USER MOD reduce.3.24.130724 H: found=0, std=0, add=1314, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1308 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 173 HIS : no HD1:sc= 1.1 K(o=1.2,f=-3.4!) USER MOD Set 1.2: A 175 CYS SG : rot 44:sc= 0.113 USER MOD Set 2.1: A 169 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 174 ASN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Set 3.1: A 124 TYR OH : rot -159:sc= 0.787 USER MOD Set 3.2: A 128 TYR OH : rot 151:sc= 0 USER MOD Set 3.3: A 168 HIS : no HD1:sc= -0.113 K(o=0.67,f=-12!) USER MOD Set 4.1: A 87 LYS NZ :NH3+ -161:sc= 2.25 (180deg=1.17) USER MOD Set 4.2: A 103 THR OG1 : rot 180:sc= 0.992 USER MOD Set 5.1: A 33 HIS : no HE2:sc= -1.76 K(o=-1.1,f=-3) USER MOD Set 5.2: A 77 HIS : +bothHN:sc= 0.671 K(o=-1.1,f=-10!) USER MOD Set 6.1: A 26 THR OG1 : rot 4:sc= 0.0354 USER MOD Set 6.2: A 29 SER OG : rot -24:sc= 1.2 USER MOD Set 7.1: A 22 SER OG : rot -175:sc= 2.06 USER MOD Set 7.2: A 25 THR OG1 : rot 22:sc= 0.829 USER MOD Single : A 8 LYS NZ :NH3+ -169:sc= -0.0126 (180deg=-0.144) USER MOD Single : A 12 GLN : amide:sc= 0.815 K(o=0.81,f=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN :FLIP amide:sc= -0.0293 F(o=-0.66,f=-0.029) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 130:sc= 0.00413 USER MOD Single : A 43 CYS SG : rot -122:sc= -0.424! USER MOD Single : A 46 MET CE :methyl 144:sc= -0.284 (180deg=-2.09!) USER MOD Single : A 50 ASN :FLIP amide:sc=-0.00965 F(o=-1.7!,f=-0.0096) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 168:sc=-0.000343 (180deg=-0.131) USER MOD Single : A 54 SER OG : rot -138:sc= 0.899 USER MOD Single : A 61 THR OG1 : rot -160:sc= -2.99! USER MOD Single : A 62 TYR OH : rot 46:sc= 0.387 USER MOD Single : A 64 THR OG1 : rot 75:sc= 0.889 USER MOD Single : A 72 MET CE :methyl -111:sc= -0.983 (180deg=-1.66) USER MOD Single : A 73 ASN : amide:sc= -0.233 X(o=-0.23,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot -64:sc= -1.35! USER MOD Single : A 96 GLN :FLIP amide:sc= 0 F(o=-0.78,f=0) USER MOD Single : A 101 HIS : no HD1:sc= -0.27 X(o=-0.27,f=-0.34) USER MOD Single : A 105 LYS NZ :NH3+ 157:sc= 1.07 (180deg=0.689) USER MOD Single : A 106 LYS NZ :NH3+ -156:sc= 0.421 (180deg=-0.11!) USER MOD Single : A 113 LYS NZ :NH3+ -159:sc= 1.27 (180deg=1.23) USER MOD Single : A 116 THR OG1 : rot -150:sc= -0.333 USER MOD Single : A 119 HIS : no HD1:sc= 0 X(o=0,f=-0.086) USER MOD Single : A 120 HIS : no HD1:sc= -0.0846 K(o=-0.085,f=-5.9!) USER MOD Single : A 127 GLN : amide:sc= 0.803 K(o=0.8,f=0) USER MOD Single : A 130 LYS NZ :NH3+ 163:sc= -0.078 (180deg=-0.425) USER MOD Single : A 137 MET CE :methyl -169:sc=-0.00603 (180deg=-0.17) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.00741 USER MOD Single : A 152 THR OG1 : rot 68:sc= -0.918 USER MOD Single : A 156 HIS :FLIP no HE2:sc= -1.97 F(o=-2.6!,f=-2) USER MOD Single : A 158 SER OG : rot 141:sc= -0.751 USER MOD Single : A 161 LYS NZ :NH3+ 137:sc= 0.47 (180deg=-0.787) USER MOD Single : A 165 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 TYR OH : rot 68:sc= 0.78 USER MOD Single : A 171 ASN : amide:sc= -0.142 X(o=-0.14,f=-0.16) USER MOD Single : A 179 LYS NZ :NH3+ 155:sc= 2.87 (180deg=0.377) USER MOD ----------------------------------------------------------------- ATOM 92 N LYS A 8 -14.418 8.272 4.691 1.00 14.43 N ATOM 93 CA LYS A 8 -14.527 8.647 3.291 1.00 62.31 C ATOM 94 C LYS A 8 -13.751 7.659 2.431 1.00 0.22 C ATOM 95 O LYS A 8 -13.988 7.542 1.229 1.00 43.10 O ATOM 96 CB LYS A 8 -13.999 10.066 3.086 1.00 54.43 C ATOM 97 CG LYS A 8 -14.524 11.071 4.109 1.00 5.02 C ATOM 98 CD LYS A 8 -16.043 11.187 4.091 1.00 61.31 C ATOM 99 CE LYS A 8 -16.554 11.725 2.764 1.00 44.51 C ATOM 100 NZ LYS A 8 -16.094 13.118 2.503 1.00 0.41 N ATOM 0 HA LYS A 8 -15.575 8.622 2.993 1.00 62.31 H new ATOM 0 HB2 LYS A 8 -12.910 10.049 3.132 1.00 54.43 H new ATOM 0 HB3 LYS A 8 -14.270 10.404 2.086 1.00 54.43 H new ATOM 0 HG2 LYS A 8 -14.198 10.773 5.106 1.00 5.02 H new ATOM 0 HG3 LYS A 8 -14.086 12.049 3.909 1.00 5.02 H new ATOM 0 HD2 LYS A 8 -16.484 10.208 4.280 1.00 61.31 H new ATOM 0 HD3 LYS A 8 -16.367 11.844 4.898 1.00 61.31 H new ATOM 0 HE2 LYS A 8 -16.215 11.076 1.957 1.00 44.51 H new ATOM 0 HE3 LYS A 8 -17.644 11.698 2.759 1.00 44.51 H new ATOM 0 HZ1 LYS A 8 -16.611 13.508 1.689 1.00 0.41 H new ATOM 0 HZ2 LYS A 8 -16.275 13.706 3.342 1.00 0.41 H new ATOM 0 HZ3 LYS A 8 -15.075 13.114 2.296 1.00 0.41 H new ATOM 114 N GLU A 9 -12.821 6.955 3.062 1.00 74.44 N ATOM 115 CA GLU A 9 -12.108 5.875 2.414 1.00 62.24 C ATOM 116 C GLU A 9 -12.944 4.601 2.454 1.00 23.51 C ATOM 117 O GLU A 9 -13.389 4.183 3.525 1.00 25.34 O ATOM 118 CB GLU A 9 -10.758 5.637 3.091 1.00 62.02 C ATOM 119 CG GLU A 9 -9.795 6.794 2.928 1.00 31.23 C ATOM 120 CD GLU A 9 -8.355 6.420 3.211 1.00 34.13 C ATOM 121 OE1 GLU A 9 -8.103 5.323 3.750 1.00 3.11 O ATOM 122 OE2 GLU A 9 -7.464 7.229 2.887 1.00 65.11 O ATOM 0 H GLU A 9 -12.545 7.119 4.030 1.00 74.44 H new ATOM 0 HA GLU A 9 -11.929 6.153 1.375 1.00 62.24 H new ATOM 0 HB2 GLU A 9 -10.919 5.454 4.153 1.00 62.02 H new ATOM 0 HB3 GLU A 9 -10.306 4.736 2.677 1.00 62.02 H new ATOM 0 HG2 GLU A 9 -9.870 7.179 1.911 1.00 31.23 H new ATOM 0 HG3 GLU A 9 -10.092 7.601 3.597 1.00 31.23 H new ATOM 129 N PRO A 10 -13.194 3.986 1.280 1.00 44.33 N ATOM 130 CA PRO A 10 -13.954 2.732 1.166 1.00 42.33 C ATOM 131 C PRO A 10 -13.297 1.571 1.911 1.00 31.33 C ATOM 132 O PRO A 10 -12.149 1.674 2.349 1.00 23.22 O ATOM 133 CB PRO A 10 -13.981 2.451 -0.340 1.00 13.43 C ATOM 134 CG PRO A 10 -12.895 3.280 -0.923 1.00 45.04 C ATOM 135 CD PRO A 10 -12.773 4.485 -0.040 1.00 64.30 C ATOM 0 HA PRO A 10 -14.944 2.829 1.611 1.00 42.33 H new ATOM 0 HB2 PRO A 10 -13.818 1.393 -0.544 1.00 13.43 H new ATOM 0 HB3 PRO A 10 -14.948 2.713 -0.770 1.00 13.43 H new ATOM 0 HG2 PRO A 10 -11.957 2.726 -0.958 1.00 45.04 H new ATOM 0 HG3 PRO A 10 -13.132 3.569 -1.947 1.00 45.04 H new ATOM 0 HD2 PRO A 10 -11.752 4.865 -0.019 1.00 64.30 H new ATOM 0 HD3 PRO A 10 -13.410 5.300 -0.383 1.00 64.30 H new ATOM 143 N GLU A 11 -14.047 0.479 2.051 1.00 73.42 N ATOM 144 CA GLU A 11 -13.602 -0.720 2.770 1.00 5.02 C ATOM 145 C GLU A 11 -12.214 -1.195 2.328 1.00 11.34 C ATOM 146 O GLU A 11 -11.416 -1.604 3.157 1.00 21.30 O ATOM 147 CB GLU A 11 -14.631 -1.863 2.613 1.00 30.22 C ATOM 148 CG GLU A 11 -14.724 -2.481 1.213 1.00 52.15 C ATOM 149 CD GLU A 11 -15.218 -1.522 0.144 1.00 15.23 C ATOM 150 OE1 GLU A 11 -16.444 -1.426 -0.060 1.00 42.01 O ATOM 151 OE2 GLU A 11 -14.380 -0.856 -0.502 1.00 51.32 O ATOM 0 H GLU A 11 -14.988 0.398 1.667 1.00 73.42 H new ATOM 0 HA GLU A 11 -13.527 -0.443 3.821 1.00 5.02 H new ATOM 0 HB2 GLU A 11 -14.383 -2.652 3.323 1.00 30.22 H new ATOM 0 HB3 GLU A 11 -15.615 -1.483 2.889 1.00 30.22 H new ATOM 0 HG2 GLU A 11 -13.741 -2.853 0.926 1.00 52.15 H new ATOM 0 HG3 GLU A 11 -15.392 -3.341 1.251 1.00 52.15 H new ATOM 158 N GLN A 12 -11.939 -1.128 1.027 1.00 54.23 N ATOM 159 CA GLN A 12 -10.643 -1.534 0.473 1.00 12.32 C ATOM 160 C GLN A 12 -9.500 -0.672 1.008 1.00 21.33 C ATOM 161 O GLN A 12 -8.411 -1.173 1.255 1.00 62.25 O ATOM 162 CB GLN A 12 -10.691 -1.468 -1.056 1.00 44.25 C ATOM 163 CG GLN A 12 -10.953 -0.071 -1.596 1.00 24.24 C ATOM 164 CD GLN A 12 -11.681 -0.072 -2.920 1.00 71.04 C ATOM 165 OE1 GLN A 12 -11.064 -0.067 -3.984 1.00 4.33 O ATOM 166 NE2 GLN A 12 -13.003 -0.082 -2.863 1.00 71.52 N ATOM 0 H GLN A 12 -12.602 -0.793 0.328 1.00 54.23 H new ATOM 0 HA GLN A 12 -10.449 -2.560 0.787 1.00 12.32 H new ATOM 0 HB2 GLN A 12 -9.745 -1.832 -1.457 1.00 44.25 H new ATOM 0 HB3 GLN A 12 -11.470 -2.140 -1.416 1.00 44.25 H new ATOM 0 HG2 GLN A 12 -11.538 0.489 -0.867 1.00 24.24 H new ATOM 0 HG3 GLN A 12 -10.003 0.451 -1.711 1.00 24.24 H new ATOM 0 HE21 GLN A 12 -13.474 -0.086 -1.959 1.00 71.52 H new ATOM 0 HE22 GLN A 12 -13.551 -0.086 -3.724 1.00 71.52 H new ATOM 175 N LEU A 13 -9.753 0.614 1.220 1.00 50.04 N ATOM 176 CA LEU A 13 -8.712 1.512 1.680 1.00 72.13 C ATOM 177 C LEU A 13 -8.497 1.351 3.177 1.00 31.10 C ATOM 178 O LEU A 13 -7.368 1.261 3.638 1.00 41.32 O ATOM 179 CB LEU A 13 -9.057 2.964 1.339 1.00 31.20 C ATOM 180 CG LEU A 13 -8.487 3.486 0.014 1.00 24.12 C ATOM 181 CD1 LEU A 13 -8.966 2.645 -1.154 1.00 43.23 C ATOM 182 CD2 LEU A 13 -8.873 4.937 -0.202 1.00 52.44 C ATOM 0 H LEU A 13 -10.664 1.052 1.081 1.00 50.04 H new ATOM 0 HA LEU A 13 -7.786 1.254 1.167 1.00 72.13 H new ATOM 0 HB2 LEU A 13 -10.142 3.064 1.312 1.00 31.20 H new ATOM 0 HB3 LEU A 13 -8.698 3.603 2.146 1.00 31.20 H new ATOM 0 HG LEU A 13 -7.401 3.415 0.070 1.00 24.12 H new ATOM 0 HD11 LEU A 13 -8.547 3.037 -2.081 1.00 43.23 H new ATOM 0 HD12 LEU A 13 -8.641 1.614 -1.017 1.00 43.23 H new ATOM 0 HD13 LEU A 13 -10.054 2.679 -1.205 1.00 43.23 H new ATOM 0 HD21 LEU A 13 -8.458 5.287 -1.147 1.00 52.44 H new ATOM 0 HD22 LEU A 13 -9.959 5.025 -0.228 1.00 52.44 H new ATOM 0 HD23 LEU A 13 -8.479 5.544 0.614 1.00 52.44 H new ATOM 194 N ARG A 14 -9.584 1.301 3.936 1.00 4.11 N ATOM 195 CA ARG A 14 -9.482 1.101 5.380 1.00 53.01 C ATOM 196 C ARG A 14 -9.182 -0.361 5.739 1.00 10.44 C ATOM 197 O ARG A 14 -9.135 -0.724 6.917 1.00 15.22 O ATOM 198 CB ARG A 14 -10.749 1.576 6.096 1.00 31.45 C ATOM 199 CG ARG A 14 -12.024 0.920 5.605 1.00 32.31 C ATOM 200 CD ARG A 14 -13.198 1.289 6.488 1.00 54.42 C ATOM 201 NE ARG A 14 -14.475 0.884 5.912 1.00 65.21 N ATOM 202 CZ ARG A 14 -15.306 0.000 6.461 1.00 5.41 C ATOM 203 NH1 ARG A 14 -15.007 -0.590 7.612 1.00 53.40 N ATOM 204 NH2 ARG A 14 -16.453 -0.278 5.862 1.00 43.12 N ATOM 0 H ARG A 14 -10.537 1.395 3.584 1.00 4.11 H new ATOM 0 HA ARG A 14 -8.642 1.705 5.723 1.00 53.01 H new ATOM 0 HB2 ARG A 14 -10.643 1.384 7.164 1.00 31.45 H new ATOM 0 HB3 ARG A 14 -10.839 2.655 5.974 1.00 31.45 H new ATOM 0 HG2 ARG A 14 -12.225 1.229 4.579 1.00 32.31 H new ATOM 0 HG3 ARG A 14 -11.899 -0.163 5.593 1.00 32.31 H new ATOM 0 HD2 ARG A 14 -13.077 0.819 7.464 1.00 54.42 H new ATOM 0 HD3 ARG A 14 -13.202 2.367 6.652 1.00 54.42 H new ATOM 0 HE ARG A 14 -14.751 1.308 5.026 1.00 65.21 H new ATOM 0 HH11 ARG A 14 -14.132 -0.368 8.087 1.00 53.40 H new ATOM 0 HH12 ARG A 14 -15.652 -1.265 8.022 1.00 53.40 H new ATOM 0 HH21 ARG A 14 -16.696 0.184 4.986 1.00 43.12 H new ATOM 0 HH22 ARG A 14 -17.094 -0.954 6.277 1.00 43.12 H new ATOM 218 N LYS A 15 -9.020 -1.202 4.731 1.00 2.52 N ATOM 219 CA LYS A 15 -8.560 -2.561 4.948 1.00 14.34 C ATOM 220 C LYS A 15 -7.049 -2.665 4.750 1.00 50.51 C ATOM 221 O LYS A 15 -6.452 -1.951 3.944 1.00 41.51 O ATOM 222 CB LYS A 15 -9.304 -3.533 4.014 1.00 21.32 C ATOM 223 CG LYS A 15 -8.884 -4.990 4.150 1.00 1.21 C ATOM 224 CD LYS A 15 -9.989 -5.947 3.724 1.00 61.04 C ATOM 225 CE LYS A 15 -10.480 -5.680 2.310 1.00 52.33 C ATOM 226 NZ LYS A 15 -11.538 -6.645 1.910 1.00 52.15 N ATOM 0 H LYS A 15 -9.200 -0.966 3.755 1.00 2.52 H new ATOM 0 HA LYS A 15 -8.780 -2.837 5.979 1.00 14.34 H new ATOM 0 HB2 LYS A 15 -10.374 -3.457 4.210 1.00 21.32 