USER MOD reduce.3.24.130724 H: found=0, std=0, add=1032, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1032 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 107 TYR OH : rot -80:sc= -3.53! USER MOD Set 1.2: A 111 CYS SG : rot 77:sc= -1.49! USER MOD Set 1.3: A 115 ASN : amide:sc= -0.228 K(o=-5.2,f=-7!) USER MOD Set 2.1: A 36 MET CE :methyl 154:sc= -3.28! (180deg=-6.5!) USER MOD Set 2.2: A 41 THR OG1 : rot 55:sc= 1.32 USER MOD Single : A 9 GLN :FLIP amide:sc= -1.85 F(o=-3.5!,f=-1.9) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -0.478 K(o=-0.48,f=-1.1) USER MOD Single : A 15 GLN :FLIP amide:sc= -0.135 F(o=-2.4!,f=-0.14) USER MOD Single : A 17 TYR OH : rot -90:sc= 0.429 USER MOD Single : A 20 ASN : amide:sc= -2.89! C(o=-2.9!,f=-3.6!) USER MOD Single : A 24 LYS NZ :NH3+ 164:sc= -0.0216 (180deg=-0.371) USER MOD Single : A 26 LYS NZ :NH3+ -171:sc= 0.846 (180deg=0.72) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -1.66 X(o=-1.7,f=-1.6) USER MOD Single : A 38 LYS NZ :NH3+ -140:sc= -2.2 (180deg=-3.18!) USER MOD Single : A 44 ASN : amide:sc=-0.00546 K(o=-0.0055,f=-1.1) USER MOD Single : A 49 MET CE :methyl 162:sc= -0.211 (180deg=-0.616) USER MOD Single : A 51 LYS NZ :NH3+ -164:sc= -0.015 (180deg=-0.273) USER MOD Single : A 52 SER OG : rot -39:sc= 0.72 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc= -0.75 USER MOD Single : A 61 ASN : amide:sc= -0.0403 K(o=-0.04,f=-2!) USER MOD Single : A 74 ASN : amide:sc= -0.191 K(o=-0.19,f=-3.5!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 83 LYS NZ :NH3+ -160:sc= -0.117 (180deg=-0.725) USER MOD Single : A 86 HIS : no HD1:sc= -0.918 X(o=-0.92,f=-0.66) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 91:sc= 1.24 USER MOD Single : A 100 THR OG1 : rot 85:sc= 0.626 USER MOD Single : A 101 GLN : amide:sc= -1.02 K(o=-1,f=-4.3!) USER MOD Single : A 102 TYR OH : rot 148:sc= 0.494 USER MOD Single : A 103 MET CE :methyl 162:sc= -1.19 (180deg=-2.03!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 143:sc= 0.643 USER MOD Single : A 113 LYS NZ :NH3+ -142:sc= 0.677 (180deg=0.177) USER MOD Single : A 114 LYS NZ :NH3+ -114:sc= -0.949 (180deg=-2.07!) USER MOD Single : A 117 SER OG : rot 87:sc= -1.57! USER MOD Single : A 118 THR OG1 : rot 180:sc= -0.903 USER MOD Single : A 123 GLN : amide:sc= -0.152 K(o=-0.15,f=-1.2) USER MOD Single : A 129 ASN : amide:sc= -8.61! C(o=-8.6!,f=-8.4!) USER MOD ----------------------------------------------------------------- ATOM 93 N GLN A 9 -15.583 -2.773 -7.571 1.00 0.00 N ATOM 94 CA GLN A 9 -14.225 -2.372 -8.039 1.00 0.00 C ATOM 95 C GLN A 9 -14.347 -1.156 -8.959 1.00 0.00 C ATOM 96 O GLN A 9 -13.509 -0.278 -8.957 1.00 0.00 O ATOM 97 CB GLN A 9 -13.579 -3.522 -8.812 1.00 0.00 C ATOM 98 CG GLN A 9 -13.384 -4.719 -7.884 1.00 0.00 C ATOM 99 CD GLN A 9 -12.446 -5.724 -8.552 1.00 0.00 C ATOM 100 OE1 GLN A 9 -11.163 -5.491 -8.553 1.00 0.00 O flip ATOM 101 NE2 GLN A 9 -12.884 -6.723 -9.087 1.00 0.00 N flip ATOM 0 HA GLN A 9 -13.607 -2.126 -7.176 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -14.207 -3.803 -9.657 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -12.619 -3.205 -9.220 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -12.967 -4.392 -6.931 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -14.344 -5.187 -7.668 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -13.888 -6.904 -9.085 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -12.248 -7.381 -9.538 1.00 0.00 H new ATOM 110 N PHE A 10 -15.385 -1.102 -9.749 1.00 0.00 N ATOM 111 CA PHE A 10 -15.553 0.048 -10.677 1.00 0.00 C ATOM 112 C PHE A 10 -15.378 1.350 -9.895 1.00 0.00 C ATOM 113 O PHE A 10 -14.661 2.241 -10.304 1.00 0.00 O ATOM 114 CB PHE A 10 -16.955 -0.005 -11.286 1.00 0.00 C ATOM 115 CG PHE A 10 -17.056 0.980 -12.424 1.00 0.00 C ATOM 116 CD1 PHE A 10 -16.727 0.579 -13.725 1.00 0.00 C ATOM 117 CD2 PHE A 10 -17.482 2.289 -12.181 1.00 0.00 C ATOM 118 CE1 PHE A 10 -16.826 1.489 -14.782 1.00 0.00 C ATOM 119 CE2 PHE A 10 -17.581 3.200 -13.240 1.00 0.00 C ATOM 120 CZ PHE A 10 -17.253 2.799 -14.540 1.00 0.00 C ATOM 0 H PHE A 10 -16.123 -1.805 -9.790 1.00 0.00 H new ATOM 0 HA PHE A 10 -14.809 0.001 -11.473 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -17.168 -1.012 -11.645 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -17.701 0.226 -10.525 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -16.397 -0.432 -13.912 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -17.735 2.598 -11.177 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -16.573 1.180 -15.786 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -17.910 4.212 -13.054 1.00 0.00 H new ATOM 0 HZ PHE A 10 -17.330 3.501 -15.357 1.00 0.00 H new ATOM 130 N LYS A 11 -16.023 1.467 -8.769 1.00 0.00 N ATOM 131 CA LYS A 11 -15.885 2.698 -7.962 1.00 0.00 C ATOM 132 C LYS A 11 -14.431 2.861 -7.520 1.00 0.00 C ATOM 133 O LYS A 11 -13.886 3.944 -7.529 1.00 0.00 O ATOM 134 CB LYS A 11 -16.767 2.559 -6.734 1.00 0.00 C ATOM 135 CG LYS A 11 -16.947 3.914 -6.063 1.00 0.00 C ATOM 136 CD LYS A 11 -17.891 3.748 -4.875 1.00 0.00 C ATOM 137 CE LYS A 11 -17.102 3.277 -3.651 1.00 0.00 C ATOM 138 NZ LYS A 11 -17.989 3.291 -2.452 1.00 0.00 N ATOM 0 H LYS A 11 -16.641 0.757 -8.376 1.00 0.00 H new ATOM 0 HA LYS A 11 -16.180 3.568 -8.549 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -17.738 2.153 -7.018 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -16.320 1.854 -6.033 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -15.984 4.302 -5.730 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -17.354 4.636 -6.771 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -18.387 4.694 -4.658 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -18.671 3.026 -5.116 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -16.716 2.272 -3.819 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -16.242 3.926 -3.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -17.453 2.971 -1.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -18.337 4.257 -2.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -18.796 2.654 -2.610 1.00 0.00 H new ATOM 152 N GLN A 12 -13.800 1.790 -7.121 1.00 0.00 N ATOM 153 CA GLN A 12 -12.386 1.885 -6.662 1.00 0.00 C ATOM 154 C GLN A 12 -11.472 2.285 -7.823 1.00 0.00 C ATOM 155 O GLN A 12 -10.694 3.212 -7.715 1.00 0.00 O ATOM 156 CB GLN A 12 -11.947 0.520 -6.116 1.00 0.00 C ATOM 157 CG GLN A 12 -12.557 0.283 -4.732 1.00 0.00 C ATOM 158 CD GLN A 12 -12.019 1.317 -3.739 1.00 0.00 C ATOM 159 OE1 GLN A 12 -12.602 2.370 -3.564 1.00 0.00 O ATOM 160 NE2 GLN A 12 -10.924 1.061 -3.076 1.00 0.00 N ATOM 0 H GLN A 12 -14.203 0.853 -7.093 1.00 0.00 H new ATOM 0 HA GLN A 12 -12.314 2.644 -5.883 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -12.259 -0.270 -6.799 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -10.860 0.478 -6.054 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -13.643 0.351 -4.788 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -12.318 -0.723 -4.387 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -10.434 0.178 -3.222 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -10.558 1.744 -2.412 1.00 0.00 H new ATOM 169 N VAL A 13 -11.553 1.602 -8.931 1.00 0.00 N ATOM 170 CA VAL A 13 -10.684 1.955 -10.085 1.00 0.00 C ATOM 171 C VAL A 13 -11.145 3.288 -10.697 1.00 0.00 C ATOM 172 O VAL A 13 -10.343 4.096 -11.107 1.00 0.00 O ATOM 173 CB VAL A 13 -10.729 0.819 -11.119 1.00 0.00 C ATOM 174 CG1 VAL A 13 -12.164 0.278 -11.273 1.00 0.00 C ATOM 175 CG2 VAL A 13 -10.225 1.337 -12.461 1.00 0.00 C ATOM 0 H VAL A 13 -12.183 0.815 -9.086 1.00 0.00 H new ATOM 0 HA VAL A 13 -9.653 2.079 -9.752 1.00 0.00 H new ATOM 0 HB VAL A 13 -10.091 0.005 -10.775 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -12.173 -0.525 -12.010 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -12.513 -0.105 -10.314 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -12.822 1.081 -11.604 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -10.256 0.533 -13.196 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -10.859 2.159 -12.795 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.200 1.690 -12.353 1.00 0.00 H new ATOM 185 N ARG A 14 -12.418 3.552 -10.751 1.00 0.00 N ATOM 186 CA ARG A 14 -12.850 4.864 -11.315 1.00 0.00 C ATOM 187 C ARG A 14 -12.264 5.970 -10.441 1.00 0.00 C ATOM 188 O ARG A 14 -11.824 6.993 -10.926 1.00 0.00 O ATOM 189 CB ARG A 14 -14.376 4.959 -11.318 1.00 0.00 C ATOM 190 CG ARG A 14 -14.813 6.232 -12.056 1.00 0.00 C ATOM 191 CD ARG A 14 -14.819 5.984 -13.572 1.00 0.00 C ATOM 192 NE ARG A 14 -14.266 7.176 -14.293 1.00 0.00 N ATOM 193 CZ ARG A 14 -14.637 8.392 -13.985 1.00 0.00 C ATOM 194 NH1 ARG A 14 -15.578 8.599 -13.106 1.00 0.00 N ATOM 195 NH2 ARG A 14 -14.082 9.405 -14.590 1.00 0.00 N ATOM 0 H ARG A 14 -13.166 2.934 -10.437 1.00 0.00 H new ATOM 0 HA ARG A 14 -12.499 4.964 -12.342 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -14.804 4.081 -11.802 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -14.751 4.973 -10.295 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -15.807 6.532 -11.724 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -14.136 7.052 -11.816 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -14.225 5.100 -13.806 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -15.835 5.784 -13.911 1.00 0.00 H new ATOM 0 HE ARG A 14 -13.586 7.036 -15.040 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -16.033 7.808 -12.650 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -15.859 9.552 -12.874 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -13.365 9.246 -15.297 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -14.365 10.356 -14.356 1.00 0.00 H new ATOM 209 N GLN A 15 -12.232 5.762 -9.152 1.00 0.00 N ATOM 210 CA GLN A 15 -11.641 6.792 -8.256 1.00 0.00 C ATOM 211 C GLN A 15 -10.193 7.034 -8.684 1.00 0.00 C ATOM 212 O GLN A 15 -9.660 8.114 -8.531 1.00 0.00 O ATOM 213 CB GLN A 15 -11.662 6.298 -6.804 1.00 0.00 C ATOM 214 CG GLN A 15 -13.082 6.384 -6.244 1.00 0.00 C ATOM 215 CD GLN A 15 -13.335 7.800 -5.725 1.00 0.00 C ATOM 216 OE1 GLN A 15 -12.566 8.777 -6.125 1.00 0.00 O flip ATOM 217 NE2 GLN A 15 -14.240 8.022 -4.946 1.00 0.00 N flip ATOM 0 H GLN A 15 -12.588 4.928 -8.685 1.00 0.00 H new ATOM 0 HA GLN A 15 -12.218 7.714 -8.325 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -11.305 5.269 -6.756 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -10.985 6.899 -6.197 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -13.807 6.133 -7.019 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -13.212 5.660 -5.439 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -14.842 7.260 -4.633 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -14.399 8.970 -4.605 1.00 0.00 H new ATOM 226 N LEU A 16 -9.553 6.027 -9.217 1.00 0.00 N ATOM 227 CA LEU A 16 -8.136 6.187 -9.649 1.00 0.00 C ATOM 228 C LEU A 16 -8.025 7.108 -10.874 1.00 0.00 C ATOM 229 O LEU A 16 -7.109 7.900 -10.965 1.00 0.00 O ATOM 230 CB LEU A 16 -7.529 4.816 -9.978 1.00 0.00 C ATOM 231 CG LEU A 16 -6.929 4.182 -8.725 1.00 0.00 C ATOM 232 CD1 LEU A 16 -6.592 2.722 -9.022 1.00 0.00 C ATOM 233 CD2 LEU A 16 -5.643 4.915 -8.315 1.00 0.00 C ATOM 0 H LEU A 16 -9.951 5.101 -9.371 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.585 6.644 -8.827 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.296 4.162 -10.392 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -6.759 4.926 -10.741 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.652 4.251 -7.912 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -6.163 2.260 -8.133 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.500 2.189 -9.305 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -5.873 2.674 -9.840 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -5.229 4.450 -7.420 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -4.916 4.855 -9.125 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.870 5.961 -8.108 1.00 0.00 H new ATOM 245 N TYR A 17 -8.923 7.021 -11.825 1.00 0.00 N ATOM 246 CA TYR A 17 -8.797 7.914 -13.016 1.00 0.00 C ATOM 247 C TYR A 17 -9.239 9.325 -12.662 1.00 0.00 C ATOM 248 O TYR A 17 -8.715 10.294 -13.174 1.00 0.00 O ATOM 249 CB TYR A 17 -9.669 7.409 -14.163 1.00 0.00 C ATOM 250 CG TYR A 17 -9.125 6.107 -14.689 1.00 0.00 C ATOM 251 CD1 TYR A 17 -8.075 6.099 -15.618 1.00 0.00 C ATOM 252 CD2 TYR A 17 -9.681 4.907 -14.255 1.00 0.00 C ATOM 253 CE1 TYR A 17 -7.586 4.885 -16.106 1.00 0.00 C ATOM 254 CE2 TYR A 17 -9.190 3.695 -14.745 1.00 0.00 C ATOM 255 CZ TYR A 17 -8.143 3.684 -15.669 1.00 0.00 C ATOM 256 OH TYR A 17 -7.661 2.483 -16.144 1.00 0.00 O ATOM 0 H TYR A 17 -9.720 6.385 -11.829 1.00 0.00 H new ATOM 0 HA TYR A 17 -7.751 7.915 -13.324 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -10.694 7.272 -13.818 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -9.698 8.150 -14.962 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -7.645 7.030 -15.956 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -10.491 4.913 -13.540 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -6.777 4.877 -16.821 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -9.621 2.764 -14.408 1.00 0.00 H new ATOM 0 HH TYR A 17 -8.154 2.229 -16.952 1.00 0.00 H new ATOM 266 N GLU A 18 -10.224 9.460 -11.824 1.00 0.00 N ATOM 267 CA GLU A 18 -10.716 10.826 -11.490 1.00 0.00 C ATOM 268 C GLU A 18 -9.609 11.630 -10.824 1.00 0.00 C ATOM 269 O GLU A 18 -9.578 12.843 -10.895 1.00 0.00 O ATOM 270 CB GLU A 18 -11.911 10.730 -10.545 1.00 0.00 C ATOM 271 CG GLU A 18 -13.089 10.080 -11.271 1.00 0.00 C ATOM 272 CD GLU A 18 -14.315 10.088 -10.358 1.00 0.00 C ATOM 273 OE1 GLU A 18 -14.164 10.452 -9.203 1.00 0.00 O ATOM 274 OE2 GLU A 18 -15.383 9.734 -10.828 1.00 0.00 O ATOM 0 H GLU A 18 -10.708 8.692 -11.358 1.00 0.00 H new ATOM 0 HA GLU A 18 -11.020 11.325 -12.410 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -11.645 10.144 -9.665 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -12.191 11.723 -10.194 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -13.305 10.620 -12.193 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -12.838 9.057 -11.552 1.00 0.00 H new ATOM 281 N ILE A 19 -8.713 10.963 -10.166 1.00 0.00 N ATOM 282 CA ILE A 19 -7.614 11.670 -9.472 1.00 0.00 C ATOM 283 C ILE A 19 -7.108 12.836 -10.326 1.00 0.00 C ATOM 284 O ILE A 19 -6.813 13.899 -9.818 1.00 0.00 O ATOM 285 CB ILE A 19 -6.504 10.668 -9.209 1.00 0.00 C ATOM 286 CG1 ILE A 19 -6.904 9.824 -8.001 1.00 0.00 C ATOM 287 CG2 ILE A 19 -5.190 11.389 -8.926 1.00 0.00 C ATOM 288 CD1 ILE A 19 -6.058 8.565 -7.955 1.00 0.00 C ATOM 0 H ILE A 19 -8.695 9.947 -10.079 1.00 0.00 H new ATOM 0 HA ILE A 19 -7.966 12.086 -8.528 1.00 0.00 H new ATOM 0 HB ILE A 19 -6.361 10.036 -10.085 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.770 10.398 -7.084 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.960 9.562 -8.062 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.405 10.656 -8.740 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.918 12.001 -9.786 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.306 12.027 -8.050 