.850 -2.202 4.391 1.00 0.00 H new ATOM 0 HG LEU A 105 5.432 -2.166 1.413 1.00 0.00 H new ATOM 0 HD11 LEU A 105 7.392 -0.851 2.076 1.00 0.00 H new ATOM 0 HD12 LEU A 105 5.872 -0.043 2.526 1.00 0.00 H new ATOM 0 HD13 LEU A 105 6.836 -0.879 3.766 1.00 0.00 H new ATOM 0 HD21 LEU A 105 7.520 -3.321 2.003 1.00 0.00 H new ATOM 0 HD22 LEU A 105 6.972 -3.446 3.692 1.00 0.00 H new ATOM 0 HD23 LEU A 105 6.090 -4.301 2.404 1.00 0.00 H new ATOM 1556 N CYS A 106 2.122 -2.895 4.888 1.00 0.00 N ATOM 1557 CA CYS A 106 1.331 -3.070 6.102 1.00 0.00 C ATOM 1558 C CYS A 106 0.806 -4.501 6.191 1.00 0.00 C ATOM 1559 O CYS A 106 1.069 -5.207 7.161 1.00 0.00 O ATOM 1560 CB CYS A 106 0.158 -2.088 6.119 1.00 0.00 C ATOM 1561 SG CYS A 106 -0.373 -1.604 7.773 1.00 0.00 S ATOM 0 H CYS A 106 1.983 -1.999 4.421 1.00 0.00 H new ATOM 0 HA CYS A 106 1.972 -2.872 6.961 1.00 0.00 H new ATOM 0 HB2 CYS A 106 0.439 -1.194 5.563 1.00 0.00 H new ATOM 0 HB3 CYS A 106 -0.686 -2.537 5.595 1.00 0.00 H new ATOM 0 HG CYS A 106 0.615 -1.033 8.396 1.00 0.00 H new ATOM 1567 N ALA A 107 0.080 -4.924 5.159 1.00 0.00 N ATOM 1568 CA ALA A 107 -0.468 -6.274 5.109 1.00 0.00 C ATOM 1569 C ALA A 107 0.637 -7.321 5.216 1.00 0.00 C ATOM 1570 O ALA A 107 0.501 -8.310 5.935 1.00 0.00 O ATOM 1571 CB ALA A 107 -1.256 -6.469 3.826 1.00 0.00 C ATOM 0 H ALA A 107 -0.142 -4.349 4.346 1.00 0.00 H new ATOM 0 HA ALA A 107 -1.136 -6.402 5.961 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -1.661 -7.480 3.798 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -2.074 -5.749 3.788 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -0.599 -6.317 2.969 1.00 0.00 H new ATOM 1577 N GLU A 108 1.733 -7.094 4.497 1.00 0.00 N ATOM 1578 CA GLU A 108 2.868 -8.016 4.510 1.00 0.00 C ATOM 1579 C GLU A 108 3.269 -8.363 5.938 1.00 0.00 C ATOM 1580 O GLU A 108 3.435 -9.532 6.289 1.00 0.00 O ATOM 1581 CB GLU A 108 4.064 -7.394 3.788 1.00 0.00 C ATOM 1582 CG GLU A 108 5.217 -8.363 3.572 1.00 0.00 C ATOM 1583 CD GLU A 108 6.221 -8.337 4.710 1.00 0.00 C ATOM 1584 OE1 GLU A 108 6.895 -7.300 4.883 1.00 0.00 O ATOM 1585 OE2 GLU A 108 6.334 -9.355 5.425 1.00 0.00 O ATOM 0 H GLU A 108 1.860 -6.279 3.897 1.00 0.00 H new ATOM 0 HA GLU A 108 2.565 -8.928 3.996 1.00 0.00 H new ATOM 0 HB2 GLU A 108 3.736 -7.012 2.821 1.00 0.00 H new ATOM 0 HB3 GLU A 108 4.421 -6.540 4.364 1.00 0.00 H new ATOM 0 HG2 GLU A 108 4.822 -9.373 3.463 1.00 0.00 H new ATOM 0 HG3 GLU A 108 5.724 -8.117 2.639 1.00 0.00 H new ATOM 1592 N SER A 109 3.423 -7.328 6.748 1.00 0.00 N ATOM 1593 CA SER A 109 3.808 -7.482 8.141 1.00 0.00 C ATOM 1594 C SER A 109 2.642 -8.020 8.977 1.00 0.00 C ATOM 1595 O SER A 109 2.851 -8.717 9.971 1.00 0.00 O ATOM 1596 CB SER A 109 4.285 -6.130 8.678 1.00 0.00 C ATOM 1597 OG SER A 109 5.382 -6.269 9.560 1.00 0.00 O ATOM 0 H SER A 109 3.285 -6.360 6.459 1.00 0.00 H new ATOM 0 HA SER A 109 4.619 -8.207 8.212 1.00 0.00 H new ATOM 0 HB2 SER A 109 4.569 -5.488 7.844 1.00 0.00 H new ATOM 0 HB3 SER A 109 3.463 -5.635 9.196 1.00 0.00 H new ATOM 0 HG SER A 109 5.759 -5.386 9.755 1.00 0.00 H new ATOM 1603 N VAL A 110 1.417 -7.696 8.564 1.00 0.00 N ATOM 1604 CA VAL A 110 0.218 -8.151 9.271 1.00 0.00 C ATOM 1605 C VAL A 110 0.167 -9.677 9.340 1.00 0.00 C ATOM 1606 O VAL A 110 0.320 -10.263 10.411 1.00 0.00 O ATOM 1607 CB VAL A 110 -1.070 -7.620 8.594 1.00 0.00 C ATOM 1608 CG1 VAL A 110 -2.323 -8.158 9.276 1.00 0.00 C ATOM 1609 CG2 VAL A 110 -1.083 -6.100 8.595 1.00 0.00 C ATOM 0 H VAL A 110 1.228 -7.120 7.744 1.00 0.00 H new ATOM 0 HA VAL A 110 0.271 -7.752 10.284 1.00 0.00 H new ATOM 0 HB VAL A 110 -1.071 -7.974 7.563 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -3.207 -7.765 8.775 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.328 -9.247 9.221 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -2.330 -7.848 10.321 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -1.995 -5.744 8.116 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.047 -5.737 9.622 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -0.216 -5.728 8.048 1.00 0.00 H new ATOM 1619 N ASN A 111 -0.059 -10.317 8.193 1.00 0.00 N ATOM 1620 CA ASN A 111 -0.139 -11.777 8.128 1.00 0.00 C ATOM 1621 C ASN A 111 1.025 -12.431 8.866 1.00 0.00 C ATOM 1622 O ASN A 111 0.843 -13.414 9.582 1.00 0.00 O ATOM 1623 CB ASN A 111 -0.160 -12.248 6.675 1.00 0.00 C ATOM 1624 CG ASN A 111 -0.907 -13.557 6.506 1.00 0.00 C ATOM 1625 OD1 ASN A 111 -1.801 -13.880 7.290 1.00 0.00 O ATOM 1626 ND2 ASN A 111 -0.543 -14.320 5.483 1.00 0.00 N ATOM 0 H ASN A 111 -0.190 -9.848 7.297 1.00 0.00 H new ATOM 0 HA ASN A 111 -1.066 -12.077 8.616 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -0.626 -11.483 6.054 1.00 0.00 H new ATOM 0 HB3 ASN A 111 0.863 -12.367 6.319 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -1.009 -15.213 5.322 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.203 -14.014 4.858 1.00 0.00 H new ATOM 1633 N LYS A 112 2.219 -11.876 8.689 1.00 0.00 N ATOM 1634 CA LYS A 112 3.415 -12.405 9.340 1.00 0.00 C ATOM 1635 C LYS A 112 3.347 -12.232 10.863 1.00 0.00 C ATOM 1636 O LYS A 112 4.283 -12.591 11.575 1.00 0.00 O ATOM 1637 CB LYS A 112 4.665 -11.716 8.783 1.00 0.00 C ATOM 1638 CG LYS A 112 5.634 -12.669 8.099 1.00 0.00 C ATOM 1639 CD LYS A 112 4.971 -13.424 6.956 1.00 0.00 C ATOM 1640 CE LYS A 112 5.304 -14.909 6.996 1.00 0.00 C ATOM 1641 NZ LYS A 112 6.060 -15.345 5.787 1.00 0.00 N ATOM 0 H LYS A 112 2.386 -11.060 8.100 1.00 0.00 H new ATOM 0 HA LYS A 112 3.469 -13.473 9.128 1.00 0.00 H new ATOM 0 HB2 LYS A 112 4.360 -10.949 8.071 1.00 0.00 H new ATOM 0 HB3 LYS A 112 5.182 -11.208 9.597 1.00 0.00 H new ATOM 0 HG2 LYS A 112 6.487 -12.108 7.718 1.00 0.00 H new ATOM 0 HG3 LYS A 112 6.021 -13.380 8.829 1.00 0.00 H new ATOM 0 HD2 LYS A 112 3.890 -13.291 7.010 1.00 0.00 H new ATOM 0 HD3 LYS A 112 5.296 -13.003 6.005 1.00 0.00 H new ATOM 0 HE2 LYS A 112 5.892 -15.125 7.888 1.00 0.00 H new ATOM 0 HE3 LYS A 112 4.382 -15.485 7.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 6.266 -16.362 5.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 5.490 -15.163 4.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 6.952 -14.814 5.725 1.00 0.00 H new ATOM 1655 N GLU A 113 2.236 -11.679 11.356 1.00 0.00 N ATOM 1656 CA GLU A 113 2.052 -11.462 12.786 1.00 0.00 C ATOM 1657 C GLU A 113 3.054 -10.447 13.318 1.00 0.00 C ATOM 1658 O GLU A 113 3.401 -10.460 14.498 1.00 0.00 O ATOM 1659 CB GLU A 113 2.178 -12.780 13.552 1.00 0.00 C ATOM 1660 CG GLU A 113 1.201 -12.903 14.710 1.00 0.00 C ATOM 1661 CD GLU A 113 -0.241 -12.691 14.285 1.00 0.00 C ATOM 1662 OE1 GLU A 113 -0.565 -12.986 13.116 1.00 0.00 O ATOM 1663 OE2 GLU A 113 -1.044 -12.229 15.123 1.00 0.00 O ATOM 0 H GLU A 113 1.451 -11.374 10.781 1.00 0.00 H new ATOM 0 HA GLU A 113 1.049 -11.064 12.937 1.00 0.00 H new ATOM 0 HB2 GLU A 113 2.018 -13.609 12.862 1.00 0.00 H new ATOM 0 HB3 GLU A 113 3.195 -12.874 13.933 1.00 0.00 H new ATOM 0 HG2 GLU A 113 1.301 -13.890 15.161 1.00 0.00 H new ATOM 0 HG3 GLU A 113 1.460 -12.174 15.478 1.00 0.00 H new ATOM 1670 N MET A 114 3.511 -9.568 12.437 1.00 0.00 N ATOM 1671 CA MET A 114 4.473 -8.543 12.810 1.00 0.00 C ATOM 1672 C MET A 114 