H new ATOM 0 HB3 LYS A 15 -9.146 -3.218 2.983 1.00 21.32 H new ATOM 0 HG2 LYS A 15 -7.996 -5.169 3.543 1.00 1.21 H new ATOM 0 HG3 LYS A 15 -8.609 -5.192 5.185 1.00 1.21 H new ATOM 0 HD2 LYS A 15 -9.623 -6.972 3.790 1.00 61.04 H new ATOM 0 HD3 LYS A 15 -10.826 -5.862 4.417 1.00 61.04 H new ATOM 0 HE2 LYS A 15 -10.869 -4.664 2.244 1.00 52.33 H new ATOM 0 HE3 LYS A 15 -9.643 -5.746 1.614 1.00 52.33 H new ATOM 0 HZ1 LYS A 15 -11.851 -6.435 0.941 1.00 52.15 H new ATOM 0 HZ2 LYS A 15 -11.158 -7.612 1.949 1.00 52.15 H new ATOM 0 HZ3 LYS A 15 -12.346 -6.563 2.560 1.00 52.15 H new ATOM 240 N LEU A 16 -6.452 -3.564 5.507 1.00 13.25 N ATOM 241 CA LEU A 16 -5.032 -3.832 5.418 1.00 52.10 C ATOM 242 C LEU A 16 -4.784 -5.267 4.977 1.00 2.14 C ATOM 243 O LEU A 16 -5.533 -6.176 5.329 1.00 10.41 O ATOM 244 CB LEU A 16 -4.331 -3.571 6.757 1.00 22.11 C ATOM 245 CG LEU A 16 -4.349 -2.122 7.241 1.00 1.31 C ATOM 246 CD1 LEU A 16 -3.507 -1.967 8.496 1.00 52.52 C ATOM 247 CD2 LEU A 16 -3.864 -1.177 6.149 1.00 44.51 C ATOM 0 H LEU A 16 -6.939 -4.130 6.202 1.00 13.25 H new ATOM 0 HA LEU A 16 -4.615 -3.153 4.674 1.00 52.10 H new ATOM 0 HB2 LEU A 16 -4.798 -4.195 7.519 1.00 22.11 H new ATOM 0 HB3 LEU A 16 -3.293 -3.894 6.672 1.00 22.11 H new ATOM 0 HG LEU A 16 -5.379 -1.859 7.483 1.00 1.31 H new ATOM 0 HD11 LEU A 16 -3.532 -0.928 8.825 1.00 52.52 H new ATOM 0 HD12 LEU A 16 -3.906 -2.607 9.283 1.00 52.52 H new ATOM 0 HD13 LEU A 16 -2.478 -2.255 8.281 1.00 52.52 H new ATOM 0 HD21 LEU A 16 -3.886 -0.152 6.519 1.00 44.51 H new ATOM 0 HD22 LEU A 16 -2.844 -1.439 5.868 1.00 44.51 H new ATOM 0 HD23 LEU A 16 -4.514 -1.263 5.278 1.00 44.51 H new ATOM 259 N PHE A 17 -3.731 -5.448 4.205 1.00 61.02 N ATOM 260 CA PHE A 17 -3.287 -6.757 3.772 1.00 61.31 C ATOM 261 C PHE A 17 -2.147 -7.199 4.673 1.00 1.04 C ATOM 262 O PHE A 17 -1.119 -6.536 4.755 1.00 65.04 O ATOM 263 CB PHE A 17 -2.835 -6.707 2.304 1.00 41.41 C ATOM 264 CG PHE A 17 -1.947 -7.854 1.888 1.00 44.44 C ATOM 265 CD1 PHE A 17 -2.473 -9.115 1.661 1.00 22.44 C ATOM 266 CD2 PHE A 17 -0.583 -7.662 1.721 1.00 33.40 C ATOM 267 CE1 PHE A 17 -1.657 -10.162 1.279 1.00 43.35 C ATOM 268 CE2 PHE A 17 0.237 -8.705 1.339 1.00 3.23 C ATOM 269 CZ PHE A 17 -0.300 -9.956 1.117 1.00 43.01 C ATOM 0 H PHE A 17 -3.154 -4.682 3.857 1.00 61.02 H new ATOM 0 HA PHE A 17 -4.106 -7.473 3.842 1.00 61.31 H new ATOM 0 HB2 PHE A 17 -3.718 -6.696 1.665 1.00 41.41 H new ATOM 0 HB3 PHE A 17 -2.304 -5.771 2.131 1.00 41.41 H new ATOM 0 HD1 PHE A 17 -3.533 -9.282 1.784 1.00 22.44 H new ATOM 0 HD2 PHE A 17 -0.157 -6.684 1.892 1.00 33.40 H new ATOM 0 HE1 PHE A 17 -2.079 -11.141 1.107 1.00 43.35 H new ATOM 0 HE2 PHE A 17 1.297 -8.542 1.214 1.00 3.23 H new ATOM 0 HZ PHE A 17 0.339 -10.773 0.817 1.00 43.01 H new ATOM 279 N ILE A 18 -2.336 -8.300 5.358 1.00 31.23 N ATOM 280 CA ILE A 18 -1.337 -8.789 6.284 1.00 75.52 C ATOM 281 C ILE A 18 -0.528 -9.893 5.628 1.00 64.22 C ATOM 282 O ILE A 18 -1.045 -10.974 5.370 1.00 61.22 O ATOM 283 CB ILE A 18 -1.974 -9.331 7.582 1.00 53.10 C ATOM 284 CG1 ILE A 18 -3.088 -8.400 8.079 1.00 4.22 C ATOM 285 CG2 ILE A 18 -0.907 -9.503 8.654 1.00 21.10 C ATOM 286 CD1 ILE A 18 -2.634 -6.981 8.337 1.00 51.34 C ATOM 0 H ILE A 18 -3.174 -8.878 5.293 1.00 31.23 H new ATOM 0 HA ILE A 18 -0.692 -7.950 6.546 1.00 75.52 H new ATOM 0 HB ILE A 18 -2.420 -10.302 7.366 1.00 53.10 H new ATOM 0 HG12 ILE A 18 -3.891 -8.385 7.342 1.00 4.22 H new ATOM 0 HG13 ILE A 18 -3.507 -8.810 8.998 1.00 4.22 H new ATOM 0 HG21 ILE A 18 -1.366 -9.886 9.566 1.00 21.10 H new ATOM 0 HG22 ILE A 18 -0.151 -10.206 8.305 1.00 21.10 H new ATOM 0 HG23 ILE A 18 -0.439 -8.540 8.860 1.00 21.10 H new ATOM 0 HD11 ILE A 18 -3.479 -6.386 8.685 1.00 51.34 H new ATOM 0 HD12 ILE A 18 -1.853 -6.981 9.097 1.00 51.34 H new ATOM 0 HD13 ILE A 18 -2.243 -6.551 7.415 1.00 51.34 H new ATOM 298 N GLY A 19 0.731 -9.617 5.354 1.00 60.25 N ATOM 299 CA GLY A 19 1.581 -10.601 4.727 1.00 45.13 C ATOM 300 C GLY A 19 2.565 -11.188 5.707 1.00 2.23 C ATOM 301 O GLY A 19 2.897 -10.549 6.703 1.00 34.12 O ATOM 0 H GLY A 19 1.183 -8.725 5.555 1.00 60.25 H new ATOM 0 HA2 GLY A 19 0.967 -11.397 4.305 1.00 45.13 H new ATOM 0 HA3 GLY A 19 2.121 -10.142 3.899 1.00 45.13 H new ATOM 305 N GLY A 20 3.020 -12.403 5.446 1.00 35.12 N ATOM 306 CA GLY A 20 4.035 -13.005 6.284 1.00 23.50 C ATOM 307 C GLY A 20 3.518 -13.442 7.639 1.00 62.52 C ATOM 308 O GLY A 20 4.201 -13.276 8.648 1.00 64.13 O ATOM 0 H GLY A 20 2.705 -12.983 4.669 1.00 35.12 H new ATOM 0 HA2 GLY A 20 4.455 -13.869 5.769 1.00 23.50 H new ATOM 0 HA3 GLY A 20 4.847 -12.292 6.426 1.00 23.50 H new ATOM 312 N LEU A 21 2.316 -13.998 7.662 1.00 5.42 N ATOM 313 CA LEU A 21 1.748 -14.556 8.881 1.00 65.43 C ATOM 314 C LEU A 21 2.322 -15.941 9.136 1.00 34.41 C ATOM 315 O LEU A 21 3.055 -16.483 8.304 1.00 40.42 O ATOM 316 CB LEU A 21 0.224 -14.656 8.760 1.00 23.43 C ATOM 317 CG LEU A 21 -0.532 -13.332 8.830 1.00 14.34 C ATOM 318 CD1 LEU A 21 -1.978 -13.517 8.405 1.00 20.32 C ATOM 319 CD2 LEU A 21 -0.471 -12.768 10.235 1.00 21.40 C ATOM 0 H LEU A 21 1.711 -14.075 6.844 1.00 5.42 H new ATOM 0 HA LEU A 21 2.000 -13.898 9.712 1.00 65.43 H new ATOM 0 HB2 LEU A 21 -0.016 -15.141 7.814 1.00 23.43 H new ATOM 0 HB3 LEU A 21 -0.144 -15.306 9.554 1.00 23.43 H new ATOM 0 HG LEU A 21 -0.058 -12.629 8.145 1.00 14.34 H new ATOM 0 HD11 LEU A 21 -2.499 -12.561 8.462 1.00 20.32 H new ATOM 0 HD12 LEU A 21 -2.012 -13.888 7.381 1.00 20.32 H new ATOM 0 HD13 LEU A 21 -2.463 -14.235 9.067 1.00 20.32 H new ATOM 0 HD21 LEU A 21 -1.014 -11.824 10.272 1.00 21.40 H new ATOM 0 HD22 LEU A 21 -0.924 -13.474 10.931 1.00 21.40 H new ATOM 0 HD23 LEU A 21 0.569 -12.600 10.515 1.00 21.40 H new ATOM 331 N SER A 22 1.980 -16.524 10.271 1.00 51.34 N ATOM 332 CA SER A 22 2.396 -17.878 10.566 1.00 52.44 C ATOM 333 C SER A 22 1.357 -18.838 10.010 1.00 1.14 C ATOM 334 O SER A 22 0.266 -18.420 9.616 1.00 14.52 O ATOM 335 CB SER A 22 2.568 -18.083 12.077 1.00 15.41 C ATOM 336 OG SER A 22 1.349 -17.874 12.769 1.00 51.22 O ATOM 0 H SER A 22 1.418 -16.082 10.998 1.00 51.34 H new ATOM 0 HA SER A 22 3.362 -18.070 10.099 1.00 52.44 H new ATOM 0 HB2 SER A 22 2.929 -19.093 12.270 1.00 15.41 H new ATOM 0 HB3 SER A 22 3.325 -17.396 12.455 1.00 15.41 H new ATOM 0 HG SER A 22 1.506 -17.936 13.734 1.00 51.22 H new ATOM 342 N PHE A 23 1.680 -20.118 9.978 1.00 14.40 N ATOM 343 CA PHE A 23 0.740 -21.120 9.505 1.00 33.32 C ATOM 344 C PHE A 23 -0.254 -21.469 10.605 1.00 63.02 C ATOM 345 O PHE A 23 -1.210 -22.215 10.389 1.00 12.51 O ATOM 346 CB PHE A 23 1.485 -22.364 9.025 1.00 74.13 C ATOM 347 CG PHE A 23 2.329 -22.110 7.805 1.00 1.54 C ATOM 348 CD1 PHE A 23 1.763 -22.149 6.542 1.00 35.15 C ATOM 349 CD2 PHE A 23 3.679 -21.824 7.919 1.00 73.34 C ATOM 350 CE1 PHE A 23 2.526 -21.910 5.417 1.00 64.11 C ATOM 351 CE2 PHE A 23 4.449 -21.585 6.796 1.00 10.21 C ATOM 352 CZ PHE A 23 3.871 -21.626 5.544 1.00 50.50 C ATOM 0 H PHE A 23 2.583 -20.489 10.273 1.00 14.40 H new ATOM 0 HA PHE A 23 0.185 -20.712 8.660 1.00 33.32 H new ATOM 0 HB2 PHE A 23 2.121 -22.733 9.830 1.00 74.13 H new ATOM 0 HB3 PHE A 23 0.763 -23.150 8.803 1.00 74.13 H new ATOM 0 HD1 PHE A 23 0.711 -22.369 6.436 1.00 35.15 H new ATOM 0 HD2 PHE A 23 4.136 -21.787 8.897 1.00 73.34 H new ATOM 0 HE1 PHE A 23 2.071 -21.945 4.438 1.00 64.11 H new ATOM 0 HE2 PHE A 23 5.502 -21.366 6.899 1.00 10.21 H new ATOM 0 HZ PHE A 23 4.469 -21.436 4.665 1.00 50.50 H new ATOM 362 N GLU A 24 -0.033 -20.886 11.778 1.00 52.22 N ATOM 363 CA GLU A 24 -0.890 -21.114 12.927 1.00 54.32 C ATOM 364 C GLU A 24 -1.772 -19.901 13.214 1.00 23.32 C ATOM 365 O GLU A 24 -2.478 -19.873 14.217 1.00 64.21 O ATOM 366 CB GLU A 24 -0.041 -21.440 14.152 1.00 3.54 C ATOM 367 CG GLU A 24 0.887 -22.622 13.948 1.00 21.32 C ATOM 368 CD GLU A 24 1.601 -23.019 15.222 1.00 21.00 C ATOM 369 OE1 GLU A 24 0.990 -23.717 16.057 1.00 73.15 O ATOM 370 OE2 GLU A 24 2.778 -22.642 15.389 1.00 45.41 O ATOM 0 H GLU A 24 0.742 -20.246 11.955 1.00 52.22 H new ATOM 0 HA GLU A 24 -1.541 -21.958 12.699 1.00 54.32 H new ATOM 0 HB2 GLU A 24 0.552 -20.564 14.417 1.00 3.54 H new ATOM 0 HB3 GLU A 24 -0.699 -21.646 14.996 1.00 3.54 H new ATOM 0 HG2 GLU A 24 0.314 -23.471 13.576 1.00 21.32 H new ATOM 0 HG3 GLU A 24 1.623 -22.375 13.183 1.00 21.32 H new ATOM 377 N THR A 25 -1.728 -18.896 12.340 1.00 23.22 N ATOM 378 CA THR A 25 -2.565 -17.713 12.496 1.00 53.13 C ATOM 379 C THR A 25 -4.020 -18.011 12.119 1.00 32.51 C ATOM 380 O THR A 25 -4.296 -18.610 11.078 1.00 63.34 O ATOM 381 CB THR A 25 -2.059 -16.540 11.624 1.00 43.43 C ATOM 382 OG1 THR A 25 -0.674 -16.285 11.882 1.00 0.13 O ATOM 383 CG2 THR A 25 -2.856 -15.271 11.898 1.00 44.31 C ATOM 0 H THR A 25 -1.122 -18.880 11.519 1.00 23.22 H new ATOM 0 HA THR A 25 -2.510 -17.429 13.547 1.00 53.13 H new ATOM 0 HB THR A 25 -2.191 -16.826 10.580 1.00 43.43 H new ATOM 0 HG1 THR A 25 -0.262 -17.083 12.273 1.00 0.13 H new ATOM 0 HG21 THR A 25 -2.479 -14.462 11.272 1.00 44.31 H new ATOM 0 HG22 THR A 25 -3.908 -15.446 11.671 1.00 44.31 H new ATOM 0 HG23 THR A 25 -2.752 -14.996 12.947 1.00 44.31 H new ATOM 391 N THR A 26 -4.936 -17.583 12.974 1.00 53.12 N ATOM 392 CA THR A 26 -6.357 -17.666 12.683 1.00 52.05 C ATOM 393 C THR A 26 -6.916 -16.261 12.511 1.00 52.31 C ATOM 394 O THR A 26 -6.236 -15.284 12.825 1.00 13.01 O ATOM 395 CB THR A 26 -7.132 -18.414 13.782 1.00 12.10 C ATOM 396 OG1 THR A 26 -6.768 -17.923 15.078 1.00 60.50 O ATOM 397 CG2 THR A 26 -6.868 -19.907 13.699 1.00 34.14 C ATOM 0 H THR A 26 -4.717 -17.172 13.881 1.00 53.12 H new ATOM 0 HA THR A 26 -6.480 -18.234 11.761 1.00 52.05 H new ATOM 0 HB THR A 26 -8.196 -18.237 13.627 1.00 12.10 H new ATOM 0 HG1 THR A 26 -6.151 -17.168 14.980 1.00 60.50 H new ATOM 0 HG21 THR A 26 -7.424 -20.419 14.484 1.00 34.14 H new ATOM 0 HG22 THR A 26 -7.187 -20.279 12.726 1.00 34.14 H new ATOM 0 HG23 THR A 26 -5.802 -20.096 13.828 1.00 34.14 H new ATOM 405 N ASP A 27 -8.139 -16.144 12.011 1.00 10.51 N ATOM 406 CA ASP A 27 -8.707 -14.832 11.730 1.00 30.14 C ATOM 407 C ASP A 27 -9.095 -14.122 13.018 1.00 13.43 C ATOM 408 O ASP A 27 -9.115 -12.897 13.068 1.00 22.11 O ATOM 409 CB ASP A 27 -9.912 -14.935 10.785 1.00 42.03 C ATOM 410 CG ASP A 27 -11.088 -15.689 11.374 1.00 2.05 C ATOM 411 OD1 ASP A 27 -11.903 -15.073 12.086 1.00 61.05 O ATOM 412 OD2 ASP A 27 -11.223 -16.895 11.095 1.00 1.44 O ATOM 0 H ASP A 27 -8.751 -16.931 11.794 1.00 10.51 H new ATOM 0 HA ASP A 27 -7.940 -14.241 11.230 1.00 30.14 H new ATOM 0 HB2 ASP A 27 -10.236 -13.930 10.513 1.00 42.03 H new ATOM 0 HB3 ASP A 27 -9.599 -15.429 9.865 1.00 42.03 H new ATOM 417 N GLU A 28 -9.379 -14.889 14.063 1.00 70.11 N ATOM 418 CA GLU A 28 -9.730 -14.317 15.355 1.00 61.43 C ATOM 419 C GLU A 28 -8.482 -13.872 16.114 1.00 41.05 C ATOM 420 O GLU A 28 -8.521 -12.883 16.843 1.00 12.24 O ATOM 421 CB GLU A 28 -10.555 -15.293 16.210 1.00 35.13 C ATOM 422 CG GLU A 28 -10.091 -16.739 16.157 1.00 51.24 C ATOM 423 CD GLU