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -6.346 7.965 -7.092 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -6.214 7.988 -8.867 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.006 8.837 -7.873 1.00 0.00 H new ATOM 300 N ASN A 20 -6.985 12.647 -11.608 1.00 0.00 N ATOM 301 CA ASN A 20 -6.475 13.747 -12.471 1.00 0.00 C ATOM 302 C ASN A 20 -6.652 13.362 -13.939 1.00 0.00 C ATOM 303 O ASN A 20 -6.744 12.202 -14.285 1.00 0.00 O ATOM 304 CB ASN A 20 -4.978 13.966 -12.183 1.00 0.00 C ATOM 305 CG ASN A 20 -4.793 15.136 -11.215 1.00 0.00 C ATOM 306 OD1 ASN A 20 -4.783 14.956 -10.014 1.00 0.00 O ATOM 307 ND2 ASN A 20 -4.636 16.339 -11.696 1.00 0.00 N ATOM 0 H ASN A 20 -7.215 11.781 -12.095 1.00 0.00 H new ATOM 0 HA ASN A 20 -7.029 14.662 -12.262 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -4.546 13.060 -11.758 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -4.447 14.166 -13.113 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -4.505 17.128 -11.063 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -4.644 16.490 -12.705 1.00 0.00 H new ATOM 314 N ASP A 21 -6.682 14.339 -14.799 1.00 0.00 N ATOM 315 CA ASP A 21 -6.834 14.047 -16.249 1.00 0.00 C ATOM 316 C ASP A 21 -5.450 13.977 -16.889 1.00 0.00 C ATOM 317 O ASP A 21 -5.107 14.766 -17.747 1.00 0.00 O ATOM 318 CB ASP A 21 -7.659 15.153 -16.910 1.00 0.00 C ATOM 319 CG ASP A 21 -6.915 16.488 -16.810 1.00 0.00 C ATOM 320 OD1 ASP A 21 -5.774 16.479 -16.375 1.00 0.00 O ATOM 321 OD2 ASP A 21 -7.502 17.497 -17.162 1.00 0.00 O ATOM 0 H ASP A 21 -6.608 15.328 -14.560 1.00 0.00 H new ATOM 0 HA ASP A 21 -7.346 13.094 -16.384 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -7.843 14.906 -17.956 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -8.632 15.232 -16.426 1.00 0.00 H new ATOM 326 N ASP A 22 -4.647 13.036 -16.478 1.00 0.00 N ATOM 327 CA ASP A 22 -3.282 12.920 -17.062 1.00 0.00 C ATOM 328 C ASP A 22 -3.296 11.837 -18.151 1.00 0.00 C ATOM 329 O ASP A 22 -3.982 10.841 -18.029 1.00 0.00 O ATOM 330 CB ASP A 22 -2.285 12.538 -15.956 1.00 0.00 C ATOM 331 CG ASP A 22 -1.629 13.799 -15.387 1.00 0.00 C ATOM 332 OD1 ASP A 22 -2.236 14.427 -14.533 1.00 0.00 O ATOM 333 OD2 ASP A 22 -0.531 14.115 -15.811 1.00 0.00 O ATOM 0 H ASP A 22 -4.876 12.344 -15.765 1.00 0.00 H new ATOM 0 HA ASP A 22 -2.981 13.872 -17.500 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -2.799 11.995 -15.163 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -1.522 11.870 -16.357 1.00 0.00 H new ATOM 338 N PRO A 23 -2.544 12.024 -19.210 1.00 0.00 N ATOM 339 CA PRO A 23 -2.482 11.036 -20.323 1.00 0.00 C ATOM 340 C PRO A 23 -1.757 9.755 -19.905 1.00 0.00 C ATOM 341 O PRO A 23 -2.318 8.677 -19.923 1.00 0.00 O ATOM 342 CB PRO A 23 -1.703 11.764 -21.423 1.00 0.00 C ATOM 343 CG PRO A 23 -0.900 12.808 -20.720 1.00 0.00 C ATOM 344 CD PRO A 23 -1.676 13.187 -19.461 1.00 0.00 C ATOM 0 HA PRO A 23 -3.475 10.718 -20.642 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -1.059 11.075 -21.969 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -2.379 12.213 -22.151 1.00 0.00 H new ATOM 0 HG2 PRO A 23 0.089 12.428 -20.465 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -0.752 13.678 -21.360 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -1.007 13.373 -18.621 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -2.260 14.095 -19.611 1.00 0.00 H new ATOM 352 N LYS A 24 -0.515 9.866 -19.525 1.00 0.00 N ATOM 353 CA LYS A 24 0.244 8.658 -19.102 1.00 0.00 C ATOM 354 C LYS A 24 -0.433 8.031 -17.885 1.00 0.00 C ATOM 355 O LYS A 24 -0.470 6.825 -17.738 1.00 0.00 O ATOM 356 CB LYS A 24 1.682 9.050 -18.740 1.00 0.00 C ATOM 357 CG LYS A 24 2.519 9.214 -20.014 1.00 0.00 C ATOM 358 CD LYS A 24 2.149 10.522 -20.718 1.00 0.00 C ATOM 359 CE LYS A 24 3.060 10.722 -21.927 1.00 0.00 C ATOM 360 NZ LYS A 24 2.789 9.654 -22.928 1.00 0.00 N ATOM 0 H LYS A 24 0.007 10.742 -19.489 1.00 0.00 H new ATOM 0 HA LYS A 24 0.261 7.939 -19.921 1.00 0.00 H new ATOM 0 HB2 LYS A 24 1.682 9.981 -18.173 1.00 0.00 H new ATOM 0 HB3 LYS A 24 2.125 8.287 -18.100 1.00 0.00 H new ATOM 0 HG2 LYS A 24 3.580 9.213 -19.765 1.00 0.00 H new ATOM 0 HG3 LYS A 24 2.348 8.370 -20.683 1.00 0.00 H new ATOM 0 HD2 LYS A 24 1.106 10.495 -21.035 1.00 0.00 H new ATOM 0 HD3 LYS A 24 2.251 11.360 -20.029 1.00 0.00 H new ATOM 0 HE2 LYS A 24 2.887 11.703 -22.369 1.00 0.00 H new ATOM 0 HE3 LYS A 24 4.105 10.691 -21.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 3.193 9.928 -23.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 3.222 8.763 -22.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 1.762 9.524 -23.027 1.00 0.00 H new ATOM 374 N ARG A 25 -0.972 8.832 -17.006 1.00 0.00 N ATOM 375 CA ARG A 25 -1.640 8.257 -15.807 1.00 0.00 C ATOM 376 C ARG A 25 -2.756 7.315 -16.257 1.00 0.00 C ATOM 377 O ARG A 25 -2.901 6.221 -15.751 1.00 0.00 O ATOM 378 CB ARG A 25 -2.244 9.377 -14.961 1.00 0.00 C ATOM 379 CG ARG A 25 -2.681 8.804 -13.612 1.00 0.00 C ATOM 380 CD ARG A 25 -3.686 9.753 -12.947 1.00 0.00 C ATOM 381 NE ARG A 25 -3.569 9.670 -11.456 1.00 0.00 N ATOM 382 CZ ARG A 25 -3.458 8.517 -10.844 1.00 0.00 C ATOM 383 NH1 ARG A 25 -3.672 7.403 -11.484 1.00 0.00 N ATOM 384 NH2 ARG A 25 -3.207 8.486 -9.564 1.00 0.00 N ATOM 0 H ARG A 25 -0.978 9.850 -17.066 1.00 0.00 H new ATOM 0 HA ARG A 25 -0.906 7.711 -15.214 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -1.514 10.172 -14.813 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -3.097 9.819 -15.476 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -3.132 7.822 -13.752 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.814 8.667 -12.966 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -3.504 10.776 -13.277 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -4.699 9.494 -13.254 1.00 0.00 H new ATOM 0 HE ARG A 25 -3.576 10.529 -10.906 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -3.929 7.423 -12.471 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -3.583 6.511 -10.998 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -3.098 9.357 -9.044 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -3.120 7.591 -9.083 1.00 0.00 H new ATOM 398 N LYS A 26 -3.557 7.737 -17.200 1.00 0.00 N ATOM 399 CA LYS A 26 -4.669 6.868 -17.673 1.00 0.00 C ATOM 400 C LYS A 26 -4.093 5.579 -18.263 1.00 0.00 C ATOM 401 O LYS A 26 -4.421 4.486 -17.843 1.00 0.00 O ATOM 402 CB LYS A 26 -5.455 7.614 -18.756 1.00 0.00 C ATOM 403 CG LYS A 26 -6.696 6.808 -19.137 1.00 0.00 C ATOM 404 CD LYS A 26 -7.423 7.501 -20.292 1.00 0.00 C ATOM 405 CE LYS A 26 -8.733 6.767 -20.580 1.00 0.00 C ATOM 406 NZ LYS A 26 -8.436 5.430 -21.165 1.00 0.00 N ATOM 0 H LYS A 26 -3.488 8.644 -17.661 1.00 0.00 H new ATOM 0 HA LYS A 26 -5.326 6.622 -16.839 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -5.747 8.600 -18.394 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -4.827 7.770 -19.633 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -6.410 5.797 -19.428 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -7.361 6.717 -18.278 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -7.625 8.542 -20.037 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -6.793 7.507 -21.182 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -9.308 6.654 -19.661 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -9.344 7.349 -21.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -9.319 4.994 -21.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -7.778 5.539 -21.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -8.004 4.822 -20.440 1.00 0.00 H new ATOM 420 N GLU A 27 -3.239 5.705 -19.238 1.00 0.00 N ATOM 421 CA GLU A 27 -2.641 4.494 -19.867 1.00 0.00 C ATOM 422 C GLU A 27 -2.055 3.589 -18.782 1.00 0.00 C ATOM 423 O GLU A 27 -2.090 2.378 -18.886 1.00 0.00 O ATOM 424 CB GLU A 27 -1.541 4.910 -20.847 1.00 0.00 C ATOM 425 CG GLU A 27 -0.964 3.668 -21.529 1.00 0.00 C ATOM 426 CD GLU A 27 0.136 4.091 -22.505 1.00 0.00 C ATOM 427 OE1 GLU A 27 0.464 5.266 -22.523 1.00 0.00 O ATOM 428 OE2 GLU A 27 0.626 3.234 -23.222 1.00 0.00 O ATOM 0 H GLU A 27 -2.928 6.595 -19.628 1.00 0.00 H new ATOM 0 HA GLU A 27 -3.414 3.950 -20.409 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -1.945 5.593 -21.594 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -0.753 5.446 -20.318 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -0.560 2.984 -20.783 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -1.751 3.132 -22.060 1.00 0.00 H new ATOM 435 N PHE A 28 -1.512 4.161 -17.745 1.00 0.00 N ATOM 436 CA PHE A 28 -0.919 3.335 -16.658 1.00 0.00 C ATOM 437 C PHE A 28 -1.992 2.480 -15.984 1.00 0.00 C ATOM 438 O PHE A 28 -1.934 1.267 -16.004 1.00 0.00 O ATOM 439 CB PHE A 28 -0.334 4.269 -15.614 1.00 0.00 C ATOM 440 CG PHE A 28 0.456 3.467 -14.629 1.00 0.00 C ATOM 441 CD1 PHE A 28 1.803 3.216 -14.884 1.00 0.00 C ATOM 442 CD2 PHE A 28 -0.141 2.995 -13.455 1.00 0.00 C ATOM 443 CE1 PHE A 28 2.561 2.490 -13.972 1.00 0.00 C ATOM 444 CE2 PHE A 28 0.616 2.262 -12.539 1.00 0.00 C ATOM 445 CZ PHE A 28 1.971 2.007 -12.798 1.00 0.00 C ATOM 0 H PHE A 28 -1.453 5.169 -17.603 1.00 0.00 H new ATOM 0 HA PHE A 28 -0.156 2.683 -17.083 1.00 0.00 H new ATOM 0 HB2 PHE A 28 0.304 5.014 -16.090 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -1.131 4.811 -15.105 1.00 0.00 H new ATOM 0 HD1 PHE A 28 2.258 3.586 -15.791 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -1.184 3.197 -13.258 1.00 0.00 H new ATOM 0 HE1 PHE A 28 3.605 2.299 -14.169 1.00 0.00 H new ATOM 0 HE2 PHE A 28 0.159 1.892 -11.633 1.00 0.00 H new ATOM 0 HZ PHE A 28 2.558 1.439 -12.092 1.00 0.00 H new ATOM 455 N LEU A 29 -2.966 3.102 -15.378 1.00 0.00 N ATOM 456 CA LEU A 29 -4.037 2.327 -14.693 1.00 0.00 C ATOM 457 C LEU A 29 -4.629 1.320 -15.665 1.00 0.00 C ATOM 458 O LEU A 29 -4.801 0.159 -15.351 1.00 0.00 O ATOM 459 CB LEU A 29 -5.142 3.287 -14.257 1.00 0.00 C ATOM 460 CG LEU A 29 -4.563 4.379 -13.360 1.00 0.00 C ATOM 461 CD1 LEU A 29 -5.636 5.437 -13.102 1.00 0.00 C ATOM 462 CD2 LEU A 29 -4.114 3.769 -12.029 1.00 0.00 C ATOM 0 H LEU A 29 -3.066 4.116 -15.328 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.619 1.811 -13.829 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -5.612 3.735 -15.133 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -5.920 2.741 -13.723 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.705 4.838 -13.851 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -5.229 6.220 -12.462 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -5.954 5.872 -14.050 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -6.492 4.975 -12.610 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -3.701 4.551 -11.391 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -4.969 3.309 -11.533 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -3.352 3.012 -12.214 1.00 0.00 H new ATOM 474 N ASP A 30 -4.934 1.755 -16.853 1.00 0.00 N ATOM 475 CA ASP A 30 -5.510 0.815 -17.853 1.00 0.00 C ATOM 476 C ASP A 30 -4.504 -0.299 -18.128 1.00 0.00 C ATOM 477 O ASP A 30 -4.842 -1.466 -18.142 1.00 0.00 O ATOM 478 CB ASP A 30 -5.802 1.554 -19.163 1.00 0.00 C ATOM 479 CG ASP A 30 -7.008 2.477 -18.982 1.00 0.00 C ATOM 480 OD1 ASP A 30 -7.969 2.053 -18.362 1.00 0.00 O ATOM 481 OD2 ASP A 30 -6.952 3.593 -19.471 1.00 0.00 O ATOM 0 H ASP A 30 -4.811 2.715 -17.175 1.00 0.00 H new ATOM 0 HA ASP A 30 -6.437 0.399 -17.459 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -4.931 2.135 -19.465 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -5.999 0.836 -19.960 1.00 0.00 H new ATOM 486 N ASP A 31 -3.268 0.053 -18.348 1.00 0.00 N ATOM 487 CA ASP A 31 -2.239 -0.983 -18.623 1.00 0.00 C ATOM 488 C ASP A 31 -2.002 -1.834 -17.371 1.00 0.00 C ATOM 489 O ASP A 31 -1.883 -3.040 -17.445 1.00 0.00 O ATOM 490 CB ASP A 31 -0.933 -0.302 -19.037 1.00 0.00 C ATOM 491 CG ASP A 31 0.011 -1.339 -19.648 1.00 0.00 C ATOM 492 OD1 ASP A 31 -0.196 -1.694 -20.796 1.00 0.00 O ATOM 493 OD2 ASP A 31 0.924 -1.759 -18.958 1.00 0.00 O ATOM 0 H ASP A 31 -2.928 1.015 -18.349 1.00 0.00 H new ATOM 0 HA ASP A 31 -2.587 -1.629 -19.429 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -1.136 0.490 -19.758 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -0.465 0.167 -18.172 1.00 0.00 H new ATOM 498 N LEU A 32 -1.902 -1.215 -16.221 1.00 0.00 N ATOM 499 CA LEU A 32 -1.638 -2.003 -14.983 1.00 0.00 C ATOM 500 C LEU A 32 -2.736 -3.035 -14.756 1.00 0.00 C ATOM 501 O LEU A 32 -2.458 -4.199 -14.539 1.00 0.00 O ATOM 502 CB LEU A 32 -1.541 -1.067 -13.774 1.00 0.00 C ATOM 503 CG LEU A 32 -1.263 -1.880 -12.501 1.00 0.00 C ATOM 504 CD1 LEU A 32 0.079 -2.603 -12.623 1.00 0.00 C ATOM 505 CD2 LEU A 32 -1.197 -0.936 -11.304 1.00 0.00 C ATOM 0 H LEU A 32 -1.991 -0.208 -16.088 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.691 -2.528 -15.105 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.746 -0.338 -13.931 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.469 -0.507 -13.662 1.00 0.00 H new ATOM 0 HG LEU A 32 -2.062 -2.609 -12.367 1.00 0.00 H new ATOM 0 HD11 LEU A 32 0.267 -3.177 -11.715 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.053 -3.277 -13.479 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.875 -1.871 -12.761 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -1.000 -1.510 -10.399 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.397 -0.211 -11.456 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.147 -0.412 -11.201 1.00 0.00 H new ATOM 517 N PHE A 33 -3.979 -2.645 -14.804 1.00 0.00 N ATOM 518 CA PHE A 33 -5.044 -3.657 -14.593 1.00 0.00 C ATOM 519 C PHE A 33 -4.946 -4.679 -15.721 1.00 0.00 C ATOM 520 O PHE A 33 -5.175 -5.856 -15.533 1.00 0.00 O ATOM 521 CB PHE A 33 -6.438 -3.020 -14.639 1.00 0.00 C ATOM 522 CG PHE A 33 -6.646 -2.057 -13.490 1.00 0.00 C ATOM 523 CD1 PHE A 33 -6.557 -2.498 -12.161 1.00 0.00 C ATOM 524 CD2 PHE A 33 -6.955 -0.719 -13.762 1.00 0.00 C ATOM 525 CE1 PHE A 33 -6.775 -1.595 -11.108 1.00 0.00 C ATOM 526 CE2 PHE A 33 -7.179 0.180 -12.712 1.00 0.00 C ATOM 527 CZ PHE A 33 -7.090 -0.256 -11.384 1.00 0.00 C ATOM 0 H PHE A 33 -4.297 -1.691 -14.976 1.00 0.00 H new ATOM 0 HA PHE A 33 -4.907 -4.116 -13.614 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -6.567 -2.493 -15.584 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -7.197 -3.801 -14.603 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -6.321 -3.530 -11.948 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -7.021 -0.379 -14.785 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -6.700 -1.932 -10.085 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -7.421 1.211 -12.926 1.00 0.00 H new ATOM 0 HZ PHE A 33 -7.263 0.437 -10.574 1.00 0.00 H new ATOM 537 N SER A 34 -4.600 -4.230 -16.898 1.00 0.00 N ATOM 538 CA SER A 34 -4.478 -5.165 -18.052 1.00 0.00 C ATOM 539 C SER A 34 -3.287 -6.099 -17.835 1.00 0.00 C ATOM 540 O SER A 34 -3.407 -7.306 -17.916 1.00 0.00 O ATOM 541 CB SER A 34 -4.274 -4.362 -19.337 1.00 0.00 C ATOM 542 OG SER A 34 -4.280 -5.248 -20.450 1.00 0.00 O ATOM 0 H SER A 34 -4.396 -3.253 -17.110 1.00 0.00 H new ATOM 0 HA SER A 34 -5.388 -5.759 -18.135 1.00 0.00 H new ATOM 0 HB2 SER A 34 -5.064 -3.619 -19.445 1.00 0.00 H new ATOM 0 HB3 SER A 34 -3.330 -3.819 -19.294 1.00 0.00 H new ATOM 0 HG SER A 34 -4.151 -4.737 -21.276 1.00 0.00 H new ATOM 548 N PHE A 35 -2.138 -5.545 -17.563 1.00 0.00 N ATOM 549 CA PHE A 35 -0.928 -6.376 -17.340 1.00 0.00 C ATOM 550 C PHE A 35 -1.154 -7.344 -16.181 1.00 0.00 C ATOM 551 O PHE A 35 -0.774 -8.496 -16.236 1.00 0.00 O ATOM 552 CB PHE A 35 0.212 -5.422 -17.001 1.00 0.00 C ATOM 553 CG PHE A 35 1.477 -6.181 -16.712 1.00 0.00 C ATOM 554 CD1 PHE A 35 2.157 -6.832 -17.743 1.00 0.00 C ATOM 555 CD2 PHE A 35 1.989 -6.197 -15.413 1.00 0.00 C ATOM 556 CE1 PHE A 35 3.357 -7.501 -17.475 1.00 0.00 C ATOM 557 CE2 PHE A 35 3.184 -6.866 -15.140 1.00 0.00 C ATOM 558 CZ PHE A 35 3.873 -7.515 -16.173 1.00 0.00 C ATOM 0 H PHE A 35 -1.987 -4.539 -17.485 1.00 0.00 H new ATOM 0 HA PHE A 35 -0.698 -6.965 -18.228 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.376 -4.735 -17.832 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -0.060 -4.817 -16.136 1.00 0.00 H new ATOM 0 HD1 PHE A 35 1.758 -6.819 -18.746 1.00 0.00 H new ATOM 0 HD2 PHE A 35 1.460 -5.691 -14.619 1.00 0.00 H new ATOM 0 HE1 PHE A 35 3.884 -8.006 -18.271 1.00 0.00 H new ATOM 0 HE2 PHE A 35 3.577 -6.883 -14.134 1.00 0.00 H new ATOM 0 HZ PHE A 35 4.802 -8.026 -15.965 1.00 0.00 H new ATOM 568 N MET A 36 -1.755 -6.877 -15.127 1.00 0.00 N ATOM 569 CA MET A 36 -1.996 -7.751 -13.944 1.00 0.00 C ATOM 570 C MET A 36 -2.864 -8.954 -14.318 1.00 0.00 C ATOM 571 O MET A 36 -2.645 -10.050 -13.842 1.00 0.00 O ATOM 572 CB MET A 36 -2.706 -6.929 -12.872 1.00 0.00 C ATOM 573 CG MET A 36 -1.739 -5.890 -12.304 1.00 0.00 C ATOM 574 SD MET A 36 -0.657 -6.671 -11.083 1.00 0.00 S ATOM 575 CE MET A 36 -1.791 -6.543 -9.679 1.00 0.00 C ATOM 0 H MET A 36 -2.093 -5.920 -15.031 1.00 0.00 H new ATOM 0 HA MET A 36 -1.040 -8.123 -13.575 1.00 0.00 H new ATOM 0 HB2 MET A 36 -3.580 -6.435 -13.297 1.00 0.00 H new ATOM 0 HB3 MET A 36 -3.064 -7.582 -12.076 1.00 0.00 H new ATOM 0 HG2 MET A 36 -1.144 -5.455 -13.107 1.00 0.00 H new ATOM 0 HG3 MET A 36 -2.296 -5.074 -11.843 1.00 0.00 H new ATOM 0 HE1 MET A 36 -1.567 -7.329 -8.958 1.00 0.00 H new ATOM 0 HE2 MET A 36 -1.672 -5.570 -9.203 1.00 0.00 H new ATOM 0 HE3 MET A 36 -2.817 -6.653 -10.029 1.00 0.00 H new ATOM 585 N GLN A 37 -3.846 -8.778 -15.159 1.00 0.00 N ATOM 586 CA GLN A 37 -4.696 -9.944 -15.528 1.00 0.00 C ATOM 587 C GLN A 37 -3.806 -11.036 -16.117 1.00 0.00 C ATOM 588 O GLN A 37 -4.017 -12.211 -15.893 1.00 0.00 O ATOM 589 CB GLN A 37 -5.747 -9.528 -16.559 1.00 0.00 C ATOM 590 CG GLN A 37 -6.801 -8.639 -15.894 1.00 0.00 C ATOM 591 CD GLN A 37 -7.605 -9.467 -14.888 1.00 0.00 C ATOM 592 OE1 GLN A 37 -7.932 -10.608 -15.146 1.00 0.00 O ATOM 593 NE2 GLN A 37 -7.944 -8.936 -13.745 1.00 0.00 N ATOM 0 H GLN A 37 -4.094 -7.892 -15.600 1.00 0.00 H new ATOM 0 HA GLN A 37 -5.207 -10.316 -14.640 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -5.272 -8.992 -17.381 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -6.220 -10.412 -16.986 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -6.320 -7.801 -15.390 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -7.466 -8.218 -16.648 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -7.670 -7.978 -13.527 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -8.483 -9.479 -13.070 1.00 0.00 H new ATOM 602 N LYS A 38 -2.808 -10.657 -16.865 1.00 0.00 N ATOM 603 CA LYS A 38 -1.903 -11.675 -17.458 1.00 0.00 C ATOM 604 C LYS A 38 -1.102 -12.367 -16.350 1.00 0.00 C ATOM 605 O LYS A 38 -0.966 -13.574 -16.329 1.00 0.00 O ATOM 606 CB LYS A 38 -0.955 -10.975 -18.446 1.00 0.00 C ATOM 607 CG LYS A 38 0.169 -11.921 -18.906 1.00 0.00 C ATOM 608 CD LYS A 38 -0.394 -13.059 -19.769 1.00 0.00 C ATOM 609 CE LYS A 38 -1.114 -12.485 -20.994 1.00 0.00 C ATOM 610 NZ LYS A 38 -2.552 -12.255 -20.669 1.00 0.00 N ATOM 0 H LYS A 38 -2.582 -9.688 -17.090 1.00 0.00 H new ATOM 0 HA LYS A 38 -2.485 -12.431 -17.985 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -1.519 -10.629 -19.312 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -0.521 -10.093 -17.975 1.00 0.00 H new ATOM 0 HG2 LYS A 38 0.912 -11.361 -19.474 1.00 0.00 H new ATOM 0 HG3 LYS A 38 0.679 -12.336 -18.037 1.00 0.00 H new ATOM 0 HD2 LYS A 38 0.414 -13.718 -20.088 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -1.085 -13.664 -19.182 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -0.645 -11.549 -21.298 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -1.027 -13.173 -21.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -3.140 -12.528 -21.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -2.817 -12.828 -19.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -2.703 -11.248 -20.455 1.00 0.00 H new ATOM 624 N ARG A 39 -0.528 -11.607 -15.460 1.00 0.00 N ATOM 625 CA ARG A 39 0.314 -12.214 -14.390 1.00 0.00 C ATOM 626 C ARG A 39 -0.525 -13.115 -13.485 1.00 0.00 C ATOM 627 O ARG A 39 -0.001 -13.996 -12.833 1.00 0.00 O ATOM 628 CB ARG A 39 0.964 -11.110 -13.541 1.00 0.00 C ATOM 629 CG ARG A 39 1.530 -10.000 -14.429 1.00 0.00 C ATOM 630 CD ARG A 39 2.216 -10.581 -15.671 1.00 0.00 C ATOM 631 NE ARG A 39 3.031 -11.791 -15.315 1.00 0.00 N ATOM 632 CZ ARG A 39 3.881 -11.775 -14.325 1.00 0.00 C ATOM 633 NH1 ARG A 39 4.222 -10.650 -13.763 1.00 0.00 N ATOM 634 NH2 ARG A 39 4.442 -12.889 -13.938 1.00 0.00 N ATOM 0 H ARG A 39 -0.605 -10.590 -15.427 1.00 0.00 H new ATOM 0 HA ARG A 39 1.088 -12.814 -14.868 1.00 0.00 H new ATOM 0 HB2 ARG A 39 0.227 -10.692 -12.855 1.00 0.00 H new ATOM 0 HB3 ARG A 39 1.761 -11.536 -12.932 1.00 0.00 H new ATOM 0 HG2 ARG A 39 0.727 -9.329 -14.734 1.00 0.00 H new ATOM 0 HG3 ARG A 39 2.244 -9.404 -13.861 1.00 0.00 H new ATOM 0 HD2 ARG A 39 1.465 -10.849 -16.414 1.00 0.00 H new ATOM 0 HD3 ARG A 39 2.858 -9.825 -16.124 1.00 0.00 H new ATOM 0 HE ARG A 39 2.917 -12.646 -15.860 1.00 0.00 H new ATOM 0 HH11 ARG A 39 3.824 -9.772 -14.096 1.00 0.00 H new ATOM 0 HH12 ARG A 39 4.887 -10.647 -12.990 1.00 0.00 H new ATOM 0 HH21 ARG A 39 4.215 -13.765 -14.409 1.00 0.00 H new ATOM 0 HH22 ARG A 39 5.107 -12.883 -13.165 1.00 0.00 H new ATOM 648 N GLY A 40 -1.810 -12.921 -13.424 1.00 0.00 N ATOM 649 CA GLY A 40 -2.630 -13.795 -12.543 1.00 0.00 C ATOM 650 C GLY A 40 -2.818 -13.099 -11.201 1.00 0.00 C ATOM 651 O GLY A 40 -3.427 -13.631 -10.296 1.00 0.00 O ATOM 0 H GLY A 40 -2.324 -12.205 -13.938 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.597 -13.994 -13.004 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.139 -14.758 -12.403 1.00 0.00 H new ATOM 655 N THR A 41 -2.312 -11.900 -11.072 1.00 0.00 N ATOM 656 CA THR A 41 -2.483 -11.153 -9.793 1.00 0.00 C ATOM 657 C THR A 41 -3.310 -9.909 -10.083 1.00 0.00 C ATOM 658 O THR A 41 -2.773 -8.844 -10.276 1.00 0.00 O ATOM 659 CB THR A 41 -1.119 -10.704 -9.257 1.00 0.00 C ATOM 660 OG1 THR A 41 -0.459 -9.924 -10.245 1.00 0.00 O ATOM 661 CG2 THR A 41 -0.266 -11.921 -8.911 1.00 0.00 C ATOM 0 H THR A 41 -1.789 -11.408 -11.796 1.00 0.00 H new ATOM 0 HA THR A 41 -2.968 -11.795 -9.058 1.00 0.00 H new ATOM 0 HB THR A 41 -1.266 -10.108 -8.356 1.00 0.00 H new ATOM 0 HG1 THR A 41 -1.042 -9.186 -10.522 1.00 0.00 H new ATOM 0 HG21 THR A 41 0.701 -11.591 -8.531 1.00 0.00 H new ATOM 0 HG22 THR A 41 -0.772 -12.515 -8.150 1.00 0.00 H new ATOM 0 HG23 THR A 41 -0.117 -12.527 -9.805 1.00 0.00 H new ATOM 669 N PRO A 42 -4.607 -10.042 -10.105 1.00 0.00 N ATOM 670 CA PRO A 42 -5.529 -8.909 -10.371 1.00 0.00 C ATOM 671 C PRO A 42 -5.834 -8.132 -9.090 1.00 0.00 C ATOM 672 O PRO A 42 -5.924 -8.700 -8.019 1.00 0.00 O ATOM 673 CB PRO A 42 -6.766 -9.619 -10.910 1.00 0.00 C ATOM 674 CG PRO A 42 -6.811 -10.906 -10.159 1.00 0.00 C ATOM 675 CD PRO A 42 -5.354 -11.294 -9.882 1.00 0.00 C ATOM 0 HA PRO A 42 -5.126 -8.164 -11.057 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -7.667 -9.029 -10.742 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -6.691 -9.788 -11.984 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -7.367 -10.794 -9.228 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -7.315 -11.678 -10.740 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -5.225 -11.661 -8.864 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -5.017 -12.085 -10.551 1.00 0.00 H new ATOM 683 N ILE A 43 -5.971 -6.838 -9.174 1.00 0.00 N ATOM 684 CA ILE A 43 -6.242 -6.052 -7.942 1.00 0.00 C ATOM 685 C ILE A 43 -7.737 -6.090 -7.621 1.00 0.00 C ATOM 686 O ILE A 43 -8.528 -5.400 -8.234 1.00 0.00 O ATOM 687 CB ILE A 43 -5.807 -4.599 -8.157 1.00 0.00 C ATOM 688 CG1 ILE A 43 -4.440 -4.575 -8.855 1.00 0.00 C ATOM 689 CG2 ILE A 43 -5.697 -3.909 -6.796 1.00 0.00 C ATOM 690 CD1 ILE A 43 -4.005 -3.133 -9.146 1.00 0.00 C ATOM 0 H ILE A 43 -5.907 -6.296 -10.036 1.00 0.00 H new ATOM 0 HA ILE A 43 -5.683 -6.484 -7.112 1.00 0.00 H new ATOM 0 HB ILE A 43 -6.538 -4.080 -8.777 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -3.696 -5.065 -8.226 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -4.492 -5.139 -9.786 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -5.388 -2.873 -6.937 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -6.665 -3.934 -6.296 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -4.959 -4.428 -6.184 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -3.034 -3.139 -9.641 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -4.740 -2.655 -9.794 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -3.932 -2.579 -8.210 1.00 0.00 H new ATOM 702 N ASN A 44 -8.135 -6.874 -6.653 1.00 0.00 N ATOM 703 CA ASN A 44 -9.581 -6.920 -6.298 1.00 0.00 C ATOM 704 C ASN A 44 -9.968 -5.567 -5.704 1.00 0.00 C ATOM 705 O ASN A 44 -10.866 -4.900 -6.176 1.00 0.00 O ATOM 706 CB ASN A 44 -9.831 -8.027 -5.269 1.00 0.00 C ATOM 707 CG ASN A 44 -9.540 -9.390 -5.899 1.00 0.00 C ATOM 708 OD1 ASN A 44 -9.748 -9.584 -7.080 1.00 0.00 O ATOM 709 ND2 ASN A 44 -9.064 -10.349 -5.154 1.00 0.00 N ATOM 0 H ASN A 44 -7.527 -7.478 -6.099 1.00 0.00 H new ATOM 0 HA ASN A 44 -10.179 -7.129 -7.185 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -9.196 -7.876 -4.396 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -10.864 -7.989 -4.922 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -8.866 -11.262 -5.563 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -8.889 -10.186 -4.162 1.00 0.00 H new ATOM 716 N ARG A 45 -9.279 -5.153 -4.676 1.00 0.00 N ATOM 717 CA ARG A 45 -9.574 -3.840 -4.045 1.00 0.00 C ATOM 718 C ARG A 45 -8.284 -3.030 -3.960 1.00 0.00 C ATOM 719 O ARG A 45 -7.252 -3.533 -3.562 1.00 0.00 O ATOM 720 CB ARG A 45 -10.114 -4.083 -2.645 1.00 0.00 C ATOM 721 CG ARG A 45 -11.488 -4.748 -2.754 1.00 0.00 C ATOM 722 CD ARG A 45 -11.890 -5.368 -1.408 1.00 0.00 C ATOM 723 NE ARG A 45 -12.161 -6.828 -1.588 1.00 0.00 N ATOM 724 CZ ARG A 45 -12.957 -7.254 -2.532 1.00 0.00 C ATOM 725 NH1 ARG A 45 -13.583 -6.402 -3.297 1.00 0.00 N ATOM 726 NH2 ARG A 45 -13.137 -8.534 -2.702 1.00 0.00 N ATOM 0 H ARG A 45 -8.517 -5.675 -4.244 1.00 0.00 H new ATOM 0 HA ARG A 45 -10.310 -3.293 -4.635 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -9.431 -4.719 -2.082 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -10.193 -3.141 -2.102 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -12.232 -4.012 -3.060 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -11.466 -5.519 -3.525 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -11.094 -5.223 -0.677 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -12.777 -4.869 -1.017 1.00 0.00 H new ATOM 0 HE ARG A 45 -11.717 -7.502 -0.964 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -13.451 -5.400 -3.159 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -14.204 -6.738 -4.033 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -12.657 -9.201 -2.098 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -13.758 -8.868 -3.439 1.00 0.00 H new ATOM 740 N LEU A 46 -8.323 -1.786 -4.335 1.00 0.00 N ATOM 741 CA LEU A 46 -7.080 -0.969 -4.269 1.00 0.00 C ATOM 742 C LEU A 46 -6.730 -0.687 -2.811 1.00 0.00 C ATOM 743 O LEU A 46 -7.605 -0.486 -1.992 1.00 0.00 O ATOM 744 CB LEU A 46 -7.289 0.384 -4.945 1.00 0.00 C ATOM 745 CG LEU A 46 -7.980 0.227 -6.295 1.00 0.00 C ATOM 746 CD1 LEU A 46 -8.561 1.576 -6.695 1.00 0.00 C ATOM 747 CD2 LEU A 46 -6.971 -0.215 -7.359 1.00 0.00 C ATOM 0 H LEU A 46 -9.151 -1.301 -4.681 1.00 0.00 H new ATOM 0 HA LEU A 46 -6.288 -1.526 -4.769 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -7.888 1.027 -4.300 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -6.327 0.877 -5.082 1.00 0.00 H new ATOM 0 HG LEU A 46 -8.765 -0.526 -6.218 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -9.061 1.485 -7.660 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -9.280 1.900 -5.943 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -7.759 2.310 -6.769 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.478 -0.323 -8.318 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.184 0.534 -7.447 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.533 -1.170 -7.070 1.00 0.00 H new ATOM 759 N PRO A 47 -5.468 -0.612 -2.488 1.00 0.00 N ATOM 760 CA PRO A 47 -5.039 -0.279 -1.108 1.00 0.00 C ATOM 761 C PRO A 47 -5.359 1.189 -0.829 1.00 0.00 C ATOM 762 O PRO A 47 -5.074 2.048 -1.639 1.00 0.00 O ATOM 763 CB PRO A 47 -3.528 -0.526 -1.113 1.00 0.00 C ATOM 764 CG PRO A 47 -3.112 -0.421 -2.544 1.00 0.00 C ATOM 765 CD PRO A 47 -4.322 -0.830 -3.384 1.00 0.00 C ATOM 0 HA PRO A 47 -5.539 -0.868 -0.339 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -3.008 0.209 -0.498 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -3.289 -1.509 -0.706 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -2.801 0.596 -2.783 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -2.261 -1.071 -2.748 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -4.402 -0.227 -4.288 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -4.255 -1.871 -3.700 1.00 0.00 H new ATOM 773 N ILE A 48 -5.964 1.496 0.283 1.00 0.00 N ATOM 774 CA ILE A 48 -6.310 2.921 0.559 1.00 0.00 C ATOM 775 C ILE A 48 -5.278 3.533 1.491 1.00 0.00 C ATOM 776 O ILE A 48 -4.794 2.905 2.406 1.00 0.00 O ATOM 777 CB ILE A 48 -7.707 3.003 1.189 1.00 0.00 C ATOM 778 CG1 ILE A 48 -8.725 2.432 0.192 1.00 0.00 C ATOM 779 CG2 ILE A 48 -8.066 4.462 1.517 1.00 0.00 C ATOM 780 CD1 ILE A 48 -10.151 2.824 0.596 1.00 0.00 C ATOM 0 H ILE A 48 -6.233 0.831 1.008 1.00 0.00 H new ATOM 0 HA ILE A 48 -6.311 3.478 -0.378 1.00 0.00 H new ATOM 0 HB ILE A 48 -7.722 2.430 2.116 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -8.509 2.804 -0.810 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -8.637 1.346 0.155 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -9.060 4.501 1.963 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -7.337 4.867 2.219 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -8.056 5.054 0.602 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -10.859 2.411 -0.122 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -10.369 2.430 1.589 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -10.240 3.910 0.609 1.00 0.00 H new ATOM 792 N MET A 49 -4.940 4.763 1.248 1.00 0.00 N ATOM 793 CA MET A 49 -3.944 5.452 2.097 1.00 0.00 C