3.778 -7.203 13.021 1.00 0.00 C ATOM 1673 O MET A 114 4.250 -6.163 12.559 1.00 0.00 O ATOM 1674 CB MET A 114 5.541 -8.421 11.731 1.00 0.00 C ATOM 1675 CG MET A 114 6.746 -9.316 11.953 1.00 0.00 C ATOM 1676 SD MET A 114 7.701 -8.838 13.403 1.00 0.00 S ATOM 1677 CE MET A 114 7.005 -9.933 14.635 1.00 0.00 C ATOM 0 H MET A 114 3.230 -9.545 11.457 1.00 0.00 H new ATOM 0 HA MET A 114 4.946 -8.832 13.749 1.00 0.00 H new ATOM 0 HB2 MET A 114 5.096 -8.660 10.765 1.00 0.00 H new ATOM 0 HB3 MET A 114 5.875 -7.385 11.680 1.00 0.00 H new ATOM 0 HG2 MET A 114 6.413 -10.348 12.065 1.00 0.00 H new ATOM 0 HG3 MET A 114 7.387 -9.282 11.072 1.00 0.00 H new ATOM 0 HE1 MET A 114 6.535 -9.343 15.422 1.00 0.00 H new ATOM 0 HE2 MET A 114 6.259 -10.577 14.170 1.00 0.00 H new ATOM 0 HE3 MET A 114 7.796 -10.547 15.065 1.00 0.00 H new ATOM 1687 N GLU A 115 2.654 -7.243 13.729 1.00 0.00 N ATOM 1688 CA GLU A 115 1.877 -6.041 14.020 1.00 0.00 C ATOM 1689 C GLU A 115 2.770 -4.950 14.606 1.00 0.00 C ATOM 1690 O GLU A 115 2.536 -3.762 14.393 1.00 0.00 O ATOM 1691 CB GLU A 115 0.734 -6.369 14.992 1.00 0.00 C ATOM 1692 CG GLU A 115 -0.061 -7.605 14.600 1.00 0.00 C ATOM 1693 CD GLU A 115 -0.927 -8.125 15.730 1.00 0.00 C ATOM 1694 OE1 GLU A 115 -0.407 -8.279 16.854 1.00 0.00 O ATOM 1695 OE2 GLU A 115 -2.125 -8.381 15.488 1.00 0.00 O ATOM 0 H GLU A 115 2.258 -8.100 14.115 1.00 0.00 H new ATOM 0 HA GLU A 115 1.451 -5.673 13.086 1.00 0.00 H new ATOM 0 HB2 GLU A 115 1.147 -6.514 15.990 1.00 0.00 H new ATOM 0 HB3 GLU A 115 0.059 -5.515 15.048 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -0.692 -7.370 13.743 1.00 0.00 H new ATOM 0 HG3 GLU A 115 0.627 -8.389 14.284 1.00 0.00 H new ATOM 1702 N VAL A 116 3.802 -5.373 15.334 1.00 0.00 N ATOM 1703 CA VAL A 116 4.750 -4.448 15.951 1.00 0.00 C ATOM 1704 C VAL A 116 5.233 -3.398 14.949 1.00 0.00 C ATOM 1705 O VAL A 116 5.103 -2.197 15.184 1.00 0.00 O ATOM 1706 CB VAL A 116 5.969 -5.197 16.527 1.00 0.00 C ATOM 1707 CG1 VAL A 116 6.928 -4.232 17.209 1.00 0.00 C ATOM 1708 CG2 VAL A 116 5.520 -6.283 17.495 1.00 0.00 C ATOM 0 H VAL A 116 4.003 -6.357 15.512 1.00 0.00 H new ATOM 0 HA VAL A 116 4.222 -3.949 16.764 1.00 0.00 H new ATOM 0 HB VAL A 116 6.499 -5.670 15.700 1.00 0.00 H new ATOM 0 HG11 VAL A 116 7.779 -4.785 17.607 1.00 0.00 H new ATOM 0 HG12 VAL A 116 7.279 -3.496 16.486 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.413 -3.723 18.024 1.00 0.00 H new ATOM 0 HG21 VAL A 116 6.393 -6.801 17.891 1.00 0.00 H new ATOM 0 HG22 VAL A 116 4.963 -5.831 18.316 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.882 -6.996 16.972 1.00 0.00 H new ATOM 1718 N LEU A 117 5.790 -3.859 13.833 1.00 0.00 N ATOM 1719 CA LEU A 117 6.290 -2.955 12.802 1.00 0.00 C ATOM 1720 C LEU A 117 5.137 -2.268 12.076 1.00 0.00 C ATOM 1721 O LEU A 117 5.274 -1.139 11.605 1.00 0.00 O ATOM 1722 CB LEU A 117 7.164 -3.715 11.802 1.00 0.00 C ATOM 1723 CG LEU A 117 8.612 -3.940 12.250 1.00 0.00 C ATOM 1724 CD1 LEU A 117 9.074 -5.345 11.894 1.00 0.00 C ATOM 1725 CD2 LEU A 117 9.532 -2.901 11.626 1.00 0.00 C ATOM 0 H LEU A 117 5.906 -4.850 13.620 1.00 0.00 H new ATOM 0 HA LEU A 117 6.896 -2.190 13.288 1.00 0.00 H new ATOM 0 HB2 LEU A 117 6.706 -4.684 11.604 1.00 0.00 H new ATOM 0 HB3 LEU A 117 7.172 -3.168 10.859 1.00 0.00 H new ATOM 0 HG LEU A 117 8.654 -3.831 13.334 1.00 0.00 H new ATOM 0 HD11 LEU A 117 10.105 -5.483 12.221 1.00 0.00 H new ATOM 0 HD12 LEU A 117 8.435 -6.075 12.391 1.00 0.00 H new ATOM 0 HD13 LEU A 117 9.014 -5.485 10.815 1.00 0.00 H new ATOM 0 HD21 LEU A 117 10.556 -3.077 11.956 1.00 0.00 H new ATOM 0 HD22 LEU A 117 9.482 -2.977 10.540 1.00 0.00 H new ATOM 0 HD23 LEU A 117 9.218 -1.904 11.935 1.00 0.00 H new ATOM 1737 N VAL A 118 4.001 -2.955 11.992 1.00 0.00 N ATOM 1738 CA VAL A 118 2.822 -2.408 11.324 1.00 0.00 C ATOM 1739 C VAL A 118 2.414 -1.073 11.938 1.00 0.00 C ATOM 1740 O VAL A 118 2.477 -0.032 11.286 1.00 0.00 O ATOM 1741 CB VAL A 118 1.624 -3.375 11.403 1.00 0.00 C ATOM 1742 CG1 VAL A 118 0.397 -2.764 10.740 1.00 0.00 C ATOM 1743 CG2 VAL A 118 1.975 -4.705 10.765 1.00 0.00 C ATOM 0 H VAL A 118 3.871 -3.890 12.377 1.00 0.00 H new ATOM 0 HA VAL A 118 3.095 -2.263 10.279 1.00 0.00 H new ATOM 0 HB VAL A 118 1.389 -3.550 12.453 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.438 -3.462 10.806 1.00 0.00 H new ATOM 0 HG12 VAL A 118 0.134 -1.835 11.246 1.00 0.00 H new ATOM 0 HG13 VAL A 118 0.615 -2.557 9.692 1.00 0.00 H new ATOM 0 HG21 VAL A 118 1.119 -5.376 10.829 1.00 0.00 H new ATOM 0 HG22 VAL A 118 2.236 -4.549 9.718 1.00 0.00 H new ATOM 0 HG23 VAL A 118 2.823 -5.147 11.288 1.00 0.00 H new ATOM 1753 N GLY A 119 1.984 -1.117 13.196 1.00 0.00 N ATOM 1754 CA GLY A 119 1.561 0.091 13.881 1.00 0.00 C ATOM 1755 C GLY A 119 2.575 1.212 13.772 1.00 0.00 C ATOM 1756 O GLY A 119 2.222 2.388 13.861 1.00 0.00 O ATOM 0 H GLY A 119 1.921 -1.969 13.753 1.00 0.00 H new ATOM 0 HA2 GLY A 119 0.610 0.425 13.466 1.00 0.00 H new ATOM 0 HA3 GLY A 119 1.387 -0.135 14.933 1.00 0.00 H new ATOM 1760 N GLN A 120 3.837 0.847 13.580 1.00 0.00 N ATOM 1761 CA GLN A 120 4.905 1.828 13.460 1.00 0.00 C ATOM 1762 C GLN A 120 4.861 2.519 12.099 1.00 0.00 C ATOM 1763 O GLN A 120 4.918 3.745 12.015 1.00 0.00 O ATOM 1764 CB GLN A 120 6.263 1.156 13.681 1.00 0.00 C ATOM 1765 CG GLN A 120 7.125 1.847 14.729 1.00 0.00 C ATOM 1766 CD GLN A 120 6.795 1.431 16.157 1.00 0.00 C ATOM 1767 OE1 GLN A 120 7.671 1.412 17.021 1.00 0.00 O ATOM 1768 NE2 GLN A 120 5.532 1.098 16.420 1.00 0.00 N ATOM 0 H GLN A 120 4.145 -0.123 13.504 1.00 0.00 H new ATOM 0 HA GLN A 120 4.762 2.590 14.226 1.00 0.00 H new ATOM 0 HB2 GLN A 120 6.101 0.121 13.981 1.00 0.00 H new ATOM 0 HB3 GLN A 120 6.805 1.133 12.736 1.00 0.00 H new ATOM 0 HG2 GLN A 120 8.174 1.627 14.528 1.00 0.00 H new ATOM 0 HG3 GLN A 120 7.002 2.926 14.636 1.00 0.00 H new ATOM 0 HE21 GLN A 120 4.832 1.126 15.678 1.00 0.00 H new ATOM 0 HE22 GLN A 120 5.265 0.816 17.363 1.00 0.00 H new ATOM 1777 N VAL A 121 4.753 1.725 11.036 1.00 0.00 N ATOM 1778 CA VAL A 121 4.695 2.264 9.679 1.00 0.00 C ATOM 1779 C VAL A 121 3.593 3.313 9.553 1.00 0.00 C ATOM 1780 O VAL A 121 3.785 4.357 8.930 1.00 0.00 O ATOM 1781 CB VAL A 121 4.459 1.146 8.643 1.00 0.00 C ATOM 1782 CG1 VAL A 121 4.399 1.716 7.231 1.00 0.00 C ATOM 1783 CG2 VAL A 121 5.545 0.086 8.752 1.00 0.00 C ATOM 0 H VAL A 121 4.704 0.707 11.088 1.00 0.00 H new ATOM 0 HA VAL A 121 5.658 2.733 9.478 1.00 0.00 H new ATOM 0 HB VAL A 121 3.498 0.679 8.856 1.00 0.00 H new ATOM 0 HG11 VAL A 121 4.232 0.908 6.519 1.00 0.00 H new ATOM 0 HG12 VAL A 121 3.582 2.434 7.163 1.00 0.00 H new ATOM 0 HG13 VAL A 121 5.340 2.214 7.000 1.00 0.00 H new ATOM 0 HG21 VAL A 121 5.365 -0.696 8.015 1.00 0.00 H new ATOM 0 HG22 VAL A 121 6.518 0.542 8.568 1.00 0.00 H new ATOM 0 HG23 VAL A 121 5.531 -0.348 9.752 1.00 0.00 H new ATOM 1793 N GLN A 122 2.442 3.027 10.152 1.00 0.00 N ATOM 1794 CA GLN A 122 1.313 3.947 10.111 1.00 0.00 C ATOM 1795 C GLN A 122 1.627 5.213 10.905 1.00 0.00 C ATOM 1796 O GLN A 122 1.344 6.326 10.463 1.00 0.00 O ATOM 1797 CB GLN A 122 0.057 3.267 10.666 1.00 0.00 C ATOM 1798 CG GLN A 122 -1.190 4.133 10.597 1.00 0.00 C ATOM 1799 CD GLN A 122 -1.671 