A 28 -10.684 -17.493 14.988 1.00 0.11 C ATOM 424 OE1 GLU A 28 -11.841 -17.943 15.091 1.00 35.11 O ATOM 425 OE2 GLU A 28 -10.002 -17.627 13.956 1.00 30.41 O ATOM 0 H GLU A 28 -9.373 -15.909 14.040 1.00 70.11 H new ATOM 0 HA GLU A 28 -10.350 -13.442 15.158 1.00 61.43 H new ATOM 0 HB2 GLU A 28 -10.530 -14.956 17.246 1.00 35.13 H new ATOM 0 HB3 GLU A 28 -11.595 -15.248 15.886 1.00 35.13 H new ATOM 0 HG2 GLU A 28 -9.003 -16.766 16.089 1.00 51.24 H new ATOM 0 HG3 GLU A 28 -10.365 -17.240 17.085 1.00 51.24 H new ATOM 432 N SER A 29 -7.370 -14.581 15.923 1.00 51.14 N ATOM 433 CA SER A 29 -6.121 -14.196 16.568 1.00 74.14 C ATOM 434 C SER A 29 -5.518 -12.990 15.851 1.00 34.31 C ATOM 435 O SER A 29 -4.930 -12.107 16.475 1.00 14.15 O ATOM 436 CB SER A 29 -5.127 -15.365 16.599 1.00 52.23 C ATOM 437 OG SER A 29 -4.691 -15.724 15.298 1.00 1.42 O ATOM 0 H SER A 29 -7.310 -15.413 15.335 1.00 51.14 H new ATOM 0 HA SER A 29 -6.336 -13.923 17.601 1.00 74.14 H new ATOM 0 HB2 SER A 29 -4.265 -15.092 17.208 1.00 52.23 H new ATOM 0 HB3 SER A 29 -5.595 -16.227 17.076 1.00 52.23 H new ATOM 0 HG SER A 29 -5.363 -15.449 14.640 1.00 1.42 H new ATOM 443 N LEU A 30 -5.697 -12.958 14.531 1.00 41.32 N ATOM 444 CA LEU A 30 -5.272 -11.829 13.718 1.00 73.31 C ATOM 445 C LEU A 30 -6.098 -10.595 14.065 1.00 4.03 C ATOM 446 O LEU A 30 -5.546 -9.512 14.270 1.00 42.23 O ATOM 447 CB LEU A 30 -5.414 -12.164 12.227 1.00 15.44 C ATOM 448 CG LEU A 30 -4.904 -11.096 11.257 1.00 73.31 C ATOM 449 CD1 LEU A 30 -3.428 -10.820 11.490 1.00 25.11 C ATOM 450 CD2 LEU A 30 -5.143 -11.529 9.818 1.00 61.13 C ATOM 0 H LEU A 30 -6.138 -13.710 14.002 1.00 41.32 H new ATOM 0 HA LEU A 30 -4.223 -11.619 13.928 1.00 73.31 H new ATOM 0 HB2 LEU A 30 -4.880 -13.093 12.029 1.00 15.44 H new ATOM 0 HB3 LEU A 30 -6.467 -12.350 12.014 1.00 15.44 H new ATOM 0 HG LEU A 30 -5.457 -10.175 11.439 1.00 73.31 H new ATOM 0 HD11 LEU A 30 -3.085 -10.058 10.790 1.00 25.11 H new ATOM 0 HD12 LEU A 30 -3.280 -10.468 12.511 1.00 25.11 H new ATOM 0 HD13 LEU A 30 -2.858 -11.736 11.336 1.00 25.11 H new ATOM 0 HD21 LEU A 30 -4.775 -10.759 9.140 1.00 61.13 H new ATOM 0 HD22 LEU A 30 -4.615 -12.463 9.627 1.00 61.13 H new ATOM 0 HD23 LEU A 30 -6.211 -11.676 9.655 1.00 61.13 H new ATOM 462 N ARG A 31 -7.422 -10.770 14.117 1.00 72.15 N ATOM 463 CA ARG A 31 -8.328 -9.716 14.558 1.00 63.32 C ATOM 464 C ARG A 31 -7.933 -9.178 15.924 1.00 44.43 C ATOM 465 O ARG A 31 -7.651 -7.999 16.054 1.00 72.23 O ATOM 466 CB ARG A 31 -9.773 -10.227 14.613 1.00 24.43 C ATOM 467 CG ARG A 31 -10.760 -9.207 15.160 1.00 70.54 C ATOM 468 CD ARG A 31 -12.157 -9.790 15.292 1.00 13.43 C ATOM 469 NE ARG A 31 -12.710 -10.173 13.994 1.00 64.03 N ATOM 470 CZ ARG A 31 -13.728 -9.553 13.400 1.00 54.41 C ATOM 471 NH1 ARG A 31 -14.315 -8.510 13.978 1.00 50.14 N ATOM 472 NH2 ARG A 31 -14.158 -9.982 12.222 1.00 1.10 N ATOM 0 H ARG A 31 -7.888 -11.639 13.856 1.00 72.15 H new ATOM 0 HA ARG A 31 -8.258 -8.907 13.830 1.00 63.32 H new ATOM 0 HB2 ARG A 31 -10.084 -10.520 13.610 1.00 24.43 H new ATOM 0 HB3 ARG A 31 -9.809 -11.123 15.232 1.00 24.43 H new ATOM 0 HG2 ARG A 31 -10.419 -8.857 16.134 1.00 70.54 H new ATOM 0 HG3 ARG A 31 -10.789 -8.339 14.501 1.00 70.54 H new ATOM 0 HD2 ARG A 31 -12.127 -10.662 15.946 1.00 13.43 H new ATOM 0 HD3 ARG A 31 -12.813 -9.059 15.765 1.00 13.43 H new ATOM 0 HE ARG A 31 -12.289 -10.967 13.512 1.00 64.03 H new ATOM 0 HH11 ARG A 31 -13.986 -8.178 14.885 1.00 50.14 H new ATOM 0 HH12 ARG A 31 -15.094 -8.042 13.515 1.00 50.14 H new ATOM 0 HH21 ARG A 31 -13.710 -10.782 11.776 1.00 1.10 H new ATOM 0 HH22 ARG A 31 -14.937 -9.512 11.761 1.00 1.10 H new ATOM 486 N SER A 32 -7.897 -10.060 16.920 1.00 65.24 N ATOM 487 CA SER A 32 -7.590 -9.685 18.302 1.00 1.41 C ATOM 488 C SER A 32 -6.298 -8.865 18.407 1.00 20.44 C ATOM 489 O SER A 32 -6.171 -8.008 19.283 1.00 70.42 O ATOM 490 CB SER A 32 -7.482 -10.946 19.163 1.00 32.43 C ATOM 491 OG SER A 32 -7.496 -10.637 20.547 1.00 62.24 O ATOM 0 H SER A 32 -8.080 -11.056 16.794 1.00 65.24 H new ATOM 0 HA SER A 32 -8.403 -9.055 18.663 1.00 1.41 H new ATOM 0 HB2 SER A 32 -8.309 -11.617 18.931 1.00 32.43 H new ATOM 0 HB3 SER A 32 -6.562 -11.477 18.918 1.00 32.43 H new ATOM 0 HG SER A 32 -7.427 -11.464 21.068 1.00 62.24 H new ATOM 497 N HIS A 33 -5.355 -9.118 17.507 1.00 51.21 N ATOM 498 CA HIS A 33 -4.105 -8.372 17.476 1.00 31.43 C ATOM 499 C HIS A 33 -4.331 -6.950 16.956 1.00 30.21 C ATOM 500 O HIS A 33 -4.106 -5.986 17.670 1.00 20.31 O ATOM 501 CB HIS A 33 -3.072 -9.093 16.606 1.00 31.12 C ATOM 502 CG HIS A 33 -1.734 -8.416 16.571 1.00 3.45 C ATOM 503 ND1 HIS A 33 -0.772 -8.690 17.505 1.00 53.34 N ATOM 504 CD2 HIS A 33 -1.257 -7.494 15.700 1.00 15.33 C ATOM 505 CE1 HIS A 33 0.264 -7.936 17.186 1.00 52.20 C ATOM 506 NE2 HIS A 33 0.018 -7.195 16.099 1.00 42.23 N ATOM 0 H HIS A 33 -5.434 -9.837 16.787 1.00 51.21 H new ATOM 0 HA HIS A 33 -3.724 -8.309 18.495 1.00 31.43 H new ATOM 0 HB2 HIS A 33 -2.945 -10.110 16.976 1.00 31.12 H new ATOM 0 HB3 HIS A 33 -3.457 -9.170 15.589 1.00 31.12 H new ATOM 0 HD1 HIS A 33 -0.841 -9.342 18.286 1.00 53.34 H new ATOM 0 HD2 HIS A 33 -1.782 -7.076 14.854 1.00 15.33 H new ATOM 0 HE1 HIS A 33 1.194 -7.919 17.734 1.00 52.20 H new ATOM 514 N PHE A 34 -4.795 -6.825 15.722 1.00 15.44 N ATOM 515 CA PHE A 34 -4.936 -5.513 15.090 1.00 13.43 C ATOM 516 C PHE A 34 -6.079 -4.700 15.701 1.00 5.31 C ATOM 517 O PHE A 34 -6.080 -3.472 15.636 1.00 74.25 O ATOM 518 CB PHE A 34 -5.114 -5.667 13.578 1.00 40.41 C ATOM 519 CG PHE A 34 -3.814 -5.908 12.853 1.00 22.02 C ATOM 520 CD1 PHE A 34 -3.287 -7.186 12.748 1.00 12.32 C ATOM 521 CD2 PHE A 34 -3.118 -4.852 12.283 1.00 43.04 C ATOM 522 CE1 PHE A 34 -2.092 -7.407 12.089 1.00 64.33 C ATOM 523 CE2 PHE A 34 -1.922 -5.067 11.622 1.00 2.54 C ATOM 524 CZ PHE A 34 -1.407 -6.348 11.525 1.00 35.13 C ATOM 0 H PHE A 34 -5.081 -7.610 15.137 1.00 15.44 H new ATOM 0 HA PHE A 34 -4.018 -4.956 15.278 1.00 13.43 H new ATOM 0 HB2 PHE A 34 -5.793 -6.496 13.380 1.00 40.41 H new ATOM 0 HB3 PHE A 34 -5.584 -4.768 13.180 1.00 40.41 H new ATOM 0 HD1 PHE A 34 -3.816 -8.019 13.186 1.00 12.32 H new ATOM 0 HD2 PHE A 34 -3.515 -3.850 12.356 1.00 43.04 H new ATOM 0 HE1 PHE A 34 -1.694 -8.408 12.015 1.00 64.33 H new ATOM 0 HE2 PHE A 34 -1.391 -4.236 11.182 1.00 2.54 H new ATOM 0 HZ PHE A 34 -0.473 -6.519 11.010 1.00 35.13 H new ATOM 534 N GLU A 35 -7.032 -5.389 16.319 1.00 4.11 N ATOM 535 CA GLU A 35 -8.152 -4.742 16.994 1.00 70.04 C ATOM 536 C GLU A 35 -7.672 -3.960 18.220 1.00 34.14 C ATOM 537 O GLU A 35 -8.369 -3.084 18.732 1.00 23.24 O ATOM 538 CB GLU A 35 -9.185 -5.797 17.402 1.00 11.01 C ATOM 539 CG GLU A 35 -10.530 -5.226 17.795 1.00 70.31 C ATOM 540 CD GLU A 35 -11.571 -6.301 18.012 1.00 71.05 C ATOM 541 OE1 GLU A 35 -12.178 -6.756 17.021 1.00 2.21 O ATOM 542 OE2 GLU A 35 -11.793 -6.694 19.174 1.00 4.02 O ATOM 0 H GLU A 35 -7.051 -6.408 16.366 1.00 4.11 H new ATOM 0 HA GLU A 35 -8.615 -4.035 16.306 1.00 70.04 H new ATOM 0 HB2 GLU A 35 -9.325 -6.492 16.574 1.00 11.01 H new ATOM 0 HB3 GLU A 35 -8.789 -6.373 18.238 1.00 11.01 H new ATOM 0 HG2 GLU A 35 -10.420 -4.640 18.708 1.00 70.31 H new ATOM 0 HG3 GLU A 35 -10.873 -4.543 17.018 1.00 70.31 H new ATOM 549 N GLN A 36 -6.468 -4.283 18.676 1.00 30.11 N ATOM 550 CA GLN A 36 -5.834 -3.573 19.781 1.00 43.52 C ATOM 551 C GLN A 36 -5.548 -2.116 19.420 1.00 10.20 C ATOM 552 O GLN A 36 -5.448 -1.260 20.298 1.00 62.30 O ATOM 553 CB GLN A 36 -4.533 -4.267 20.172 1.00 33.02 C ATOM 554 CG GLN A 36 -4.738 -5.630 20.813 1.00 64.02 C ATOM 555 CD GLN A 36 -3.442 -6.402 20.999 1.00 45.30 C ATOM 556 OE1 GLN A 36 -2.548 -6.317 20.025 1.00 24.31 O flip ATOM 557 NE2 GLN A 36 -3.267 -7.111 21.989 1.00 32.20 N flip ATOM 0 H GLN A 36 -5.905 -5.042 18.292 1.00 30.11 H new ATOM 0 HA GLN A 36 -6.525 -3.586 20.624 1.00 43.52 H new ATOM 0 HB2 GLN A 36 -3.912 -4.382 19.284 1.00 33.02 H new ATOM 0 HB3 GLN A 36 -3.984 -3.628 20.864 1.00 33.02 H new ATOM 0 HG2 GLN A 36 -5.219 -5.500 21.782 1.00 64.02 H new ATOM 0 HG3 GLN A 36 -5.418 -6.217 20.196 1.00 64.02 H new ATOM 0 HE21 GLN A 36 -3.978 -7.151 22.719 1.00 32.20 H new ATOM 0 HE22 GLN A 36 -2.411 -7.658 22.079 1.00 32.20 H new ATOM 566 N TRP A 37 -5.427 -1.842 18.128 1.00 54.21 N ATOM 567 CA TRP A 37 -5.143 -0.492 17.658 1.00 31.43 C ATOM 568 C TRP A 37 -6.393 0.188 17.115 1.00 30.23 C ATOM 569 O TRP A 37 -6.426 1.408 16.969 1.00 71.44 O ATOM 570 CB TRP A 37 -4.039 -0.518 16.601 1.00 31.14 C ATOM 571 CG TRP A 37 -2.685 -0.752 17.192 1.00 73.10 C ATOM 572 CD1 TRP A 37 -1.833 0.196 17.673 1.00 40.23 C ATOM 573 CD2 TRP A 37 -2.027 -2.012 17.375 1.00 20.21 C ATOM 574 NE1 TRP A 37 -0.689 -0.395 18.148 1.00 73.22 N ATOM 575 CE2 TRP A 37 -0.781 -1.749 17.974 1.00 35.50 C ATOM 576 CE3 TRP A 37 -2.370 -3.334 17.095 1.00 32.43 C ATOM 577 CZ2 TRP A 37 0.120 -2.758 18.295 1.00 44.02 C ATOM 578 CZ3 TRP A 37 -1.474 -4.336 17.412 1.00 2.50 C ATOM 579 CH2 TRP A 37 -0.243 -4.043 18.007 1.00 23.31 C ATOM 0 H TRP A 37 -5.521 -2.536 17.387 1.00 54.21 H new ATOM 0 HA TRP A 37 -4.798 0.092 18.511 1.00 31.43 H new ATOM 0 HB2 TRP A 37 -4.255 -1.301 15.874 1.00 31.14 H new ATOM 0 HB3 TRP A 37 -4.037 0.428 16.059 1.00 31.14 H new ATOM 0 HD1 TRP A 37 -2.029 1.258 17.680 1.00 40.23 H new ATOM 0 HE1 TRP A 37 0.102 0.096 18.564 1.00 73.22 H new ATOM 0 HE3 TRP A 37 -3.320 -3.570 16.638 1.00 32.43 H new ATOM 0 HZ2 TRP A 37 1.071 -2.534 18.755 1.00 44.02 H new ATOM 0 HZ3 TRP A 37 -1.728 -5.363 17.197 1.00 2.50 H new ATOM 0 HH2 TRP A 37 0.435 -4.850 18.244 1.00 23.31 H new ATOM 590 N GLY A 38 -7.417 -0.594 16.805 1.00 52.01 N ATOM 591 CA GLY A 38 -8.670 -0.018 16.373 1.00 24.53 C ATOM 592 C GLY A 38 -9.730 -1.062 16.116 1.00 73.23 C ATOM 593 O GLY A 38 -9.421 -2.241 15.968 1.00 73.32 O ATOM 0 H GLY A 38 -7.401 -1.613 16.845 1.00 52.01 H new ATOM 0 HA2 GLY A 38 -9.027 0.678 17.132 1.00 24.53 H new ATOM 0 HA3 GLY A 38 -8.506 0.560 15.463 1.00 24.53 H new ATOM 597 N THR A 39 -10.978 -0.623 16.049 1.00 43.42 N ATOM 598 CA THR A 39 -12.102 -1.520 15.862 1.00 24.35 C ATOM 599 C THR A 39 -12.091 -2.151 14.474 1.00 11.24 C ATOM 600 O THR A 39 -12.149 -1.457 13.461 1.00 42.02 O ATOM 601 CB THR A 39 -13.437 -0.790 16.075 1.00 50.42 C ATOM 602 OG1 THR A 39 -13.511 -0.286 17.417 1.00 13.00 O ATOM 603 CG2 THR A 39 -14.601 -1.727 15.813 1.00 31.45 C ATOM 0 H THR A 39 -11.236 0.361 16.123 1.00 43.42 H new ATOM 0 HA THR A 39 -12.002 -2.309 16.608 1.00 24.35 H new ATOM 0 HB THR A 39 -13.493 0.043 15.374 1.00 50.42 H new ATOM 0 HG1 THR A 39 -14.364 0.180 17.545 1.00 13.00 H new ATOM 0 HG21 THR A 39 -15.539 -1.194 15.968 1.00 31.45 H new ATOM 0 HG22 THR A 39 -14.554 -2.087 14.785 1.00 31.45 H new ATOM 0 HG23 THR A 39 -14.547 -2.574 16.497 1.00 31.45 H new ATOM 611 N LEU A 40 -11.980 -3.466 14.445 1.00 23.14 N ATOM 612 CA LEU A 40 -12.057 -4.207 13.201 1.00 62.45 C ATOM 613 C LEU A 40 -13.494 -4.572 12.858 1.00 32.25 C ATOM 614 O LEU A 40 -14.231 -5.124 