ATOM 794 C MET A 49 -4.389 6.895 2.304 1.00 0.00 C ATOM 795 O MET A 49 -4.581 7.640 1.364 1.00 0.00 O ATOM 796 CB MET A 49 -2.583 5.418 1.404 1.00 0.00 C ATOM 797 CG MET A 49 -2.026 3.994 1.460 1.00 0.00 C ATOM 798 SD MET A 49 -0.304 3.989 0.896 1.00 0.00 S ATOM 799 CE MET A 49 0.438 4.707 2.383 1.00 0.00 C ATOM 0 H MET A 49 -5.318 5.326 0.486 1.00 0.00 H new ATOM 0 HA MET A 49 -3.863 4.955 3.064 1.00 0.00 H new ATOM 0 HB2 MET A 49 -2.681 5.743 0.368 1.00 0.00 H new ATOM 0 HB3 MET A 49 -1.896 6.110 1.891 1.00 0.00 H new ATOM 0 HG2 MET A 49 -2.086 3.609 2.478 1.00 0.00 H new ATOM 0 HG3 MET A 49 -2.626 3.334 0.834 1.00 0.00 H new ATOM 0 HE1 MET A 49 1.509 4.506 2.389 1.00 0.00 H new ATOM 0 HE2 MET A 49 0.271 5.784 2.389 1.00 0.00 H new ATOM 0 HE3 MET A 49 -0.019 4.264 3.268 1.00 0.00 H new ATOM 809 N ALA A 50 -4.579 7.289 3.529 1.00 0.00 N ATOM 810 CA ALA A 50 -5.037 8.679 3.790 1.00 0.00 C ATOM 811 C ALA A 50 -6.504 8.796 3.367 1.00 0.00 C ATOM 812 O ALA A 50 -6.923 9.787 2.804 1.00 0.00 O ATOM 813 CB ALA A 50 -4.182 9.648 2.976 1.00 0.00 C ATOM 0 H ALA A 50 -4.438 6.712 4.358 1.00 0.00 H new ATOM 0 HA ALA A 50 -4.940 8.920 4.849 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -4.512 10.670 3.163 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -3.137 9.545 3.269 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.285 9.421 1.915 1.00 0.00 H new ATOM 819 N LYS A 51 -7.274 7.780 3.643 1.00 0.00 N ATOM 820 CA LYS A 51 -8.723 7.789 3.285 1.00 0.00 C ATOM 821 C LYS A 51 -8.892 7.959 1.772 1.00 0.00 C ATOM 822 O LYS A 51 -9.940 8.349 1.294 1.00 0.00 O ATOM 823 CB LYS A 51 -9.408 8.946 4.012 1.00 0.00 C ATOM 824 CG LYS A 51 -9.183 8.794 5.516 1.00 0.00 C ATOM 825 CD LYS A 51 -9.873 9.940 6.246 1.00 0.00 C ATOM 826 CE LYS A 51 -9.434 9.952 7.712 1.00 0.00 C ATOM 827 NZ LYS A 51 -9.816 8.664 8.359 1.00 0.00 N ATOM 0 H LYS A 51 -6.956 6.930 4.109 1.00 0.00 H new ATOM 0 HA LYS A 51 -9.175 6.843 3.584 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -9.006 9.898 3.666 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -10.475 8.951 3.790 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -9.578 7.838 5.860 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -8.116 8.796 5.738 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -9.622 10.889 5.773 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -10.955 9.827 6.181 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -8.356 10.098 7.778 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -9.901 10.786 8.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -9.770 8.768 9.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -10.785 8.409 8.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -9.160 7.916 8.057 1.00 0.00 H new ATOM 841 N SER A 52 -7.875 7.660 1.012 1.00 0.00 N ATOM 842 CA SER A 52 -7.982 7.793 -0.472 1.00 0.00 C ATOM 843 C SER A 52 -7.280 6.607 -1.141 1.00 0.00 C ATOM 844 O SER A 52 -6.448 5.953 -0.547 1.00 0.00 O ATOM 845 CB SER A 52 -7.323 9.100 -0.913 1.00 0.00 C ATOM 846 OG SER A 52 -5.915 8.996 -0.751 1.00 0.00 O ATOM 0 H SER A 52 -6.973 7.329 1.353 1.00 0.00 H new ATOM 0 HA SER A 52 -9.032 7.802 -0.765 1.00 0.00 H new ATOM 0 HB2 SER A 52 -7.566 9.309 -1.955 1.00 0.00 H new ATOM 0 HB3 SER A 52 -7.708 9.932 -0.323 1.00 0.00 H new ATOM 0 HG SER A 52 -5.716 8.507 0.075 1.00 0.00 H new ATOM 852 N VAL A 53 -7.606 6.321 -2.374 1.00 0.00 N ATOM 853 CA VAL A 53 -6.948 5.174 -3.062 1.00 0.00 C ATOM 854 C VAL A 53 -5.482 5.511 -3.321 1.00 0.00 C ATOM 855 O VAL A 53 -5.132 6.648 -3.567 1.00 0.00 O ATOM 856 CB VAL A 53 -7.649 4.875 -4.394 1.00 0.00 C ATOM 857 CG1 VAL A 53 -9.088 4.438 -4.127 1.00 0.00 C ATOM 858 CG2 VAL A 53 -7.657 6.126 -5.282 1.00 0.00 C ATOM 0 H VAL A 53 -8.294 6.828 -2.930 1.00 0.00 H new ATOM 0 HA VAL A 53 -7.017 4.293 -2.424 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.109 4.078 -4.905 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -9.585 4.226 -5.073 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -9.087 3.541 -3.508 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -9.620 5.235 -3.608 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -8.157 5.900 -6.224 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.188 6.930 -4.773 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -6.632 6.437 -5.481 1.00 0.00 H new ATOM 868 N LEU A 54 -4.619 4.535 -3.269 1.00 0.00 N ATOM 869 CA LEU A 54 -3.182 4.818 -3.518 1.00 0.00 C ATOM 870 C LEU A 54 -2.957 4.953 -5.022 1.00 0.00 C ATOM 871 O LEU A 54 -3.302 4.085 -5.799 1.00 0.00 O ATOM 872 CB LEU A 54 -2.328 3.674 -2.964 1.00 0.00 C ATOM 873 CG LEU A 54 -0.847 3.968 -3.217 1.00 0.00 C ATOM 874 CD1 LEU A 54 -0.421 5.202 -2.420 1.00 0.00 C ATOM 875 CD2 LEU A 54 -0.008 2.765 -2.778 1.00 0.00 C ATOM 0 H LEU A 54 -4.846 3.561 -3.066 1.00 0.00 H new ATOM 0 HA LEU A 54 -2.896 5.745 -3.021 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.508 3.557 -1.895 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -2.609 2.734 -3.439 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.693 4.155 -4.280 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.634 5.407 -2.603 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -1.017 6.060 -2.731 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.576 5.020 -1.357 1.00 0.00 H new ATOM 0 HD21 LEU A 54 1.047 2.972 -2.957 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -0.166 2.580 -1.716 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -0.307 1.885 -3.348 1.00 0.00 H new ATOM 887 N ASP A 55 -2.400 6.056 -5.432 1.00 0.00 N ATOM 888 CA ASP A 55 -2.166 6.293 -6.884 1.00 0.00 C ATOM 889 C ASP A 55 -1.190 5.255 -7.445 1.00 0.00 C ATOM 890 O ASP A 55 0.011 5.388 -7.312 1.00 0.00 O ATOM 891 CB ASP A 55 -1.559 7.685 -7.053 1.00 0.00 C ATOM 892 CG ASP A 55 -2.496 8.730 -6.449 1.00 0.00 C ATOM 893 OD1 ASP A 55 -3.560 8.348 -5.990 1.00 0.00 O ATOM 894 OD2 ASP A 55 -2.133 9.894 -6.451 1.00 0.00 O ATOM 0 H ASP A 55 -2.094 6.811 -4.819 1.00 0.00 H new ATOM 0 HA ASP A 55 -3.112 6.213 -7.420 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -0.585 7.730 -6.565 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -1.396 7.896 -8.110 1.00 0.00 H new ATOM 899 N LEU A 56 -1.687 4.223 -8.076 1.00 0.00 N ATOM 900 CA LEU A 56 -0.768 3.200 -8.636 1.00 0.00 C ATOM 901 C LEU A 56 0.213 3.892 -9.579 1.00 0.00 C ATOM 902 O LEU A 56 1.319 3.433 -9.790 1.00 0.00 O ATOM 903 CB LEU A 56 -1.569 2.155 -9.417 1.00 0.00 C ATOM 904 CG LEU A 56 -2.697 1.612 -8.541 1.00 0.00 C ATOM 905 CD1 LEU A 56 -3.539 0.626 -9.354 1.00 0.00 C ATOM 906 CD2 LEU A 56 -2.104 0.891 -7.327 1.00 0.00 C ATOM 0 H LEU A 56 -2.681 4.049 -8.225 1.00 0.00 H new ATOM 0 HA LEU A 56 -0.230 2.705 -7.828 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -1.981 2.600 -10.323 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -0.915 1.341 -9.731 1.00 0.00 H new ATOM 0 HG LEU A 56 -3.322 2.438 -8.202 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -4.345 0.237 -8.732 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.963 1.136 -10.219 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.910 -0.198 -9.691 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.910 0.505 -6.704 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -1.478 0.065 -7.664 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -1.501 1.590 -6.748 1.00 0.00 H new ATOM 918 N TYR A 57 -0.190 4.984 -10.171 1.00 0.00 N ATOM 919 CA TYR A 57 0.712 5.683 -11.120 1.00 0.00 C ATOM 920 C TYR A 57 1.785 6.497 -10.391 1.00 0.00 C ATOM 921 O TYR A 57 2.964 6.269 -10.573 1.00 0.00 O ATOM 922 CB TYR A 57 -0.105 6.618 -12.011 1.00 0.00 C ATOM 923 CG TYR A 57 0.829 7.315 -12.966 1.00 0.00 C ATOM 924 CD1 TYR A 57 1.598 6.559 -13.847 1.00 0.00 C ATOM 925 CD2 TYR A 57 0.926 8.707 -12.970 1.00 0.00 C ATOM 926 CE1 TYR A 57 2.466 7.176 -14.739 1.00 0.00 C ATOM 927 CE2 TYR A 57 1.799 9.342 -13.864 1.00 0.00 C ATOM 928 CZ TYR A 57 2.571 8.576 -14.752 1.00 0.00 C ATOM 929 OH TYR A 57 3.429 9.198 -15.635 1.00 0.00 O ATOM 0 H TYR A 57 -1.103 5.418 -10.037 1.00 0.00 H new ATOM 0 HA TYR A 57 1.211 4.923 -11.722 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -0.857 6.053 -12.562 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -0.638 7.349 -11.403 1.00 0.00 H new ATOM 0 HD1 TYR A 57 1.519 5.482 -13.837 1.00 0.00 H new ATOM 0 HD2 TYR A 57 0.330 9.293 -12.286 1.00 0.00 H new ATOM 0 HE1 TYR A 57 3.057 6.581 -15.419 1.00 0.00 H new ATOM 0 HE2 TYR A 57 1.878 10.419 -13.870 1.00 0.00 H new ATOM 0 HH TYR A 57 3.378 10.169 -15.512 1.00 0.00 H new ATOM 939 N GLU A 58 1.405 7.461 -9.592 1.00 0.00 N ATOM 940 CA GLU A 58 2.442 8.283 -8.902 1.00 0.00 C ATOM 941 C GLU A 58 3.338 7.370 -8.074 1.00 0.00 C ATOM 942 O GLU A 58 4.531 7.561 -8.002 1.00 0.00 O ATOM 943 CB GLU A 58 1.776 9.299 -7.975 1.00 0.00 C ATOM 944 CG GLU A 58 0.786 10.156 -8.766 1.00 0.00 C ATOM 945 CD GLU A 58 0.189 11.219 -7.841 1.00 0.00 C ATOM 946 OE1 GLU A 58 0.453 11.155 -6.652 1.00 0.00 O ATOM 947 OE2 GLU A 58 -0.521 12.078 -8.337 1.00 0.00 O ATOM 0 H GLU A 58 0.437 7.711 -9.390 1.00 0.00 H new ATOM 0 HA GLU A 58 3.033 8.811 -9.651 1.00 0.00 H new ATOM 0 HB2 GLU A 58 1.258 8.782 -7.167 1.00 0.00 H new ATOM 0 HB3 GLU A 58 2.532 9.934 -7.514 1.00 0.00 H new ATOM 0 HG2 GLU A 58 1.290 10.631 -9.608 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -0.005 9.531 -9.179 1.00 0.00 H new ATOM 954 N LEU A 59 2.781 6.367 -7.464 1.00 0.00 N ATOM 955 CA LEU A 59 3.625 5.444 -6.663 1.00 0.00 C ATOM 956 C LEU A 59 4.686 4.853 -7.582 1.00 0.00 C ATOM 957 O LEU A 59 5.856 4.830 -7.274 1.00 0.00 O ATOM 958 CB LEU A 59 2.739 4.329 -6.101 1.00 0.00 C ATOM 959 CG LEU A 59 3.578 3.358 -5.263 1.00 0.00 C ATOM 960 CD1 LEU A 59 4.078 4.071 -4.007 1.00 0.00 C ATOM 961 CD2 LEU A 59 2.719 2.146 -4.865 1.00 0.00 C ATOM 0 H LEU A 59 1.785 6.147 -7.484 1.00 0.00 H new ATOM 0 HA LEU A 59 4.104 5.971 -5.838 1.00 0.00 H new ATOM 0 HB2 LEU A 59 1.946 4.758 -5.488 1.00 0.00 H new ATOM 0 HB3 LEU A 59 2.256 3.792 -6.917 1.00 0.00 H new ATOM 0 HG LEU A 59 4.432 3.016 -5.848 1.00 0.00 H new ATOM 0 HD11 LEU A 59 4.675 3.381 -3.410 1.00 0.00 H new ATOM 0 HD12 LEU A 59 4.690 4.926 -4.293 1.00 0.00 H new ATOM 0 HD13 LEU A 59 3.226 4.415 -3.420 1.00 0.00 H new ATOM 0 HD21 LEU A 59 3.317 1.456 -4.269 1.00 0.00 H new ATOM 0 HD22 LEU A 59 1.863 2.483 -4.280 1.00 0.00 H new ATOM 0 HD23 LEU A 59 2.367 1.639 -5.763 1.00 0.00 H new ATOM 973 N TYR A 60 4.274 4.400 -8.724 1.00 0.00 N ATOM 974 CA TYR A 60 5.225 3.817 -9.702 1.00 0.00 C ATOM 975 C TYR A 60 6.244 4.877 -10.142 1.00 0.00 C ATOM 976 O TYR A 60 7.421 4.772 -9.870 1.00 0.00 O ATOM 977 CB TYR A 60 4.404 3.369 -10.909 1.00 0.00 C ATOM 978 CG TYR A 60 5.227 2.510 -11.827 1.00 0.00 C ATOM 979 CD1 TYR A 60 5.459 1.175 -11.500 1.00 0.00 C ATOM 980 CD2 TYR A 60 5.732 3.041 -13.017 1.00 0.00 C ATOM 981 CE1 TYR A 60 6.196 0.364 -12.363 1.00 0.00 C ATOM 982 CE2 TYR A 60 6.475 2.230 -13.881 1.00 0.00 C ATOM 983 CZ TYR A 60 6.706 0.890 -13.555 1.00 0.00 C ATOM 984 OH TYR A 60 7.430 0.086 -14.410 1.00 0.00 O ATOM 0 H TYR A 60 3.300 4.408 -9.028 1.00 0.00 H new ATOM 0 HA TYR A 60 5.769 2.982 -9.260 1.00 0.00 H new ATOM 0 HB2 TYR A 60 3.528 2.814 -10.573 1.00 0.00 H new ATOM 0 HB3 TYR A 60 4.040 4.242 -11.450 1.00 0.00 H new ATOM 0 HD1 TYR A 60 5.068 0.769 -10.579 1.00 0.00 H new ATOM 0 HD2 TYR A 60 5.549 4.075 -13.269 1.00 0.00 H new ATOM 0 HE1 TYR A 60 6.373 -0.671 -12.111 1.00 0.00 H new ATOM 0 HE2 TYR A 60 6.870 2.639 -14.799 1.00 0.00 H new ATOM 0 HH TYR A 60 7.709 0.607 -15.191 1.00 0.00 H new ATOM 994 N ASN A 61 5.792 5.882 -10.841 1.00 0.00 N ATOM 995 CA ASN A 61 6.717 6.940 -11.347 1.00 0.00 C ATOM 996 C ASN A 61 7.778 7.294 -10.302 1.00 0.00 C ATOM 997 O ASN A 61 8.935 7.469 -10.631 1.00 0.00 O ATOM 998 CB ASN A 61 5.909 8.194 -11.693 1.00 0.00 C ATOM 999 CG ASN A 61 6.777 9.149 -12.513 1.00 0.00 C ATOM 1000 OD1 ASN A 61 7.751 8.741 -13.113 1.00 0.00 O ATOM 1001 ND2 ASN A 61 6.466 10.416 -12.563 1.00 0.00 N ATOM 0 H ASN A 61 4.811 6.018 -11.086 1.00 0.00 H new ATOM 0 HA ASN A 61 7.223 6.559 -12.234 1.00 0.00 H new ATOM 0 HB2 ASN A 61 5.017 7.921 -12.257 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.571 8.685 -10.781 1.00 0.00 H new ATOM 0 HD21 ASN A 61 7.041 11.061 -13.105 1.00 0.00 H new ATOM 0 HD22 ASN A 61 5.648 10.761 -12.060 1.00 0.00 H new ATOM 1008 N LEU A 62 7.420 7.387 -9.053 1.00 0.00 N ATOM 1009 CA LEU A 62 8.468 7.718 -8.047 1.00 0.00 C ATOM 1010 C LEU A 62 9.334 6.481 -7.844 1.00 0.00 C ATOM 1011 O LEU A 62 10.541 6.560 -7.857 1.00 0.00 O ATOM 1012 CB LEU A 62 7.860 8.168 -6.705 1.00 0.00 C ATOM 1013 CG LEU A 62 6.952 9.399 -6.889 1.00 0.00 C ATOM 1014 CD1 LEU A 62 6.768 10.109 -5.552 1.00 0.00 C ATOM 1015 CD2 LEU A 62 7.558 10.390 -7.890 1.00 0.00 C ATOM 0 H LEU A 62 6.476 7.253 -8.691 1.00 0.00 H new ATOM 0 HA LEU A 62 9.064 8.552 -8.417 1.00 0.00 H new ATOM 0 HB2 LEU A 62 7.285 7.350 -6.271 1.00 0.00 H new ATOM 0 HB3 LEU A 62 8.659 8.404 -6.002 1.00 0.00 H new ATOM 0 HG LEU A 62 5.992 9.051 -7.271 1.00 0.00 H new ATOM 0 HD11 LEU A 62 6.125 10.979 -5.687 1.00 0.00 H new ATOM 0 HD12 LEU A 62 6.309 9.426 -4.838 1.00 0.00 H new ATOM 0 HD13 LEU A 62 7.739 10.430 -5.174 1.00 0.00 H new ATOM 0 HD21 LEU A 62 6.895 11.248 -7.999 1.00 0.00 H new ATOM 0 HD22 LEU A 62 8.529 10.726 -7.527 1.00 0.00 H new ATOM 0 HD23 LEU A 62 7.681 9.901 -8.857 1.00 0.00 H new ATOM 1027 N VAL A 63 8.739 5.336 -7.675 1.00 0.00 N ATOM 1028 CA VAL A 63 9.566 4.111 -7.484 1.00 0.00 C ATOM 1029 C VAL A 63 10.570 3.975 -8.638 1.00 0.00 C ATOM 1030 O VAL A 63 11.729 3.688 -8.418 1.00 0.00 O ATOM 1031 CB VAL A 63 8.655 2.870 -7.416 1.00 0.00 C ATOM 1032 CG1 VAL A 63 9.494 1.606 -7.581 1.00 0.00 C ATOM 1033 CG2 VAL A 63 7.946 2.817 -6.046 1.00 0.00 C ATOM 0 H VAL A 63 7.729 5.193 -7.660 1.00 0.00 H new ATOM 0 HA VAL A 63 10.118 4.192 -6.547 1.00 0.00 H new ATOM 0 HB VAL A 63 7.915 2.932 -8.214 1.00 0.00 H new ATOM 0 HG11 VAL A 63 8.846 0.731 -7.532 1.00 0.00 H new ATOM 0 HG12 VAL A 63 10.001 1.629 -8.546 1.00 0.00 H new ATOM 0 HG13 VAL A 63 10.235 1.554 -6.783 1.00 0.00 H new ATOM 0 HG21 VAL A 63 7.303 1.938 -6.003 1.00 0.00 H new ATOM 0 HG22 VAL A 63 8.691 2.761 -5.253 1.00 0.00 H new ATOM 0 HG23 VAL A 63 7.342 3.715 -5.914 1.00 0.00 H new ATOM 1043 N ILE A 64 10.155 4.187 -9.861 1.00 0.00 N ATOM 1044 CA ILE A 64 11.129 4.070 -10.989 1.00 0.00 C ATOM 1045 C ILE A 64 12.125 5.219 -10.866 1.00 0.00 C ATOM 1046 O ILE A 64 13.297 5.090 -11.160 1.00 0.00 O ATOM 1047 CB ILE A 64 10.403 4.178 -12.338 1.00 0.00 C ATOM 1048 CG1 ILE A 64 9.096 3.387 -12.301 1.00 0.00 C ATOM 1049 CG2 ILE A 64 11.293 3.593 -13.439 1.00 0.00 C ATOM 1050 CD1 ILE A 64 9.365 1.990 -11.759 1.00 0.00 C ATOM 0 H ILE A 64 9.201 4.432 -10.125 1.00 0.00 H new ATOM 0 HA ILE A 64 11.634 3.105 -10.943 1.00 0.00 H new ATOM 0 HB ILE A 64 10.188 5.228 -12.537 1.00 0.00 H new ATOM 0 HG12 ILE A 64 8.366 3.898 -11.673 1.00 0.00 H new ATOM 0 HG13 ILE A 64 8.668 3.325 -13.301 1.00 0.00 H new ATOM 0 HG21 ILE A 64 10.781 3.668 -14.399 1.00 0.00 H new ATOM 0 HG22 ILE A 64 12.230 4.149 -13.483 1.00 0.00 H new ATOM 0 HG23 ILE A 64 11.502 