4.571 11.967 1.00 0.00 C ATOM 1800 OE1 GLN A 122 -1.679 5.760 12.283 1.00 0.00 O ATOM 1801 NE2 GLN A 122 -2.074 3.608 12.788 1.00 0.00 N ATOM 0 H GLN A 122 2.267 2.166 10.671 1.00 0.00 H new ATOM 0 HA GLN A 122 1.130 4.227 9.074 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -0.121 2.345 10.112 1.00 0.00 H new ATOM 0 HB3 GLN A 122 0.236 2.986 11.704 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -0.983 5.014 9.990 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -1.985 3.580 10.096 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -2.050 2.635 12.483 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -2.408 3.842 13.723 1.00 0.00 H new ATOM 1810 N GLU A 123 2.210 5.026 12.085 1.00 0.00 N ATOM 1811 CA GLU A 123 2.565 6.145 12.954 1.00 0.00 C ATOM 1812 C GLU A 123 3.393 7.188 12.208 1.00 0.00 C ATOM 1813 O GLU A 123 3.063 8.375 12.213 1.00 0.00 O ATOM 1814 CB GLU A 123 3.335 5.650 14.180 1.00 0.00 C ATOM 1815 CG GLU A 123 3.376 6.660 15.315 1.00 0.00 C ATOM 1816 CD GLU A 123 3.341 6.004 16.682 1.00 0.00 C ATOM 1817 OE1 GLU A 123 4.321 5.313 17.034 1.00 0.00 O ATOM 1818 OE2 GLU A 123 2.334 6.180 17.400 1.00 0.00 O ATOM 0 H GLU A 123 2.447 4.109 12.463 1.00 0.00 H new ATOM 0 HA GLU A 123 1.637 6.615 13.280 1.00 0.00 H new ATOM 0 HB2 GLU A 123 2.877 4.729 14.540 1.00 0.00 H new ATOM 0 HB3 GLU A 123 4.355 5.405 13.885 1.00 0.00 H new ATOM 0 HG2 GLU A 123 4.281 7.262 15.228 1.00 0.00 H new ATOM 0 HG3 GLU A 123 2.530 7.341 15.221 1.00 0.00 H new ATOM 1825 N TRP A 124 4.467 6.741 11.565 1.00 0.00 N ATOM 1826 CA TRP A 124 5.335 7.641 10.814 1.00 0.00 C ATOM 1827 C TRP A 124 4.597 8.222 9.617 1.00 0.00 C ATOM 1828 O TRP A 124 4.766 9.393 9.274 1.00 0.00 O ATOM 1829 CB TRP A 124 6.585 6.901 10.341 1.00 0.00 C ATOM 1830 CG TRP A 124 7.677 6.863 11.364 1.00 0.00 C ATOM 1831 CD1 TRP A 124 7.559 7.119 12.699 1.00 0.00 C ATOM 1832 CD2 TRP A 124 9.055 6.551 11.135 1.00 0.00 C ATOM 1833 NE1 TRP A 124 8.778 6.986 13.315 1.00 0.00 N ATOM 1834 CE2 TRP A 124 9.713 6.638 12.376 1.00 0.00 C ATOM 1835 CE3 TRP A 124 9.796 6.207 10.001 1.00 0.00 C ATOM 1836 CZ2 TRP A 124 11.077 6.392 12.514 1.00 0.00 C ATOM 1837 CZ3 TRP A 124 11.151 5.963 10.140 1.00 0.00 C ATOM 1838 CH2 TRP A 124 11.777 6.056 11.388 1.00 0.00 C ATOM 0 H TRP A 124 4.757 5.763 11.549 1.00 0.00 H new ATOM 0 HA TRP A 124 5.632 8.457 11.473 1.00 0.00 H new ATOM 0 HB2 TRP A 124 6.314 5.880 10.072 1.00 0.00 H new ATOM 0 HB3 TRP A 124 6.961 7.380 9.437 1.00 0.00 H new ATOM 0 HD1 TRP A 124 6.640 7.387 13.198 1.00 0.00 H new ATOM 0 HE1 TRP A 124 8.958 7.124 14.309 1.00 0.00 H new ATOM 0 HE3 TRP A 124 9.320 6.133 9.034 1.00 0.00 H new ATOM 0 HZ2 TRP A 124 11.564 6.464 13.475 1.00 0.00 H new ATOM 0 HZ3 TRP A 124 11.735 5.697 9.271 1.00 0.00 H new ATOM 0 HH2 TRP A 124 12.836 5.858 11.464 1.00 0.00 H new ATOM 1849 N MET A 125 3.776 7.392 8.984 1.00 0.00 N ATOM 1850 CA MET A 125 3.005 7.811 7.821 1.00 0.00 C ATOM 1851 C MET A 125 2.182 9.058 8.127 1.00 0.00 C ATOM 1852 O MET A 125 2.346 10.097 7.488 1.00 0.00 O ATOM 1853 CB MET A 125 2.088 6.676 7.361 1.00 0.00 C ATOM 1854 CG MET A 125 2.260 6.334 5.896 1.00 0.00 C ATOM 1855 SD MET A 125 1.001 5.200 5.274 1.00 0.00 S ATOM 1856 CE MET A 125 0.837 4.072 6.652 1.00 0.00 C ATOM 0 H MET A 125 3.627 6.421 9.259 1.00 0.00 H new ATOM 0 HA MET A 125 3.704 8.054 7.021 1.00 0.00 H new ATOM 0 HB2 MET A 125 2.288 5.789 7.962 1.00 0.00 H new ATOM 0 HB3 MET A 125 1.051 6.957 7.544 1.00 0.00 H new ATOM 0 HG2 MET A 125 2.233 7.253 5.310 1.00 0.00 H new ATOM 0 HG3 MET A 125 3.244 5.890 5.747 1.00 0.00 H new ATOM 0 HE1 MET A 125 0.452 3.116 6.296 1.00 0.00 H new ATOM 0 HE2 MET A 125 1.812 3.921 7.116 1.00 0.00 H new ATOM 0 HE3 MET A 125 0.147 4.491 7.385 1.00 0.00 H new ATOM 1866 N VAL A 126 1.297 8.946 9.109 1.00 0.00 N ATOM 1867 CA VAL A 126 0.449 10.061 9.502 1.00 0.00 C ATOM 1868 C VAL A 126 1.285 11.223 10.040 1.00 0.00 C ATOM 1869 O VAL A 126 0.872 12.381 9.968 1.00 0.00 O ATOM 1870 CB VAL A 126 -0.576 9.624 10.568 1.00 0.00 C ATOM 1871 CG1 VAL A 126 -1.440 10.798 11.006 1.00 0.00 C ATOM 1872 CG2 VAL A 126 -1.439 8.487 10.037 1.00 0.00 C ATOM 0 H VAL A 126 1.149 8.093 9.648 1.00 0.00 H new ATOM 0 HA VAL A 126 -0.086 10.395 8.613 1.00 0.00 H new ATOM 0 HB VAL A 126 -0.031 9.266 11.441 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -2.155 10.463 11.758 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -0.807 11.578 11.429 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -1.978 11.195 10.145 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -2.158 8.189 10.800 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -1.972 8.820 9.147 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -0.805 7.637 9.784 1.00 0.00 H new ATOM 1882 N ALA A 127 2.461 10.904 10.576 1.00 0.00 N ATOM 1883 CA ALA A 127 3.355 11.917 11.124 1.00 0.00 C ATOM 1884 C ALA A 127 3.818 12.889 10.045 1.00 0.00 C ATOM 1885 O ALA A 127 3.526 14.083 10.110 1.00 0.00 O ATOM 1886 CB ALA A 127 4.552 11.261 11.793 1.00 0.00 C ATOM 0 H ALA A 127 2.816 9.950 10.642 1.00 0.00 H new ATOM 0 HA ALA A 127 2.800 12.484 11.871 1.00 0.00 H new ATOM 0 HB1 ALA A 127 5.210 12.030 12.197 1.00 0.00 H new ATOM 0 HB2 ALA A 127 4.209 10.616 12.602 1.00 0.00 H new ATOM 0 HB3 ALA A 127 5.097 10.666 11.061 1.00 0.00 H new ATOM 1892 N TYR A 128 4.538 12.374 9.051 1.00 0.00 N ATOM 1893 CA TYR A 128 5.027 13.208 7.962 1.00 0.00 C ATOM 1894 C TYR A 128 3.861 13.847 7.226 1.00 0.00 C ATOM 1895 O TYR A 128 3.965 14.966 6.724 1.00 0.00 O ATOM 1896 CB TYR A 128 5.871 12.386 6.984 1.00 0.00 C ATOM 1897 CG TYR A 128 6.457 13.198 5.846 1.00 0.00 C ATOM 1898 CD1 TYR A 128 5.669 13.606 4.774 1.00 0.00 C ATOM 1899 CD2 TYR A 128 7.801 13.552 5.839 1.00 0.00 C ATOM 1900 CE1 TYR A 128 6.206 14.342 3.733 1.00 0.00 C ATOM 1901 CE2 TYR A 128 8.342 14.290 4.800 1.00 0.00 C ATOM 1902 CZ TYR A 128 7.539 14.680 3.751 1.00 0.00 C ATOM 1903 OH TYR A 128 8.074 15.409 2.714 1.00 0.00 O ATOM 0 H TYR A 128 4.793 11.389 8.979 1.00 0.00 H new ATOM 0 HA TYR A 128 5.654 13.991 8.388 1.00 0.00 H new ATOM 0 HB2 TYR A 128 6.683 11.909 7.532 1.00 0.00 H new ATOM 0 HB3 TYR A 128 5.255 11.589 6.569 1.00 0.00 H new ATOM 0 HD1 TYR A 128 4.621 13.344 4.754 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.434 13.246 6.658 1.00 0.00 H new ATOM 0 HE1 TYR A 128 5.580 14.650 2.909 1.00 0.00 H new ATOM 0 HE2 TYR A 128 9.388 14.558 4.812 1.00 0.00 H new ATOM 0 HH TYR A 128 9.027 15.564 2.881 1.00 0.00 H new ATOM 1913 N LEU A 129 2.744 13.126 7.168 1.00 0.00 N ATOM 1914 CA LEU A 129 1.556 13.624 6.490 1.00 0.00 C ATOM 1915 C LEU A 129 1.170 15.009 7.000 1.00 0.00 C ATOM 1916 O LEU A 129 1.008 15.944 6.218 1.00 0.00 O ATOM 1917 CB LEU A 129 0.389 12.652 6.658 1.00 0.00 C ATOM 1918 CG LEU A 129 -0.321 12.296 5.348 1.00 0.00 C ATOM 1919 CD1 LEU A 129 -0.415 10.788 5.170 1.00 0.00 C ATOM 1920 CD2 LEU A 129 -1.702 12.937 5.292 1.00 0.00 C ATOM 0 H LEU A 129 2.639 12.199 7.581 1.00 0.00 H new ATOM 0 HA LEU A 129 1.790 13.706 5.429 1.00 0.00 H new ATOM 0 HB2 LEU A 129 0.757 11.736 7.120 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.336 13.087 7.345 1.00 0.00 H new ATOM 0 HG LEU A 129 0.272 