13.671 1.00 13.35 O ATOM 615 CB LEU A 40 -11.187 -5.463 13.267 1.00 60.34 C ATOM 616 CG LEU A 40 -9.682 -5.205 13.381 1.00 60.11 C ATOM 617 CD1 LEU A 40 -8.921 -6.512 13.365 1.00 31.55 C ATOM 618 CD2 LEU A 40 -9.194 -4.308 12.257 1.00 25.14 C ATOM 0 H LEU A 40 -11.836 -4.044 15.273 1.00 23.14 H new ATOM 0 HA LEU A 40 -11.679 -3.562 12.408 1.00 62.45 H new ATOM 0 HB2 LEU A 40 -11.503 -6.061 14.122 1.00 60.34 H new ATOM 0 HB3 LEU A 40 -11.371 -6.061 12.374 1.00 60.34 H new ATOM 0 HG LEU A 40 -9.500 -4.698 14.328 1.00 60.11 H new ATOM 0 HD11 LEU A 40 -7.853 -6.312 13.447 1.00 31.55 H new ATOM 0 HD12 LEU A 40 -9.240 -7.129 14.205 1.00 31.55 H new ATOM 0 HD13 LEU A 40 -9.121 -7.038 12.432 1.00 31.55 H new ATOM 0 HD21 LEU A 40 -8.122 -4.142 12.363 1.00 25.14 H new ATOM 0 HD22 LEU A 40 -9.394 -4.785 11.298 1.00 25.14 H new ATOM 0 HD23 LEU A 40 -9.716 -3.352 12.302 1.00 25.14 H new ATOM 630 N THR A 41 -13.871 -4.251 11.638 1.00 64.54 N ATOM 631 CA THR A 41 -15.197 -4.554 11.136 1.00 71.11 C ATOM 632 C THR A 41 -15.181 -5.893 10.408 1.00 12.34 C ATOM 633 O THR A 41 -16.198 -6.579 10.308 1.00 54.10 O ATOM 634 CB THR A 41 -15.693 -3.444 10.191 1.00 13.12 C ATOM 635 OG1 THR A 41 -14.703 -3.178 9.190 1.00 22.34 O ATOM 636 CG2 THR A 41 -15.991 -2.164 10.959 1.00 14.21 C ATOM 0 H THR A 41 -13.269 -3.774 10.967 1.00 64.54 H new ATOM 0 HA THR A 41 -15.882 -4.612 11.982 1.00 71.11 H new ATOM 0 HB THR A 41 -16.613 -3.788 9.719 1.00 13.12 H new ATOM 0 HG1 THR A 41 -15.122 -3.192 8.304 1.00 22.34 H new ATOM 0 HG21 THR A 41 -16.339 -1.397 10.267 1.00 14.21 H new ATOM 0 HG22 THR A 41 -16.763 -2.358 11.704 1.00 14.21 H new ATOM 0 HG23 THR A 41 -15.085 -1.819 11.457 1.00 14.21 H new ATOM 644 N ASP A 42 -14.000 -6.256 9.924 1.00 43.52 N ATOM 645 CA ASP A 42 -13.800 -7.507 9.208 1.00 75.05 C ATOM 646 C ASP A 42 -12.371 -7.978 9.397 1.00 72.34 C ATOM 647 O ASP A 42 -11.475 -7.168 9.626 1.00 72.04 O ATOM 648 CB ASP A 42 -14.068 -7.315 7.716 1.00 65.23 C ATOM 649 CG ASP A 42 -14.097 -8.617 6.939 1.00 74.10 C ATOM 650 OD1 ASP A 42 -14.751 -9.575 7.394 1.00 34.43 O ATOM 651 OD2 ASP A 42 -13.463 -8.684 5.866 1.00 72.11 O ATOM 0 H ASP A 42 -13.156 -5.692 10.017 1.00 43.52 H new ATOM 0 HA ASP A 42 -14.493 -8.250 9.604 1.00 75.05 H new ATOM 0 HB2 ASP A 42 -15.021 -6.803 7.588 1.00 65.23 H new ATOM 0 HB3 ASP A 42 -13.299 -6.667 7.296 1.00 65.23 H new ATOM 656 N CYS A 43 -12.168 -9.276 9.325 1.00 11.24 N ATOM 657 CA CYS A 43 -10.840 -9.859 9.355 1.00 21.51 C ATOM 658 C CYS A 43 -10.911 -11.292 8.867 1.00 62.00 C ATOM 659 O CYS A 43 -11.697 -12.089 9.380 1.00 71.01 O ATOM 660 CB CYS A 43 -10.254 -9.819 10.771 1.00 74.35 C ATOM 661 SG CYS A 43 -8.721 -10.760 10.957 1.00 14.52 S ATOM 0 H CYS A 43 -12.920 -9.960 9.244 1.00 11.24 H new ATOM 0 HA CYS A 43 -10.189 -9.278 8.702 1.00 21.51 H new ATOM 0 HB2 CYS A 43 -10.067 -8.781 11.047 1.00 74.35 H new ATOM 0 HB3 CYS A 43 -10.994 -10.207 11.471 1.00 74.35 H new ATOM 0 HG CYS A 43 -8.876 -11.664 11.878 1.00 14.52 H new ATOM 667 N VAL A 44 -10.098 -11.628 7.884 1.00 10.12 N ATOM 668 CA VAL A 44 -10.090 -12.969 7.355 1.00 52.21 C ATOM 669 C VAL A 44 -8.680 -13.357 6.934 1.00 71.23 C ATOM 670 O VAL A 44 -8.081 -12.754 6.041 1.00 25.23 O ATOM 671 CB VAL A 44 -11.103 -13.143 6.185 1.00 21.32 C ATOM 672 CG1 VAL A 44 -10.876 -12.118 5.084 1.00 11.52 C ATOM 673 CG2 VAL A 44 -11.049 -14.559 5.624 1.00 43.01 C ATOM 0 H VAL A 44 -9.438 -10.990 7.440 1.00 10.12 H new ATOM 0 HA VAL A 44 -10.414 -13.644 8.147 1.00 52.21 H new ATOM 0 HB VAL A 44 -12.100 -12.972 6.591 1.00 21.32 H new ATOM 0 HG11 VAL A 44 -11.603 -12.273 4.287 1.00 11.52 H new ATOM 0 HG12 VAL A 44 -10.994 -11.114 5.492 1.00 11.52 H new ATOM 0 HG13 VAL A 44 -9.869 -12.231 4.684 1.00 11.52 H new ATOM 0 HG21 VAL A 44 -11.766 -14.655 4.808 1.00 43.01 H new ATOM 0 HG22 VAL A 44 -10.046 -14.765 5.251 1.00 43.01 H new ATOM 0 HG23 VAL A 44 -11.297 -15.272 6.411 1.00 43.01 H new ATOM 683 N VAL A 45 -8.128 -14.325 7.637 1.00 12.50 N ATOM 684 CA VAL A 45 -6.851 -14.884 7.262 1.00 70.34 C ATOM 685 C VAL A 45 -7.073 -15.891 6.142 1.00 71.40 C ATOM 686 O VAL A 45 -8.069 -16.619 6.136 1.00 12.13 O ATOM 687 CB VAL A 45 -6.133 -15.545 8.471 1.00 32.44 C ATOM 688 CG1 VAL A 45 -6.929 -16.720 9.005 1.00 62.34 C ATOM 689 CG2 VAL A 45 -4.720 -15.978 8.108 1.00 11.10 C ATOM 0 H VAL A 45 -8.546 -14.739 8.470 1.00 12.50 H new ATOM 0 HA VAL A 45 -6.199 -14.082 6.915 1.00 70.34 H new ATOM 0 HB VAL A 45 -6.064 -14.794 9.258 1.00 32.44 H new ATOM 0 HG11 VAL A 45 -6.402 -17.162 9.850 1.00 62.34 H new ATOM 0 HG12 VAL A 45 -7.911 -16.377 9.329 1.00 62.34 H new ATOM 0 HG13 VAL A 45 -7.047 -17.467 8.220 1.00 62.34 H new ATOM 0 HG21 VAL A 45 -4.246 -16.436 8.976 1.00 11.10 H new ATOM 0 HG22 VAL A 45 -4.759 -16.700 7.292 1.00 11.10 H new ATOM 0 HG23 VAL A 45 -4.142 -15.108 7.796 1.00 11.10 H new ATOM 699 N MET A 46 -6.189 -15.893 5.168 1.00 31.11 N ATOM 700 CA MET A 46 -6.289 -16.841 4.084 1.00 72.23 C ATOM 701 C MET A 46 -5.793 -18.190 4.562 1.00 62.34 C ATOM 702 O MET A 46 -4.801 -18.275 5.285 1.00 54.22 O ATOM 703 CB MET A 46 -5.498 -16.362 2.868 1.00 14.52 C ATOM 704 CG MET A 46 -5.960 -15.015 2.330 1.00 41.33 C ATOM 705 SD MET A 46 -7.264 -15.149 1.086 1.00 1.02 S ATOM 706 CE MET A 46 -8.728 -15.334 2.103 1.00 2.22 C ATOM 0 H MET A 46 -5.398 -15.252 5.106 1.00 31.11 H new ATOM 0 HA MET A 46 -7.331 -16.932 3.776 1.00 72.23 H new ATOM 0 HB2 MET A 46 -4.443 -16.294 3.135 1.00 14.52 H new ATOM 0 HB3 MET A 46 -5.579 -17.107 2.076 1.00 14.52 H new ATOM 0 HG2 MET A 46 -6.320 -14.405 3.159 1.00 41.33 H new ATOM 0 HG3 MET A 46 -5.107 -14.493 1.897 1.00 41.33 H new ATOM 0 HE1 MET A 46 -9.565 -14.817 1.634 1.00 2.22 H new ATOM 0 HE2 MET A 46 -8.968 -16.392 2.207 1.00 2.22 H new ATOM 0 HE3 MET A 46 -8.543 -14.906 3.088 1.00 2.22 H new ATOM 716 N ARG A 47 -6.489 -19.235 4.156 1.00 22.35 N ATOM 717 CA ARG A 47 -6.219 -20.573 4.640 1.00 71.11 C ATOM 718 C ARG A 47 -6.320 -21.602 3.532 1.00 41.33 C ATOM 719 O ARG A 47 -6.974 -21.383 2.511 1.00 40.41 O ATOM 720 CB ARG A 47 -7.180 -20.939 5.758 1.00 2.11 C ATOM 721 CG ARG A 47 -7.051 -20.035 6.954 1.00 41.11 C ATOM 722 CD ARG A 47 -8.318 -19.999 7.762 1.00 63.40 C ATOM 723 NE ARG A 47 -9.380 -19.210 7.138 1.00 11.32 N ATOM 724 CZ ARG A 47 -10.294 -18.532 7.834 1.00 42.25 C ATOM 725 NH1 ARG A 47 -10.266 -18.554 9.162 1.00 70.45 N ATOM 726 NH2 ARG A 47 -11.236 -17.842 7.206 1.00 42.45 N ATOM 0 H ARG A 47 -7.254 -19.180 3.484 1.00 22.35 H new ATOM 0 HA ARG A 47 -5.197 -20.578 5.020 1.00 71.11 H new ATOM 0 HB2 ARG A 47 -8.202 -20.894 5.382 1.00 2.11 H new ATOM 0 HB3 ARG A 47 -6.998 -21.969 6.065 1.00 2.11 H new ATOM 0 HG2 ARG A 47 -6.228 -20.377 7.582 1.00 41.11 H new ATOM 0 HG3 ARG A 47 -6.801 -19.027 6.623 1.00 41.11 H new ATOM 0 HD2 ARG A 47 -8.673 -21.018 7.913 1.00 63.40 H new ATOM 0 HD3 ARG A 47 -8.101 -19.588 8.748 1.00 63.40 H new ATOM 0 HE ARG A 47 -9.424 -19.177 6.119 1.00 11.32 H new ATOM 0 HH11 ARG A 47 -9.546 -19.089 9.648 1.00 70.45 H new ATOM 0 HH12 ARG A 47 -10.964 -18.036 9.695 1.00 70.45 H new ATOM 0 HH21 ARG A 47 -11.264 -17.828 6.186 1.00 42.45 H new ATOM 0 HH22 ARG A 47 -11.933 -17.325 7.742 1.00 42.45 H new ATOM 740 N ASP A 48 -5.655 -22.715 3.754 1.00 24.13 N ATOM 741 CA ASP A 48 -5.659 -23.837 2.842 1.00 35.54 C ATOM 742 C ASP A 48 -7.024 -24.518 2.861 1.00 33.53 C ATOM 743 O ASP A 48 -7.585 -24.741 3.927 1.00 21.32 O ATOM 744 CB ASP A 48 -4.578 -24.827 3.273 1.00 35.03 C ATOM 745 CG ASP A 48 -4.566 -26.080 2.434 1.00 24.23 C ATOM 746 OD1 ASP A 48 -4.261 -25.997 1.234 1.00 45.24 O ATOM 747 OD2 ASP A 48 -4.857 -27.157 2.981 1.00 4.43 O ATOM 0 H ASP A 48 -5.087 -22.868 4.587 1.00 24.13 H new ATOM 0 HA ASP A 48 -5.457 -23.489 1.829 1.00 35.54 H new ATOM 0 HB2 ASP A 48 -3.603 -24.344 3.210 1.00 35.03 H new ATOM 0 HB3 ASP A 48 -4.734 -25.096 4.318 1.00 35.03 H new ATOM 752 N PRO A 49 -7.590 -24.850 1.697 1.00 11.25 N ATOM 753 CA PRO A 49 -8.905 -25.492 1.624 1.00 55.21 C ATOM 754 C PRO A 49 -8.878 -26.977 2.012 1.00 13.24 C ATOM 755 O PRO A 49 -9.917 -27.567 2.289 1.00 30.32 O ATOM 756 CB PRO A 49 -9.294 -25.324 0.154 1.00 43.44 C ATOM 757 CG PRO A 49 -8.004 -25.221 -0.585 1.00 10.11 C ATOM 758 CD PRO A 49 -7.012 -24.599 0.363 1.00 71.53 C ATOM 0 HA PRO A 49 -9.609 -25.045 2.326 1.00 55.21 H new ATOM 0 HB2 PRO A 49 -9.882 -26.172 -0.197 1.00 43.44 H new ATOM 0 HB3 PRO A 49 -9.903 -24.432 0.008 1.00 43.44 H new ATOM 0 HG2 PRO A 49 -7.665 -26.204 -0.910 1.00 10.11 H new ATOM 0 HG3 PRO A 49 -8.119 -24.611 -1.481 1.00 10.11 H new ATOM 0 HD2 PRO A 49 -6.026 -25.052 0.263 1.00 71.53 H new ATOM 0 HD3 PRO A 49 -6.893 -23.532 0.173 1.00 71.53 H new ATOM 766 N ASN A 50 -7.692 -27.579 2.014 1.00 51.45 N ATOM 767 CA ASN A 50 -7.564 -29.011 2.299 1.00 14.12 C ATOM 768 C ASN A 50 -7.474 -29.290 3.797 1.00 42.22 C ATOM 769 O ASN A 50 -8.276 -30.041 4.345 1.00 54.05 O ATOM 770 CB ASN A 50 -6.342 -29.609 1.590 1.00 44.31 C ATOM 771 CG ASN A 50 -6.551 -29.823 0.098 1.00 25.43 C ATOM 772 OD1 ASN A 50 -7.341 -28.965 -0.530 1.00 11.14 O flip ATOM 773 ND2 ASN A 50 -6.005 -30.756 -0.489 1.00 14.43 N flip ATOM 0 H ASN A 50 -6.810 -27.104 1.823 1.00 51.45 H new ATOM 0 HA ASN A 50 -8.467 -29.487 1.917 1.00 14.12 H new ATOM 0 HB2 ASN A 50 -5.487 -28.949 1.738 1.00 44.31 H new ATOM 0 HB3 ASN A 50 -6.093 -30.563 2.055 1.00 44.31 H new ATOM 0 HD21 ASN A 50 -5.402 -31.399 0.025 1.00 14.43 H new ATOM 0 HD22 ASN A 50 -6.155 -30.887 -1.489 1.00 14.43 H new ATOM 780 N THR A 51 -6.502 -28.669 4.454 1.00 32.44 N ATOM 781 CA THR A 51 -6.238 -28.923 5.869 1.00 23.32 C ATOM 782 C THR A 51 -6.720 -27.760 6.740 1.00 52.11 C ATOM 783 O THR A 51 -6.743 -27.857 7.970 1.00 44.30 O ATOM 784 CB THR A 51 -4.730 -29.165 6.099 1.00 23.53 C ATOM 785 OG1 THR A 51 -4.203 -29.983 5.041 1.00 2.21 O ATOM 786 CG2 THR A 51 -4.474 -29.852 7.435 1.00 24.23 C ATOM 0 H THR A 51 -5.879 -27.982 4.029 1.00 32.44 H new ATOM 0 HA THR A 51 -6.791 -29.817 6.157 1.00 23.32 H new ATOM 0 HB THR A 51 -4.233 -28.195 6.108 1.00 23.53 H new ATOM 0 HG1 THR A 51 -3.246 -30.133 5.189 1.00 2.21 H new ATOM 0 HG21 THR A 51 -3.403 -30.007 7.565 1.00 24.23 H new ATOM 0 HG22 THR A 51 -4.851 -29.226 8.244 1.00 24.23 H new ATOM 0 HG23 THR A 51 -4.985 -30.815 7.453 1.00 24.23 H new ATOM 794 N LYS A 52 -7.106 -26.666 6.081 1.00 53.00 N ATOM 795 CA LYS A 52 -7.668 -25.479 6.742 1.00 10.43 C ATOM 796 C LYS A 52 -6.622 -24.787 7.617 1.00 23.45 C ATOM 797 O LYS A 52 -6.927 -24.298 8.702 1.00 43.04 O ATOM 798 CB LYS A 52 -8.921 -25.824 7.575 1.00 24.30 C ATOM 799 CG LYS A 52 -9.967 -26.666 6.841 1.00 32.51 C ATOM 800 CD LYS A 52 -10.310 -26.100 5.473 1.00 53.13 C ATOM 801 CE LYS A 52 -11.493 -26.824 4.845 1.00 35.10 C ATOM 802 NZ LYS A 52 -12.772 -26.541 5.552 1.00 51.35 N ATOM 0 H LYS A 52 -7.038 -26.575 5.067 1.00 53.00 H new ATOM 0 HA LYS A 52 -7.971 -24.790 5.953 1.00 10.43 H new ATOM 0 HB2 LYS A 52 -8.608 -26.359 8.472 1.00 24.30 H new ATOM 