2.546 -13.220 1.00 0.00 H new ATOM 0 HD11 ILE A 64 8.434 1.425 -11.732 1.00 0.00 H new ATOM 0 HD12 ILE A 64 10.080 1.481 -12.405 1.00 0.00 H new ATOM 0 HD13 ILE A 64 9.774 2.063 -10.751 1.00 0.00 H new ATOM 1062 N ALA A 65 11.640 6.351 -10.446 1.00 0.00 N ATOM 1063 CA ALA A 65 12.513 7.546 -10.307 1.00 0.00 C ATOM 1064 C ALA A 65 13.652 7.272 -9.318 1.00 0.00 C ATOM 1065 O ALA A 65 14.630 7.994 -9.288 1.00 0.00 O ATOM 1066 CB ALA A 65 11.679 8.732 -9.815 1.00 0.00 C ATOM 0 H ALA A 65 10.664 6.501 -10.190 1.00 0.00 H new ATOM 0 HA ALA A 65 12.947 7.778 -11.280 1.00 0.00 H new ATOM 0 HB1 ALA A 65 12.318 9.609 -9.713 1.00 0.00 H new ATOM 0 HB2 ALA A 65 10.887 8.942 -10.533 1.00 0.00 H new ATOM 0 HB3 ALA A 65 11.237 8.490 -8.848 1.00 0.00 H new ATOM 1072 N ARG A 66 13.567 6.238 -8.516 1.00 0.00 N ATOM 1073 CA ARG A 66 14.677 5.947 -7.561 1.00 0.00 C ATOM 1074 C ARG A 66 15.571 4.866 -8.169 1.00 0.00 C ATOM 1075 O ARG A 66 16.546 4.437 -7.585 1.00 0.00 O ATOM 1076 CB ARG A 66 14.093 5.444 -6.240 1.00 0.00 C ATOM 1077 CG ARG A 66 13.007 6.403 -5.756 1.00 0.00 C ATOM 1078 CD ARG A 66 13.637 7.713 -5.299 1.00 0.00 C ATOM 1079 NE ARG A 66 12.630 8.490 -4.510 1.00 0.00 N ATOM 1080 CZ ARG A 66 11.468 8.812 -5.021 1.00 0.00 C ATOM 1081 NH1 ARG A 66 11.230 8.619 -6.289 1.00 0.00 N ATOM 1082 NH2 ARG A 66 10.553 9.367 -4.273 1.00 0.00 N ATOM 0 H ARG A 66 12.782 5.588 -8.483 1.00 0.00 H new ATOM 0 HA ARG A 66 15.258 6.850 -7.374 1.00 0.00 H new ATOM 0 HB2 ARG A 66 13.676 4.446 -6.373 1.00 0.00 H new ATOM 0 HB3 ARG A 66 14.881 5.364 -5.491 1.00 0.00 H new ATOM 0 HG2 ARG A 66 12.294 6.593 -6.558 1.00 0.00 H new ATOM 0 HG3 ARG A 66 12.450 5.951 -4.935 1.00 0.00 H new ATOM 0 HD2 ARG A 66 14.519 7.514 -4.691 1.00 0.00 H new ATOM 0 HD3 ARG A 66 13.968 8.292 -6.161 1.00 0.00 H new ATOM 0 HE ARG A 66 12.853 8.774 -3.556 1.00 0.00 H new ATOM 0 HH11 ARG A 66 11.951 8.216 -6.888 1.00 0.00 H new ATOM 0 HH12 ARG A 66 10.323 8.872 -6.682 1.00 0.00 H new ATOM 0 HH21 ARG A 66 10.742 9.551 -3.288 1.00 0.00 H new ATOM 0 HH22 ARG A 66 9.649 9.617 -4.674 1.00 0.00 H new ATOM 1096 N GLY A 67 15.243 4.445 -9.356 1.00 0.00 N ATOM 1097 CA GLY A 67 16.065 3.410 -10.043 1.00 0.00 C ATOM 1098 C GLY A 67 15.665 1.991 -9.609 1.00 0.00 C ATOM 1099 O GLY A 67 16.365 1.042 -9.906 1.00 0.00 O ATOM 0 H GLY A 67 14.435 4.775 -9.885 1.00 0.00 H new ATOM 0 HA2 GLY A 67 15.947 3.508 -11.122 1.00 0.00 H new ATOM 0 HA3 GLY A 67 17.119 3.575 -9.821 1.00 0.00 H new ATOM 1103 N GLY A 68 14.547 1.813 -8.940 1.00 0.00 N ATOM 1104 CA GLY A 68 14.140 0.421 -8.542 1.00 0.00 C ATOM 1105 C GLY A 68 13.662 0.359 -7.086 1.00 0.00 C ATOM 1106 O GLY A 68 14.242 0.950 -6.197 1.00 0.00 O ATOM 0 H GLY A 68 13.908 2.556 -8.656 1.00 0.00 H new ATOM 0 HA2 GLY A 68 13.344 0.073 -9.200 1.00 0.00 H new ATOM 0 HA3 GLY A 68 14.983 -0.256 -8.676 1.00 0.00 H new ATOM 1110 N LEU A 69 12.592 -0.361 -6.852 1.00 0.00 N ATOM 1111 CA LEU A 69 12.028 -0.494 -5.475 1.00 0.00 C ATOM 1112 C LEU A 69 13.123 -0.926 -4.491 1.00 0.00 C ATOM 1113 O LEU A 69 13.193 -0.441 -3.379 1.00 0.00 O ATOM 1114 CB LEU A 69 10.940 -1.575 -5.503 1.00 0.00 C ATOM 1115 CG LEU A 69 10.046 -1.480 -4.251 1.00 0.00 C ATOM 1116 CD1 LEU A 69 8.960 -0.404 -4.440 1.00 0.00 C ATOM 1117 CD2 LEU A 69 9.377 -2.839 -4.007 1.00 0.00 C ATOM 0 H LEU A 69 12.078 -0.870 -7.571 1.00 0.00 H new ATOM 0 HA LEU A 69 11.620 0.465 -5.156 1.00 0.00 H new ATOM 0 HB2 LEU A 69 10.331 -1.462 -6.400 1.00 0.00 H new ATOM 0 HB3 LEU A 69 11.401 -2.561 -5.553 1.00 0.00 H new ATOM 0 HG LEU A 69 10.664 -1.206 -3.396 1.00 0.00 H new ATOM 0 HD11 LEU A 69 8.339 -0.352 -3.545 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.432 0.564 -4.610 1.00 0.00 H new ATOM 0 HD13 LEU A 69 8.339 -0.661 -5.298 1.00 0.00 H new ATOM 0 HD21 LEU A 69 8.743 -2.779 -3.122 1.00 0.00 H new ATOM 0 HD22 LEU A 69 8.769 -3.106 -4.872 1.00 0.00 H new ATOM 0 HD23 LEU A 69 10.143 -3.599 -3.853 1.00 0.00 H new ATOM 1129 N VAL A 70 13.969 -1.844 -4.880 1.00 0.00 N ATOM 1130 CA VAL A 70 15.040 -2.305 -3.951 1.00 0.00 C ATOM 1131 C VAL A 70 15.893 -1.108 -3.524 1.00 0.00 C ATOM 1132 O VAL A 70 16.236 -0.960 -2.368 1.00 0.00 O ATOM 1133 CB VAL A 70 15.920 -3.353 -4.652 1.00 0.00 C ATOM 1134 CG1 VAL A 70 17.051 -3.793 -3.714 1.00 0.00 C ATOM 1135 CG2 VAL A 70 15.061 -4.569 -5.028 1.00 0.00 C ATOM 0 H VAL A 70 13.964 -2.292 -5.796 1.00 0.00 H new ATOM 0 HA VAL A 70 14.587 -2.757 -3.069 1.00 0.00 H new ATOM 0 HB VAL A 70 16.352 -2.918 -5.553 1.00 0.00 H new ATOM 0 HG11 VAL A 70 17.672 -4.536 -4.216 1.00 0.00 H new ATOM 0 HG12 VAL A 70 17.661 -2.929 -3.449 1.00 0.00 H new ATOM 0 HG13 VAL A 70 16.625 -4.227 -2.809 1.00 0.00 H new ATOM 0 HG21 VAL A 70 15.682 -5.314 -5.525 1.00 0.00 H new ATOM 0 HG22 VAL A 70 14.628 -5.001 -4.126 1.00 0.00 H new ATOM 0 HG23 VAL A 70 14.262 -4.256 -5.700 1.00 0.00 H new ATOM 1145 N ASP A 71 16.244 -0.256 -4.443 1.00 0.00 N ATOM 1146 CA ASP A 71 17.075 0.925 -4.078 1.00 0.00 C ATOM 1147 C ASP A 71 16.356 1.732 -2.993 1.00 0.00 C ATOM 1148 O ASP A 71 16.959 2.207 -2.058 1.00 0.00 O ATOM 1149 CB ASP A 71 17.278 1.797 -5.319 1.00 0.00 C ATOM 1150 CG ASP A 71 18.120 1.033 -6.343 1.00 0.00 C ATOM 1151 OD1 ASP A 71 18.759 0.069 -5.954 1.00 0.00 O ATOM 1152 OD2 ASP A 71 18.107 1.421 -7.500 1.00 0.00 O ATOM 0 H ASP A 71 15.993 -0.324 -5.429 1.00 0.00 H new ATOM 0 HA ASP A 71 18.044 0.596 -3.702 1.00 0.00 H new ATOM 0 HB2 ASP A 71 16.314 2.064 -5.751 1.00 0.00 H new ATOM 0 HB3 ASP A 71 17.774 2.728 -5.046 1.00 0.00 H new ATOM 1157 N VAL A 72 15.067 1.874 -3.113 1.00 0.00 N ATOM 1158 CA VAL A 72 14.286 2.641 -2.096 1.00 0.00 C ATOM 1159 C VAL A 72 14.405 1.967 -0.733 1.00 0.00 C ATOM 1160 O VAL A 72 14.579 2.620 0.268 1.00 0.00 O ATOM 1161 CB VAL A 72 12.818 2.677 -2.534 1.00 0.00 C ATOM 1162 CG1 VAL A 72 11.978 3.502 -1.557 1.00 0.00 C ATOM 1163 CG2 VAL A 72 12.723 3.290 -3.932 1.00 0.00 C ATOM 0 H VAL A 72 14.513 1.489 -3.878 1.00 0.00 H new ATOM 0 HA VAL A 72 14.675 3.656 -2.017 1.00 0.00 H new ATOM 0 HB VAL A 72 12.432 1.658 -2.546 1.00 0.00 H new ATOM 0 HG11 VAL A 72 10.940 3.513 -1.889 1.00 0.00 H new ATOM 0 HG12 VAL A 72 12.036 3.059 -0.563 1.00 0.00 H new ATOM 0 HG13 VAL A 72 12.358 4.523 -1.522 1.00 0.00 H new ATOM 0 HG21 VAL A 72 11.680 3.317 -4.247 1.00 0.00 H new ATOM 0 HG22 VAL A 72 13.123 4.304 -3.913 1.00 0.00 H new ATOM 0 HG23 VAL A 72 13.298 2.686 -4.634 1.00 0.00 H new ATOM 1173 N ILE A 73 14.304 0.674 -0.672 1.00 0.00 N ATOM 1174 CA ILE A 73 14.403 -0.006 0.648 1.00 0.00 C ATOM 1175 C ILE A 73 15.812 0.161 1.231 1.00 0.00 C ATOM 1176 O ILE A 73 15.986 0.682 2.315 1.00 0.00 O ATOM 1177 CB ILE A 73 14.090 -1.493 0.473 1.00 0.00 C ATOM 1178 CG1 ILE A 73 12.666 -1.637 -0.067 1.00 0.00 C ATOM 1179 CG2 ILE A 73 14.194 -2.200 1.826 1.00 0.00 C ATOM 1180 CD1 ILE A 73 12.401 -3.087 -0.476 1.00 0.00 C ATOM 0 H ILE A 73 14.158 0.059 -1.472 1.00 0.00 H new ATOM 0 HA ILE A 73 13.687 0.444 1.336 1.00 0.00 H new ATOM 0 HB ILE A 73 14.799 -1.941 -0.223 1.00 0.00 H new ATOM 0 HG12 ILE A 73 11.948 -1.329 0.693 1.00 0.00 H new ATOM 0 HG13 ILE A 73 12.526 -0.978 -0.924 1.00 0.00 H new ATOM 0 HG21 ILE A 73 13.971 -3.260 1.701 1.00 0.00 H new ATOM 0 HG22 ILE A 73 15.204 -2.086 2.219 1.00 0.00 H new ATOM 0 HG23 ILE A 73 13.481 -1.759 2.523 1.00 0.00 H new ATOM 0 HD11 ILE A 73 11.384 -3.177 -0.859 1.00 0.00 H new ATOM 0 HD12 ILE A 73 13.108 -3.381 -1.252 1.00 0.00 H new ATOM 0 HD13 ILE A 73 12.521 -3.737 0.390 1.00 0.00 H new ATOM 1192 N ASN A 74 16.817 -0.285 0.527 1.00 0.00 N ATOM 1193 CA ASN A 74 18.208 -0.167 1.038 1.00 0.00 C ATOM 1194 C ASN A 74 18.556 1.292 1.321 1.00 0.00 C ATOM 1195 O ASN A 74 19.187 1.603 2.312 1.00 0.00 O ATOM 1196 CB ASN A 74 19.174 -0.734 -0.003 1.00 0.00 C ATOM 1197 CG ASN A 74 18.935 -2.238 -0.153 1.00 0.00 C ATOM 1198 OD1 ASN A 74 18.500 -2.891 0.775 1.00 0.00 O ATOM 1199 ND2 ASN A 74 19.198 -2.819 -1.291 1.00 0.00 N ATOM 0 H ASN A 74 16.731 -0.729 -0.387 1.00 0.00 H new ATOM 0 HA ASN A 74 18.292 -0.728 1.969 1.00 0.00 H new ATOM 0 HB2 ASN A 74 19.028 -0.234 -0.961 1.00 0.00 H new ATOM 0 HB3 ASN A 74 20.204 -0.547 0.301 1.00 0.00 H new ATOM 0 HD21 ASN A 74 19.038 -3.820 -1.401 1.00 0.00 H new ATOM 0 HD22 ASN A 74 19.563 -2.272 -2.071 1.00 0.00 H new ATOM 1206 N LYS A 75 18.154 2.196 0.465 1.00 0.00 N ATOM 1207 CA LYS A 75 18.475 3.630 0.710 1.00 0.00 C ATOM 1208 C LYS A 75 17.326 4.314 1.456 1.00 0.00 C ATOM 1209 O LYS A 75 17.442 5.445 1.880 1.00 0.00 O ATOM 1210 CB LYS A 75 18.724 4.360 -0.619 1.00 0.00 C ATOM 1211 CG LYS A 75 20.120 4.024 -1.166 1.00 0.00 C ATOM 1212 CD LYS A 75 20.084 2.686 -1.910 1.00 0.00 C ATOM 1213 CE LYS A 75 21.504 2.300 -2.327 1.00 0.00 C ATOM 1214 NZ LYS A 75 21.536 0.858 -2.702 1.00 0.00 N ATOM 0 H LYS A 75 17.623 2.004 -0.384 1.00 0.00 H new ATOM 0 HA LYS A 75 19.378 3.676 1.319 1.00 0.00 H new ATOM 0 HB2 LYS A 75 17.964 4.073 -1.346 1.00 0.00 H new ATOM 0 HB3 LYS A 75 18.634 5.436 -0.472 1.00 0.00 H new ATOM 0 HG2 LYS A 75 20.456 4.814 -1.838 1.00 0.00 H new ATOM 0 HG3 LYS A 75 20.838 3.975 -0.347 1.00 0.00 H new ATOM 0 HD2 LYS A 75 19.658 1.913 -1.271 1.00 0.00 H new ATOM 0 HD3 LYS A 75 19.443 2.763 -2.788 1.00 0.00 H new ATOM 0 HE2 LYS A 75 21.827 2.913 -3.168 1.00 0.00 H new ATOM 0 HE3 LYS A 75 22.199 2.490 -1.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 22.501 0.594 -2.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 21.245 0.281 -1.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 20.884 0.691 -3.495 1.00 0.00 H new ATOM 1228 N LYS A 76 16.209 3.653 1.586 1.00 0.00 N ATOM 1229 CA LYS A 76 15.042 4.280 2.274 1.00 0.00 C ATOM 1230 C LYS A 76 14.644 5.561 1.545 1.00 0.00 C ATOM 1231 O LYS A 76 14.632 6.632 2.119 1.00 0.00 O ATOM 1232 CB LYS A 76 15.376 4.615 3.738 1.00 0.00 C ATOM 1233 CG LYS A 76 15.060 3.428 4.658 1.00 0.00 C ATOM 1234 CD LYS A 76 14.823 3.948 6.080 1.00 0.00 C ATOM 1235 CE LYS A 76 16.126 4.515 6.654 1.00 0.00 C ATOM 1236 NZ LYS A 76 16.117 4.374 8.140 1.00 0.00 N ATOM 0 H LYS A 76 16.052 2.704 1.245 1.00 0.00 H new ATOM 0 HA LYS A 76 14.217 3.568 2.259 1.00 0.00 H new ATOM 0 HB2 LYS A 76 16.431 4.876 3.824 1.00 0.00 H new ATOM 0 HB3 LYS A 76 14.805 5.488 4.055 1.00 0.00 H new ATOM 0 HG2 LYS A 76 14.178 2.898 4.299 1.00 0.00 H new ATOM 0 HG3 LYS A 76 15.885 2.716 4.650 1.00 0.00 H new ATOM 0 HD2 LYS A 76 14.054 4.720 6.070 1.00 0.00 H new ATOM 0 HD3 LYS A 76 14.457 3.141 6.715 1.00 0.00 H new ATOM 0 HE2 LYS A 76 16.982 3.987 6.233 1.00 0.00 H new ATOM 0 HE3 LYS A 76 16.231 5.564 6.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 17.001 4.759 8.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 15.308 4.897 8.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 16.035 3.369 8.393 1.00 0.00 H new ATOM 1250 N LEU A 77 14.300 5.470 0.294 1.00 0.00 N ATOM 1251 CA LEU A 77 13.890 6.696 -0.438 1.00 0.00 C ATOM 1252 C LEU A 77 12.368 6.820 -0.367 1.00 0.00 C ATOM 1253 O LEU A 77 11.759 7.576 -1.097 1.00 0.00 O ATOM 1254 CB LEU A 77 14.377 6.618 -1.889 1.00 0.00 C ATOM 1255 CG LEU A 77 15.909 6.487 -1.886 1.00 0.00 C ATOM 1256 CD1 LEU A 77 16.398 5.830 -3.185 1.00 0.00 C ATOM 1257 CD2 LEU A 77 16.548 7.881 -1.747 1.00 0.00 C ATOM 0 H LEU A 77 14.285 4.607 -0.250 1.00 0.00 H new ATOM 0 HA LEU A 77 14.337 7.581 0.016 1.00 0.00 H new ATOM 0 HB2 LEU A 77 13.925 5.764 -2.394 1.00 0.00 H new ATOM 0 HB3 LEU A 77 14.075 7.510 -2.438 1.00 0.00 H new ATOM 0 HG LEU A 77 16.202 5.861 -1.043 1.00 0.00 H new ATOM 0 HD11 LEU A 77 17.485 5.746 -3.164 1.00 0.00 H new ATOM 0 HD12 LEU A 77 15.959 4.837 -3.278 1.00 0.00 H new ATOM 0 HD13 LEU A 77 16.098 6.440 -4.037 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.634 7.785 -1.745 1.00 0.00 H new ATOM 0 HD22 LEU A 77 16.241 8.507 -2.584 1.00 0.00 H new ATOM 0 HD23 LEU A 77 16.223 8.339 -0.813 1.00 0.00 H new ATOM 1269 N TRP A 78 11.748 6.087 0.527 1.00 0.00 N ATOM 1270 CA TRP A 78 10.268 6.174 0.663 1.00 0.00 C ATOM 1271 C TRP A 78 9.894 7.585 1.092 1.00 0.00 C ATOM 1272 O TRP A 78 8.953 8.154 0.590 1.00 0.00 O ATOM 1273 CB TRP A 78 9.766 5.180 1.713 1.00 0.00 C ATOM 1274 CG TRP A 78 10.154 3.801 1.302 1.00 0.00 C ATOM 1275 CD1 TRP A 78 11.235 3.138 1.759 1.00 0.00 C ATOM 1276 CD2 TRP A 78 9.491 2.906 0.362 1.00 0.00 C ATOM 1277 NE1 TRP A 78 11.288 1.896 1.160 1.00 0.00 N ATOM 1278 CE2 TRP A 78 10.234 1.704 0.292 1.00 0.00 C ATOM 1279 CE3 TRP A 78 8.330 3.017 -0.430 1.00 0.00 C ATOM 1280 CZ2 TRP A 78 9.845 0.653 -0.531 1.00 0.00 C ATOM 1281 CZ3 TRP A 78 7.940 1.954 -1.259 1.00 0.00 C ATOM 1282 CH2 TRP A 78 8.697 0.780 -1.308 1.00 0.00 C ATOM 0 H TRP A 78 12.205 5.435 1.165 1.00 0.00 H new ATOM 0 HA TRP A 78 9.808 5.934 -0.296 1.00 0.00 H new ATOM 0 HB2 TRP A 78 10.192 5.416 2.688 1.00 0.00 H new ATOM 0 HB3 TRP A 78 8.683 5.252 1.812 1.00 0.00 H new ATOM 0 HD1 TRP A 78 11.945 3.518 2.478 1.00 0.00 H new ATOM 0 HE1 TRP A 78 12.017 1.205 1.337 1.00 0.00 H new ATOM 0 HE3 TRP A 78 7.740 3.921 -0.399 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 10.429 -0.255 -0.567 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 7.049 2.044 -1.863 1.00 0.00 H new ATOM 0 HH2 TRP A 78 8.390 -0.032 -1.951 1.00 0.00 H new ATOM 1293 N GLN A 79 10.622 8.180 2.001 1.00 0.00 N ATOM 1294 CA GLN A 79 10.261 9.564 2.407 1.00 0.00 C ATOM 1295 C GLN A 79 10.063 10.401 1.146 1.00 0.00 C ATOM 1296 O GLN A 79 9.157 11.207 1.060 1.00 0.00 O ATOM 1297 CB GLN A 79 11.388 10.152 3.253 1.00 0.00 C ATOM 1298 CG GLN A 79 11.493 9.366 4.558 1.00 0.00 C ATOM 1299 CD GLN A 79 12.681 9.874 5.371 1.00 0.00 C ATOM 1300 OE1 GLN A 79 13.013 11.042 5.326 1.00 0.00 O ATOM 1301 NE2 GLN A 79 13.343 9.033 6.113 1.00 0.00 N ATOM 0 H GLN A 79 11.433 7.776 2.469 1.00 0.00 H new ATOM 0 HA GLN A 79 9.343 9.561 2.995 1.00 0.00 H new ATOM 0 HB2 GLN A 79 12.331 10.105 2.709 1.00 0.00 H new ATOM 0 HB3 GLN A 79 11.192 11.204 3.462 1.00 0.00 H new ATOM 0 HG2 GLN A 79 10.574 9.474 5.133 1.00 0.00 H new ATOM 0 HG3 GLN A 79 11.613 8.304 4.345 1.00 0.00 H new ATOM 0 HE21 GLN A 79 13.062 8.053 6.149 1.00 0.00 H new ATOM 0 HE22 GLN A 79 14.143 9.354 6.659 1.00 0.00 H new ATOM 1310 N GLU A 80 10.883 10.197 0.150 1.00 0.00 N ATOM 1311 CA GLU A 80 10.707 10.961 -1.113 1.00 0.00 C ATOM 1312 C GLU A 80 9.387 10.523 -1.748 1.00 0.00 C ATOM 1313 O GLU A 80 8.642 11.321 -2.282 1.00 0.00 O ATOM 1314 CB GLU A 80 11.871 10.659 -2.065 1.00 0.00 C ATOM 1315 CG GLU A 80 13.155 11.276 -1.514 1.00 0.00 C ATOM 1316 CD GLU A 80 13.022 12.799 -1.487 1.00 0.00 C ATOM 1317 OE1 GLU A 80 12.129 13.308 -2.144 1.00 0.00 O ATOM 1318 OE2 GLU A 80 13.816 13.432 -0.811 1.00 0.00 O ATOM 0 H GLU A 80 11.662 9.538 0.158 1.00 0.00 H new ATOM 0 HA GLU A 80 10.692 12.032 -0.913 1.00 0.00 H new ATOM 0 HB2 GLU A 80 11.992 9.582 -2.178 1.00 0.00 H new ATOM 0 HB3 GLU A 80 11.658 11.061 -3.056 1.00 0.00 H new ATOM 0 HG2 GLU A 80 13.349 10.900 -0.509 1.00 0.00 H new ATOM 0 HG3 GLU A 80 14.004 10.986 -2.133 1.00 0.00 H new ATOM 1325 N ILE A 81 9.086 9.254 -1.668 1.00 0.00 N ATOM 1326 CA ILE A 81 7.804 8.747 -2.236 1.00 0.00 C ATOM 1327 C ILE A 81 6.654 9.145 -1.309 1.00 0.00 C ATOM 1328 O ILE A 81 5.670 9.716 -1.728 1.00 0.00 O ATOM 1329 CB ILE A 81 7.859 