12.693 4.524 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -0.923 10.563 4.232 1.00 0.00 H new ATOM 0 HD12 LEU A 129 0.588 10.361 5.151 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -0.977 10.358 5.999 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -2.189 12.671 4.354 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -2.304 12.578 6.127 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.603 14.021 5.355 1.00 0.00 H new ATOM 1932 N GLU A 130 1.017 15.132 8.311 1.00 0.00 N ATOM 1933 CA GLU A 130 0.642 16.403 8.919 1.00 0.00 C ATOM 1934 C GLU A 130 1.850 17.330 9.049 1.00 0.00 C ATOM 1935 O GLU A 130 1.701 18.522 9.326 1.00 0.00 O ATOM 1936 CB GLU A 130 0.002 16.164 10.286 1.00 0.00 C ATOM 1937 CG GLU A 130 -1.512 16.291 10.266 1.00 0.00 C ATOM 1938 CD GLU A 130 -2.174 15.580 11.429 1.00 0.00 C ATOM 1939 OE1 GLU A 130 -1.514 15.411 12.475 1.00 0.00 O ATOM 1940 OE2 GLU A 130 -3.353 15.190 11.294 1.00 0.00 O ATOM 0 H GLU A 130 1.146 14.368 8.975 1.00 0.00 H new ATOM 0 HA GLU A 130 -0.085 16.890 8.269 1.00 0.00 H new ATOM 0 HB2 GLU A 130 0.272 15.168 10.638 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.411 16.877 11.002 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -1.784 17.346 10.288 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -1.894 15.883 9.331 1.00 0.00 H new ATOM 1947 N THR A 131 3.046 16.775 8.864 1.00 0.00 N ATOM 1948 CA THR A 131 4.275 17.548 8.964 1.00 0.00 C ATOM 1949 C THR A 131 4.523 18.361 7.692 1.00 0.00 C ATOM 1950 O THR A 131 4.361 19.583 7.681 1.00 0.00 O ATOM 1951 CB THR A 131 5.461 16.614 9.228 1.00 0.00 C ATOM 1952 OG1 THR A 131 5.302 15.927 10.458 1.00 0.00 O ATOM 1953 CG2 THR A 131 6.796 17.327 9.269 1.00 0.00 C ATOM 0 H THR A 131 3.187 15.789 8.643 1.00 0.00 H new ATOM 0 HA THR A 131 4.170 18.244 9.796 1.00 0.00 H new ATOM 0 HB THR A 131 5.466 15.920 8.387 1.00 0.00 H new ATOM 0 HG1 THR A 131 4.472 15.406 10.437 1.00 0.00 H new ATOM 0 HG21 THR A 131 7.589 16.604 9.460 1.00 0.00 H new ATOM 0 HG22 THR A 131 6.976 17.818 8.313 1.00 0.00 H new ATOM 0 HG23 THR A 131 6.786 18.073 10.064 1.00 0.00 H new ATOM 1961 N ARG A 132 4.927 17.679 6.623 1.00 0.00 N ATOM 1962 CA ARG A 132 5.210 18.351 5.355 1.00 0.00 C ATOM 1963 C ARG A 132 4.138 18.064 4.305 1.00 0.00 C ATOM 1964 O ARG A 132 4.039 18.770 3.300 1.00 0.00 O ATOM 1965 CB ARG A 132 6.584 17.935 4.824 1.00 0.00 C ATOM 1966 CG ARG A 132 7.724 18.804 5.333 1.00 0.00 C ATOM 1967 CD ARG A 132 7.870 20.086 4.523 1.00 0.00 C ATOM 1968 NE ARG A 132 6.649 20.896 4.540 1.00 0.00 N ATOM 1969 CZ ARG A 132 6.571 22.134 5.029 1.00 0.00 C ATOM 1970 NH1 ARG A 132 7.653 22.758 5.480 1.00 0.00 N ATOM 1971 NH2 ARG A 132 5.405 22.761 5.047 1.00 0.00 N ATOM 0 H ARG A 132 5.065 16.669 6.608 1.00 0.00 H new ATOM 0 HA ARG A 132 5.207 19.423 5.550 1.00 0.00 H new ATOM 0 HB2 ARG A 132 6.774 16.899 5.106 1.00 0.00 H new ATOM 0 HB3 ARG A 132 6.569 17.972 3.735 1.00 0.00 H new ATOM 0 HG2 ARG A 132 7.550 19.054 6.379 1.00 0.00 H new ATOM 0 HG3 ARG A 132 8.656 18.240 5.291 1.00 0.00 H new ATOM 0 HD2 ARG A 132 8.698 20.672 4.921 1.00 0.00 H new ATOM 0 HD3 ARG A 132 8.123 19.836 3.493 1.00 0.00 H new ATOM 0 HE ARG A 132 5.801 20.485 4.151 1.00 0.00 H new ATOM 0 HH11 ARG A 132 8.559 22.290 5.455 1.00 0.00 H new ATOM 0 HH12 ARG A 132 7.578 23.705 5.851 1.00 0.00 H new ATOM 0 HH21 ARG A 132 4.571 22.297 4.688 1.00 0.00 H new ATOM 0 HH22 ARG A 132 5.341 23.708 5.420 1.00 0.00 H new ATOM 1985 N LEU A 133 3.322 17.047 4.548 1.00 0.00 N ATOM 1986 CA LEU A 133 2.249 16.702 3.624 1.00 0.00 C ATOM 1987 C LEU A 133 0.975 17.461 3.984 1.00 0.00 C ATOM 1988 O LEU A 133 -0.076 17.234 3.398 1.00 0.00 O ATOM 1989 CB LEU A 133 1.978 15.198 3.653 1.00 0.00 C ATOM 1990 CG LEU A 133 1.902 14.521 2.284 1.00 0.00 C ATOM 1991 CD1 LEU A 133 3.250 13.932 1.909 1.00 0.00 C ATOM 1992 CD2 LEU A 133 0.829 13.444 2.281 1.00 0.00 C ATOM 0 H LEU A 133 3.381 16.449 5.372 1.00 0.00 H new ATOM 0 HA LEU A 133 2.561 16.985 2.619 1.00 0.00 H new ATOM 0 HB2 LEU A 133 2.763 14.715 4.236 1.00 0.00 H new ATOM 0 HB3 LEU A 133 1.039 15.025 4.178 1.00 0.00 H new ATOM 0 HG LEU A 133 1.635 15.273 1.541 1.00 0.00 H new ATOM 0 HD11 LEU A 133 3.179 13.454 0.932 1.00 0.00 H new ATOM 0 HD12 LEU A 133 3.996 14.726 1.871 1.00 0.00 H new ATOM 0 HD13 LEU A 133 3.544 13.193 2.654 1.00 0.00 H new ATOM 0 HD21 LEU A 133 0.789 12.973 1.299 1.00 0.00 H new ATOM 0 HD22 LEU A 133 1.065 12.693 3.034 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -0.138 13.893 2.508 1.00 0.00 H new ATOM 2004 N ALA A 134 1.078 18.346 4.969 1.00 0.00 N ATOM 2005 CA ALA A 134 -0.066 19.124 5.418 1.00 0.00 C ATOM 2006 C ALA A 134 -0.436 20.192 4.403 1.00 0.00 C ATOM 2007 O ALA A 134 -1.576 20.643 4.364 1.00 0.00 O ATOM 2008 CB ALA A 134 0.219 19.759 6.770 1.00 0.00 C ATOM 0 H ALA A 134 1.944 18.541 5.471 1.00 0.00 H new ATOM 0 HA ALA A 134 -0.913 18.445 5.520 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -0.648 20.337 7.090 1.00 0.00 H new ATOM 0 HB2 ALA A 134 0.425 18.978 7.502 1.00 0.00 H new ATOM 0 HB3 ALA A 134 1.084 20.417 6.688 1.00 0.00 H new ATOM 2014 N ASP A 135 0.525 20.591 3.575 1.00 0.00 N ATOM 2015 CA ASP A 135 0.279 21.603 2.558 1.00 0.00 C ATOM 2016 C ASP A 135 -0.330 20.973 1.311 1.00 0.00 C ATOM 2017 O ASP A 135 -1.478 21.243 0.961 1.00 0.00 O ATOM 2018 CB ASP A 135 1.584 22.314 2.194 1.00 0.00 C ATOM 2019 CG ASP A 135 1.385 23.790 1.923 1.00 0.00 C ATOM 2020 OD1 ASP A 135 0.879 24.495 2.821 1.00 0.00 O ATOM 2021 OD2 ASP A 135 1.736 24.244 0.814 1.00 0.00 O ATOM 0 H ASP A 135 1.478 20.229 3.590 1.00 0.00 H new ATOM 0 HA ASP A 135 -0.425 22.331 2.962 1.00 0.00 H new ATOM 0 HB2 ASP A 135 2.300 22.191 3.007 1.00 0.00 H new ATOM 0 HB3 ASP A 135 2.018 21.841 1.313 1.00 0.00 H new ATOM 2026 N TRP A 136 0.449 20.128 0.644 1.00 0.00 N ATOM 2027 CA TRP A 136 -0.008 19.457 -0.570 1.00 0.00 C ATOM 2028 C TRP A 136 -1.372 18.798 -0.361 1.00 0.00 C ATOM 2029 O TRP A 136 -2.163 18.674 -1.295 1.00 0.00 O ATOM 2030 CB TRP A 136 1.022 18.420 -1.011 1.00 0.00 C ATOM 2031 CG TRP A 136 2.383 18.996 -1.288 1.00 0.00 C ATOM 2032 CD1 TRP A 136 3.577 18.366 -1.108 1.00 0.00 C ATOM 2033 CD2 TRP A 136 2.696 20.307 -1.784 1.00 0.00 C ATOM 2034 NE1 TRP A 136 4.612 19.188 -1.476 1.00 0.00 N ATOM 2035 CE2 TRP A 136 4.100 20.386 -1.889 1.00 0.00 C ATOM 2036 CE3 TRP A 136 1.935 21.419 -2.154 1.00 0.00 C ATOM 2037 CZ2 TRP A 136 4.752 21.527 -2.346 1.00 0.00 C ATOM 2038 CZ3 TRP A 136 2.586 22.553 -2.605 1.00 0.00 C ATOM 2039 CH2 TRP A 136 3.982 22.598 -2.699 1.00 0.00 C ATOM 0 H TRP A 136 1.401 19.891 0.923 1.00 0.00 H new ATOM 0 HA TRP A 136 -0.118 20.207 -1.353 1.00 0.00 H new ATOM 0 HB2 TRP A 136 1.111 17.658 -0.237 1.00 0.00 H new ATOM 0 HB3 TRP A 136 0.659 17.921 -1.909 1.00 0.00 H new ATOM 0 HD1 TRP A 136 3.693 17.361 -0.729 1.00 0.00 H new ATOM 0 HE1 TRP A 136 5.602 18.945 -1.446 1.00 0.00 H new ATOM 0 HE3 TRP A 136 0.857 21.393 -2.089 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 5.829 21.564 -2.419 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 2.007 23.419 -2.890 1.00 0.00 H new ATOM 0 HH2 TRP A 136 4.460 23.498 -3.058 1.00 0.00 H new ATOM 2050 N ILE A 137 -1.640 