0 HB3 LYS A 52 -9.388 -24.896 7.904 1.00 24.30 H new ATOM 0 HG2 LYS A 52 -9.595 -27.684 6.727 1.00 32.51 H new ATOM 0 HG3 LYS A 52 -10.873 -26.723 7.445 1.00 32.51 H new ATOM 0 HD2 LYS A 52 -10.540 -25.039 5.566 1.00 53.13 H new ATOM 0 HD3 LYS A 52 -9.443 -26.182 4.817 1.00 53.13 H new ATOM 0 HE2 LYS A 52 -11.585 -26.526 3.800 1.00 35.10 H new ATOM 0 HE3 LYS A 52 -11.305 -27.898 4.855 1.00 35.10 H new ATOM 0 HZ1 LYS A 52 -13.569 -26.884 4.979 1.00 51.35 H new ATOM 0 HZ2 LYS A 52 -12.774 -27.025 6.473 1.00 51.35 H new ATOM 0 HZ3 LYS A 52 -12.868 -25.516 5.700 1.00 51.35 H new ATOM 816 N ARG A 53 -5.391 -24.722 7.123 1.00 54.03 N ATOM 817 CA ARG A 53 -4.309 -24.076 7.857 1.00 33.00 C ATOM 818 C ARG A 53 -3.995 -22.739 7.214 1.00 51.31 C ATOM 819 O ARG A 53 -4.321 -22.536 6.052 1.00 14.41 O ATOM 820 CB ARG A 53 -3.056 -24.959 7.873 1.00 72.53 C ATOM 821 CG ARG A 53 -3.263 -26.320 8.524 1.00 65.43 C ATOM 822 CD ARG A 53 -3.729 -26.193 9.968 1.00 23.42 C ATOM 823 NE ARG A 53 -2.772 -25.459 10.795 1.00 22.33 N ATOM 824 CZ ARG A 53 -3.066 -24.915 11.976 1.00 15.24 C ATOM 825 NH1 ARG A 53 -4.293 -25.016 12.483 1.00 45.11 N ATOM 826 NH2 ARG A 53 -2.127 -24.266 12.646 1.00 34.11 N ATOM 0 H ARG A 53 -5.117 -25.108 6.219 1.00 54.03 H new ATOM 0 HA ARG A 53 -4.627 -23.922 8.888 1.00 33.00 H new ATOM 0 HB2 ARG A 53 -2.715 -25.106 6.848 1.00 72.53 H new ATOM 0 HB3 ARG A 53 -2.261 -24.433 8.401 1.00 72.53 H new ATOM 0 HG2 ARG A 53 -3.998 -26.887 7.954 1.00 65.43 H new ATOM 0 HG3 ARG A 53 -2.331 -26.884 8.492 1.00 65.43 H new ATOM 0 HD2 ARG A 53 -4.693 -25.685 9.993 1.00 23.42 H new ATOM 0 HD3 ARG A 53 -3.881 -27.187 10.388 1.00 23.42 H new ATOM 0 HE ARG A 53 -1.819 -25.357 10.446 1.00 22.33 H new ATOM 0 HH11 ARG A 53 -5.019 -25.513 11.967 1.00 45.11 H new ATOM 0 HH12 ARG A 53 -4.507 -24.596 13.388 1.00 45.11 H new ATOM 0 HH21 ARG A 53 -1.187 -24.185 12.258 1.00 34.11 H new ATOM 0 HH22 ARG A 53 -2.343 -23.847 13.550 1.00 34.11 H new ATOM 840 N SER A 54 -3.352 -21.842 7.945 1.00 64.22 N ATOM 841 CA SER A 54 -3.108 -20.496 7.441 1.00 64.13 C ATOM 842 C SER A 54 -2.165 -20.527 6.243 1.00 75.51 C ATOM 843 O SER A 54 -1.207 -21.297 6.211 1.00 74.43 O ATOM 844 CB SER A 54 -2.531 -19.617 8.552 1.00 74.11 C ATOM 845 OG SER A 54 -2.133 -18.345 8.063 1.00 10.51 O ATOM 0 H SER A 54 -2.991 -22.018 8.883 1.00 64.22 H new ATOM 0 HA SER A 54 -4.057 -20.073 7.113 1.00 64.13 H new ATOM 0 HB2 SER A 54 -3.276 -19.488 9.337 1.00 74.11 H new ATOM 0 HB3 SER A 54 -1.674 -20.117 9.004 1.00 74.11 H new ATOM 0 HG SER A 54 -1.273 -18.096 8.461 1.00 10.51 H new ATOM 851 N ARG A 55 -2.456 -19.689 5.257 1.00 63.31 N ATOM 852 CA ARG A 55 -1.638 -19.581 4.059 1.00 22.45 C ATOM 853 C ARG A 55 -0.492 -18.606 4.281 1.00 42.23 C ATOM 854 O ARG A 55 0.355 -18.424 3.408 1.00 12.40 O ATOM 855 CB ARG A 55 -2.478 -19.109 2.874 1.00 34.30 C ATOM 856 CG ARG A 55 -3.370 -20.178 2.268 1.00 15.45 C ATOM 857 CD ARG A 55 -4.310 -19.566 1.243 1.00 12.34 C ATOM 858 NE ARG A 55 -5.101 -20.561 0.524 1.00 2.34 N ATOM 859 CZ ARG A 55 -4.982 -20.813 -0.780 1.00 14.24 C ATOM 860 NH1 ARG A 55 -4.099 -20.153 -1.521 1.00 64.03 N ATOM 861 NH2 ARG A 55 -5.781 -21.698 -1.353 1.00 13.23 N ATOM 0 H ARG A 55 -3.264 -19.067 5.266 1.00 63.31 H new ATOM 0 HA ARG A 55 -1.233 -20.569 3.841 1.00 22.45 H new ATOM 0 HB2 ARG A 55 -3.100 -18.274 3.196 1.00 34.30 H new ATOM 0 HB3 ARG A 55 -1.811 -18.729 2.100 1.00 34.30 H new ATOM 0 HG2 ARG A 55 -2.758 -20.947 1.796 1.00 15.45 H new ATOM 0 HG3 ARG A 55 -3.947 -20.667 3.053 1.00 15.45 H new ATOM 0 HD2 ARG A 55 -4.982 -18.870 1.745 1.00 12.34 H new ATOM 0 HD3 ARG A 55 -3.728 -18.986 0.526 1.00 12.34 H new ATOM 0 HE ARG A 55 -5.788 -21.098 1.053 1.00 2.34 H new ATOM 0 HH11 ARG A 55 -3.503 -19.445 -1.093 1.00 64.03 H new ATOM 0 HH12 ARG A 55 -4.017 -20.355 -2.518 1.00 64.03 H new ATOM 0 HH21 ARG A 55 -6.485 -22.185 -0.798 1.00 13.23 H new ATOM 0 HH22 ARG A 55 -5.693 -21.894 -2.350 1.00 13.23 H new ATOM 875 N GLY A 56 -0.468 -17.981 5.449 1.00 70.32 N ATOM 876 CA GLY A 56 0.593 -17.046 5.761 1.00 63.51 C ATOM 877 C GLY A 56 0.294 -15.620 5.340 1.00 5.21 C ATOM 878 O GLY A 56 1.202 -14.793 5.284 1.00 61.11 O ATOM 0 H GLY A 56 -1.163 -18.104 6.185 1.00 70.32 H new ATOM 0 HA2 GLY A 56 0.779 -17.067 6.835 1.00 63.51 H new ATOM 0 HA3 GLY A 56 1.510 -17.375 5.272 1.00 63.51 H new ATOM 882 N PHE A 57 -0.959 -15.322 5.024 1.00 24.45 N ATOM 883 CA PHE A 57 -1.367 -13.949 4.746 1.00 32.12 C ATOM 884 C PHE A 57 -2.874 -13.793 4.949 1.00 61.33 C ATOM 885 O PHE A 57 -3.616 -14.769 4.871 1.00 74.54 O ATOM 886 CB PHE A 57 -0.952 -13.516 3.325 1.00 33.10 C ATOM 887 CG PHE A 57 -1.563 -14.314 2.202 1.00 42.32 C ATOM 888 CD1 PHE A 57 -1.083 -15.576 1.882 1.00 51.23 C ATOM 889 CD2 PHE A 57 -2.603 -13.792 1.451 1.00 22.45 C ATOM 890 CE1 PHE A 57 -1.632 -16.298 0.843 1.00 3.11 C ATOM 891 CE2 PHE A 57 -3.153 -14.509 0.407 1.00 41.24 C ATOM 892 CZ PHE A 57 -2.667 -15.764 0.103 1.00 70.14 C ATOM 0 H PHE A 57 -1.709 -16.009 4.954 1.00 24.45 H new ATOM 0 HA PHE A 57 -0.853 -13.293 5.449 1.00 32.12 H new ATOM 0 HB2 PHE A 57 -1.219 -12.468 3.190 1.00 33.10 H new ATOM 0 HB3 PHE A 57 0.133 -13.581 3.246 1.00 33.10 H new ATOM 0 HD1 PHE A 57 -0.270 -15.998 2.454 1.00 51.23 H new ATOM 0 HD2 PHE A 57 -2.989 -12.811 1.685 1.00 22.45 H new ATOM 0 HE1 PHE A 57 -1.252 -17.281 0.609 1.00 3.11 H new ATOM 0 HE2 PHE A 57 -3.963 -14.088 -0.171 1.00 41.24 H new ATOM 0 HZ PHE A 57 -3.096 -16.327 -0.713 1.00 70.14 H new ATOM 902 N GLY A 58 -3.308 -12.571 5.237 1.00 2.24 N ATOM 903 CA GLY A 58 -4.715 -12.309 5.489 1.00 41.41 C ATOM 904 C GLY A 58 -5.055 -10.842 5.321 1.00 60.55 C ATOM 905 O GLY A 58 -4.259 -10.086 4.775 1.00 10.32 O ATOM 0 H GLY A 58 -2.706 -11.750 5.301 1.00 2.24 H new ATOM 0 HA2 GLY A 58 -5.323 -12.903 4.807 1.00 41.41 H new ATOM 0 HA3 GLY A 58 -4.968 -12.627 6.500 1.00 41.41 H new ATOM 909 N PHE A 59 -6.242 -10.437 5.773 1.00 33.10 N ATOM 910 CA PHE A 59 -6.674 -9.043 5.671 1.00 3.22 C ATOM 911 C PHE A 59 -7.455 -8.639 6.914 1.00 0.02 C ATOM 912 O PHE A 59 -8.144 -9.463 7.519 1.00 51.01 O ATOM 913 CB PHE A 59 -7.576 -8.807 4.444 1.00 10.11 C ATOM 914 CG PHE A 59 -7.239 -9.638 3.241 1.00 54.23 C ATOM 915 CD1 PHE A 59 -7.800 -10.891 3.087 1.00 53.55 C ATOM 916 CD2 PHE A 59 -6.363 -9.174 2.273 1.00 35.34 C ATOM 917 CE1 PHE A 59 -7.500 -11.671 1.997 1.00 31.21 C ATOM 918 CE2 PHE A 59 -6.056 -9.954 1.172 1.00 72.51 C ATOM 919 CZ PHE A 59 -6.624 -11.205 1.035 1.00 53.20 C ATOM 0 H PHE A 59 -6.922 -11.056 6.214 1.00 33.10 H new ATOM 0 HA PHE A 59 -5.770 -8.442 5.570 1.00 3.22 H new ATOM 0 HB2 PHE A 59 -8.609 -9.007 4.727 1.00 10.11 H new ATOM 0 HB3 PHE A 59 -7.520 -7.754 4.167 1.00 10.11 H new ATOM 0 HD1 PHE A 59 -8.485 -11.263 3.835 1.00 53.55 H new ATOM 0 HD2 PHE A 59 -5.916 -8.196 2.379 1.00 35.34 H new ATOM 0 HE1 PHE A 59 -7.948 -12.648 1.892 1.00 31.21 H new ATOM 0 HE2 PHE A 59 -5.373 -9.585 0.421 1.00 72.51 H new ATOM 0 HZ PHE A 59 -6.384 -11.818 0.178 1.00 53.20 H new ATOM 929 N VAL A 60 -7.350 -7.369 7.279 1.00 2.34 N ATOM 930 CA VAL A 60 -8.119 -6.810 8.385 1.00 2.35 C ATOM 931 C VAL A 60 -8.764 -5.493 7.959 1.00 33.52 C ATOM 932 O VAL A 60 -8.110 -4.637 7.377 1.00 43.22 O ATOM 933 CB VAL A 60 -7.248 -6.572 9.649 1.00 34.51 C ATOM 934 CG1 VAL A 60 -6.863 -7.887 10.302 1.00 73.11 C ATOM 935 CG2 VAL A 60 -5.999 -5.776 9.311 1.00 64.12 C ATOM 0 H VAL A 60 -6.733 -6.699 6.820 1.00 2.34 H new ATOM 0 HA VAL A 60 -8.887 -7.539 8.643 1.00 2.35 H new ATOM 0 HB VAL A 60 -7.847 -5.996 10.354 1.00 34.51 H new ATOM 0 HG11 VAL A 60 -6.254 -7.691 11.184 1.00 73.11 H new ATOM 0 HG12 VAL A 60 -7.764 -8.425 10.596 1.00 73.11 H new ATOM 0 HG13 VAL A 60 -6.294 -8.491 9.595 1.00 73.11 H new ATOM 0 HG21 VAL A 60 -5.409 -5.624 10.215 1.00 64.12 H new ATOM 0 HG22 VAL A 60 -5.406 -6.323 8.578 1.00 64.12 H new ATOM 0 HG23 VAL A 60 -6.285 -4.809 8.898 1.00 64.12 H new ATOM 945 N THR A 61 -10.050 -5.342 8.218 1.00 34.32 N ATOM 946 CA THR A 61 -10.754 -4.117 7.870 1.00 20.24 C ATOM 947 C THR A 61 -11.036 -3.299 9.120 1.00 43.22 C ATOM 948 O THR A 61 -11.697 -3.776 10.039 1.00 43.20 O ATOM 949 CB THR A 61 -12.083 -4.411 7.149 1.00 15.54 C ATOM 950 OG1 THR A 61 -11.890 -5.444 6.178 1.00 61.41 O ATOM 951 CG2 THR A 61 -12.614 -3.160 6.459 1.00 2.24 C ATOM 0 H THR A 61 -10.630 -6.051 8.668 1.00 34.32 H new ATOM 0 HA THR A 61 -10.111 -3.553 7.194 1.00 20.24 H new ATOM 0 HB THR A 61 -12.811 -4.736 7.893 1.00 15.54 H new ATOM 0 HG1 THR A 61 -12.615 -5.414 5.520 1.00 61.41 H new ATOM 0 HG21 THR A 61 -13.553 -3.392 5.957 1.00 2.24 H new ATOM 0 HG22 THR A 61 -12.783 -2.379 7.201 1.00 2.24 H new ATOM 0 HG23 THR A 61 -11.887 -2.813 5.725 1.00 2.24 H new ATOM 959 N TYR A 62 -10.516 -2.081 9.162 1.00 74.21 N ATOM 960 CA TYR A 62 -10.745 -1.195 10.291 1.00 53.13 C ATOM 961 C TYR A 62 -12.043 -0.429 10.115 1.00 13.02 C ATOM 962 O TYR A 62 -12.586 -0.360 9.016 1.00 41.20 O ATOM 963 CB TYR A 62 -9.589 -0.212 10.444 1.00 72.12 C ATOM 964 CG TYR A 62 -8.413 -0.767 11.210 1.00 54.24 C ATOM 965 CD1 TYR A 62 -8.392 -0.724 12.595 1.00 31.34 C ATOM 966 CD2 TYR A 62 -7.322 -1.322 10.553 1.00 11.23 C ATOM 967 CE1 TYR A 62 -7.317 -1.217 13.306 1.00 4.24 C ATOM 968 CE2 TYR A 62 -6.245 -1.820 11.258 1.00 24.20 C ATOM 969 CZ TYR A 62 -6.248 -1.763 12.634 1.00 5.02 C ATOM 970 OH TYR A 62 -5.180 -2.256 13.341 1.00 43.51 O ATOM 0 H TYR A 62 -9.932 -1.684 8.426 1.00 74.21 H new ATOM 0 HA TYR A 62 -10.813 -1.807 11.190 1.00 53.13 H new ATOM 0 HB2 TYR A 62 -9.253 0.096 9.454 1.00 72.12 H new ATOM 0 HB3 TYR A 62 -9.950 0.683 10.950 1.00 72.12 H new ATOM 0 HD1 TYR A 62 -9.230 -0.298 13.126 1.00 31.34 H new ATOM 0 HD2 TYR A 62 -7.317 -1.364 9.474 1.00 11.23 H new ATOM 0 HE1 TYR A 62 -7.315 -1.174 14.385 1.00 4.24 H new ATOM 0 HE2 TYR A 62 -5.405 -2.252 10.734 1.00 24.20 H new ATOM 0 HH TYR A 62 -5.505 -2.810 14.081 1.00 43.51 H new ATOM 980 N ALA A 63 -12.536 0.133 11.206 1.00 44.33 N ATOM 981 CA ALA A 63 -13.744 0.936 11.175 1.00 21.14 C ATOM 982 C ALA A 63 -13.464 2.305 10.568 1.00 34.15 C ATOM 983 O ALA A 63 -14.220 2.785 9.729 1.00 71.21 O ATOM 984 CB ALA A 63 -14.315 1.078 12.577 1.00 75.45 C ATOM 0 H ALA A 63 -12.113 0.046 12.130 1.00 44.33 H new ATOM 0 HA ALA A 63 -14.480 0.432 10.549 1.00 21.14 H new ATOM 0 HB1 ALA A 63 -15.221 1.683 12.541 1.00 75.45 H new ATOM 0 HB2 ALA A 63 -14.552 0.091 12.975 1.00 75.45 H new ATOM 0 HB3 ALA A 63 -13.581 1.562 13.221 1.00 75.45 H new ATOM 990 N THR A 64 -12.360 2.918 10.982 1.00 22.52 N ATOM 991 CA THR A 64 -12.000 4.251 10.513 1.00 64.40 C ATOM 992 C THR A 64 -10.598 4.257 9.894 1.00 63.34 C ATOM 993 O THR A 64 -9.755 3.422 10.236 1.00 21.12 O ATOM 994 CB THR A 64 -12.036 5.267 11.674 1.00 34.45 C ATOM 995 OG1 THR A 64 -13.057 4.902 12.614 1.00 45.31 O ATOM 996 CG2 THR A 64 -12.303 6.673 11.155 1.00 15.22 C ATOM 0 H THR A 64 -11.698 2.512 11.643 1.00 22.52 H new ATOM 0 HA THR A 64 -12.729 4.536 9.755 1.00 64.40 H new