7.225 -2.347 1.00 0.00 C ATOM 1330 CG1 ILE A 81 9.084 6.831 -3.176 1.00 0.00 C ATOM 1331 CG2 ILE A 81 6.587 6.715 -3.032 1.00 0.00 C ATOM 1332 CD1 ILE A 81 8.943 5.388 -3.659 1.00 0.00 C ATOM 0 H ILE A 81 9.675 8.545 -1.232 1.00 0.00 H new ATOM 0 HA ILE A 81 7.648 9.176 -3.226 1.00 0.00 H new ATOM 0 HB ILE A 81 7.931 6.784 -1.353 1.00 0.00 H new ATOM 0 HG12 ILE A 81 9.187 7.501 -4.030 1.00 0.00 H new ATOM 0 HG13 ILE A 81 9.989 6.936 -2.577 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.627 5.629 -3.111 1.00 0.00 H new ATOM 0 HG22 ILE A 81 5.716 7.004 -2.444 1.00 0.00 H new ATOM 0 HG23 ILE A 81 6.512 7.149 -4.029 1.00 0.00 H new ATOM 0 HD11 ILE A 81 9.818 5.114 -4.248 1.00 0.00 H new ATOM 0 HD12 ILE A 81 8.862 4.723 -2.799 1.00 0.00 H new ATOM 0 HD13 ILE A 81 8.048 5.296 -4.274 1.00 0.00 H new ATOM 1344 N ILE A 82 6.773 8.836 -0.047 1.00 0.00 N ATOM 1345 CA ILE A 82 5.691 9.180 0.911 1.00 0.00 C ATOM 1346 C ILE A 82 5.341 10.659 0.757 1.00 0.00 C ATOM 1347 O ILE A 82 4.200 11.018 0.544 1.00 0.00 O ATOM 1348 CB ILE A 82 6.184 8.913 2.339 1.00 0.00 C ATOM 1349 CG1 ILE A 82 6.611 7.446 2.467 1.00 0.00 C ATOM 1350 CG2 ILE A 82 5.056 9.192 3.340 1.00 0.00 C ATOM 1351 CD1 ILE A 82 7.470 7.261 3.725 1.00 0.00 C ATOM 0 H ILE A 82 7.577 8.358 0.361 1.00 0.00 H new ATOM 0 HA ILE A 82 4.807 8.574 0.712 1.00 0.00 H new ATOM 0 HB ILE A 82 7.030 9.566 2.551 1.00 0.00 H new ATOM 0 HG12 ILE A 82 5.731 6.805 2.519 1.00 0.00 H new ATOM 0 HG13 ILE A 82 7.174 7.143 1.584 1.00 0.00 H new ATOM 0 HG21 ILE A 82 5.412 9.001 4.352 1.00 0.00 H new ATOM 0 HG22 ILE A 82 4.744 10.233 3.256 1.00 0.00 H new ATOM 0 HG23 ILE A 82 4.209 8.541 3.124 1.00 0.00 H new ATOM 0 HD11 ILE A 82 7.770 6.217 3.810 1.00 0.00 H new ATOM 0 HD12 ILE A 82 8.358 7.889 3.655 1.00 0.00 H new ATOM 0 HD13 ILE A 82 6.893 7.546 4.605 1.00 0.00 H new ATOM 1363 N LYS A 83 6.316 11.521 0.850 1.00 0.00 N ATOM 1364 CA LYS A 83 6.037 12.974 0.693 1.00 0.00 C ATOM 1365 C LYS A 83 5.675 13.266 -0.766 1.00 0.00 C ATOM 1366 O LYS A 83 4.805 14.064 -1.053 1.00 0.00 O ATOM 1367 CB LYS A 83 7.281 13.772 1.085 1.00 0.00 C ATOM 1368 CG LYS A 83 7.593 13.528 2.563 1.00 0.00 C ATOM 1369 CD LYS A 83 8.766 14.407 2.993 1.00 0.00 C ATOM 1370 CE LYS A 83 9.179 14.042 4.419 1.00 0.00 C ATOM 1371 NZ LYS A 83 7.970 13.988 5.286 1.00 0.00 N ATOM 0 H LYS A 83 7.291 11.282 1.028 1.00 0.00 H new ATOM 0 HA LYS A 83 5.205 13.261 1.336 1.00 0.00 H new ATOM 0 HB2 LYS A 83 8.128 13.473 0.468 1.00 0.00 H new ATOM 0 HB3 LYS A 83 7.117 14.835 0.907 1.00 0.00 H new ATOM 0 HG2 LYS A 83 6.717 13.751 3.171 1.00 0.00 H new ATOM 0 HG3 LYS A 83 7.835 12.478 2.725 1.00 0.00 H new ATOM 0 HD2 LYS A 83 9.606 14.269 2.313 1.00 0.00 H new ATOM 0 HD3 LYS A 83 8.484 15.459 2.942 1.00 0.00 H new ATOM 0 HE2 LYS A 83 9.688 13.078 4.426 1.00 0.00 H new ATOM 0 HE3 LYS A 83 9.884 14.778 4.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 8.253 14.079 6.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 7.328 14.767 5.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 7.483 13.080 5.146 1.00 0.00 H new ATOM 1385 N GLY A 84 6.338 12.622 -1.691 1.00 0.00 N ATOM 1386 CA GLY A 84 6.035 12.860 -3.131 1.00 0.00 C ATOM 1387 C GLY A 84 4.541 12.660 -3.365 1.00 0.00 C ATOM 1388 O GLY A 84 3.929 13.334 -4.170 1.00 0.00 O ATOM 0 H GLY A 84 7.076 11.942 -1.510 1.00 0.00 H new ATOM 0 HA2 GLY A 84 6.328 13.871 -3.415 1.00 0.00 H new ATOM 0 HA3 GLY A 84 6.609 12.174 -3.755 1.00 0.00 H new ATOM 1392 N LEU A 85 3.948 11.745 -2.656 1.00 0.00 N ATOM 1393 CA LEU A 85 2.491 11.503 -2.816 1.00 0.00 C ATOM 1394 C LEU A 85 1.734 12.461 -1.896 1.00 0.00 C ATOM 1395 O LEU A 85 0.525 12.577 -1.956 1.00 0.00 O ATOM 1396 CB LEU A 85 2.181 10.060 -2.429 1.00 0.00 C ATOM 1397 CG LEU A 85 2.978 9.109 -3.330 1.00 0.00 C ATOM 1398 CD1 LEU A 85 2.743 7.663 -2.894 1.00 0.00 C ATOM 1399 CD2 LEU A 85 2.522 9.279 -4.783 1.00 0.00 C ATOM 0 H LEU A 85 4.412 11.151 -1.969 1.00 0.00 H new ATOM 0 HA LEU A 85 2.188 11.671 -3.850 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.438 9.889 -1.384 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.113 9.866 -2.531 1.00 0.00 H new ATOM 0 HG LEU A 85 4.039 9.344 -3.248 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.312 6.992 -3.538 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.068 7.537 -1.861 1.00 0.00 H new ATOM 0 HD13 LEU A 85 1.682 7.427 -2.972 1.00 0.00 H new ATOM 0 HD21 LEU A 85 3.088 8.603 -5.424 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.460 9.047 -4.860 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.693 10.308 -5.100 1.00 0.00 H new ATOM 1411 N HIS A 86 2.449 13.150 -1.049 1.00 0.00 N ATOM 1412 CA HIS A 86 1.808 14.119 -0.112 1.00 0.00 C ATOM 1413 C HIS A 86 0.889 13.375 0.858 1.00 0.00 C ATOM 1414 O HIS A 86 -0.177 13.846 1.200 1.00 0.00 O ATOM 1415 CB HIS A 86 0.995 15.142 -0.906 1.00 0.00 C ATOM 1416 CG HIS A 86 1.790 15.602 -2.099 1.00 0.00 C ATOM 1417 ND1 HIS A 86 2.781 16.567 -2.000 1.00 0.00 N ATOM 1418 CD2 HIS A 86 1.751 15.238 -3.424 1.00 0.00 C ATOM 1419 CE1 HIS A 86 3.293 16.749 -3.232 1.00 0.00 C ATOM 1420 NE2 HIS A 86 2.701 15.964 -4.136 1.00 0.00 N ATOM 0 H HIS A 86 3.463 13.082 -0.965 1.00 0.00 H new ATOM 0 HA HIS A 86 2.584 14.634 0.454 1.00 0.00 H new ATOM 0 HB2 HIS A 86 0.054 14.700 -1.232 1.00 0.00 H new ATOM 0 HB3 HIS A 86 0.745 15.993 -0.273 1.00 0.00 H new ATOM 0 HD2 HIS A 86 1.085 14.501 -3.848 1.00 0.00 H new ATOM 0 HE1 HIS A 86 4.086 17.445 -3.461 1.00 0.00 H new ATOM 0 HE2 HIS A 86 2.902 15.909 -5.134 1.00 0.00 H new ATOM 1428 N LEU A 87 1.309 12.235 1.331 1.00 0.00 N ATOM 1429 CA LEU A 87 0.473 11.488 2.312 1.00 0.00 C ATOM 1430 C LEU A 87 0.561 12.186 3.678 1.00 0.00 C ATOM 1431 O LEU A 87 1.608 12.678 4.052 1.00 0.00 O ATOM 1432 CB LEU A 87 0.979 10.050 2.439 1.00 0.00 C ATOM 1433 CG LEU A 87 0.664 9.279 1.152 1.00 0.00 C ATOM 1434 CD1 LEU A 87 1.692 8.163 0.961 1.00 0.00 C ATOM 1435 CD2 LEU A 87 -0.737 8.666 1.246 1.00 0.00 C ATOM 0 H LEU A 87 2.192 11.789 1.082 1.00 0.00 H new ATOM 0 HA LEU A 87 -0.562 11.471 1.970 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.053 10.047 2.623 1.00 0.00 H new ATOM 0 HB3 LEU A 87 0.508 9.562 3.292 1.00 0.00 H new ATOM 0 HG LEU A 87 0.704 9.964 0.305 1.00 0.00 H new ATOM 0 HD11 LEU A 87 1.468 7.615 0.046 1.00 0.00 H new ATOM 0 HD12 LEU A 87 2.690 8.596 0.890 1.00 0.00 H new ATOM 0 HD13 LEU A 87 1.652 7.482 1.811 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -0.957 8.119 0.329 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -0.779 7.984 2.095 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -1.473 9.459 1.381 1.00 0.00 H new ATOM 1447 N PRO A 88 -0.510 12.220 4.433 1.00 0.00 N ATOM 1448 CA PRO A 88 -0.506 12.857 5.781 1.00 0.00 C ATOM 1449 C PRO A 88 0.315 12.040 6.790 1.00 0.00 C ATOM 1450 O PRO A 88 0.322 10.826 6.755 1.00 0.00 O ATOM 1451 CB PRO A 88 -1.983 12.889 6.185 1.00 0.00 C ATOM 1452 CG PRO A 88 -2.639 11.815 5.384 1.00 0.00 C ATOM 1453 CD PRO A 88 -1.830 11.665 4.093 1.00 0.00 C ATOM 0 HA PRO A 88 -0.050 13.847 5.764 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -2.101 12.709 7.254 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -2.426 13.862 5.974 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -2.658 10.877 5.939 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -3.674 12.076 5.163 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -1.757 10.621 3.787 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -2.291 12.208 3.268 1.00 0.00 H new ATOM 1461 N SER A 89 1.010 12.695 7.676 1.00 0.00 N ATOM 1462 CA SER A 89 1.838 11.958 8.674 1.00 0.00 C ATOM 1463 C SER A 89 0.949 11.046 9.528 1.00 0.00 C ATOM 1464 O SER A 89 1.416 10.392 10.439 1.00 0.00 O ATOM 1465 CB SER A 89 2.555 12.957 9.579 1.00 0.00 C ATOM 1466 OG SER A 89 1.676 13.361 10.620 1.00 0.00 O ATOM 0 H SER A 89 1.042 13.712 7.754 1.00 0.00 H new ATOM 0 HA SER A 89 2.570 11.348 8.145 1.00 0.00 H new ATOM 0 HB2 SER A 89 3.453 12.505 10.000 1.00 0.00 H new ATOM 0 HB3 SER A 89 2.876 13.824 9.001 1.00 0.00 H new ATOM 0 HG SER A 89 2.133 14.001 11.204 1.00 0.00 H new ATOM 1472 N SER A 90 -0.328 11.020 9.264 1.00 0.00 N ATOM 1473 CA SER A 90 -1.232 10.173 10.097 1.00 0.00 C ATOM 1474 C SER A 90 -0.909 8.690 9.882 1.00 0.00 C ATOM 1475 O SER A 90 -1.197 7.864 10.725 1.00 0.00 O ATOM 1476 CB SER A 90 -2.690 10.442 9.718 1.00 0.00 C ATOM 1477 OG SER A 90 -2.931 9.978 8.395 1.00 0.00 O ATOM 0 H SER A 90 -0.783 11.543 8.515 1.00 0.00 H new ATOM 0 HA SER A 90 -1.080 10.422 11.147 1.00 0.00 H new ATOM 0 HB2 SER A 90 -3.357 9.939 10.418 1.00 0.00 H new ATOM 0 HB3 SER A 90 -2.903 11.509 9.785 1.00 0.00 H new ATOM 0 HG SER A 90 -3.865 10.149 8.153 1.00 0.00 H new ATOM 1483 N ILE A 91 -0.296 8.341 8.781 1.00 0.00 N ATOM 1484 CA ILE A 91 0.053 6.906 8.556 1.00 0.00 C ATOM 1485 C ILE A 91 1.531 6.685 8.890 1.00 0.00 C ATOM 1486 O ILE A 91 2.408 7.072 8.146 1.00 0.00 O ATOM 1487 CB ILE A 91 -0.197 6.529 7.092 1.00 0.00 C ATOM 1488 CG1 ILE A 91 -1.684 6.724 6.764 1.00 0.00 C ATOM 1489 CG2 ILE A 91 0.192 5.065 6.862 1.00 0.00 C ATOM 1490 CD1 ILE A 91 -1.964 6.361 5.296 1.00 0.00 C ATOM 0 H ILE A 91 -0.024 8.980 8.034 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.569 6.282 9.198 1.00 0.00 H new ATOM 0 HB ILE A 91 0.406 7.166 6.445 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -2.292 6.102 7.421 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -1.971 7.759 6.950 1.00 0.00 H new ATOM 0 HG21 ILE A 91 0.013 4.800 5.820 1.00 0.00 H new ATOM 0 HG22 ILE A 91 1.248 4.928 7.095 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -0.408 4.423 7.508 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -3.023 6.505 5.081 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -1.371 7.001 4.643 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -1.697 5.319 5.122 1.00 0.00 H new ATOM 1502 N THR A 92 1.814 6.054 9.999 1.00 0.00 N ATOM 1503 CA THR A 92 3.235 5.800 10.364 1.00 0.00 C ATOM 1504 C THR A 92 3.745 4.611 9.551 1.00 0.00 C ATOM 1505 O THR A 92 4.924 4.469 9.298 1.00 0.00 O ATOM 1506 CB THR A 92 3.332 5.480 11.856 1.00 0.00 C ATOM 1507 OG1 THR A 92 2.684 4.242 12.114 1.00 0.00 O ATOM 1508 CG2 THR A 92 2.658 6.592 12.661 1.00 0.00 C ATOM 0 H THR A 92 1.124 5.705 10.664 1.00 0.00 H new ATOM 0 HA THR A 92 3.837 6.683 10.149 1.00 0.00 H new ATOM 0 HB THR A 92 4.380 5.409 12.148 1.00 0.00 H new ATOM 0 HG1 THR A 92 2.746 4.033 13.069 1.00 0.00 H new ATOM 0 HG21 THR A 92 2.727 6.364 13.725 1.00 0.00 H new ATOM 0 HG22 THR A 92 3.157 7.540 12.460 1.00 0.00 H new ATOM 0 HG23 THR A 92 1.609 6.665 12.373 1.00 0.00 H new ATOM 1516 N SER A 93 2.849 3.757 9.138 1.00 0.00 N ATOM 1517 CA SER A 93 3.247 2.569 8.332 1.00 0.00 C ATOM 1518 C SER A 93 3.117 2.905 6.844 1.00 0.00 C ATOM 1519 O SER A 93 2.806 2.055 6.032 1.00 0.00 O ATOM 1520 CB SER A 93 2.331 1.393 8.677 1.00 0.00 C ATOM 1521 OG SER A 93 2.608 0.959 10.002 1.00 0.00 O ATOM 0 H SER A 93 1.849 3.833 9.326 1.00 0.00 H new ATOM 0 HA SER A 93 4.279 2.299 8.555 1.00 0.00 H new ATOM 0 HB2 SER A 93 1.286 1.692 8.590 1.00 0.00 H new ATOM 0 HB3 SER A 93 2.488 0.575 7.973 1.00 0.00 H new ATOM 0 HG SER A 93 2.023 0.207 10.229 1.00 0.00 H new ATOM 1527 N ALA A 94 3.347 4.140 6.481 1.00 0.00 N ATOM 1528 CA ALA A 94 3.232 4.526 5.045 1.00 0.00 C ATOM 1529 C ALA A 94 4.287 3.770 4.238 1.00 0.00 C ATOM 1530 O ALA A 94 3.970 2.944 3.406 1.00 0.00 O ATOM 1531 CB ALA A 94 3.454 6.035 4.898 1.00 0.00 C ATOM 0 H ALA A 94 3.609 4.895 7.115 1.00 0.00 H new ATOM 0 HA ALA A 94 2.238 4.274 4.676 1.00 0.00 H new ATOM 0 HB1 ALA A 94 3.370 6.315 3.848 1.00 0.00 H new ATOM 0 HB2 ALA A 94 2.703 6.571 5.478 1.00 0.00 H new ATOM 0 HB3 ALA A 94 4.448 6.294 5.264 1.00 0.00 H new ATOM 1537 N ALA A 95 5.543 4.040 4.473 1.00 0.00 N ATOM 1538 CA ALA A 95 6.605 3.323 3.708 1.00 0.00 C ATOM 1539 C ALA A 95 6.294 1.822 3.710 1.00 0.00 C ATOM 1540 O ALA A 95 6.258 1.189 2.674 1.00 0.00 O ATOM 1541 CB ALA A 95 7.964 3.569 4.371 1.00 0.00 C ATOM 0 H ALA A 95 5.878 4.720 5.155 1.00 0.00 H new ATOM 0 HA ALA A 95 6.635 3.690 2.682 1.00 0.00 H new ATOM 0 HB1 ALA A 95 8.741 3.046 3.813 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.178 4.638 4.376 1.00 0.00 H new ATOM 0 HB3 ALA A 95 7.941 3.199 5.396 1.00 0.00 H new ATOM 1547 N LEU A 96 6.072 1.246 4.860 1.00 0.00 N ATOM 1548 CA LEU A 96 5.767 -0.213 4.912 1.00 0.00 C ATOM 1549 C LEU A 96 4.531 -0.498 4.062 1.00 0.00 C ATOM 1550 O LEU A 96 4.504 -1.436 3.289 1.00 0.00 O ATOM 1551 CB LEU A 96 5.483 -0.606 6.362 1.00 0.00 C ATOM 1552 CG LEU A 96 5.187 -2.110 6.466 1.00 0.00 C ATOM 1553 CD1 LEU A 96 6.492 -2.897 6.614 1.00 0.00 C ATOM 1554 CD2 LEU A 96 4.319 -2.347 7.694 1.00 0.00 C ATOM 0 H LEU A 96 6.088 1.720 5.763 1.00 0.00 H new ATOM 0 HA LEU A 96 6.613 -0.785 4.530 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.340 -0.354 6.987 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.634 -0.036 6.740 1.00 0.00 H new ATOM 0 HG LEU A 96 4.674 -2.444 5.564 1.00 0.00 H new ATOM 0 HD11 LEU A 96 6.269 -3.961 6.687 1.00 0.00 H new ATOM 0 HD12 LEU A 96 7.126 -2.718 5.745 1.00 0.00 H new ATOM 0 HD13 LEU A 96 7.012 -2.573 7.515 1.00 0.00 H new ATOM 0 HD21 LEU A 96 4.099 -3.411 7.784 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.849 -2.010 8.585 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.387 -1.791 7.594 1.00 0.00 H new ATOM 1566 N THR A 97 3.511 0.305 4.182 1.00 0.00 N ATOM 1567 CA THR A 97 2.291 0.076 3.365 1.00 0.00 C ATOM 1568 C THR A 97 2.659 0.197 1.889 1.00 0.00 C ATOM 1569 O THR A 97 2.189 -0.551 1.054 1.00 0.00 O ATOM 1570 CB THR A 97 1.243 1.131 3.739 1.00 0.00 C ATOM 1571 OG1 THR A 97 0.704 0.827 5.017 1.00 0.00 O ATOM 1572 CG2 THR A 97 0.123 1.164 2.700 1.00 0.00 C ATOM 0 H THR A 97 3.471 1.108 4.810 1.00 0.00 H new ATOM 0 HA THR A 97 1.883 -0.917 3.552 1.00 0.00 H new ATOM 0 HB THR A 97 1.720 2.111 3.765 1.00 0.00 H new ATOM 0 HG1 THR A 97 1.227 1.282 5.709 1.00 0.00 H new ATOM 0 HG21 THR A 97 -0.612 1.918 2.981 1.00 0.00 H new ATOM 0 HG22 THR A 97 0.540 1.410 1.723 1.00 0.00 H new ATOM 0 HG23 THR A 97 -0.359 0.187 2.653 1.00 0.00 H new ATOM 1580 N LEU A 98 3.499 1.139 1.564 1.00 0.00 N ATOM 1581 CA LEU A 98 3.907 1.320 0.152 1.00 0.00 C ATOM 1582 C LEU A 98 4.742 0.120 -0.309 1.00 0.00 C ATOM 1583 O LEU A 98 4.548 -0.403 -1.385 1.00 0.00 O ATOM 1584 CB LEU A 98 4.752 2.594 0.055 1.00 0.00 C ATOM 1585 CG LEU A 98 3.891 3.827 0.365 1.00 0.00 C ATOM 1586 CD1 LEU A 98 4.765 4.932 0.968 1.00 0.00 C ATOM 1587 CD2 LEU A 98 3.274 4.349 -0.930 1.00 0.00 C ATOM 0 H LEU A 98 3.921 1.793 2.223 1.00 0.00 H new ATOM 0 HA LEU A 98 3.024 1.399 -0.482 1.00 0.00 H new ATOM 0 HB2 LEU A 98 5.587 2.539 0.754 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.178 2.681 -0.944 1.00 0.00 H new ATOM 0 HG LEU A 98 3.109 3.547 1.071 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.149 5.805 1.186 1.00 0.00 H new ATOM 0 HD12 LEU A 98 5.223 4.572 1.889 1.00 0.00 H new ATOM 0 HD13 LEU A 98 5.545 5.207 0.258 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.662 5.225 -0.714 1.00 0.00 H new ATOM 0 HD22 LEU A 98 4.067 4.623 -1.626 1.00 0.00 H new ATOM 