18.390 0.873 1.00 0.00 N ATOM 2051 CA ILE A 137 -2.914 17.759 1.212 1.00 0.00 C ATOM 2052 C ILE A 137 -3.995 18.818 1.415 1.00 0.00 C ATOM 2053 O ILE A 137 -5.100 18.692 0.892 1.00 0.00 O ATOM 2054 CB ILE A 137 -2.799 16.853 2.470 1.00 0.00 C ATOM 2055 CG1 ILE A 137 -1.896 15.651 2.172 1.00 0.00 C ATOM 2056 CG2 ILE A 137 -4.171 16.373 2.940 1.00 0.00 C ATOM 2057 CD1 ILE A 137 -2.467 14.700 1.138 1.00 0.00 C ATOM 0 H ILE A 137 -0.994 18.484 1.657 1.00 0.00 H new ATOM 0 HA ILE A 137 -3.194 17.120 0.375 1.00 0.00 H new ATOM 0 HB ILE A 137 -2.358 17.446 3.271 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -0.928 16.012 1.825 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -1.718 15.103 3.097 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -4.054 15.742 3.821 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -4.792 17.234 3.190 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -4.648 15.800 2.145 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -1.773 13.875 0.980 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -3.421 14.309 1.491 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -2.618 15.232 0.199 1.00 0.00 H new ATOM 2069 N HIS A 138 -3.672 19.867 2.171 1.00 0.00 N ATOM 2070 CA HIS A 138 -4.626 20.944 2.428 1.00 0.00 C ATOM 2071 C HIS A 138 -5.094 21.579 1.123 1.00 0.00 C ATOM 2072 O HIS A 138 -6.271 21.902 0.963 1.00 0.00 O ATOM 2073 CB HIS A 138 -4.005 22.019 3.328 1.00 0.00 C ATOM 2074 CG HIS A 138 -4.729 22.207 4.625 1.00 0.00 C ATOM 2075 ND1 HIS A 138 -5.926 21.588 4.913 1.00 0.00 N ATOM 2076 CD2 HIS A 138 -4.426 22.956 5.715 1.00 0.00 C ATOM 2077 CE1 HIS A 138 -6.330 21.945 6.118 1.00 0.00 C ATOM 2078 NE2 HIS A 138 -5.438 22.774 6.627 1.00 0.00 N ATOM 0 H HIS A 138 -2.762 19.993 2.614 1.00 0.00 H new ATOM 0 HA HIS A 138 -5.486 20.508 2.937 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -2.969 21.753 3.535 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -3.989 22.967 2.790 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -3.553 23.579 5.842 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -7.236 21.615 6.604 1.00 0.00 H new ATOM 0 HE2 HIS A 138 -5.491 23.209 7.548 1.00 0.00 H new ATOM 2086 N SER A 139 -4.162 21.758 0.194 1.00 0.00 N ATOM 2087 CA SER A 139 -4.474 22.360 -1.099 1.00 0.00 C ATOM 2088 C SER A 139 -5.580 21.586 -1.807 1.00 0.00 C ATOM 2089 O SER A 139 -6.670 22.110 -2.035 1.00 0.00 O ATOM 2090 CB SER A 139 -3.223 22.409 -1.979 1.00 0.00 C ATOM 2091 OG SER A 139 -2.409 21.266 -1.776 1.00 0.00 O ATOM 0 H SER A 139 -3.183 21.495 0.311 1.00 0.00 H new ATOM 0 HA SER A 139 -4.824 23.377 -0.923 1.00 0.00 H new ATOM 0 HB2 SER A 139 -3.515 22.470 -3.027 1.00 0.00 H new ATOM 0 HB3 SER A 139 -2.652 23.310 -1.754 1.00 0.00 H new ATOM 0 HG SER A 139 -1.706 21.240 -2.458 1.00 0.00 H new ATOM 2097 N SER A 140 -5.293 20.336 -2.151 1.00 0.00 N ATOM 2098 CA SER A 140 -6.266 19.488 -2.831 1.00 0.00 C ATOM 2099 C SER A 140 -7.324 18.970 -1.854 1.00 0.00 C ATOM 2100 O SER A 140 -8.318 18.369 -2.261 1.00 0.00 O ATOM 2101 CB SER A 140 -5.556 18.310 -3.503 1.00 0.00 C ATOM 2102 OG SER A 140 -5.820 18.283 -4.895 1.00 0.00 O ATOM 0 H SER A 140 -4.395 19.887 -1.971 1.00 0.00 H new ATOM 0 HA SER A 140 -6.767 20.089 -3.590 1.00 0.00 H new ATOM 0 HB2 SER A 140 -4.482 18.385 -3.335 1.00 0.00 H new ATOM 0 HB3 SER A 140 -5.886 17.376 -3.049 1.00 0.00 H new ATOM 0 HG SER A 140 -5.354 17.523 -5.302 1.00 0.00 H new ATOM 2108 N GLY A 141 -7.098 19.205 -0.566 1.00 0.00 N ATOM 2109 CA GLY A 141 -8.032 18.756 0.450 1.00 0.00 C ATOM 2110 C GLY A 141 -7.809 17.306 0.837 1.00 0.00 C ATOM 2111 O GLY A 141 -8.069 16.915 1.976 1.00 0.00 O ATOM 0 H GLY A 141 -6.282 19.700 -0.207 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -7.933 19.385 1.335 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -9.051 18.879 0.083 1.00 0.00 H new ATOM 2115 N GLY A 142 -7.332 16.507 -0.112 1.00 0.00 N ATOM 2116 CA GLY A 142 -7.079 15.116 0.138 1.00 0.00 C ATOM 2117 C GLY A 142 -7.273 14.288 -1.109 1.00 0.00 C ATOM 2118 O GLY A 142 -6.814 14.648 -2.195 1.00 0.00 O ATOM 0 H GLY A 142 -7.116 16.813 -1.061 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -6.060 14.990 0.505 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -7.747 14.758 0.922 1.00 0.00 H new ATOM 2122 N TRP A 143 -7.944 13.173 -0.933 1.00 0.00 N ATOM 2123 CA TRP A 143 -8.212 12.243 -2.026 1.00 0.00 C ATOM 2124 C TRP A 143 -9.343 12.750 -2.926 1.00 0.00 C ATOM 2125 O TRP A 143 -9.473 12.320 -4.070 1.00 0.00 O ATOM 2126 CB TRP A 143 -8.539 10.832 -1.495 1.00 0.00 C ATOM 2127 CG TRP A 143 -9.019 10.791 -0.074 1.00 0.00 C ATOM 2128 CD1 TRP A 143 -8.278 11.013 1.052 1.00 0.00 C ATOM 2129 CD2 TRP A 143 -10.346 10.496 0.370 1.00 0.00 C ATOM 2130 NE1 TRP A 143 -9.067 10.890 2.168 1.00 0.00 N ATOM 2131 CE2 TRP A 143 -10.342 10.568 1.776 1.00 0.00 C ATOM 2132 CE3 TRP A 143 -11.539 10.183 -0.286 1.00 0.00 C ATOM 2133 CZ2 TRP A 143 -11.487 10.335 2.536 1.00 0.00 C ATOM 2134 CZ3 TRP A 143 -12.673 9.952 0.468 1.00 0.00 C ATOM 2135 CH2 TRP A 143 -12.640 10.029 1.866 1.00 0.00 C ATOM 0 H TRP A 143 -8.322 12.878 -0.033 1.00 0.00 H new ATOM 0 HA TRP A 143 -7.303 12.180 -2.625 1.00 0.00 H new ATOM 0 HB2 TRP A 143 -9.301 10.386 -2.134 1.00 0.00 H new ATOM 0 HB3 TRP A 143 -7.647 10.211 -1.581 1.00 0.00 H new ATOM 0 HD1 TRP A 143 -7.225 11.251 1.062 1.00 0.00 H new ATOM 0 HE1 TRP A 143 -8.757 11.017 3.131 1.00 0.00 H new ATOM 0 HE3 TRP A 143 -11.574 10.123 -1.364 1.00 0.00 H new ATOM 0 HZ2 TRP A 143 -11.465 10.394 3.614 1.00 0.00 H new ATOM 0 HZ3 TRP A 143 -13.600 9.708 -0.029 1.00 0.00 H new ATOM 0 HH2 TRP A 143 -13.544 9.843 2.427 1.00 0.00 H new ATOM 2146 N ALA A 144 -10.154 13.672 -2.407 1.00 0.00 N ATOM 2147 CA ALA A 144 -11.269 14.240 -3.168 1.00 0.00 C ATOM 2148 C ALA A 144 -10.882 14.516 -4.620 1.00 0.00 C ATOM 2149 O ALA A 144 -11.443 13.927 -5.544 1.00 0.00 O ATOM 2150 CB ALA A 144 -11.760 15.517 -2.505 1.00 0.00 C ATOM 0 H ALA A 144 -10.060 14.042 -1.461 1.00 0.00 H new ATOM 0 HA ALA A 144 -12.073 13.504 -3.174 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -12.589 15.930 -3.080 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -12.096 15.295 -1.492 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -10.948 16.243 -2.467 1.00 0.00 H new ATOM 2156 N GLU A 145 -9.923 15.415 -4.815 1.00 0.00 N ATOM 2157 CA GLU A 145 -9.464 15.764 -6.154 1.00 0.00 C ATOM 2158 C GLU A 145 -9.053 14.515 -6.933 1.00 0.00 C ATOM 2159 O GLU A 145 -9.110 14.492 -8.162 1.00 0.00 O ATOM 2160 CB GLU A 145 -8.295 16.747 -6.074 1.00 0.00 C ATOM 2161 CG GLU A 145 -8.731 18.193 -5.880 1.00 0.00 C ATOM 2162 CD GLU A 145 -8.114 19.135 -6.897 1.00 0.00 C ATOM 2163 OE1 GLU A 145 -7.127 18.740 -7.552 1.00 0.00 O ATOM 2164 OE2 GLU A 145 -8.620 20.269 -7.038 1.00 0.00 O ATOM 0 H GLU A 145 -9.449 15.915 -4.063 1.00 0.00 H new ATOM 0 HA GLU A 145 -10.289 16.240 -6.684 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -7.643 16.458 -5.249 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -7.705 16.673 -6.987 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -9.817 18.252 -5.949 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -8.457 