ATOM 0 HB THR A 64 -11.064 5.255 12.167 1.00 34.45 H new ATOM 0 HG1 THR A 64 -12.755 4.135 13.144 1.00 45.31 H new ATOM 0 HG21 THR A 64 -12.324 7.372 11.991 1.00 15.22 H new ATOM 0 HG22 THR A 64 -11.513 6.961 10.461 1.00 15.22 H new ATOM 0 HG23 THR A 64 -13.264 6.695 10.640 1.00 15.22 H new ATOM 1004 N VAL A 65 -10.355 5.204 8.985 1.00 10.12 N ATOM 1005 CA VAL A 65 -9.037 5.382 8.381 1.00 74.51 C ATOM 1006 C VAL A 65 -7.984 5.720 9.445 1.00 62.34 C ATOM 1007 O VAL A 65 -6.862 5.223 9.393 1.00 21.32 O ATOM 1008 CB VAL A 65 -9.068 6.475 7.277 1.00 15.34 C ATOM 1009 CG1 VAL A 65 -9.674 7.774 7.789 1.00 71.23 C ATOM 1010 CG2 VAL A 65 -7.677 6.728 6.716 1.00 25.43 C ATOM 0 H VAL A 65 -11.060 5.862 8.651 1.00 10.12 H new ATOM 0 HA VAL A 65 -8.759 4.437 7.914 1.00 74.51 H new ATOM 0 HB VAL A 65 -9.703 6.100 6.474 1.00 15.34 H new ATOM 0 HG11 VAL A 65 -9.678 8.514 6.989 1.00 71.23 H new ATOM 0 HG12 VAL A 65 -10.696 7.593 8.121 1.00 71.23 H new ATOM 0 HG13 VAL A 65 -9.082 8.147 8.625 1.00 71.23 H new ATOM 0 HG21 VAL A 65 -7.730 7.497 5.946 1.00 25.43 H new ATOM 0 HG22 VAL A 65 -7.017 7.061 7.517 1.00 25.43 H new ATOM 0 HG23 VAL A 65 -7.286 5.807 6.283 1.00 25.43 H new ATOM 1020 N GLU A 66 -8.356 6.579 10.398 1.00 61.51 N ATOM 1021 CA GLU A 66 -7.513 6.901 11.554 1.00 3.51 C ATOM 1022 C GLU A 66 -6.956 5.653 12.240 1.00 41.03 C ATOM 1023 O GLU A 66 -5.789 5.620 12.635 1.00 21.22 O ATOM 1024 CB GLU A 66 -8.326 7.703 12.571 1.00 63.01 C ATOM 1025 CG GLU A 66 -8.961 8.962 12.002 1.00 63.21 C ATOM 1026 CD GLU A 66 -9.807 9.693 13.024 1.00 20.05 C ATOM 1027 OE1 GLU A 66 -10.991 9.327 13.189 1.00 13.54 O ATOM 1028 OE2 GLU A 66 -9.295 10.630 13.668 1.00 31.31 O ATOM 0 H GLU A 66 -9.250 7.071 10.390 1.00 61.51 H new ATOM 0 HA GLU A 66 -6.669 7.483 11.184 1.00 3.51 H new ATOM 0 HB2 GLU A 66 -9.111 7.065 12.978 1.00 63.01 H new ATOM 0 HB3 GLU A 66 -7.677 7.980 13.402 1.00 63.01 H new ATOM 0 HG2 GLU A 66 -8.179 9.628 11.638 1.00 63.21 H new ATOM 0 HG3 GLU A 66 -9.579 8.698 11.144 1.00 63.21 H new ATOM 1035 N GLU A 67 -7.789 4.633 12.368 1.00 22.02 N ATOM 1036 CA GLU A 67 -7.403 3.405 13.046 1.00 74.22 C ATOM 1037 C GLU A 67 -6.447 2.577 12.184 1.00 51.43 C ATOM 1038 O GLU A 67 -5.652 1.794 12.702 1.00 65.12 O ATOM 1039 CB GLU A 67 -8.657 2.618 13.412 1.00 12.23 C ATOM 1040 CG GLU A 67 -9.571 3.390 14.351 1.00 32.40 C ATOM 1041 CD GLU A 67 -10.870 2.674 14.643 1.00 15.45 C ATOM 1042 OE1 GLU A 67 -11.757 2.669 13.770 1.00 73.11 O ATOM 1043 OE2 GLU A 67 -11.018 2.130 15.758 1.00 2.11 O ATOM 0 H GLU A 67 -8.744 4.631 12.009 1.00 22.02 H new ATOM 0 HA GLU A 67 -6.866 3.652 13.962 1.00 74.22 H new ATOM 0 HB2 GLU A 67 -9.203 2.366 12.503 1.00 12.23 H new ATOM 0 HB3 GLU A 67 -8.369 1.677 13.881 1.00 12.23 H new ATOM 0 HG2 GLU A 67 -9.046 3.573 15.289 1.00 32.40 H new ATOM 0 HG3 GLU A 67 -9.791 4.364 13.914 1.00 32.40 H new ATOM 1050 N VAL A 68 -6.520 2.772 10.870 1.00 12.52 N ATOM 1051 CA VAL A 68 -5.545 2.194 9.946 1.00 34.01 C ATOM 1052 C VAL A 68 -4.184 2.864 10.136 1.00 3.21 C ATOM 1053 O VAL A 68 -3.151 2.195 10.184 1.00 35.24 O ATOM 1054 CB VAL A 68 -6.004 2.343 8.473 1.00 11.12 C ATOM 1055 CG1 VAL A 68 -4.842 2.182 7.502 1.00 23.23 C ATOM 1056 CG2 VAL A 68 -7.087 1.336 8.153 1.00 1.42 C ATOM 0 H VAL A 68 -7.247 3.328 10.419 1.00 12.52 H new ATOM 0 HA VAL A 68 -5.462 1.130 10.168 1.00 34.01 H new ATOM 0 HB VAL A 68 -6.403 3.351 8.355 1.00 11.12 H new ATOM 0 HG11 VAL A 68 -5.204 2.293 6.480 1.00 23.23 H new ATOM 0 HG12 VAL A 68 -4.090 2.944 7.705 1.00 23.23 H new ATOM 0 HG13 VAL A 68 -4.400 1.193 7.625 1.00 23.23 H new ATOM 0 HG21 VAL A 68 -7.398 1.454 7.115 1.00 1.42 H new ATOM 0 HG22 VAL A 68 -6.702 0.327 8.304 1.00 1.42 H new ATOM 0 HG23 VAL A 68 -7.942 1.500 8.809 1.00 1.42 H new ATOM 1066 N ASP A 69 -4.206 4.190 10.248 1.00 43.32 N ATOM 1067 CA ASP A 69 -3.000 4.977 10.507 1.00 73.32 C ATOM 1068 C ASP A 69 -2.304 4.509 11.781 1.00 72.14 C ATOM 1069 O ASP A 69 -1.095 4.291 11.789 1.00 4.10 O ATOM 1070 CB ASP A 69 -3.356 6.455 10.640 1.00 23.44 C ATOM 1071 CG ASP A 69 -2.142 7.324 10.894 1.00 70.05 C ATOM 1072 OD1 ASP A 69 -1.472 7.726 9.922 1.00 21.13 O ATOM 1073 OD2 ASP A 69 -1.866 7.625 12.070 1.00 14.23 O ATOM 0 H ASP A 69 -5.055 4.748 10.162 1.00 43.32 H new ATOM 0 HA ASP A 69 -2.321 4.837 9.666 1.00 73.32 H new ATOM 0 HB2 ASP A 69 -3.853 6.789 9.729 1.00 23.44 H new ATOM 0 HB3 ASP A 69 -4.067 6.582 11.456 1.00 23.44 H new ATOM 1078 N ALA A 70 -3.081 4.396 12.857 1.00 2.25 N ATOM 1079 CA ALA A 70 -2.612 3.821 14.121 1.00 42.14 C ATOM 1080 C ALA A 70 -1.879 2.491 13.929 1.00 0.13 C ATOM 1081 O ALA A 70 -0.852 2.254 14.557 1.00 41.24 O ATOM 1082 CB ALA A 70 -3.780 3.641 15.080 1.00 45.42 C ATOM 0 H ALA A 70 -4.054 4.700 12.879 1.00 2.25 H new ATOM 0 HA ALA A 70 -1.893 4.523 14.543 1.00 42.14 H new ATOM 0 HB1 ALA A 70 -3.420 3.213 16.016 1.00 45.42 H new ATOM 0 HB2 ALA A 70 -4.241 4.609 15.277 1.00 45.42 H new ATOM 0 HB3 ALA A 70 -4.516 2.972 14.635 1.00 45.42 H new ATOM 1088 N ALA A 71 -2.383 1.648 13.031 1.00 33.42 N ATOM 1089 CA ALA A 71 -1.774 0.344 12.783 1.00 13.41 C ATOM 1090 C ALA A 71 -0.517 0.486 11.936 1.00 30.55 C ATOM 1091 O ALA A 71 0.435 -0.277 12.078 1.00 64.32 O ATOM 1092 CB ALA A 71 -2.760 -0.583 12.097 1.00 34.35 C ATOM 0 H ALA A 71 -3.209 1.844 12.465 1.00 33.42 H new ATOM 0 HA ALA A 71 -1.497 -0.087 13.745 1.00 13.41 H new ATOM 0 HB1 ALA A 71 -2.288 -1.550 11.920 1.00 34.35 H new ATOM 0 HB2 ALA A 71 -3.636 -0.717 12.732 1.00 34.35 H new ATOM 0 HB3 ALA A 71 -3.065 -0.149 11.145 1.00 34.35 H new ATOM 1098 N MET A 72 -0.516 1.483 11.066 1.00 75.31 N ATOM 1099 CA MET A 72 0.613 1.749 10.185 1.00 30.11 C ATOM 1100 C MET A 72 1.788 2.341 10.950 1.00 13.31 C ATOM 1101 O MET A 72 2.936 1.970 10.717 1.00 33.34 O ATOM 1102 CB MET A 72 0.180 2.678 9.055 1.00 33.20 C ATOM 1103 CG MET A 72 -0.474 1.922 7.921 1.00 23.04 C ATOM 1104 SD MET A 72 0.694 0.818 7.123 1.00 13.10 S ATOM 1105 CE MET A 72 -0.394 -0.394 6.402 1.00 74.52 C ATOM 0 H MET A 72 -1.296 2.130 10.950 1.00 75.31 H new ATOM 0 HA MET A 72 0.946 0.803 9.759 1.00 30.11 H new ATOM 0 HB2 MET A 72 -0.515 3.422 9.443 1.00 33.20 H new ATOM 0 HB3 MET A 72 1.048 3.219 8.677 1.00 33.20 H new ATOM 0 HG2 MET A 72 -1.319 1.349 8.302 1.00 23.04 H new ATOM 0 HG3 MET A 72 -0.870 2.627 7.190 1.00 23.04 H new ATOM 0 HE1 MET A 72 -0.273 -1.345 6.920 1.00 74.52 H new ATOM 0 HE2 MET A 72 -1.427 -0.058 6.497 1.00 74.52 H new ATOM 0 HE3 MET A 72 -0.149 -0.521 5.348 1.00 74.52 H new ATOM 1115 N ASN A 73 1.485 3.238 11.880 1.00 11.33 N ATOM 1116 CA ASN A 73 2.500 3.834 12.746 1.00 71.34 C ATOM 1117 C ASN A 73 2.986 2.807 13.774 1.00 34.33 C ATOM 1118 O ASN A 73 4.074 2.931 14.336 1.00 52.03 O ATOM 1119 CB ASN A 73 1.935 5.101 13.427 1.00 63.21 C ATOM 1120 CG ASN A 73 1.940 5.046 14.948 1.00 64.23 C ATOM 1121 OD1 ASN A 73 2.925 5.408 15.588 1.00 43.30 O ATOM 1122 ND2 ASN A 73 0.832 4.618 15.537 1.00 13.41 N ATOM 0 H ASN A 73 0.538 3.572 12.056 1.00 11.33 H new ATOM 0 HA ASN A 73 3.359 4.133 12.146 1.00 71.34 H new ATOM 0 HB2 ASN A 73 2.517 5.964 13.104 1.00 63.21 H new ATOM 0 HB3 ASN A 73 0.913 5.259 13.084 1.00 63.21 H new ATOM 0 HD21 ASN A 73 0.777 4.581 16.555 1.00 13.41 H new ATOM 0 HD22 ASN A 73 0.034 4.326 14.972 1.00 13.41 H new ATOM 1129 N ALA A 74 2.179 1.771 13.980 1.00 62.21 N ATOM 1130 CA ALA A 74 2.499 0.720 14.935 1.00 2.24 C ATOM 1131 C ALA A 74 3.432 -0.325 14.327 1.00 32.34 C ATOM 1132 O ALA A 74 3.909 -1.209 15.029 1.00 34.24 O ATOM 1133 CB ALA A 74 1.233 0.058 15.445 1.00 51.32 C ATOM 0 H ALA A 74 1.292 1.638 13.493 1.00 62.21 H new ATOM 0 HA ALA A 74 3.017 1.186 15.773 1.00 2.24 H new ATOM 0 HB1 ALA A 74 1.493 -0.725 16.158 1.00 51.32 H new ATOM 0 HB2 ALA A 74 0.606 0.802 15.936 1.00 51.32 H new ATOM 0 HB3 ALA A 74 0.689 -0.380 14.608 1.00 51.32 H new ATOM 1139 N ARG A 75 3.660 -0.243 13.017 1.00 13.15 N ATOM 1140 CA ARG A 75 4.608 -1.133 12.349 1.00 24.13 C ATOM 1141 C ARG A 75 6.016 -0.978 12.924 1.00 32.53 C ATOM 1142 O ARG A 75 6.413 0.122 13.314 1.00 13.40 O ATOM 1143 CB ARG A 75 4.639 -0.872 10.842 1.00 2.33 C ATOM 1144 CG ARG A 75 3.671 -1.739 10.056 1.00 14.24 C ATOM 1145 CD ARG A 75 3.924 -1.657 8.558 1.00 24.14 C ATOM 1146 NE ARG A 75 3.492 -0.380 7.998 1.00 4.22 N ATOM 1147 CZ ARG A 75 4.128 0.277 7.029 1.00 41.20 C ATOM 1148 NH1 ARG A 75 5.238 -0.214 6.493 1.00 33.45 N ATOM 1149 NH2 ARG A 75 3.633 1.424 6.584 1.00 50.20 N ATOM 0 H ARG A 75 3.203 0.428 12.399 1.00 13.15 H new ATOM 0 HA ARG A 75 4.269 -2.154 12.525 1.00 24.13 H new ATOM 0 HB2 ARG A 75 4.406 0.177 10.658 1.00 2.33 H new ATOM 0 HB3 ARG A 75 5.650 -1.043 10.472 1.00 2.33 H new ATOM 0 HG2 ARG A 75 3.763 -2.775 10.384 1.00 14.24 H new ATOM 0 HG3 ARG A 75 2.649 -1.427 10.269 1.00 14.24 H new ATOM 0 HD2 ARG A 75 4.987 -1.797 8.362 1.00 24.14 H new ATOM 0 HD3 ARG A 75 3.397 -2.469 8.057 1.00 24.14 H new ATOM 0 HE ARG A 75 2.642 0.039 8.376 1.00 4.22 H new ATOM 0 HH11 ARG A 75 5.613 -1.104 6.822 1.00 33.45 H new ATOM 0 HH12 ARG A 75 5.716 0.298 5.752 1.00 33.45 H new ATOM 0 HH21 ARG A 75 2.772 1.797 6.983 1.00 50.20 H new ATOM 0 HH22 ARG A 75 4.114 1.933 5.842 1.00 50.20 H new ATOM 1163 N PRO A 76 6.799 -2.072 12.978 1.00 4.21 N ATOM 1164 CA PRO A 76 6.388 -3.403 12.510 1.00 34.32 C ATOM 1165 C PRO A 76 5.456 -4.126 13.487 1.00 11.33 C ATOM 1166 O PRO A 76 5.340 -3.748 14.655 1.00 32.33 O ATOM 1167 CB PRO A 76 7.717 -4.170 12.380 1.00 33.23 C ATOM 1168 CG PRO A 76 8.799 -3.175 12.648 1.00 44.35 C ATOM 1169 CD PRO A 76 8.175 -2.097 13.478 1.00 54.12 C ATOM 0 HA PRO A 76 5.820 -3.335 11.582 1.00 34.32 H new ATOM 0 HB2 PRO A 76 7.762 -4.995 13.091 1.00 33.23 H new ATOM 0 HB3 PRO A 76 7.822 -4.601 11.384 1.00 33.23 H new ATOM 0 HG2 PRO A 76 9.633 -3.639 13.175 1.00 44.35 H new ATOM 0 HG3 PRO A 76 9.195 -2.770 11.717 1.00 44.35 H new ATOM 0 HD2 PRO A 76 8.216 -2.329 14.542 1.00 54.12 H new ATOM 0 HD3 PRO A 76 8.675 -1.138 13.341 1.00 54.12 H new ATOM 1177 N HIS A 77 4.804 -5.172 12.997 1.00 21.23 N ATOM 1178 CA HIS A 77 3.850 -5.933 13.802 1.00 21.02 C ATOM 1179 C HIS A 77 4.300 -7.377 13.964 1.00 12.34 C ATOM 1180 O HIS A 77 5.044 -7.902 13.134 1.00 34.20 O ATOM 1181 CB HIS A 77 2.460 -5.913 13.166 1.00 1.13 C ATOM 1182 CG HIS A 77 1.681 -4.669 13.433 1.00 34.20 C ATOM 1183 ND1 HIS A 77 0.704 -4.629 14.392 1.00 72.21 N ATOM 1184 CD2 HIS A 77 1.756 -3.465 12.825 1.00 44.45 C ATOM 1185 CE1 HIS A 77 0.208 -3.407 14.347 1.00 45.40 C ATOM 1186 NE2 HIS A 77 0.815 -2.669 13.412 1.00 53.32 N ATOM 0 H HIS A 77 4.917 -5.516 12.043 1.00 21.23 H new ATOM 0 HA HIS A 77 3.805 -5.459 14.783 1.00 21.02 H new ATOM 0 HB2 HIS A 77 2.564 -6.038 12.088 1.00 1.13 H new ATOM 0 HB3 HIS A 77 1.893 -6.769 13.533 1.00 1.13 H new ATOM 0 HD1 HIS A 77 0.419 -5.387 15.012 1.00 72.21 H new ATOM 0 HD2 HIS A 77 2.430 -3.186 12.029 1.00 44.45 H new ATOM 0 HE1 HIS A 77 -0.587 -3.049 14.984 1.00 45.40 H new ATOM 0 HE2 HIS A 77 0.613 -1.696 13.181 1.00 