0 HD23 LEU A 98 2.652 3.572 -1.376 1.00 0.00 H new ATOM 1599 N ARG A 99 5.678 -0.312 0.493 1.00 0.00 N ATOM 1600 CA ARG A 99 6.536 -1.465 0.089 1.00 0.00 C ATOM 1601 C ARG A 99 5.737 -2.761 0.054 1.00 0.00 C ATOM 1602 O ARG A 99 5.803 -3.510 -0.901 1.00 0.00 O ATOM 1603 CB ARG A 99 7.694 -1.609 1.084 1.00 0.00 C ATOM 1604 CG ARG A 99 8.693 -2.670 0.584 1.00 0.00 C ATOM 1605 CD ARG A 99 8.454 -4.003 1.300 1.00 0.00 C ATOM 1606 NE ARG A 99 8.846 -3.875 2.730 1.00 0.00 N ATOM 1607 CZ ARG A 99 8.479 -4.783 3.592 1.00 0.00 C ATOM 1608 NH1 ARG A 99 7.769 -5.806 3.202 1.00 0.00 N ATOM 1609 NH2 ARG A 99 8.825 -4.668 4.845 1.00 0.00 N ATOM 0 H ARG A 99 5.886 0.083 1.410 1.00 0.00 H new ATOM 0 HA ARG A 99 6.921 -1.272 -0.913 1.00 0.00 H new ATOM 0 HB2 ARG A 99 8.200 -0.651 1.206 1.00 0.00 H new ATOM 0 HB3 ARG A 99 7.309 -1.894 2.063 1.00 0.00 H new ATOM 0 HG2 ARG A 99 8.585 -2.803 -0.492 1.00 0.00 H new ATOM 0 HG3 ARG A 99 9.714 -2.331 0.762 1.00 0.00 H new ATOM 0 HD2 ARG A 99 7.404 -4.286 1.224 1.00 0.00 H new ATOM 0 HD3 ARG A 99 9.033 -4.794 0.822 1.00 0.00 H new ATOM 0 HE ARG A 99 9.402 -3.077 3.036 1.00 0.00 H new ATOM 0 HH11 ARG A 99 7.500 -5.896 2.222 1.00 0.00 H new ATOM 0 HH12 ARG A 99 7.483 -6.515 3.877 1.00 0.00 H new ATOM 0 HH21 ARG A 99 9.382 -3.869 5.149 1.00 0.00 H new ATOM 0 HH22 ARG A 99 8.539 -5.377 5.520 1.00 0.00 H new ATOM 1623 N THR A 100 5.001 -3.054 1.081 1.00 0.00 N ATOM 1624 CA THR A 100 4.234 -4.323 1.077 1.00 0.00 C ATOM 1625 C THR A 100 3.351 -4.385 -0.174 1.00 0.00 C ATOM 1626 O THR A 100 3.403 -5.332 -0.933 1.00 0.00 O ATOM 1627 CB THR A 100 3.360 -4.396 2.334 1.00 0.00 C ATOM 1628 OG1 THR A 100 4.003 -3.695 3.390 1.00 0.00 O ATOM 1629 CG2 THR A 100 3.162 -5.859 2.747 1.00 0.00 C ATOM 0 H THR A 100 4.897 -2.477 1.916 1.00 0.00 H new ATOM 0 HA THR A 100 4.925 -5.166 1.070 1.00 0.00 H new ATOM 0 HB THR A 100 2.389 -3.947 2.125 1.00 0.00 H new ATOM 0 HG1 THR A 100 3.786 -2.741 3.329 1.00 0.00 H new ATOM 0 HG21 THR A 100 2.540 -5.904 3.641 1.00 0.00 H new ATOM 0 HG22 THR A 100 2.674 -6.403 1.938 1.00 0.00 H new ATOM 0 HG23 THR A 100 4.131 -6.312 2.956 1.00 0.00 H new ATOM 1637 N GLN A 101 2.535 -3.389 -0.393 1.00 0.00 N ATOM 1638 CA GLN A 101 1.647 -3.403 -1.590 1.00 0.00 C ATOM 1639 C GLN A 101 2.453 -3.382 -2.898 1.00 0.00 C ATOM 1640 O GLN A 101 2.134 -4.081 -3.835 1.00 0.00 O ATOM 1641 CB GLN A 101 0.724 -2.191 -1.547 1.00 0.00 C ATOM 1642 CG GLN A 101 -0.214 -2.310 -0.345 1.00 0.00 C ATOM 1643 CD GLN A 101 -1.211 -3.444 -0.586 1.00 0.00 C ATOM 1644 OE1 GLN A 101 -1.993 -3.392 -1.513 1.00 0.00 O ATOM 1645 NE2 GLN A 101 -1.213 -4.477 0.213 1.00 0.00 N ATOM 0 H GLN A 101 2.445 -2.567 0.205 1.00 0.00 H new ATOM 0 HA GLN A 101 1.067 -4.325 -1.568 1.00 0.00 H new ATOM 0 HB2 GLN A 101 1.311 -1.275 -1.475 1.00 0.00 H new ATOM 0 HB3 GLN A 101 0.146 -2.127 -2.469 1.00 0.00 H new ATOM 0 HG2 GLN A 101 0.361 -2.503 0.561 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -0.745 -1.371 -0.191 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -0.556 -4.521 0.992 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -1.872 -5.240 0.058 1.00 0.00 H new ATOM 1654 N TYR A 102 3.487 -2.591 -2.992 1.00 0.00 N ATOM 1655 CA TYR A 102 4.251 -2.564 -4.267 1.00 0.00 C ATOM 1656 C TYR A 102 4.737 -3.974 -4.589 1.00 0.00 C ATOM 1657 O TYR A 102 4.694 -4.421 -5.718 1.00 0.00 O ATOM 1658 CB TYR A 102 5.453 -1.629 -4.130 1.00 0.00 C ATOM 1659 CG TYR A 102 5.870 -1.152 -5.499 1.00 0.00 C ATOM 1660 CD1 TYR A 102 6.448 -2.043 -6.409 1.00 0.00 C ATOM 1661 CD2 TYR A 102 5.665 0.183 -5.857 1.00 0.00 C ATOM 1662 CE1 TYR A 102 6.822 -1.594 -7.682 1.00 0.00 C ATOM 1663 CE2 TYR A 102 6.035 0.633 -7.129 1.00 0.00 C ATOM 1664 CZ TYR A 102 6.615 -0.256 -8.043 1.00 0.00 C ATOM 1665 OH TYR A 102 6.983 0.185 -9.299 1.00 0.00 O ATOM 0 H TYR A 102 3.829 -1.974 -2.255 1.00 0.00 H new ATOM 0 HA TYR A 102 3.607 -2.204 -5.069 1.00 0.00 H new ATOM 0 HB2 TYR A 102 5.197 -0.779 -3.498 1.00 0.00 H new ATOM 0 HB3 TYR A 102 6.280 -2.149 -3.646 1.00 0.00 H new ATOM 0 HD1 TYR A 102 6.606 -3.075 -6.131 1.00 0.00 H new ATOM 0 HD2 TYR A 102 5.220 0.868 -5.151 1.00 0.00 H new ATOM 0 HE1 TYR A 102 7.270 -2.280 -8.386 1.00 0.00 H new ATOM 0 HE2 TYR A 102 5.874 1.664 -7.406 1.00 0.00 H new ATOM 0 HH TYR A 102 6.371 0.894 -9.589 1.00 0.00 H new ATOM 1675 N MET A 103 5.218 -4.667 -3.599 1.00 0.00 N ATOM 1676 CA MET A 103 5.737 -6.042 -3.813 1.00 0.00 C ATOM 1677 C MET A 103 4.706 -6.956 -4.491 1.00 0.00 C ATOM 1678 O MET A 103 4.985 -7.582 -5.491 1.00 0.00 O ATOM 1679 CB MET A 103 6.103 -6.622 -2.450 1.00 0.00 C ATOM 1680 CG MET A 103 7.427 -6.033 -1.980 1.00 0.00 C ATOM 1681 SD MET A 103 7.900 -6.807 -0.415 1.00 0.00 S ATOM 1682 CE MET A 103 8.178 -8.477 -1.059 1.00 0.00 C ATOM 0 H MET A 103 5.274 -4.334 -2.637 1.00 0.00 H new ATOM 0 HA MET A 103 6.602 -5.987 -4.473 1.00 0.00 H new ATOM 0 HB2 MET A 103 5.318 -6.400 -1.727 1.00 0.00 H new ATOM 0 HB3 MET A 103 6.179 -7.707 -2.515 1.00 0.00 H new ATOM 0 HG2 MET A 103 8.200 -6.200 -2.730 1.00 0.00 H new ATOM 0 HG3 MET A 103 7.334 -4.954 -1.853 1.00 0.00 H new ATOM 0 HE1 MET A 103 8.776 -9.046 -0.348 1.00 0.00 H new ATOM 0 HE2 MET A 103 7.219 -8.974 -1.207 1.00 0.00 H new ATOM 0 HE3 MET A 103 8.706 -8.417 -2.011 1.00 0.00 H new ATOM 1692 N LYS A 104 3.544 -7.102 -3.930 1.00 0.00 N ATOM 1693 CA LYS A 104 2.559 -8.049 -4.541 1.00 0.00 C ATOM 1694 C LYS A 104 1.982 -7.521 -5.861 1.00 0.00 C ATOM 1695 O LYS A 104 1.860 -8.249 -6.826 1.00 0.00 O ATOM 1696 CB LYS A 104 1.383 -8.271 -3.590 1.00 0.00 C ATOM 1697 CG LYS A 104 1.875 -8.388 -2.147 1.00 0.00 C ATOM 1698 CD LYS A 104 0.699 -8.786 -1.254 1.00 0.00 C ATOM 1699 CE LYS A 104 1.074 -8.588 0.215 1.00 0.00 C ATOM 1700 NZ LYS A 104 0.144 -9.378 1.072 1.00 0.00 N ATOM 0 H LYS A 104 3.230 -6.619 -3.088 1.00 0.00 H new ATOM 0 HA LYS A 104 3.102 -8.975 -4.730 1.00 0.00 H new ATOM 0 HB2 LYS A 104 0.679 -7.443 -3.674 1.00 0.00 H new ATOM 0 HB3 LYS A 104 0.846 -9.177 -3.872 1.00 0.00 H new ATOM 0 HG2 LYS A 104 2.669 -9.132 -2.078 1.00 0.00 H new ATOM 0 HG3 LYS A 104 2.297 -7.440 -1.814 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -0.176 -8.184 -1.500 1.00 0.00 H new ATOM 0 HD3 LYS A 104 0.430 -9.827 -1.433 1.00 0.00 H new ATOM 0 HE2 LYS A 104 2.103 -8.906 0.386 1.00 0.00 H new ATOM 0 HE3 LYS A 104 1.019 -7.531 0.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 0.396 -9.245 2.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -0.832 -9.054 0.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 0.218 -10.386 0.827 1.00 0.00 H new ATOM 1714 N TYR A 105 1.533 -6.299 -5.880 1.00 0.00 N ATOM 1715 CA TYR A 105 0.854 -5.771 -7.103 1.00 0.00 C ATOM 1716 C TYR A 105 1.801 -5.176 -8.169 1.00 0.00 C ATOM 1717 O TYR A 105 1.693 -5.503 -9.335 1.00 0.00 O ATOM 1718 CB TYR A 105 -0.155 -4.710 -6.650 1.00 0.00 C ATOM 1719 CG TYR A 105 -1.073 -5.325 -5.613 1.00 0.00 C ATOM 1720 CD1 TYR A 105 -2.126 -6.151 -6.017 1.00 0.00 C ATOM 1721 CD2 TYR A 105 -0.853 -5.091 -4.250 1.00 0.00 C ATOM 1722 CE1 TYR A 105 -2.966 -6.738 -5.058 1.00 0.00 C ATOM 1723 CE2 TYR A 105 -1.685 -5.682 -3.291 1.00 0.00 C ATOM 1724 CZ TYR A 105 -2.745 -6.504 -3.696 1.00 0.00 C ATOM 1725 OH TYR A 105 -3.565 -7.088 -2.751 1.00 0.00 O ATOM 0 H TYR A 105 1.605 -5.640 -5.105 1.00 0.00 H new ATOM 0 HA TYR A 105 0.377 -6.617 -7.598 1.00 0.00 H new ATOM 0 HB2 TYR A 105 0.365 -3.848 -6.231 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -0.733 -4.351 -7.501 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -2.293 -6.338 -7.068 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -0.040 -4.453 -3.938 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -3.783 -7.371 -5.371 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -1.510 -5.504 -2.240 1.00 0.00 H new ATOM 0 HH TYR A 105 -3.272 -6.822 -1.854 1.00 0.00 H new ATOM 1735 N LEU A 106 2.669 -4.266 -7.818 1.00 0.00 N ATOM 1736 CA LEU A 106 3.534 -3.623 -8.870 1.00 0.00 C ATOM 1737 C LEU A 106 4.935 -4.238 -8.978 1.00 0.00 C ATOM 1738 O LEU A 106 5.800 -3.668 -9.614 1.00 0.00 O ATOM 1739 CB LEU A 106 3.677 -2.137 -8.550 1.00 0.00 C ATOM 1740 CG LEU A 106 2.342 -1.435 -8.798 1.00 0.00 C ATOM 1741 CD1 LEU A 106 1.295 -1.952 -7.806 1.00 0.00 C ATOM 1742 CD2 LEU A 106 2.521 0.073 -8.608 1.00 0.00 C ATOM 0 H LEU A 106 2.822 -3.938 -6.864 1.00 0.00 H new ATOM 0 HA LEU A 106 3.040 -3.789 -9.827 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.983 -2.005 -7.512 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.455 -1.693 -9.171 1.00 0.00 H new ATOM 0 HG LEU A 106 2.008 -1.640 -9.815 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.344 -1.450 -7.985 1.00 0.00 H new ATOM 0 HD12 LEU A 106 1.168 -3.027 -7.938 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.627 -1.748 -6.788 1.00 0.00 H new ATOM 0 HD21 LEU A 106 1.571 0.577 -8.784 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.856 0.274 -7.590 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.264 0.443 -9.314 1.00 0.00 H new ATOM 1754 N TYR A 107 5.203 -5.360 -8.380 1.00 0.00 N ATOM 1755 CA TYR A 107 6.586 -5.908 -8.503 1.00 0.00 C ATOM 1756 C TYR A 107 6.900 -6.338 -9.948 1.00 0.00 C ATOM 1757 O TYR A 107 8.016 -6.176 -10.401 1.00 0.00 O ATOM 1758 CB TYR A 107 6.793 -7.088 -7.555 1.00 0.00 C ATOM 1759 CG TYR A 107 8.157 -7.679 -7.801 1.00 0.00 C ATOM 1760 CD1 TYR A 107 9.302 -6.913 -7.548 1.00 0.00 C ATOM 1761 CD2 TYR A 107 8.282 -8.987 -8.279 1.00 0.00 C ATOM 1762 CE1 TYR A 107 10.570 -7.457 -7.773 1.00 0.00 C ATOM 1763 CE2 TYR A 107 9.550 -9.532 -8.505 1.00 0.00 C ATOM 1764 CZ TYR A 107 10.695 -8.765 -8.251 1.00 0.00 C ATOM 1765 OH TYR A 107 11.948 -9.301 -8.468 1.00 0.00 O ATOM 0 H TYR A 107 4.549 -5.912 -7.825 1.00 0.00 H new ATOM 0 HA TYR A 107 7.273 -5.107 -8.228 1.00 0.00 H new ATOM 0 HB2 TYR A 107 6.706 -6.759 -6.519 1.00 0.00 H new ATOM 0 HB3 TYR A 107 6.021 -7.841 -7.716 1.00 0.00 H new ATOM 0 HD1 TYR A 107 9.205 -5.903 -7.179 1.00 0.00 H new ATOM 0 HD2 TYR A 107 7.399 -9.577 -8.474 1.00 0.00 H new ATOM 0 HE1 TYR A 107 11.453 -6.867 -7.578 1.00 0.00 H new ATOM 0 HE2 TYR A 107 9.647 -10.542 -8.875 1.00 0.00 H new ATOM 0 HH TYR A 107 12.297 -8.981 -9.326 1.00 0.00 H new ATOM 1775 N PRO A 108 5.954 -6.893 -10.673 1.00 0.00 N ATOM 1776 CA PRO A 108 6.202 -7.345 -12.068 1.00 0.00 C ATOM 1777 C PRO A 108 6.099 -6.199 -13.085 1.00 0.00 C ATOM 1778 O PRO A 108 6.880 -6.111 -14.010 1.00 0.00 O ATOM 1779 CB PRO A 108 5.134 -8.411 -12.282 1.00 0.00 C ATOM 1780 CG PRO A 108 3.989 -8.021 -11.398 1.00 0.00 C ATOM 1781 CD PRO A 108 4.559 -7.146 -10.270 1.00 0.00 C ATOM 0 HA PRO A 108 7.213 -7.725 -12.214 1.00 0.00 H new ATOM 0 HB2 PRO A 108 4.826 -8.452 -13.327 1.00 0.00 H new ATOM 0 HB3 PRO A 108 5.510 -9.400 -12.022 1.00 0.00 H new ATOM 0 HG2 PRO A 108 3.235 -7.474 -11.965 1.00 0.00 H new ATOM 0 HG3 PRO A 108 3.501 -8.906 -10.989 1.00 0.00 H new ATOM 0 HD2 PRO A 108 4.000 -6.216 -10.167 1.00 0.00 H new ATOM 0 HD3 PRO A 108 4.509 -7.656 -9.308 1.00 0.00 H new ATOM 1789 N TYR A 109 5.170 -5.304 -12.909 1.00 0.00 N ATOM 1790 CA TYR A 109 5.052 -4.153 -13.850 1.00 0.00 C ATOM 1791 C TYR A 109 6.387 -3.392 -13.822 1.00 0.00 C ATOM 1792 O TYR A 109 6.903 -2.976 -14.839 1.00 0.00 O ATOM 1793 CB TYR A 109 3.912 -3.236 -13.378 1.00 0.00 C ATOM 1794 CG TYR A 109 3.482 -2.291 -14.484 1.00 0.00 C ATOM 1795 CD1 TYR A 109 4.324 -1.249 -14.887 1.00 0.00 C ATOM 1796 CD2 TYR A 109 2.231 -2.456 -15.099 1.00 0.00 C ATOM 1797 CE1 TYR A 109 3.917 -0.372 -15.903 1.00 0.00 C ATOM 1798 CE2 TYR A 109 1.823 -1.579 -16.114 1.00 0.00 C ATOM 1799 CZ TYR A 109 2.668 -0.537 -16.515 1.00 0.00 C ATOM 1800 OH TYR A 109 2.271 0.328 -17.516 1.00 0.00 O ATOM 0 H TYR A 109 4.485 -5.318 -12.153 1.00 0.00 H new ATOM 0 HA TYR A 109 4.834 -4.492 -14.863 1.00 0.00 H new ATOM 0 HB2 TYR A 109 3.062 -3.840 -13.060 1.00 0.00 H new ATOM 0 HB3 TYR A 109 4.237 -2.662 -12.510 1.00 0.00 H new ATOM 0 HD1 TYR A 109 5.287 -1.120 -14.416 1.00 0.00 H new ATOM 0 HD2 TYR A 109 1.581 -3.261 -14.789 1.00 0.00 H new ATOM 0 HE1 TYR A 109 4.568 0.432 -16.214 1.00 0.00 H new ATOM 0 HE2 TYR A 109 0.860 -1.707 -16.585 1.00 0.00 H new ATOM 0 HH TYR A 109 1.770 -0.168 -18.197 1.00 0.00 H new ATOM 1810 N GLU A 110 6.951 -3.228 -12.649 1.00 0.00 N ATOM 1811 CA GLU A 110 8.263 -2.517 -12.516 1.00 0.00 C ATOM 1812 C GLU A 110 9.392 -3.398 -13.061 1.00 0.00 C ATOM 1813 O GLU A 110 10.220 -2.959 -13.830 1.00 0.00 O ATOM 1814 CB GLU A 110 8.539 -2.249 -11.033 1.00 0.00 C ATOM 1815 CG GLU A 110 9.821 -1.428 -10.887 1.00 0.00 C ATOM 1816 CD GLU A 110 10.149 -1.244 -9.404 1.00 0.00 C ATOM 1817 OE1 GLU A 110 9.488 -1.864 -8.590 1.00 0.00 O ATOM 1818 OE2 GLU A 110 11.053 -0.480 -9.106 1.00 0.00 O ATOM 0 H GLU A 110 6.555 -3.560 -11.770 1.00 0.00 H new ATOM 0 HA GLU A 110 8.219 -1.583 -13.075 1.00 0.00 H new ATOM 0 HB2 GLU A 110 7.700 -1.714 -10.588 1.00 0.00 H new ATOM 0 HB3 GLU A 110 8.636 -3.192 -10.495 1.00 0.00 H new ATOM 0 HG2 GLU A 110 10.646 -1.931 -11.392 1.00 0.00 H new ATOM 0 HG3 GLU A 110 9.699 -0.456 -11.366 1.00 0.00 H new ATOM 1825 N CYS A 111 9.441 -4.634 -12.644 1.00 0.00 N ATOM 1826 CA CYS A 111 10.530 -5.543 -13.107 1.00 0.00 C ATOM 1827 C CYS A 111 10.304 -5.970 -14.560 1.00 0.00 C ATOM 1828 O CYS A 111 11.218 -5.992 -15.359 1.00 0.00 O ATOM 1829 CB CYS A 111 10.562 -6.786 -12.207 1.00 0.00 C ATOM 1830 SG CYS A 111 12.271 -7.350 -12.014 1.00 0.00 S ATOM 0 H CYS A 111 8.771 -5.055 -12.000 1.00 0.00 H new ATOM 0 HA CYS A 111 11.480 -5.011 -13.049 1.00 0.00 H new ATOM 0 HB2 CYS A 111 10.133 -6.553 -11.233 1.00 0.00 H new ATOM 0 HB3 CYS A 111 9.953 -7.579 -12.642 1.00 0.00 H new ATOM 0 HG CYS A 111 12.888 -6.583 -11.164 1.00 0.00 H new ATOM 1836 N GLU A 112 9.106 -6.347 -14.900 1.00 0.00 N ATOM 1837 CA GLU A 112 8.841 -6.814 -16.288 1.00 0.00 C ATOM 1838 C GLU A 112 9.008 -5.669 -17.291 1.00 0.00 C ATOM 1839 O GLU A 112 9.643 -5.820 -18.316 1.00 0.00 O ATOM 1840 CB GLU A 112 7.405 -7.339 -16.362 1.00 0.00 C ATOM 1841 CG GLU A 112 7.186 -8.006 -17.721 1.00 0.00 C ATOM 1842 CD GLU A 112 7.996 -9.303 -17.788 1.00 0.00 C ATOM 1843 OE1 GLU A 112 8.286 -9.854 -16.738 1.00 0.00 O ATOM 1844 OE2 GLU A 112 8.315 -9.724 -18.888 1.00 0.00 O ATOM 0 H GLU A 112 8.298 -6.352 -14.278 1.00 0.00 H new ATOM 0 HA GLU A 112 9.553 -7.600 -16.539 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.224 -8.053 -15.559 1.00 0.00 H new ATOM 0 HB3 GLU A 112 6.698 -6.521 -16.226 1.00 0.00 H new ATOM 0 HG2 GLU A 112 6.127 -8.218 -17.868 1.00 0.00 H new ATOM 0 HG3 GLU A 112 7.490 -7.333 -18.522 1.00 0.00 H new ATOM 1851 N LYS A 113 8.432 -4.536 -17.022 1.00 0.00 N ATOM 1852 CA LYS A 113 8.547 -3.401 -17.979 1.00 0.00 C ATOM 1853 C LYS A 113 9.922 -2.726 -17.882 1.00 0.00 C ATOM 1854 O LYS A 113 10.380 -2.123 -18.833 1.00 0.00 O ATOM 1855 CB LYS A 113 7.451 -2.375 -17.679 1.00 0.00 C ATOM 1856 CG LYS A 113 6.081 -3.068 -17.643 1.00 0.00 C ATOM 1857 CD LYS A 113 5.747 -3.656 -19.020 1.00 0.00 C ATOM 1858 CE LYS A 113 4.259 -4.019 -19.079 1.00 0.00 C ATOM 1859 NZ LYS A 113 3.478 -2.846 -19.563 1.00 0.00 N ATOM 0 H LYS A 113 7.886 -4.344 -16.182 1.00 0.00 H new ATOM 0 HA LYS A 113 8.432 -3.791 -18.990 1.00 0.00 H new ATOM 0 HB2 LYS A 113 7.648 -1.889 -16.723 1.00 0.00 H new ATOM 0 HB3 LYS A 113 7.453 -1.594 -18.440 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.085 -3.859 -16.893 1.00 0.00 H new ATOM 0 HG3 LYS A 113 5.312 -2.354 -17.348 1.00 0.00 H new ATOM 0 HD2 LYS A 113 5.987 -2.935 -19.802 1.00 0.00 H new ATOM 0 HD3 LYS A 113 6.355 -4.541 -19.205 1.00 0.00 H new ATOM 0 HE2 LYS A 113 4.108 -4.869 -19.744 1.00 0.00 H new ATOM 0 HE3 LYS A 113 3.908 -4.320 -18.