18.519 -4.877 1.00 0.00 H new ATOM 2171 N PHE A 146 -8.649 13.472 -6.208 1.00 0.00 N ATOM 2172 CA PHE A 146 -8.242 12.219 -6.836 1.00 0.00 C ATOM 2173 C PHE A 146 -9.464 11.414 -7.271 1.00 0.00 C ATOM 2174 O PHE A 146 -9.540 10.950 -8.409 1.00 0.00 O ATOM 2175 CB PHE A 146 -7.368 11.392 -5.874 1.00 0.00 C ATOM 2176 CG PHE A 146 -7.837 9.973 -5.668 1.00 0.00 C ATOM 2177 CD1 PHE A 146 -7.539 8.978 -6.586 1.00 0.00 C ATOM 2178 CD2 PHE A 146 -8.578 9.641 -4.552 1.00 0.00 C ATOM 2179 CE1 PHE A 146 -7.976 7.679 -6.387 1.00 0.00 C ATOM 2180 CE2 PHE A 146 -9.015 8.350 -4.348 1.00 0.00 C ATOM 2181 CZ PHE A 146 -8.717 7.366 -5.262 1.00 0.00 C ATOM 0 H PHE A 146 -8.596 13.471 -5.189 1.00 0.00 H new ATOM 0 HA PHE A 146 -7.653 12.456 -7.722 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -6.347 11.372 -6.256 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -7.337 11.895 -4.908 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -6.960 9.218 -7.465 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -8.819 10.405 -3.827 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -7.739 6.912 -7.109 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -9.593 8.110 -3.468 1.00 0.00 H new ATOM 0 HZ PHE A 146 -9.060 6.354 -5.102 1.00 0.00 H new ATOM 2191 N THR A 147 -10.413 11.240 -6.354 1.00 0.00 N ATOM 2192 CA THR A 147 -11.619 10.475 -6.648 1.00 0.00 C ATOM 2193 C THR A 147 -12.295 10.978 -7.918 1.00 0.00 C ATOM 2194 O THR A 147 -12.904 10.210 -8.663 1.00 0.00 O ATOM 2195 CB THR A 147 -12.600 10.527 -5.477 1.00 0.00 C ATOM 2196 OG1 THR A 147 -11.951 10.194 -4.262 1.00 0.00 O ATOM 2197 CG2 THR A 147 -13.772 9.583 -5.649 1.00 0.00 C ATOM 0 H THR A 147 -10.370 11.616 -5.407 1.00 0.00 H new ATOM 0 HA THR A 147 -11.318 9.439 -6.805 1.00 0.00 H new ATOM 0 HB THR A 147 -12.974 11.551 -5.451 1.00 0.00 H new ATOM 0 HG1 THR A 147 -11.081 9.787 -4.457 1.00 0.00 H new ATOM 0 HG21 THR A 147 -14.434 9.664 -4.787 1.00 0.00 H new ATOM 0 HG22 THR A 147 -14.321 9.845 -6.554 1.00 0.00 H new ATOM 0 HG23 THR A 147 -13.406 8.560 -5.730 1.00 0.00 H new ATOM 2205 N ALA A 148 -12.180 12.270 -8.161 1.00 0.00 N ATOM 2206 CA ALA A 148 -12.775 12.874 -9.346 1.00 0.00 C ATOM 2207 C ALA A 148 -11.792 12.867 -10.512 1.00 0.00 C ATOM 2208 O ALA A 148 -12.175 12.628 -11.658 1.00 0.00 O ATOM 2209 CB ALA A 148 -13.240 14.292 -9.052 1.00 0.00 C ATOM 0 H ALA A 148 -11.682 12.923 -7.557 1.00 0.00 H new ATOM 0 HA ALA A 148 -13.643 12.278 -9.627 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -13.681 14.724 -9.950 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -13.984 14.273 -8.256 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -12.389 14.897 -8.739 1.00 0.00 H new ATOM 2215 N LEU A 149 -10.527 13.142 -10.211 1.00 0.00 N ATOM 2216 CA LEU A 149 -9.485 13.179 -11.232 1.00 0.00 C ATOM 2217 C LEU A 149 -9.350 11.839 -11.945 1.00 0.00 C ATOM 2218 O LEU A 149 -9.209 11.792 -13.165 1.00 0.00 O ATOM 2219 CB LEU A 149 -8.144 13.568 -10.613 1.00 0.00 C ATOM 2220 CG LEU A 149 -6.965 13.556 -11.588 1.00 0.00 C ATOM 2221 CD1 LEU A 149 -6.524 14.974 -11.911 1.00 0.00 C ATOM 2222 CD2 LEU A 149 -5.807 12.746 -11.024 1.00 0.00 C ATOM 0 H LEU A 149 -10.198 13.343 -9.267 1.00 0.00 H new ATOM 0 HA LEU A 149 -9.776 13.929 -11.967 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -8.233 14.566 -10.183 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -7.926 12.885 -9.792 1.00 0.00 H new ATOM 0 HG LEU A 149 -7.291 13.081 -12.513 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -5.685 14.945 -12.606 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -7.352 15.518 -12.365 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -6.218 15.478 -10.994 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -4.980 12.751 -11.734 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -5.480 13.186 -10.082 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -6.131 11.720 -10.852 1.00 0.00 H new ATOM 2234 N TYR A 150 -9.370 10.753 -11.181 1.00 0.00 N ATOM 2235 CA TYR A 150 -9.222 9.421 -11.753 1.00 0.00 C ATOM 2236 C TYR A 150 -10.576 8.831 -12.145 1.00 0.00 C ATOM 2237 O TYR A 150 -10.778 7.618 -12.076 1.00 0.00 O ATOM 2238 CB TYR A 150 -8.503 8.500 -10.754 1.00 0.00 C ATOM 2239 CG TYR A 150 -9.406 7.860 -9.714 1.00 0.00 C ATOM 2240 CD1 TYR A 150 -10.603 8.457 -9.328 1.00 0.00 C ATOM 2241 CD2 TYR A 150 -9.060 6.654 -9.121 1.00 0.00 C ATOM 2242 CE1 TYR A 150 -11.421 7.868 -8.386 1.00 0.00 C ATOM 2243 CE2 TYR A 150 -9.875 6.063 -8.176 1.00 0.00 C ATOM 2244 CZ TYR A 150 -11.055 6.676 -7.815 1.00 0.00 C ATOM 2245 OH TYR A 150 -11.875 6.099 -6.876 1.00 0.00 O ATOM 0 H TYR A 150 -9.487 10.769 -10.168 1.00 0.00 H new ATOM 0 HA TYR A 150 -8.622 9.503 -12.659 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -7.996 7.711 -11.309 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -7.732 9.075 -10.241 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.896 9.396 -9.773 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -8.137 6.169 -9.404 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -12.347 8.344 -8.099 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -9.589 5.126 -7.722 1.00 0.00 H new ATOM 0 HH TYR A 150 -12.620 5.648 -7.325 1.00 0.00 H new ATOM 2255 N GLY A 151 -11.497 9.694 -12.558 1.00 0.00 N ATOM 2256 CA GLY A 151 -12.812 9.235 -12.953 1.00 0.00 C ATOM 2257 C GLY A 151 -12.783 8.478 -14.265 1.00 0.00 C ATOM 2258 O GLY A 151 -13.439 7.447 -14.410 1.00 0.00 O ATOM 0 H GLY A 151 -11.355 10.702 -12.626 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -13.220 8.592 -12.173 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -13.482 10.090 -13.044 1.00 0.00 H new ATOM 2262 N ASP A 152 -12.018 8.992 -15.222 1.00 0.00 N ATOM 2263 CA ASP A 152 -11.905 8.359 -16.530 1.00 0.00 C ATOM 2264 C ASP A 152 -10.478 8.454 -17.060 1.00 0.00 C ATOM 2265 O ASP A 152 -9.913 9.543 -17.158 1.00 0.00 O ATOM 2266 CB ASP A 152 -12.875 9.011 -17.518 1.00 0.00 C ATOM 2267 CG ASP A 152 -13.880 8.024 -18.076 1.00 0.00 C ATOM 2268 OD1 ASP A 152 -14.876 7.734 -17.381 1.00 0.00 O ATOM 2269 OD2 ASP A 152 -13.671 7.541 -19.209 1.00 0.00 O ATOM 0 H ASP A 152 -11.468 9.844 -15.116 1.00 0.00 H new ATOM 0 HA ASP A 152 -12.161 7.305 -16.421 1.00 0.00 H new ATOM 0 HB2 ASP A 152 -13.405 9.823 -17.020 1.00 0.00 H new ATOM 0 HB3 ASP A 152 -12.311 9.454 -18.339 1.00 0.00 H new ATOM 2274 N GLY A 153 -9.903 7.308 -17.402 1.00 0.00 N ATOM 2275 CA GLY A 153 -8.549 7.284 -17.919 1.00 0.00 C ATOM 2276 C GLY A 153 -7.971 5.885 -17.956 1.00 0.00 C ATOM 2277 O GLY A 153 -8.058 5.146 -16.975 1.00 0.00 O ATOM 0 H GLY A 153 -10.351 6.394 -17.330 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -8.539 7.705 -18.924 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -7.915 7.920 -17.301 1.00 0.00 H new ATOM 2281 N ALA A 154 -7.375 5.517 -19.089 1.00 0.00 N ATOM 2282 CA ALA A 154 -6.780 4.197 -19.244 1.00 0.00 C ATOM 2283 C ALA A 154 -5.882 3.865 -18.063 1.00 0.00 C ATOM 2284 O ALA A 154 -5.062 4.681 -17.639 1.00 0.00 O ATOM 2285 CB ALA A 154 -5.998 4.115 -20.546 1.00 0.00 C ATOM 0 H ALA A 154 -7.293 6.116 -19.911 1.00 0.00 H new ATOM 0 HA ALA A 154 -7.585 3.463 -19.276 