53.32 H new ATOM 1194 N LYS A 78 3.845 -8.013 15.034 1.00 41.02 N ATOM 1195 CA LYS A 78 4.151 -9.410 15.281 1.00 23.22 C ATOM 1196 C LYS A 78 2.948 -10.142 15.876 1.00 71.33 C ATOM 1197 O LYS A 78 2.601 -9.950 17.041 1.00 10.43 O ATOM 1198 CB LYS A 78 5.378 -9.528 16.194 1.00 2.10 C ATOM 1199 CG LYS A 78 5.624 -10.933 16.717 1.00 54.41 C ATOM 1200 CD LYS A 78 7.092 -11.172 17.031 1.00 21.41 C ATOM 1201 CE LYS A 78 7.891 -11.482 15.773 1.00 45.52 C ATOM 1202 NZ LYS A 78 9.317 -11.773 16.077 1.00 3.33 N ATOM 0 H LYS A 78 3.259 -7.579 15.747 1.00 41.02 H new ATOM 0 HA LYS A 78 4.383 -9.886 14.328 1.00 23.22 H new ATOM 0 HB2 LYS A 78 6.260 -9.195 15.646 1.00 2.10 H new ATOM 0 HB3 LYS A 78 5.255 -8.852 17.040 1.00 2.10 H new ATOM 0 HG2 LYS A 78 5.029 -11.095 17.616 1.00 54.41 H new ATOM 0 HG3 LYS A 78 5.288 -11.660 15.977 1.00 54.41 H new ATOM 0 HD2 LYS A 78 7.508 -10.291 17.519 1.00 21.41 H new ATOM 0 HD3 LYS A 78 7.184 -12.000 17.734 1.00 21.41 H new ATOM 0 HE2 LYS A 78 7.447 -12.337 15.263 1.00 45.52 H new ATOM 0 HE3 LYS A 78 7.832 -10.636 15.088 1.00 45.52 H new ATOM 0 HZ1 LYS A 78 9.825 -11.979 15.193 1.00 3.33 H new ATOM 0 HZ2 LYS A 78 9.748 -10.948 16.541 1.00 3.33 H new ATOM 0 HZ3 LYS A 78 9.376 -12.596 16.710 1.00 3.33 H new ATOM 1216 N VAL A 79 2.319 -10.982 15.057 1.00 4.41 N ATOM 1217 CA VAL A 79 1.169 -11.778 15.480 1.00 62.41 C ATOM 1218 C VAL A 79 1.590 -13.231 15.648 1.00 71.45 C ATOM 1219 O VAL A 79 2.234 -13.786 14.758 1.00 72.12 O ATOM 1220 CB VAL A 79 0.014 -11.725 14.446 1.00 31.32 C ATOM 1221 CG1 VAL A 79 -1.266 -12.314 15.025 1.00 43.01 C ATOM 1222 CG2 VAL A 79 -0.226 -10.307 13.951 1.00 23.12 C ATOM 0 H VAL A 79 2.591 -11.130 14.085 1.00 4.41 H new ATOM 0 HA VAL A 79 0.814 -11.360 16.422 1.00 62.41 H new ATOM 0 HB VAL A 79 0.314 -12.331 13.591 1.00 31.32 H new ATOM 0 HG11 VAL A 79 -2.059 -12.264 14.279 1.00 43.01 H new ATOM 0 HG12 VAL A 79 -1.095 -13.354 15.304 1.00 43.01 H new ATOM 0 HG13 VAL A 79 -1.561 -11.746 15.907 1.00 43.01 H new ATOM 0 HG21 VAL A 79 -1.042 -10.307 13.228 1.00 23.12 H new ATOM 0 HG22 VAL A 79 -0.488 -9.667 14.794 1.00 23.12 H new ATOM 0 HG23 VAL A 79 0.679 -9.929 13.476 1.00 23.12 H new ATOM 1232 N ASP A 80 1.261 -13.826 16.801 1.00 53.23 N ATOM 1233 CA ASP A 80 1.532 -15.253 17.071 1.00 71.12 C ATOM 1234 C ASP A 80 3.045 -15.510 17.186 1.00 33.22 C ATOM 1235 O ASP A 80 3.522 -16.638 17.059 1.00 43.44 O ATOM 1236 CB ASP A 80 0.891 -16.144 15.977 1.00 13.42 C ATOM 1237 CG ASP A 80 0.955 -17.631 16.285 1.00 72.31 C ATOM 1238 OD1 ASP A 80 0.449 -18.049 17.350 1.00 1.32 O ATOM 1239 OD2 ASP A 80 1.503 -18.387 15.458 1.00 10.01 O ATOM 0 H ASP A 80 0.802 -13.340 17.572 1.00 53.23 H new ATOM 0 HA ASP A 80 1.079 -15.516 18.027 1.00 71.12 H new ATOM 0 HB2 ASP A 80 -0.152 -15.853 15.849 1.00 13.42 H new ATOM 0 HB3 ASP A 80 1.393 -15.957 15.028 1.00 13.42 H new ATOM 1244 N GLY A 81 3.800 -14.454 17.472 1.00 31.53 N ATOM 1245 CA GLY A 81 5.247 -14.565 17.525 1.00 54.33 C ATOM 1246 C GLY A 81 5.859 -14.592 16.141 1.00 62.44 C ATOM 1247 O GLY A 81 6.965 -15.091 15.942 1.00 43.42 O ATOM 0 H GLY A 81 3.435 -13.522 17.668 1.00 31.53 H new ATOM 0 HA2 GLY A 81 5.656 -13.725 18.087 1.00 54.33 H new ATOM 0 HA3 GLY A 81 5.523 -15.472 18.062 1.00 54.33 H new ATOM 1251 N ARG A 82 5.132 -14.033 15.190 1.00 33.13 N ATOM 1252 CA ARG A 82 5.551 -13.999 13.803 1.00 51.24 C ATOM 1253 C ARG A 82 5.570 -12.555 13.319 1.00 44.51 C ATOM 1254 O ARG A 82 4.650 -11.799 13.613 1.00 15.10 O ATOM 1255 CB ARG A 82 4.591 -14.837 12.951 1.00 64.51 C ATOM 1256 CG ARG A 82 4.784 -14.669 11.457 1.00 55.43 C ATOM 1257 CD ARG A 82 5.817 -15.633 10.905 1.00 21.11 C ATOM 1258 NE ARG A 82 6.029 -15.424 9.473 1.00 2.52 N ATOM 1259 CZ ARG A 82 6.566 -16.328 8.654 1.00 40.11 C ATOM 1260 NH1 ARG A 82 6.947 -17.514 9.117 1.00 11.41 N ATOM 1261 NH2 ARG A 82 6.725 -16.042 7.368 1.00 24.42 N ATOM 0 H ARG A 82 4.230 -13.588 15.361 1.00 33.13 H new ATOM 0 HA ARG A 82 6.553 -14.418 13.710 1.00 51.24 H new ATOM 0 HB2 ARG A 82 4.718 -15.889 13.207 1.00 64.51 H new ATOM 0 HB3 ARG A 82 3.566 -14.568 13.207 1.00 64.51 H new ATOM 0 HG2 ARG A 82 3.833 -14.827 10.949 1.00 55.43 H new ATOM 0 HG3 ARG A 82 5.093 -13.646 11.244 1.00 55.43 H new ATOM 0 HD2 ARG A 82 6.759 -15.503 11.437 1.00 21.11 H new ATOM 0 HD3 ARG A 82 5.491 -16.658 11.080 1.00 21.11 H new ATOM 0 HE ARG A 82 5.748 -14.528 9.075 1.00 2.52 H new ATOM 0 HH11 ARG A 82 6.829 -17.738 10.105 1.00 11.41 H new ATOM 0 HH12 ARG A 82 7.357 -18.201 8.484 1.00 11.41 H new ATOM 0 HH21 ARG A 82 6.437 -15.132 7.008 1.00 24.42 H new ATOM 0 HH22 ARG A 82 7.136 -16.732 6.739 1.00 24.42 H new ATOM 1275 N VAL A 83 6.605 -12.175 12.582 1.00 12.14 N ATOM 1276 CA VAL A 83 6.720 -10.804 12.103 1.00 51.12 C ATOM 1277 C VAL A 83 5.847 -10.619 10.859 1.00 13.23 C ATOM 1278 O VAL A 83 6.091 -11.215 9.810 1.00 35.51 O ATOM 1279 CB VAL A 83 8.194 -10.389 11.829 1.00 4.01 C ATOM 1280 CG1 VAL A 83 8.885 -11.336 10.856 1.00 20.22 C ATOM 1281 CG2 VAL A 83 8.260 -8.952 11.327 1.00 42.14 C ATOM 0 H VAL A 83 7.370 -12.790 12.305 1.00 12.14 H new ATOM 0 HA VAL A 83 6.363 -10.142 12.892 1.00 51.12 H new ATOM 0 HB VAL A 83 8.732 -10.454 12.775 1.00 4.01 H new ATOM 0 HG11 VAL A 83 9.912 -11.007 10.695 1.00 20.22 H new ATOM 0 HG12 VAL A 83 8.888 -12.344 11.270 1.00 20.22 H new ATOM 0 HG13 VAL A 83 8.350 -11.335 9.906 1.00 20.22 H new ATOM 0 HG21 VAL A 83 9.299 -8.679 11.141 1.00 42.14 H new ATOM 0 HG22 VAL A 83 7.690 -8.863 10.402 1.00 42.14 H new ATOM 0 HG23 VAL A 83 7.839 -8.284 12.079 1.00 42.14 H new ATOM 1291 N VAL A 84 4.798 -9.830 11.000 1.00 53.31 N ATOM 1292 CA VAL A 84 3.830 -9.673 9.931 1.00 42.23 C ATOM 1293 C VAL A 84 3.959 -8.306 9.276 1.00 32.43 C ATOM 1294 O VAL A 84 4.390 -7.337 9.903 1.00 61.21 O ATOM 1295 CB VAL A 84 2.381 -9.895 10.435 1.00 70.30 C ATOM 1296 CG1 VAL A 84 2.326 -11.110 11.343 1.00 5.33 C ATOM 1297 CG2 VAL A 84 1.837 -8.670 11.152 1.00 34.34 C ATOM 0 H VAL A 84 4.595 -9.290 11.841 1.00 53.31 H new ATOM 0 HA VAL A 84 4.046 -10.438 9.185 1.00 42.23 H new ATOM 0 HB VAL A 84 1.749 -10.069 9.564 1.00 70.30 H new ATOM 0 HG11 VAL A 84 1.304 -11.258 11.692 1.00 5.33 H new ATOM 0 HG12 VAL A 84 2.652 -11.992 10.791 1.00 5.33 H new ATOM 0 HG13 VAL A 84 2.983 -10.955 12.199 1.00 5.33 H new ATOM 0 HG21 VAL A 84 0.819 -8.868 11.489 1.00 34.34 H new ATOM 0 HG22 VAL A 84 2.466 -8.443 12.012 1.00 34.34 H new ATOM 0 HG23 VAL A 84 1.834 -7.820 10.469 1.00 34.34 H new ATOM 1307 N GLU A 85 3.612 -8.257 8.007 1.00 23.23 N ATOM 1308 CA GLU A 85 3.697 -7.038 7.230 1.00 21.23 C ATOM 1309 C GLU A 85 2.306 -6.543 6.843 1.00 41.22 C ATOM 1310 O GLU A 85 1.731 -7.013 5.861 1.00 34.55 O ATOM 1311 CB GLU A 85 4.528 -7.289 5.968 1.00 54.33 C ATOM 1312 CG GLU A 85 5.117 -6.025 5.356 1.00 34.43 C ATOM 1313 CD GLU A 85 6.088 -5.316 6.277 1.00 40.52 C ATOM 1314 OE1 GLU A 85 5.644 -4.493 7.101 1.00 74.24 O ATOM 1315 OE2 GLU A 85 7.304 -5.576 6.176 1.00 31.43 O ATOM 0 H GLU A 85 3.263 -9.061 7.485 1.00 23.23 H new ATOM 0 HA GLU A 85 4.178 -6.272 7.838 1.00 21.23 H new ATOM 0 HB2 GLU A 85 5.339 -7.976 6.209 1.00 54.33 H new ATOM 0 HB3 GLU A 85 3.902 -7.783 5.225 1.00 54.33 H new ATOM 0 HG2 GLU A 85 5.627 -6.282 4.428 1.00 34.43 H new ATOM 0 HG3 GLU A 85 4.307 -5.343 5.097 1.00 34.43 H new ATOM 1322 N PRO A 86 1.727 -5.615 7.621 1.00 54.14 N ATOM 1323 CA PRO A 86 0.463 -4.993 7.265 1.00 54.11 C ATOM 1324 C PRO A 86 0.658 -3.931 6.194 1.00 41.43 C ATOM 1325 O PRO A 86 1.509 -3.045 6.318 1.00 4.33 O ATOM 1326 CB PRO A 86 -0.022 -4.374 8.571 1.00 12.31 C ATOM 1327 CG PRO A 86 1.202 -4.143 9.387 1.00 12.54 C ATOM 1328 CD PRO A 86 2.254 -5.110 8.902 1.00 72.31 C ATOM 0 HA PRO A 86 -0.251 -5.703 6.848 1.00 54.11 H new ATOM 0 HB2 PRO A 86 -0.553 -3.440 8.388 1.00 12.31 H new ATOM 0 HB3 PRO A 86 -0.716 -5.039 9.085 1.00 12.31 H new ATOM 0 HG2 PRO A 86 1.547 -3.115 9.280 1.00 12.54 H new ATOM 0 HG3 PRO A 86 0.994 -4.301 10.445 1.00 12.54 H new ATOM 0 HD2 PRO A 86 3.216 -4.616 8.768 1.00 72.31 H new ATOM 0 HD3 PRO A 86 2.408 -5.920 9.615 1.00 72.31 H new ATOM 1336 N LYS A 87 -0.114 -4.042 5.133 1.00 21.41 N ATOM 1337 CA LYS A 87 -0.001 -3.138 4.007 1.00 35.14 C ATOM 1338 C LYS A 87 -1.378 -2.655 3.619 1.00 74.23 C ATOM 1339 O LYS A 87 -2.366 -3.150 4.136 1.00 13.41 O ATOM 1340 CB LYS A 87 0.672 -3.822 2.806 1.00 74.04 C ATOM 1341 CG LYS A 87 1.979 -4.527 3.142 1.00 21.13 C ATOM 1342 CD LYS A 87 2.854 -4.716 1.914 1.00 4.12 C ATOM 1343 CE LYS A 87 3.796 -5.891 2.093 1.00 10.13 C ATOM 1344 NZ LYS A 87 4.622 -6.131 0.885 1.00 52.31 N ATOM 0 H LYS A 87 -0.834 -4.757 5.027 1.00 21.41 H new ATOM 0 HA LYS A 87 0.622 -2.293 4.301 1.00 35.14 H new ATOM 0 HB2 LYS A 87 -0.021 -4.548 2.380 1.00 74.04 H new ATOM 0 HB3 LYS A 87 0.863 -3.074 2.036 1.00 74.04 H new ATOM 0 HG2 LYS A 87 2.522 -3.948 3.889 1.00 21.13 H new ATOM 0 HG3 LYS A 87 1.763 -5.498 3.587 1.00 21.13 H new ATOM 0 HD2 LYS A 87 2.227 -4.879 1.038 1.00 4.12 H new ATOM 0 HD3 LYS A 87 3.429 -3.809 1.730 1.00 4.12 H new ATOM 0 HE2 LYS A 87 4.448 -5.706 2.947 1.00 10.13 H new ATOM 0 HE3 LYS A 87 3.219 -6.787 2.321 1.00 10.13 H new ATOM 0 HZ1 LYS A 87 5.004 -7.098 0.912 1.00 52.31 H new ATOM 0 HZ2 LYS A 87 4.035 -6.014 0.034 1.00 52.31 H new ATOM 0 HZ3 LYS A 87 5.407 -5.450 0.860 1.00 52.31 H new ATOM 1358 N ARG A 88 -1.447 -1.689 2.731 1.00 14.45 N ATOM 1359 CA ARG A 88 -2.728 -1.206 2.253 1.00 53.11 C ATOM 1360 C ARG A 88 -3.378 -2.261 1.365 1.00 22.30 C ATOM 1361 O ARG A 88 -2.705 -2.875 0.534 1.00 32.53 O ATOM 1362 CB ARG A 88 -2.531 0.100 1.480 1.00 51.12 C ATOM 1363 CG ARG A 88 -3.824 0.783 1.060 1.00 71.23 C ATOM 1364 CD ARG A 88 -4.638 1.236 2.260 1.00 30.30 C ATOM 1365 NE ARG A 88 -3.884 2.139 3.134 1.00 40.43 N ATOM 1366 CZ ARG A 88 -4.409 3.194 3.760 1.00 1.42 C ATOM 1367 NH1 ARG A 88 -5.698 3.495 3.616 1.00 61.42 N ATOM 1368 NH2 ARG A 88 -3.639 3.944 4.536 1.00 12.11 N ATOM 0 H ARG A 88 -0.636 -1.222 2.325 1.00 14.45 H new ATOM 0 HA ARG A 88 -3.384 -1.014 3.102 1.00 53.11 H new ATOM 0 HB2 ARG A 88 -1.954 0.789 2.096 1.00 51.12 H new ATOM 0 HB3 ARG A 88 -1.937 -0.105 0.589 1.00 51.12 H new ATOM 0 HG2 ARG A 88 -3.593 1.643 0.432 1.00 71.23 H new ATOM 0 HG3 ARG A 88 -4.418 0.097 0.456 1.00 71.23 H new ATOM 0 HD2 ARG A 88 -5.542 1.738 1.915 1.00 30.30 H new ATOM 0 HD3 ARG A 88 -4.957 0.364 2.831 1.00 30.30 H new ATOM 0 HE ARG A 88 -2.892 1.948 3.273 1.00 40.43 H new ATOM 0 HH11 ARG A 88 -6.294 2.917 3.023 1.00 61.42 H new ATOM 0 HH12 ARG A 88 -6.090 4.304 4.099 1.00 61.42 H new ATOM 0 HH21 ARG A 88 -2.652 3.713 4.651 1.00 12.11 H new ATOM 0 HH22 ARG A 88 -4.033 4.752 5.018 1.00 12.11 H new ATOM 1382 N ALA A 89 -4.662 -2.531 1.593 1.00 21.41 N ATOM 1383 CA ALA A 89 -5.416 -3.388 0.693 1.00 40.15 C ATOM 1384 C ALA A 89 -5.587 -2.697 -0.646 1.00 65.24 C ATOM 1385 O ALA A 89 -6.468 -1.853 -0.826 1.00 1.45 O ATOM 1386 CB ALA A 89 -6.758 -3.776 1.285 1.00 32.31 C ATOM 0 H ALA A 89 -5.194 -2.171 2.386 