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 2.575 -2.794 -19.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 4.021 -1.975 -19.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 3.291 -2.949 -20.581 1.00 0.00 H new ATOM 1873 N LYS A 114 10.571 -2.781 -16.743 1.00 0.00 N ATOM 1874 CA LYS A 114 11.894 -2.095 -16.604 1.00 0.00 C ATOM 1875 C LYS A 114 12.988 -3.068 -16.122 1.00 0.00 C ATOM 1876 O LYS A 114 14.150 -2.904 -16.438 1.00 0.00 O ATOM 1877 CB LYS A 114 11.730 -0.953 -15.603 1.00 0.00 C ATOM 1878 CG LYS A 114 12.969 -0.062 -15.617 1.00 0.00 C ATOM 1879 CD LYS A 114 12.936 0.882 -16.825 1.00 0.00 C ATOM 1880 CE LYS A 114 13.948 2.008 -16.609 1.00 0.00 C ATOM 1881 NZ LYS A 114 15.291 1.427 -16.322 1.00 0.00 N ATOM 0 H LYS A 114 10.244 -3.268 -15.909 1.00 0.00 H new ATOM 0 HA LYS A 114 12.207 -1.715 -17.577 1.00 0.00 H new ATOM 0 HB2 LYS A 114 10.847 -0.365 -15.852 1.00 0.00 H new ATOM 0 HB3 LYS A 114 11.573 -1.356 -14.602 1.00 0.00 H new ATOM 0 HG2 LYS A 114 13.018 0.518 -14.696 1.00 0.00 H new ATOM 0 HG3 LYS A 114 13.867 -0.678 -15.654 1.00 0.00 H new ATOM 0 HD2 LYS A 114 13.173 0.334 -17.737 1.00 0.00 H new ATOM 0 HD3 LYS A 114 11.935 1.295 -16.952 1.00 0.00 H new ATOM 0 HE2 LYS A 114 13.997 2.641 -17.495 1.00 0.00 H new ATOM 0 HE3 LYS A 114 13.631 2.642 -15.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 15.568 1.659 -15.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 15.254 0.394 -16.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 15.989 1.822 -16.984 1.00 0.00 H new ATOM 1895 N ASN A 115 12.639 -4.080 -15.369 1.00 0.00 N ATOM 1896 CA ASN A 115 13.680 -5.047 -14.888 1.00 0.00 C ATOM 1897 C ASN A 115 14.737 -4.309 -14.057 1.00 0.00 C ATOM 1898 O ASN A 115 15.925 -4.509 -14.222 1.00 0.00 O ATOM 1899 CB ASN A 115 14.355 -5.711 -16.091 1.00 0.00 C ATOM 1900 CG ASN A 115 15.063 -6.987 -15.637 1.00 0.00 C ATOM 1901 OD1 ASN A 115 14.623 -7.645 -14.714 1.00 0.00 O ATOM 1902 ND2 ASN A 115 16.153 -7.367 -16.247 1.00 0.00 N ATOM 0 H ASN A 115 11.686 -4.280 -15.066 1.00 0.00 H new ATOM 0 HA ASN A 115 13.202 -5.806 -14.269 1.00 0.00 H new ATOM 0 HB2 ASN A 115 13.613 -5.946 -16.854 1.00 0.00 H new ATOM 0 HB3 ASN A 115 15.072 -5.026 -16.543 1.00 0.00 H new ATOM 0 HD21 ASN A 115 16.635 -8.215 -15.949 1.00 0.00 H new ATOM 0 HD22 ASN A 115 16.523 -6.816 -17.021 1.00 0.00 H new ATOM 1909 N LEU A 116 14.311 -3.453 -13.171 1.00 0.00 N ATOM 1910 CA LEU A 116 15.278 -2.690 -12.327 1.00 0.00 C ATOM 1911 C LEU A 116 16.007 -3.610 -11.355 1.00 0.00 C ATOM 1912 O LEU A 116 17.152 -3.379 -11.017 1.00 0.00 O ATOM 1913 CB LEU A 116 14.518 -1.636 -11.535 1.00 0.00 C ATOM 1914 CG LEU A 116 13.926 -0.645 -12.524 1.00 0.00 C ATOM 1915 CD1 LEU A 116 12.922 0.264 -11.816 1.00 0.00 C ATOM 1916 CD2 LEU A 116 15.052 0.202 -13.146 1.00 0.00 C ATOM 0 H LEU A 116 13.328 -3.246 -12.993 1.00 0.00 H new ATOM 0 HA LEU A 116 16.015 -2.225 -12.981 1.00 0.00 H new ATOM 0 HB2 LEU A 116 13.730 -2.099 -10.941 1.00 0.00 H new ATOM 0 HB3 LEU A 116 15.185 -1.128 -10.838 1.00 0.00 H new ATOM 0 HG LEU A 116 13.411 -1.193 -13.313 1.00 0.00 H new ATOM 0 HD11 LEU A 116 12.503 0.971 -12.532 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.121 -0.340 -11.391 1.00 0.00 H new ATOM 0 HD13 LEU A 116 13.425 0.811 -11.019 1.00 0.00 H new ATOM 0 HD21 LEU A 116 14.625 0.911 -13.855 1.00 0.00 H new ATOM 0 HD22 LEU A 116 15.575 0.745 -12.359 1.00 0.00 H new ATOM 0 HD23 LEU A 116 15.754 -0.451 -13.665 1.00 0.00 H new ATOM 1928 N SER A 117 15.362 -4.631 -10.872 1.00 0.00 N ATOM 1929 CA SER A 117 16.055 -5.518 -9.886 1.00 0.00 C ATOM 1930 C SER A 117 15.475 -6.936 -9.897 1.00 0.00 C ATOM 1931 O SER A 117 14.750 -7.325 -10.791 1.00 0.00 O ATOM 1932 CB SER A 117 15.899 -4.927 -8.486 1.00 0.00 C ATOM 1933 OG SER A 117 16.395 -5.855 -7.529 1.00 0.00 O ATOM 0 H SER A 117 14.404 -4.891 -11.107 1.00 0.00 H new ATOM 0 HA SER A 117 17.107 -5.578 -10.165 1.00 0.00 H new ATOM 0 HB2 SER A 117 16.443 -3.985 -8.413 1.00 0.00 H new ATOM 0 HB3 SER A 117 14.851 -4.706 -8.286 1.00 0.00 H new ATOM 0 HG SER A 117 17.358 -5.719 -7.411 1.00 0.00 H new ATOM 1939 N THR A 118 15.822 -7.715 -8.900 1.00 0.00 N ATOM 1940 CA THR A 118 15.334 -9.129 -8.826 1.00 0.00 C ATOM 1941 C THR A 118 14.708 -9.394 -7.447 1.00 0.00 C ATOM 1942 O THR A 118 14.936 -8.645 -6.517 1.00 0.00 O ATOM 1943 CB THR A 118 16.528 -10.065 -9.018 1.00 0.00 C ATOM 1944 OG1 THR A 118 17.494 -9.799 -8.014 1.00 0.00 O ATOM 1945 CG2 THR A 118 17.146 -9.837 -10.397 1.00 0.00 C ATOM 0 H THR A 118 16.426 -7.430 -8.129 1.00 0.00 H new ATOM 0 HA THR A 118 14.585 -9.300 -9.599 1.00 0.00 H new ATOM 0 HB THR A 118 16.196 -11.100 -8.943 1.00 0.00 H new ATOM 0 HG1 THR A 118 18.261 -10.398 -8.131 1.00 0.00 H new ATOM 0 HG21 THR A 118 17.996 -10.506 -10.530 1.00 0.00 H new ATOM 0 HG22 THR A 118 16.402 -10.039 -11.167 1.00 0.00 H new ATOM 0 HG23 THR A 118 17.481 -8.803 -10.479 1.00 0.00 H new ATOM 1953 N PRO A 119 13.931 -10.453 -7.291 1.00 0.00 N ATOM 1954 CA PRO A 119 13.301 -10.780 -5.975 1.00 0.00 C ATOM 1955 C PRO A 119 14.340 -11.004 -4.869 1.00 0.00 C ATOM 1956 O PRO A 119 14.157 -10.582 -3.744 1.00 0.00 O ATOM 1957 CB PRO A 119 12.517 -12.076 -6.239 1.00 0.00 C ATOM 1958 CG PRO A 119 12.346 -12.147 -7.717 1.00 0.00 C ATOM 1959 CD PRO A 119 13.558 -11.447 -8.323 1.00 0.00 C ATOM 0 HA PRO A 119 12.675 -9.960 -5.623 1.00 0.00 H new ATOM 0 HB2 PRO A 119 13.059 -12.945 -5.865 1.00 0.00 H new ATOM 0 HB3 PRO A 119 11.552 -12.060 -5.733 1.00 0.00 H new ATOM 0 HG2 PRO A 119 12.287 -13.183 -8.052 1.00 0.00 H new ATOM 0 HG3 PRO A 119 11.421 -11.659 -8.025 1.00 0.00 H new ATOM 0 HD2 PRO A 119 14.370 -12.147 -8.519 1.00 0.00 H new ATOM 0 HD3 PRO A 119 13.313 -10.969 -9.272 1.00 0.00 H new ATOM 1967 N ALA A 120 15.428 -11.665 -5.168 1.00 0.00 N ATOM 1968 CA ALA A 120 16.462 -11.908 -4.117 1.00 0.00 C ATOM 1969 C ALA A 120 17.029 -10.581 -3.641 1.00 0.00 C ATOM 1970 O ALA A 120 17.282 -10.390 -2.467 1.00 0.00 O ATOM 1971 CB ALA A 120 17.585 -12.772 -4.690 1.00 0.00 C ATOM 0 H ALA A 120 15.645 -12.045 -6.089 1.00 0.00 H new ATOM 0 HA ALA A 120 16.004 -12.426 -3.275 1.00 0.00 H new ATOM 0 HB1 ALA A 120 18.337 -12.947 -3.921 1.00 0.00 H new ATOM 0 HB2 ALA A 120 17.176 -13.726 -5.022 1.00 0.00 H new ATOM 0 HB3 ALA A 120 18.043 -12.259 -5.536 1.00 0.00 H new ATOM 1977 N GLU A 121 17.209 -9.647 -4.526 1.00 0.00 N ATOM 1978 CA GLU A 121 17.728 -8.334 -4.082 1.00 0.00 C ATOM 1979 C GLU A 121 16.649 -7.693 -3.211 1.00 0.00 C ATOM 1980 O GLU A 121 16.920 -7.170 -2.148 1.00 0.00 O ATOM 1981 CB GLU A 121 18.019 -7.461 -5.304 1.00 0.00 C ATOM 1982 CG GLU A 121 19.161 -8.082 -6.111 1.00 0.00 C ATOM 1983 CD GLU A 121 19.429 -7.232 -7.354 1.00 0.00 C ATOM 1984 OE1 GLU A 121 18.659 -6.318 -7.601 1.00 0.00 O ATOM 1985 OE2 GLU A 121 20.399 -7.509 -8.039 1.00 0.00 O ATOM 0 H GLU A 121 17.022 -9.735 -5.525 1.00 0.00 H new ATOM 0 HA GLU A 121 18.654 -8.444 -3.517 1.00 0.00 H new ATOM 0 HB2 GLU A 121 17.126 -7.374 -5.924 1.00 0.00 H new ATOM 0 HB3 GLU A 121 18.288 -6.453 -4.989 1.00 0.00 H new ATOM 0 HG2 GLU A 121 20.061 -8.144 -5.499 1.00 0.00 H new ATOM 0 HG3 GLU A 121 18.903 -9.100 -6.402 1.00 0.00 H new ATOM 1992 N LEU A 122 15.418 -7.749 -3.654 1.00 0.00 N ATOM 1993 CA LEU A 122 14.290 -7.169 -2.872 1.00 0.00 C ATOM 1994 C LEU A 122 14.087 -7.953 -1.572 1.00 0.00 C ATOM 1995 O LEU A 122 14.086 -7.395 -0.493 1.00 0.00 O ATOM 1996 CB LEU A 122 13.031 -7.275 -3.737 1.00 0.00 C ATOM 1997 CG LEU A 122 11.786 -6.907 -2.929 1.00 0.00 C ATOM 1998 CD1 LEU A 122 11.996 -5.553 -2.246 1.00 0.00 C ATOM 1999 CD2 LEU A 122 10.563 -6.843 -3.868 1.00 0.00 C ATOM 0 H LEU A 122 15.146 -8.179 -4.538 1.00 0.00 H new ATOM 0 HA LEU A 122 14.502 -6.131 -2.614 1.00 0.00 H new ATOM 0 HB2 LEU A 122 13.120 -6.614 -4.599 1.00 0.00 H new ATOM 0 HB3 LEU A 122 12.933 -8.290 -4.123 1.00 0.00 H new ATOM 0 HG LEU A 122 11.610 -7.665 -2.165 1.00 0.00 H new ATOM 0 HD11 LEU A 122 11.107 -5.294 -1.671 1.00 0.00 H new ATOM 0 HD12 LEU A 122 12.856 -5.612 -1.578 1.00 0.00 H new ATOM 0 HD13 LEU A 122 12.175 -4.788 -3.002 1.00 0.00 H new ATOM 0 HD21 LEU A 122 9.675 -6.581 -3.292 1.00 0.00 H new ATOM 0 HD22 LEU A 122 10.733 -6.089 -4.636 1.00 0.00 H new ATOM 0 HD23 LEU A 122 10.415 -7.814 -4.340 1.00 0.00 H new ATOM 2011 N GLN A 123 13.941 -9.246 -1.664 1.00 0.00 N ATOM 2012 CA GLN A 123 13.771 -10.069 -0.436 1.00 0.00 C ATOM 2013 C GLN A 123 14.955 -9.820 0.497 1.00 0.00 C ATOM 2014 O GLN A 123 14.795 -9.603 1.681 1.00 0.00 O ATOM 2015 CB GLN A 123 13.725 -11.544 -0.833 1.00 0.00 C ATOM 2016 CG GLN A 123 13.363 -12.397 0.380 1.00 0.00 C ATOM 2017 CD GLN A 123 11.879 -12.215 0.705 1.00 0.00 C ATOM 2018 OE1 GLN A 123 11.055 -12.153 -0.186 1.00 0.00 O ATOM 2019 NE2 GLN A 123 11.499 -12.130 1.952 1.00 0.00 N ATOM 0 H GLN A 123 13.932 -9.769 -2.540 1.00 0.00 H new ATOM 0 HA GLN A 123 12.846 -9.801 0.075 1.00 0.00 H new ATOM 0 HB2 GLN A 123 12.992 -11.694 -1.626 1.00 0.00 H new ATOM 0 HB3 GLN A 123 14.692 -11.853 -1.230 1.00 0.00 H new ATOM 0 HG2 GLN A 123 13.576 -13.447 0.177 1.00 0.00 H new ATOM 0 HG3 GLN A 123 13.972 -12.108 1.236 1.00 0.00 H new ATOM 0 HE21 GLN A 123 12.190 -12.182 2.700 1.00 0.00 H new ATOM 0 HE22 GLN A 123 10.511 -12.012 2.177 1.00 0.00 H new ATOM 2028 N ALA A 124 16.145 -9.844 -0.036 1.00 0.00 N ATOM 2029 CA ALA A 124 17.346 -9.601 0.817 1.00 0.00 C ATOM 2030 C ALA A 124 17.266 -8.201 1.439 1.00 0.00 C ATOM 2031 O ALA A 124 17.619 -7.998 2.584 1.00 0.00 O ATOM 2032 CB ALA A 124 18.605 -9.702 -0.043 1.00 0.00 C ATOM 0 H ALA A 124 16.339 -10.021 -1.022 1.00 0.00 H new ATOM 0 HA ALA A 124 17.382 -10.346 1.611 1.00 0.00 H new ATOM 0 HB1 ALA A 124 19.484 -9.525 0.577 1.00 0.00 H new ATOM 0 HB2 ALA A 124 18.666 -10.697 -0.483 1.00 0.00 H new ATOM 0 HB3 ALA A 124 18.564 -8.956 -0.837 1.00 0.00 H new ATOM 2038 N ALA A 125 16.807 -7.235 0.691 1.00 0.00 N ATOM 2039 CA ALA A 125 16.704 -5.847 1.234 1.00 0.00 C ATOM 2040 C ALA A 125 15.629 -5.823 2.305 1.00 0.00 C ATOM 2041 O ALA A 125 15.725 -5.128 3.297 1.00 0.00 O ATOM 2042 CB ALA A 125 16.317 -4.886 0.114 1.00 0.00 C ATOM 0 H ALA A 125 16.498 -7.346 -0.275 1.00 0.00 H new ATOM 0 HA ALA A 125 17.663 -5.543 1.655 1.00 0.00 H new ATOM 0 HB1 ALA A 125 16.242 -3.874 0.512 1.00 0.00 H new ATOM 0 HB2 ALA A 125 17.076 -4.913 -0.667 1.00 0.00 H new ATOM 0 HB3 ALA A 125 15.355 -5.183 -0.304 1.00 0.00 H new ATOM 2048 N ILE A 126 14.616 -6.602 2.111 1.00 0.00 N ATOM 2049 CA ILE A 126 13.529 -6.673 3.099 1.00 0.00 C ATOM 2050 C ILE A 126 14.085 -7.256 4.394 1.00 0.00 C ATOM 2051 O ILE A 126 13.913 -6.705 5.462 1.00 0.00 O ATOM 2052 CB ILE A 126 12.434 -7.545 2.514 1.00 0.00 C ATOM 2053 CG1 ILE A 126 11.592 -6.681 1.574 1.00 0.00 C ATOM 2054 CG2 ILE A 126 11.556 -8.117 3.627 1.00 0.00 C ATOM 2055 CD1 ILE A 126 10.636 -7.553 0.776 1.00 0.00 C ATOM 0 H ILE A 126 14.496 -7.202 1.295 1.00 0.00 H new ATOM 0 HA ILE A 126 13.116 -5.690 3.324 1.00 0.00 H new ATOM 0 HB ILE A 126 12.874 -8.380 1.969 1.00 0.00 H new ATOM 0 HG12 ILE A 126 11.030 -5.945 2.150 1.00 0.00 H new ATOM 0 HG13 ILE A 126 12.242 -6.127 0.897 1.00 0.00 H new ATOM 0 HG21 ILE A 126 10.775 -8.740 3.191 1.00 0.00 H new ATOM 0 HG22 ILE A 126 12.167 -8.719 4.300 1.00 0.00 H new ATOM 0 HG23 ILE A 126 11.098 -7.300 4.186 1.00 0.00 H new ATOM 0 HD11 ILE A 126 10.042 -6.927 0.110 1.00 0.00 H new ATOM 0 HD12 ILE A 126 11.205 -8.272 0.186 1.00 0.00 H new ATOM 0 HD13 ILE A 126 9.975 -8.087 1.458 1.00 0.00 H new ATOM 2067 N ASP A 127 14.781 -8.353 4.303 1.00 0.00 N ATOM 2068 CA ASP A 127 15.378 -8.951 5.530 1.00 0.00 C ATOM 2069 C ASP A 127 16.375 -7.949 6.120 1.00 0.00 C ATOM 2070 O ASP A 127 16.494 -7.801 7.319 1.00 0.00 O ATOM 2071 CB ASP A 127 16.107 -10.247 5.165 1.00 0.00 C ATOM 2072 CG ASP A 127 16.552 -10.964 6.442 1.00 0.00 C ATOM 2073 OD1 ASP A 127 16.212 -10.491 7.513 1.00 0.00 O ATOM 2074 OD2 ASP A 127 17.227 -11.973 6.326 1.00 0.00 O ATOM 0 H ASP A 127 14.962 -8.860 3.437 1.00 0.00 H new ATOM 0 HA ASP A 127 14.598 -9.176 6.257 1.00 0.00 H new ATOM 0 HB2 ASP A 127 15.450 -10.894 4.583 1.00 0.00 H new ATOM 0 HB3 ASP A 127 16.972 -10.026 4.540 1.00 0.00 H new ATOM 2079 N GLY A 128 17.093 -7.263 5.271 1.00 0.00 N ATOM 2080 CA GLY A 128 18.092 -6.267 5.751 1.00 0.00 C ATOM 2081 C GLY A 128 17.401 -5.112 6.490 1.00 0.00 C ATOM 2082 O GLY A 128 17.959 -4.538 7.404 1.00 0.00 O ATOM 0 H GLY A 128 17.029 -7.352 4.257 1.00 0.00 H new ATOM 0 HA2 GLY A 128 18.807 -6.753 6.415 1.00 0.00 H new ATOM 0 HA3 GLY A 128 18.658 -5.876 4.905 1.00 0.00 H new ATOM 2086 N ASN A 129 16.206 -4.746 6.098 1.00 0.00 N ATOM 2087 CA ASN A 129 15.530 -3.604 6.798 1.00 0.00 C ATOM 2088 C ASN A 129 14.624 -4.120 7.919 1.00 0.00 C ATOM 2089 O ASN A 129 14.470 -3.476 8.937 1.00 0.00 O ATOM 2090 CB ASN A 129 14.713 -2.767 5.805 1.00 0.00 C ATOM 2091 CG ASN A 129 13.397 -3.464 5.454 1.00 0.00 C ATOM 2092 OD1 ASN A 129 13.116 -3.697 4.298 1.00 0.00 O ATOM 2093 ND2 ASN A 129 12.561 -3.785 6.402 1.00 0.00 N ATOM 0 H ASN A 129 15.676 -5.176 5.340 1.00 0.00 H new ATOM 0 HA ASN A 129 16.302 -2.971 7.235 1.00 0.00 H new ATOM 0 HB2 ASN A 129 14.506 -1.786 6.234 1.00 0.00 H new ATOM 0 HB3 ASN A 129 15.295 -2.602 4.898 1.00 0.00 H new ATOM 0 HD21 ASN A 129 11.673 -4.231 6.170 1.00 0.00 H new ATOM 0 HD22 ASN A 129 12.795 -3.590 7.376 1.00 0.00 H new ATOM 2100 N ARG A 130 14.020 -5.263 7.756 1.00 0.00 N ATOM 2101 CA ARG A 130 13.133 -5.779 8.839 1.00 0.00 C ATOM 2102 C ARG A 130 13.958 -6.031 10.102 1.00 0.00 C ATOM 2103 O ARG A 130 15.097 -6.450 10.044 1.00 0.00 O ATOM 2104 CB ARG A 130 12.460 -7.076 8.397 1.00 0.00 C ATOM 2105 CG ARG A 130 11.403 -6.750 7.347 1.00 0.00 C ATOM 2106 CD ARG A 130 10.611 -8.014 7.012 1.00 0.00 C ATOM 2107 NE ARG A 130 9.827 -8.442 8.204 1.00 0.00 N ATOM 2108 CZ ARG A 130 8.853 -9.300 8.072 1.00 0.00 C ATOM 2109 NH1 ARG A 130 8.553 -9.771 6.894 1.00 0.00 N ATOM 2110 NH2 ARG A 130 8.176 -9.687 9.121 1.00 0.00 N ATOM 0 H ARG A 130 14.099 -5.858 6.931 1.00 0.00 H new ATOM 0 HA ARG A 130 12.363 -5.037 9.050 1.00 0.00 H new ATOM 0 HB2 ARG A 130 13.199 -7.764 7.987 1.00 0.00 H new ATOM 0 HB3 ARG A 130 12.002 -7.573 9.252 1.00 0.00 H new ATOM 0 HG2 ARG A 130 10.732 -5.976 7.719 1.00 0.00 H new ATOM 0 HG3 ARG A 130 11.877 -6.356 6.448 1.00 0.00 H new ATOM 0 HD2 ARG A 130 9.942 -7.824 6.173 1.00 0.00 H new ATOM 0 HD3 ARG A 130 11.289 -8.810 6.705 1.00 0.00 H new ATOM 0 HE ARG A 130 10.052 -8.064 9.124 1.00 0.00 H new ATOM 0 HH11 ARG A 130 9.080 -9.469 6.075 1.00 0.00 H new ATOM 0 HH12 ARG A 130 7.791 -10.442 6.792 1.00 0.00 H new ATOM 0 HH21 ARG A 130 8.409 -9.318 10.043 1.00 0.00 H new ATOM 0 HH22 ARG A 130 7.415 -10.358 9.018 1.00 0.00 H new