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -5.560 3.122 -20.646 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -6.668 4.302 -21.385 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -5.205 4.862 -20.542 1.00 0.00 H new ATOM 2291 N LEU A 155 -6.043 2.663 -17.536 1.00 0.00 N ATOM 2292 CA LEU A 155 -5.247 2.220 -16.399 1.00 0.00 C ATOM 2293 C LEU A 155 -3.768 2.160 -16.783 1.00 0.00 C ATOM 2294 O LEU A 155 -2.921 2.767 -16.131 1.00 0.00 O ATOM 2295 CB LEU A 155 -5.722 0.850 -15.884 1.00 0.00 C ATOM 2296 CG LEU A 155 -7.212 0.529 -16.094 1.00 0.00 C ATOM 2297 CD1 LEU A 155 -7.377 -0.816 -16.788 1.00 0.00 C ATOM 2298 CD2 LEU A 155 -7.960 0.536 -14.767 1.00 0.00 C ATOM 0 H LEU A 155 -6.716 1.976 -17.875 1.00 0.00 H new ATOM 0 HA LEU A 155 -5.377 2.943 -15.594 1.00 0.00 H new ATOM 0 HB2 LEU A 155 -5.132 0.076 -16.374 1.00 0.00 H new ATOM 0 HB3 LEU A 155 -5.505 0.790 -14.818 1.00 0.00 H new ATOM 0 HG LEU A 155 -7.638 1.303 -16.732 1.00 0.00 H new ATOM 0 HD11 LEU A 155 -8.437 -1.026 -16.928 1.00 0.00 H new ATOM 0 HD12 LEU A 155 -6.882 -0.788 -17.759 1.00 0.00 H new ATOM 0 HD13 LEU A 155 -6.930 -1.599 -16.175 1.00 0.00 H new ATOM 0 HD21 LEU A 155 -9.011 0.307 -14.941 1.00 0.00 H new ATOM 0 HD22 LEU A 155 -7.530 -0.214 -14.103 1.00 0.00 H new ATOM 0 HD23 LEU A 155 -7.875 1.520 -14.306 1.00 0.00 H new ATOM 2310 N GLU A 156 -3.465 1.432 -17.855 1.00 0.00 N ATOM 2311 CA GLU A 156 -2.089 1.299 -18.334 1.00 0.00 C ATOM 2312 C GLU A 156 -1.384 2.656 -18.403 1.00 0.00 C ATOM 2313 O GLU A 156 -0.160 2.736 -18.286 1.00 0.00 O ATOM 2314 CB GLU A 156 -2.068 0.632 -19.712 1.00 0.00 C ATOM 2315 CG GLU A 156 -3.039 1.248 -20.707 1.00 0.00 C ATOM 2316 CD GLU A 156 -3.483 0.263 -21.770 1.00 0.00 C ATOM 2317 OE1 GLU A 156 -3.915 -0.851 -21.405 1.00 0.00 O ATOM 2318 OE2 GLU A 156 -3.400 0.606 -22.968 1.00 0.00 O ATOM 0 H GLU A 156 -4.154 0.924 -18.410 1.00 0.00 H new ATOM 0 HA GLU A 156 -1.551 0.674 -17.621 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -1.059 0.692 -20.119 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -2.303 -0.426 -19.597 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -3.913 1.621 -20.173 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -2.568 2.107 -21.186 1.00 0.00 H new ATOM 2325 N GLU A 157 -2.162 3.717 -18.590 1.00 0.00 N ATOM 2326 CA GLU A 157 -1.613 5.069 -18.670 1.00 0.00 C ATOM 2327 C GLU A 157 -1.063 5.507 -17.316 1.00 0.00 C ATOM 2328 O GLU A 157 0.143 5.712 -17.150 1.00 0.00 O ATOM 2329 CB GLU A 157 -2.697 6.048 -19.128 1.00 0.00 C ATOM 2330 CG GLU A 157 -2.218 7.050 -20.168 1.00 0.00 C ATOM 2331 CD GLU A 157 -2.204 8.473 -19.643 1.00 0.00 C ATOM 2332 OE1 GLU A 157 -1.683 8.689 -18.528 1.00 0.00 O ATOM 2333 OE2 GLU A 157 -2.712 9.372 -20.346 1.00 0.00 O ATOM 0 H GLU A 157 -3.176 3.668 -18.689 1.00 0.00 H new ATOM 0 HA GLU A 157 -0.798 5.067 -19.394 1.00 0.00 H new ATOM 0 HB2 GLU A 157 -3.534 5.483 -19.539 1.00 0.00 H new ATOM 0 HB3 GLU A 157 -3.074 6.590 -18.261 1.00 0.00 H new ATOM 0 HG2 GLU A 157 -1.215 6.777 -20.495 1.00 0.00 H new ATOM 0 HG3 GLU A 157 -2.864 6.996 -21.044 1.00 0.00 H new ATOM 2340 N ALA A 158 -1.964 5.648 -16.350 1.00 0.00 N ATOM 2341 CA ALA A 158 -1.592 6.062 -15.006 1.00 0.00 C ATOM 2342 C ALA A 158 -0.466 5.191 -14.450 1.00 0.00 C ATOM 2343 O ALA A 158 0.435 5.691 -13.776 1.00 0.00 O ATOM 2344 CB ALA A 158 -2.807 6.026 -14.090 1.00 0.00 C ATOM 0 H ALA A 158 -2.962 5.480 -16.476 1.00 0.00 H new ATOM 0 HA ALA A 158 -1.222 7.086 -15.055 1.00 0.00 H new ATOM 0 HB1 ALA A 158 -2.516 6.338 -13.087 1.00 0.00 H new ATOM 0 HB2 ALA A 158 -3.571 6.702 -14.473 1.00 0.00 H new ATOM 0 HB3 ALA A 158 -3.205 5.012 -14.053 1.00 0.00 H new ATOM 2350 N ARG A 159 -0.510 3.887 -14.739 1.00 0.00 N ATOM 2351 CA ARG A 159 0.530 2.977 -14.259 1.00 0.00 C ATOM 2352 C ARG A 159 1.895 3.424 -14.747 1.00 0.00 C ATOM 2353 O ARG A 159 2.736 3.856 -13.961 1.00 0.00 O ATOM 2354 CB ARG A 159 0.294 1.538 -14.728 1.00 0.00 C ATOM 2355 CG ARG A 159 1.254 0.533 -14.102 1.00 0.00 C ATOM 2356 CD ARG A 159 1.317 0.658 -12.581 1.00 0.00 C ATOM 2357 NE ARG A 159 2.435 -0.107 -12.019 1.00 0.00 N ATOM 2358 CZ ARG A 159 2.690 -0.214 -10.715 1.00 0.00 C ATOM 2359 NH1 ARG A 159 1.894 0.356 -9.828 1.00 0.00 N ATOM 2360 NH2 ARG A 159 3.733 -0.913 -10.300 1.00 0.00 N ATOM 0 H ARG A 159 -1.243 3.445 -15.294 1.00 0.00 H new ATOM 0 HA ARG A 159 0.490 3.003 -13.170 1.00 0.00 H new ATOM 0 HB2 ARG A 159 -0.730 1.249 -14.489 1.00 0.00 H new ATOM 0 HB3 ARG A 159 0.392 1.496 -15.813 1.00 0.00 H new ATOM 0 HG2 ARG A 159 0.943 -0.477 -14.368 1.00 0.00 H new ATOM 0 HG3 ARG A 159 2.251 0.679 -14.518 1.00 0.00 H new ATOM 0 HD2 ARG A 159 1.420 1.708 -12.306 1.00 0.00 H new ATOM 0 HD3 ARG A 159 0.381 0.306 -12.148 1.00 0.00 H new ATOM 0 HE ARG A 159 3.058 -0.588 -12.668 1.00 0.00 H new ATOM 0 HH11 ARG A 159 1.078 0.882 -10.139 1.00 0.00 H new ATOM 0 HH12 ARG A 159 2.096 0.270 -8.832 1.00 0.00 H new ATOM 0 HH21 ARG A 159 4.343 -1.370 -10.978 1.00 0.00 H new ATOM 0 HH22 ARG A 159 3.928 -0.995 -9.302 1.00 0.00 H new ATOM 2374 N ARG A 160 2.107 3.296 -16.057 1.00 0.00 N ATOM 2375 CA ARG A 160 3.369 3.667 -16.678 1.00 0.00 C ATOM 2376 C ARG A 160 3.921 4.948 -16.079 1.00 0.00 C ATOM 2377 O ARG A 160 5.131 5.124 -15.964 1.00 0.00 O ATOM 2378 CB ARG A 160 3.186 3.819 -18.185 1.00 0.00 C ATOM 2379 CG ARG A 160 4.471 3.629 -18.971 1.00 0.00 C ATOM 2380 CD ARG A 160 4.346 2.509 -19.993 1.00 0.00 C ATOM 2381 NE ARG A 160 5.064 1.306 -19.576 1.00 0.00 N ATOM 2382 CZ ARG A 160 5.468 0.356 -20.417 1.00 0.00 C ATOM 2383 NH1 ARG A 160 5.226 0.462 -21.717 1.00 0.00 N ATOM 2384 NH2 ARG A 160 6.118 -0.703 -19.956 1.00 0.00 N ATOM 0 H ARG A 160 1.411 2.934 -16.710 1.00 0.00 H new ATOM 0 HA ARG A 160 4.090 2.872 -16.486 1.00 0.00 H new ATOM 0 HB2 ARG A 160 2.448 3.094 -18.529 1.00 0.00 H new ATOM 0 HB3 ARG A 160 2.783 4.809 -18.396 1.00 0.00 H new ATOM 0 HG2 ARG A 160 4.727 4.558 -19.479 1.00 0.00 H new ATOM 0 HG3 ARG A 160 5.288 3.406 -18.285 1.00 0.00 H new ATOM 0 HD2 ARG A 160 3.293 2.270 -20.142 1.00 0.00 H new ATOM 0 HD3 ARG A 160 4.735 2.849 -20.953 1.00 0.00 H new ATOM 0 HE ARG A 160 5.267 1.187 -18.584 1.00 0.00 H new ATOM 0 HH11 ARG A 160 4.727 1.275 -22.078 1.00 0.00 H new ATOM 0 HH12 ARG A 160 5.539 -0.270 -22.355 1.00 0.00 H new ATOM 0 HH21 ARG A 160 6.308 -0.790 -18.958 1.00 0.00 H new ATOM 0 HH22 ARG A 160 6.428 -1.431 -20.600 1.00 0.00 H new ATOM 2398 N LEU A 161 3.020 5.830 -15.682 1.00 0.00 N ATOM 2399 CA LEU A 161 3.411 7.089 -15.073 1.00 0.00 C ATOM 2400 C LEU A 161 4.026 6.853 -13.694 1.00 0.00 C ATOM 2401 O LEU A 161 5.169 7.230 -13.438 1.00 0.00 O ATOM 2402 CB LEU A 161 2.204 8.015 -14.949 1.00 0.00 C ATOM 2403 CG LEU A 161 2.522 9.421 -14.445 1.00 0.00 C ATOM 2404 CD1 LEU A 161 2.879 10.332 -15.609 1.00 0.00 C ATOM 2405 CD2 LEU A 161 1.346 9.984 -13.660 1.00 0.00 C ATOM 0 H LEU A 161 2.013 5.697 -15.771 1.00 0.00 H new ATOM 0 HA LEU A 161 4.157 7.560 -15.713 1.00 0.00 H new ATOM 0 HB2 LEU A 161 1.723 8.094 -15.924 1.00 0.00 H new ATOM 0 HB3 LEU A 161 1.481 7.557 -14.274 1.00 0.00 H new ATOM 0 HG LEU A 161 3.382 9.365 -13.777 1.00 0.00 H new ATOM 0 HD11 LEU A 161 3.103 11.331 -15.234 1.00 0.00 H new ATOM 0 HD12 LEU A 161 3.752 9.935 -16.128 1.00 0.00 H new ATOM 0 HD13 LEU A 161 2.038 10.384 -16.301 1.00 0.00 H new ATOM 0 HD21 LEU A 161 1.590 10.986 -13.308 1.00 0.00 H new ATOM 0 HD22 LEU A 161 0.467 10.029 -14.303 1.00 0.00 H new ATOM 0 HD23 LEU A 161 1.137 9.340 -12.805 1.00 0.00 H new ATOM 2417 N ARG A 162 3.254 6.230 -12.810 1.00 0.00 N ATOM 2418 CA ARG A 162 3.715 5.949 -11.452 1.00 0.00 C ATOM 2419 C ARG A 162 4.939 5.045 -11.448 1.00 0.00 C ATOM 2420 O ARG A 162 5.980 5.402 -10.899 1.00 0.00 O ATOM 2421 CB ARG A 162 2.602 5.310 -10.637 1.00 0.00 C ATOM 2422 CG ARG A 162 2.006 6.248 -9.610 1.00 0.00 C ATOM 2423 CD ARG A 162 0.566 5.895 -9.293 1.00 0.00 C ATOM 2424 NE ARG A 162 0.031 4.870 -10.186 1.00 0.00 N ATOM 2425 CZ ARG A 162 0.200 3.567 -9.997 1.00 0.00 C ATOM 2426 NH1 ARG A 162 0.916 3.128 -8.973 1.00 0.00 N ATOM 2427 NH2 ARG A 162 -0.323 2.703 -10.852 1.00 0.00 N ATOM 0 H ARG A 162 2.306 5.909 -13.008 1.00 0.00 H new ATOM 0 HA ARG A 162 3.996 6.900 -11.000 1.00 0.00 H new ATOM 0 HB2 ARG A 162 1.815 4.971 -11.311 1.00 0.00 H new ATOM 0 HB3 ARG A 162 2.991 4.427 -10.131 1.00 0.00 H new ATOM 0 HG2 ARG A 162 2.599 6.210 -8.696 1.00 0.00 H new ATOM 0 HG3 ARG A 162 2.056 7.272 -9.981 1.00 0.00 H new ATOM 0 HD2 ARG A 162 0.500 5.545 -8.263 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -0.049 6.792 -9.365 1.00 0.00 H new ATOM 0 HE ARG A 162 -0.503 5.173 -11.001 1.00 0.00 H new ATOM 0 HH11 ARG A 162 1.340 3.792 -8.325 1.00 0.00 H new ATOM 0 HH12 ARG A 162 1.043 2.126 -8.832 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -0.855 3.039 -11.655 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -0.194 1.701 -10.708 1.00 0.00 H new ATOM 2441 N GLU A 163 4.815 3.875 -12.063 1.00 0.00 N ATOM 2442 CA GLU A 163 5.924 2.938 -12.123 1.00 0.00 C ATOM 2443 C GLU A 163 7.016 3.467 -13.045 1.00 0.00 C ATOM 2444 O GLU A 163 8.142 2.974 -13.040 1.00 0.00 O ATOM 2445 CB GLU A 163 5.439 1.573 -12.606 1.00 0.00 C ATOM 2446 CG GLU A 163 6.254 0.413 -12.060 1.00 0.00 C ATOM 2447 CD GLU A 163 7.060 -0.296 -13.132 1.00 0.00 C ATOM 2448 OE1 GLU A 163 6.794 -0.062 -14.330 1.00 0.00 O ATOM 2449 OE2 GLU A 163 7.956 -1.087 -12.772 1.00 0.00 O ATOM 0 H GLU A 163 3.963 3.556 -12.524 1.00 0.00 H new ATOM 0 HA GLU A 163 6.339 2.826 -11.121 1.00 0.00 H new ATOM 0 HB2 GLU A 163 4.396 1.443 -12.316 1.00 0.00 H new ATOM 0 HB3 GLU A 163 5.472 1.549 -13.695 1.00 0.00 H new ATOM 0 HG2 GLU A 163 6.930 0.781 -11.288 1.00 0.00 H new ATOM 0 HG3 GLU A 163 5.584 -0.302 -11.583 1.00 0.00 H new ATOM 2456 N GLY A 164 6.672 4.480 -13.835 1.00 0.00 N ATOM 2457 CA GLY A 164 7.631 5.065 -14.747 1.00 0.00 C ATOM 2458 C GLY A 164 8.724 5.817 -14.020 1.00 0.00 C ATOM 2459 O GLY A 164 9.890 5.427 -14.068 1.00 0.00 O ATOM 0 H GLY A 164 5.745 4.904 -13.858 1.00 0.00 H new ATOM 0 HA2 GLY A 164 8.077 4.279 -15.357 1.00 0.00 H new ATOM 0 HA3 GLY A 164 7.116 5.743 -15.428 1.00 0.00 H new ATOM 2463 N ASN A 165 8.344 6.893 -13.340 1.00 0.00 N ATOM 2464 CA ASN A 165 9.300 7.702 -12.595 1.00 0.00 C ATOM 2465 C ASN A 165 9.904 6.906 -11.444 1.00 0.00 C ATOM 2466 O ASN A 165 11.103 6.993 -11.181 1.00 0.00 O ATOM 2467 CB ASN A 165 8.627 8.971 -12.067 1.00 0.00 C ATOM 2468 CG ASN A 165 7.888 9.725 -13.154 1.00 0.00 C ATOM 2469 OD1 ASN A 165 7.109 9.144 -13.910 1.00 0.00 O ATOM 2470 ND2 ASN A 165 8.130 11.028 -13.242 1.00 0.00 N ATOM 0 H ASN A 165 7.381 7.225 -13.290 1.00 0.00 H new ATOM 0 HA ASN A 165 10.105 7.988 -13.272 1.00 0.00 H new ATOM 0 HB2 ASN A 165 7.929 8.706 -11.273 1.00 0.00 H new ATOM 0 HB3 ASN A 165 9.381 9.622 -11.624 1.00 0.00 H new ATOM 0 HD21 ASN A 165 7.663 11.586 -13.956 1.00 0.00 H new ATOM 0 HD22 ASN A 165 8.783 11.470 -12.595 1.00 0.00 H new ATOM 2477 N TRP A 166 9.070 6.130 -10.759 1.00 0.00 N ATOM 2478 CA TRP A 166 9.532 5.322 -9.639 1.00 0.00 C ATOM 2479 C TRP A 166 10.566 4.301 -10.092 1.00 0.00 C ATOM 2480 O TRP A 166 11.726 4.356 -9.683 1.00 0.00 O ATOM 2481 CB TRP A 166 8.354 4.613 -8.976 1.00 0.00 C ATOM 2482 CG TRP A 166 7.618 5.489 -8.016 1.00 0.00 C ATOM 2483 CD1 TRP A 166 7.379 6.826 -8.146 1.00 0.00 C ATOM 2484 CD2 TRP A 166 7.032 5.093 -6.775 1.00 0.00 C ATOM 2485 NE1 TRP A 166 6.681 7.287 -7.058 1.00 0.00 N ATOM 2486 CE2 TRP A 166 6.456 6.241 -6.202 1.00 0.00 C ATOM 2487 CE3 TRP A 166 6.939 3.877 -6.092 1.00 0.00 C ATOM 2488 CZ2 TRP A 166 5.796 6.208 -4.978 1.00 0.00 C ATOM 2489 CZ3 TRP A 166 6.282 3.845 -4.877 1.00 0.00 C ATOM 2490 CH2 TRP A 166 5.717 5.005 -4.331 1.00 0.00 C ATOM 0 H TRP A 166 8.074 6.045 -10.960 1.00 0.00 H new ATOM 0 HA TRP A 166 10.002 5.987 -8.914 1.00 0.00 H new ATOM 0 HB2 TRP A 166 7.665 4.266 -9.746 1.00 0.00 H new ATOM 0 HB3 TRP A 166 8.716 3.730 -8.450 1.00 0.00 H new ATOM 0 HD1 TRP A 166 7.693 7.433 -8.983 1.00 0.00 H new ATOM 0 HE1 TRP A 166 6.379 8.250 -6.911 1.00 0.00 H new ATOM 0 HE3 TRP A 166 7.373 2.979 -6.506 1.00 0.00 H new ATOM 0 HZ2 TRP A 166 5.361 7.101 -4.553 1.00 0.00 H new ATOM 0 HZ3 TRP A 166 6.203 2.911 -4.340 1.00 0.00 H new ATOM 0 HH2 TRP A 166 5.209 4.948 -3.380 1.00 0.00 H new ATOM 2501 N ALA A 167 10.143 3.370 -10.940 1.00 0.00 N ATOM 2502 CA ALA A 167 11.039 2.340 -11.444 1.00 0.00 C ATOM 2503 C ALA A 167 12.192 2.944 -12.245 1.00 0.00 C ATOM 2504 O ALA A 167 13.174 2.261 -12.535 1.00 0.00 O ATOM 2505 CB ALA A 167 10.274 1.331 -12.286 1.00 0.00 C ATOM 0 H ALA A 167 9.187 3.309 -11.291 1.00 0.00 H new ATOM 0 HA ALA A 167 11.467 1.824 -10.585 1.00 0.00 H new ATOM 0 HB1 ALA A 167 10.961 0.569 -12.654 1.00 0.00 H new ATOM 0 HB2 ALA A 167 9.502 0.860 -11.677 1.00 0.00 H new ATOM 0 HB3 ALA A 167 9.810 1.840 -13.131 1.00 0.00 H new ATOM 2511 N SER A 168 12.082 4.230 -12.591 1.00 0.00 N ATOM 2512 CA SER A 168 13.136 4.912 -13.344 1.00 0.00 C ATOM 2513 C SER A 168 14.420 5.045 -12.521 1.00 0.00 C ATOM 2514 O SER A 168 15.313 5.814 -12.876 1.00 0.00 O ATOM 2515 CB SER A 168 12.667 6.303 -13.785 1.00 0.00 C ATOM 2516 OG SER A 168 12.816 6.477 -15.185 1.00 0.00 O ATOM 0 H SER A 168 11.279 4.816 -12.363 1.00 0.00 H new ATOM 0 HA SER A 168 13.351 4.304 -14.223 1.00 0.00 H new ATOM 0 HB2 SER A 168 11.622 6.441 -13.508 1.00 0.00 H new ATOM 0 HB3 SER A 168 13.240 7.066 -13.258 1.00 0.00 H new ATOM 0 HG SER A 168 12.508 7.372 -15.438 1.00 0.00 H new ATOM 2522 N VAL A 169 14.512 4.298 -11.423 1.00 0.00 N ATOM 2523 CA VAL A 169 15.683 4.337 -10.563 1.00 0.00 C ATOM 2524 C VAL A 169 16.965 4.132 -11.363 1.00 0.00 C ATOM 2525 O VAL A 169 17.103 3.158 -12.103 1.00 0.00 O ATOM 2526 CB VAL A 169 15.592 3.261 -9.465 1.00 0.00 C ATOM 2527 CG1 VAL A 169 14.427 3.553 -8.530 1.00 0.00 C ATOM 2528 CG2 VAL A 169 15.457 1.872 -10.078 1.00 0.00 C ATOM 0 H VAL A 169 13.783 3.657 -11.110 1.00 0.00 H new ATOM 0 HA VAL A 169 15.711 5.324 -10.100 1.00 0.00 H new ATOM 0 HB VAL A 169 16.514 3.285 -8.884 1.00 0.00 H new ATOM 0 HG11 VAL A 169 14.377 2.783 -7.760 1.00 0.00 H new ATOM 0 HG12 VAL A 169 14.572 4.526 -8.061 1.00 0.00 H new ATOM 0 HG13 VAL A 169 13.497 3.559 -9.098 1.00 0.00 H new ATOM 0 HG21 VAL A 169 15.394 1.128 -9.284 1.00 0.00 H new ATOM 0 HG22 VAL A 169 14.554 1.829 -10.687 1.00 0.00 H new ATOM 0 HG23 VAL A 169 16.326 1.664 -10.702 1.00 0.00 H new