1.00 21.41 H new ATOM 0 HA ALA A 89 -4.856 -4.312 0.545 1.00 40.15 H new ATOM 0 HB1 ALA A 89 -7.293 -4.417 0.584 1.00 32.31 H new ATOM 0 HB2 ALA A 89 -6.601 -4.313 2.221 1.00 32.31 H new ATOM 0 HB3 ALA A 89 -7.345 -2.878 1.476 1.00 32.31 H new ATOM 1392 N VAL A 90 -4.698 -3.052 -1.561 1.00 64.35 N ATOM 1393 CA VAL A 90 -4.629 -2.445 -2.878 1.00 52.14 C ATOM 1394 C VAL A 90 -5.953 -2.560 -3.619 1.00 33.44 C ATOM 1395 O VAL A 90 -6.589 -3.620 -3.622 1.00 35.01 O ATOM 1396 CB VAL A 90 -3.528 -3.121 -3.729 1.00 4.40 C ATOM 1397 CG1 VAL A 90 -3.279 -2.340 -5.005 1.00 50.52 C ATOM 1398 CG2 VAL A 90 -2.236 -3.281 -2.943 1.00 32.14 C ATOM 0 H VAL A 90 -3.998 -3.777 -1.407 1.00 64.35 H new ATOM 0 HA VAL A 90 -4.396 -1.391 -2.731 1.00 52.14 H new ATOM 0 HB VAL A 90 -3.883 -4.117 -3.994 1.00 4.40 H new ATOM 0 HG11 VAL A 90 -2.501 -2.833 -5.588 1.00 50.52 H new ATOM 0 HG12 VAL A 90 -4.198 -2.296 -5.590 1.00 50.52 H new ATOM 0 HG13 VAL A 90 -2.959 -1.328 -4.756 1.00 50.52 H new ATOM 0 HG21 VAL A 90 -1.485 -3.759 -3.571 1.00 32.14 H new ATOM 0 HG22 VAL A 90 -1.877 -2.301 -2.630 1.00 32.14 H new ATOM 0 HG23 VAL A 90 -2.419 -3.898 -2.063 1.00 32.14 H new ATOM 1408 N SER A 91 -6.355 -1.450 -4.242 1.00 3.51 N ATOM 1409 CA SER A 91 -7.565 -1.397 -5.048 1.00 43.33 C ATOM 1410 C SER A 91 -7.525 -2.483 -6.111 1.00 72.14 C ATOM 1411 O SER A 91 -6.462 -2.777 -6.659 1.00 4.21 O ATOM 1412 CB SER A 91 -7.691 -0.019 -5.708 1.00 11.24 C ATOM 1413 OG SER A 91 -8.762 0.023 -6.640 1.00 1.15 O ATOM 0 H SER A 91 -5.848 -0.566 -4.199 1.00 3.51 H new ATOM 0 HA SER A 91 -8.430 -1.562 -4.406 1.00 43.33 H new ATOM 0 HB2 SER A 91 -7.847 0.739 -4.940 1.00 11.24 H new ATOM 0 HB3 SER A 91 -6.758 0.228 -6.215 1.00 11.24 H new ATOM 0 HG SER A 91 -8.813 0.916 -7.039 1.00 1.15 H new ATOM 1419 N ARG A 92 -8.685 -3.064 -6.403 1.00 63.20 N ATOM 1420 CA ARG A 92 -8.782 -4.218 -7.297 1.00 20.32 C ATOM 1421 C ARG A 92 -8.278 -3.900 -8.705 1.00 61.55 C ATOM 1422 O ARG A 92 -7.966 -4.805 -9.480 1.00 44.44 O ATOM 1423 CB ARG A 92 -10.227 -4.716 -7.353 1.00 51.24 C ATOM 1424 CG ARG A 92 -10.382 -6.168 -6.935 1.00 31.05 C ATOM 1425 CD ARG A 92 -9.679 -7.094 -7.908 1.00 23.11 C ATOM 1426 NE ARG A 92 -9.662 -8.477 -7.446 1.00 70.13 N ATOM 1427 CZ ARG A 92 -8.829 -9.403 -7.916 1.00 73.01 C ATOM 1428 NH1 ARG A 92 -7.951 -9.089 -8.863 1.00 75.33 N ATOM 1429 NH2 ARG A 92 -8.880 -10.640 -7.444 1.00 42.43 N ATOM 0 H ARG A 92 -9.581 -2.752 -6.030 1.00 63.20 H new ATOM 0 HA ARG A 92 -8.141 -5.002 -6.893 1.00 20.32 H new ATOM 0 HB2 ARG A 92 -10.844 -4.092 -6.706 1.00 51.24 H new ATOM 0 HB3 ARG A 92 -10.606 -4.596 -8.368 1.00 51.24 H new ATOM 0 HG2 ARG A 92 -9.972 -6.307 -5.935 1.00 31.05 H new ATOM 0 HG3 ARG A 92 -11.440 -6.424 -6.884 1.00 31.05 H new ATOM 0 HD2 ARG A 92 -10.176 -7.044 -8.877 1.00 23.11 H new ATOM 0 HD3 ARG A 92 -8.655 -6.751 -8.057 1.00 23.11 H new ATOM 0 HE ARG A 92 -10.326 -8.750 -6.722 1.00 70.13 H new ATOM 0 HH11 ARG A 92 -7.915 -8.138 -9.230 1.00 75.33 H new ATOM 0 HH12 ARG A 92 -7.313 -9.799 -9.223 1.00 75.33 H new ATOM 0 HH21 ARG A 92 -9.557 -10.882 -6.721 1.00 42.43 H new ATOM 0 HH22 ARG A 92 -8.242 -11.350 -7.804 1.00 42.43 H new ATOM 1443 N GLU A 93 -8.198 -2.620 -9.027 1.00 51.02 N ATOM 1444 CA GLU A 93 -7.669 -2.186 -10.307 1.00 64.12 C ATOM 1445 C GLU A 93 -6.157 -2.389 -10.364 1.00 71.22 C ATOM 1446 O GLU A 93 -5.633 -2.919 -11.342 1.00 72.42 O ATOM 1447 CB GLU A 93 -8.020 -0.719 -10.542 1.00 55.35 C ATOM 1448 CG GLU A 93 -9.515 -0.461 -10.555 1.00 15.04 C ATOM 1449 CD GLU A 93 -9.854 1.004 -10.707 1.00 74.42 C ATOM 1450 OE1 GLU A 93 -9.705 1.540 -11.821 1.00 33.25 O ATOM 1451 OE2 GLU A 93 -10.287 1.622 -9.718 1.00 31.24 O ATOM 0 H GLU A 93 -8.495 -1.860 -8.415 1.00 51.02 H new ATOM 0 HA GLU A 93 -8.121 -2.789 -11.095 1.00 64.12 H new ATOM 0 HB2 GLU A 93 -7.559 -0.112 -9.763 1.00 55.35 H new ATOM 0 HB3 GLU A 93 -7.593 -0.397 -11.492 1.00 55.35 H new ATOM 0 HG2 GLU A 93 -9.969 -1.021 -11.372 1.00 15.04 H new ATOM 0 HG3 GLU A 93 -9.952 -0.837 -9.630 1.00 15.04 H new ATOM 1458 N ASP A 94 -5.463 -2.003 -9.300 1.00 62.44 N ATOM 1459 CA ASP A 94 -4.007 -2.112 -9.260 1.00 60.01 C ATOM 1460 C ASP A 94 -3.573 -3.511 -8.829 1.00 32.14 C ATOM 1461 O ASP A 94 -2.552 -4.016 -9.287 1.00 42.42 O ATOM 1462 CB ASP A 94 -3.403 -1.057 -8.331 1.00 53.34 C ATOM 1463 CG ASP A 94 -1.885 -1.045 -8.378 1.00 74.04 C ATOM 1464 OD1 ASP A 94 -1.319 -0.481 -9.337 1.00 21.10 O ATOM 1465 OD2 ASP A 94 -1.255 -1.596 -7.452 1.00 12.32 O ATOM 0 H ASP A 94 -5.882 -1.613 -8.456 1.00 62.44 H new ATOM 0 HA ASP A 94 -3.635 -1.934 -10.269 1.00 60.01 H new ATOM 0 HB2 ASP A 94 -3.780 -0.073 -8.609 1.00 53.34 H new ATOM 0 HB3 ASP A 94 -3.731 -1.247 -7.309 1.00 53.34 H new ATOM 1470 N SER A 95 -4.375 -4.161 -7.982 1.00 0.52 N ATOM 1471 CA SER A 95 -4.075 -5.527 -7.542 1.00 64.21 C ATOM 1472 C SER A 95 -4.408 -6.547 -8.633 1.00 30.24 C ATOM 1473 O SER A 95 -4.302 -7.756 -8.426 1.00 62.15 O ATOM 1474 CB SER A 95 -4.819 -5.870 -6.246 1.00 31.24 C ATOM 1475 OG SER A 95 -6.199 -5.570 -6.343 1.00 65.41 O ATOM 0 H SER A 95 -5.230 -3.768 -7.589 1.00 0.52 H new ATOM 0 HA SER A 95 -3.004 -5.576 -7.344 1.00 64.21 H new ATOM 0 HB2 SER A 95 -4.691 -6.929 -6.022 1.00 31.24 H new ATOM 0 HB3 SER A 95 -4.382 -5.313 -5.417 1.00 31.24 H new ATOM 0 HG SER A 95 -6.317 -4.603 -6.452 1.00 65.41 H new ATOM 1481 N GLN A 96 -4.818 -6.042 -9.790 1.00 15.11 N ATOM 1482 CA GLN A 96 -5.001 -6.861 -10.976 1.00 13.42 C ATOM 1483 C GLN A 96 -3.665 -6.980 -11.715 1.00 44.51 C ATOM 1484 O GLN A 96 -3.504 -7.786 -12.632 1.00 20.14 O ATOM 1485 CB GLN A 96 -6.074 -6.229 -11.872 1.00 32.21 C ATOM 1486 CG GLN A 96 -6.467 -7.067 -13.080 1.00 33.31 C ATOM 1487 CD GLN A 96 -7.640 -6.480 -13.850 1.00 44.11 C ATOM 1488 OE1 GLN A 96 -7.789 -5.163 -13.809 1.00 30.23 O flip ATOM 1489 NE2 GLN A 96 -8.410 -7.208 -14.478 1.00 11.15 N flip ATOM 0 H GLN A 96 -5.032 -5.055 -9.930 1.00 15.11 H new ATOM 0 HA GLN A 96 -5.334 -7.861 -10.697 1.00 13.42 H new ATOM 0 HB2 GLN A 96 -6.964 -6.041 -11.272 1.00 32.21 H new ATOM 0 HB3 GLN A 96 -5.714 -5.261 -12.220 1.00 32.21 H new ATOM 0 HG2 GLN A 96 -5.610 -7.158 -13.747 1.00 33.31 H new ATOM 0 HG3 GLN A 96 -6.723 -8.074 -12.750 1.00 33.31 H new ATOM 0 HE21 GLN A 96 -8.264 -8.217 -14.487 1.00 11.15 H new ATOM 0 HE22 GLN A 96 -9.193 -6.801 -14.989 1.00 11.15 H new ATOM 1498 N ARG A 97 -2.698 -6.179 -11.279 1.00 21.03 N ATOM 1499 CA ARG A 97 -1.361 -6.185 -11.854 1.00 54.23 C ATOM 1500 C ARG A 97 -0.449 -7.096 -11.037 1.00 75.14 C ATOM 1501 O ARG A 97 -0.664 -7.275 -9.838 1.00 43.12 O ATOM 1502 CB ARG A 97 -0.784 -4.764 -11.877 1.00 3.21 C ATOM 1503 CG ARG A 97 -1.692 -3.740 -12.540 1.00 31.42 C ATOM 1504 CD ARG A 97 -1.802 -3.981 -14.035 1.00 32.14 C ATOM 1505 NE ARG A 97 -0.511 -3.833 -14.704 1.00 62.25 N ATOM 1506 CZ ARG A 97 -0.220 -4.346 -15.899 1.00 13.32 C ATOM 1507 NH1 ARG A 97 -1.128 -5.048 -16.570 1.00 72.24 N ATOM 1508 NH2 ARG A 97 0.985 -4.151 -16.425 1.00 73.53 N ATOM 0 H ARG A 97 -2.820 -5.510 -10.519 1.00 21.03 H new ATOM 0 HA ARG A 97 -1.423 -6.558 -12.876 1.00 54.23 H new ATOM 0 HB2 ARG A 97 -0.583 -4.448 -10.853 1.00 3.21 H new ATOM 0 HB3 ARG A 97 0.172 -4.779 -12.400 1.00 3.21 H new ATOM 0 HG2 ARG A 97 -2.683 -3.785 -12.089 1.00 31.42 H new ATOM 0 HG3 ARG A 97 -1.305 -2.737 -12.359 1.00 31.42 H new ATOM 0 HD2 ARG A 97 -2.192 -4.983 -14.214 1.00 32.14 H new ATOM 0 HD3 ARG A 97 -2.517 -3.279 -14.465 1.00 32.14 H new ATOM 0 HE ARG A 97 0.216 -3.302 -14.224 1.00 62.25 H new ATOM 0 HH11 ARG A 97 -2.055 -5.197 -16.171 1.00 72.24 H new ATOM 0 HH12 ARG A 97 -0.898 -5.438 -17.484 1.00 72.24 H new ATOM 0 HH21 ARG A 97 1.683 -3.610 -15.914 1.00 73.53 H new ATOM 0 HH22 ARG A 97 1.212 -4.542 -17.339 1.00 73.53 H new ATOM 1522 N PRO A 98 0.566 -7.701 -11.679 1.00 14.34 N ATOM 1523 CA PRO A 98 1.533 -8.563 -10.992 1.00 62.45 C ATOM 1524 C PRO A 98 2.566 -7.764 -10.192 1.00 15.42 C ATOM 1525 O PRO A 98 3.248 -6.886 -10.733 1.00 75.12 O ATOM 1526 CB PRO A 98 2.206 -9.317 -12.140 1.00 3.14 C ATOM 1527 CG PRO A 98 2.081 -8.426 -13.330 1.00 62.32 C ATOM 1528 CD PRO A 98 0.836 -7.603 -13.127 1.00 25.31 C ATOM 0 HA PRO A 98 1.054 -9.212 -10.259 1.00 62.45 H new ATOM 0 HB2 PRO A 98 3.252 -9.525 -11.913 1.00 3.14 H new ATOM 0 HB3 PRO A 98 1.721 -10.277 -12.316 1.00 3.14 H new ATOM 0 HG2 PRO A 98 2.957 -7.785 -13.427 1.00 62.32 H new ATOM 0 HG3 PRO A 98 2.012 -9.012 -14.246 1.00 62.32 H new ATOM 0 HD2 PRO A 98 0.989 -6.568 -13.434 1.00 25.31 H new ATOM 0 HD3 PRO A 98 0.003 -7.990 -13.714 1.00 25.31 H new ATOM 1536 N GLY A 99 2.672 -8.070 -8.906 1.00 35.05 N ATOM 1537 CA GLY A 99 3.617 -7.381 -8.045 1.00 30.32 C ATOM 1538 C GLY A 99 3.001 -6.172 -7.369 1.00 62.44 C ATOM 1539 O GLY A 99 3.692 -5.201 -7.062 1.00 32.30 O ATOM 0 H GLY A 99 2.117 -8.788 -8.440 1.00 35.05 H new ATOM 0 HA2 GLY A 99 3.984 -8.072 -7.286 1.00 30.32 H new ATOM 0 HA3 GLY A 99 4.479 -7.066 -8.633 1.00 30.32 H new ATOM 1543 N ALA A 100 1.699 -6.245 -7.119 1.00 11.12 N ATOM 1544 CA ALA A 100 0.958 -5.125 -6.557 1.00 34.13 C ATOM 1545 C ALA A 100 1.047 -5.088 -5.036 1.00 24.34 C ATOM 1546 O ALA A 100 1.004 -4.019 -4.435 1.00 22.23 O ATOM 1547 CB ALA A 100 -0.495 -5.191 -6.993 1.00 72.11 C ATOM 0 H ALA A 100 1.133 -7.074 -7.298 1.00 11.12 H new ATOM 0 HA ALA A 100 1.411 -4.208 -6.935 1.00 34.13 H new ATOM 0 HB1 ALA A 100 -1.041 -4.349 -6.568 1.00 72.11 H new ATOM 0 HB2 ALA A 100 -0.551 -5.147 -8.081 1.00 72.11 H new ATOM 0 HB3 ALA A 100 -0.938 -6.124 -6.644 1.00 72.11 H new ATOM 1553 N HIS A 101 1.179 -6.253 -4.415 1.00 52.52 N ATOM 1554 CA HIS A 101 1.223 -6.331 -2.957 1.00 41.23 C ATOM 1555 C HIS A 101 2.656 -6.397 -2.443 1.00 74.52 C ATOM 1556 O HIS A 101 2.887 -6.614 -1.252 1.00 12.11 O ATOM 1557 CB HIS A 101 0.418 -7.531 -2.448 1.00 34.44 C ATOM 1558 CG HIS A 101 -1.036 -7.229 -2.240 1.00 32.32 C ATOM 1559 ND1 HIS A 101 -2.014 -7.840 -2.990 1.00 43.11 N ATOM 1560 CD2 HIS A 101 -1.620 -6.388 -1.355 1.00 73.32 C ATOM 1561 CE1 HIS A 101 -3.163 -7.358 -2.545 1.00 61.30 C ATOM 1562 NE2 HIS A 101 -2.972 -6.476 -1.555 1.00 24.30 N ATOM 0 H HIS A 101 1.257 -7.151 -4.892 1.00 52.52 H new ATOM 0 HA HIS A 101 0.769 -5.419 -2.569 1.00 41.23 H new ATOM 0 HB2 HIS A 101 0.513 -8.351 -3.160 1.00 34.44 H new ATOM 0 HB3 HIS A 101 0.848 -7.875 -1.507 1.00 34.44 H new ATOM 0 HD2 HIS A 101 -1.116 -5.766 -0.630 1.00 73.32 H new ATOM 0 HE1 HIS A 101 -4.132 -7.640 -2.931 1.00 61.30 H new ATOM 0 HE2 HIS A 101 -3.695 -5.967 -1.047 1.00 24.30 H new ATOM 1570 N LEU A 102 3.616 -6.200 -3.339 1.00 43.13 N ATOM 1571 CA LEU A 102 5.017 -6.125 -2.952 1.00 22.11 C ATOM 1572 C LEU A 102 5.297 -4.779 -2.291 1.00 14.13 C ATOM 1573 O LEU A 102 4.533 -3.828 -2.465 1.00 61.11 O ATOM 1574 CB LEU A 102 5.932 -6.315 -4.167 1.00 13.20 C ATOM 1575 CG LEU A 102 5.859 -7.688 -4.843 1.00 5.33 C ATOM 1576 CD1 LEU A 102 6.763 -7.729 -6.067 1.00 65.03 C ATOM 1577 CD2 LEU A 102 6.241 -8.793 -3.868 1.00 63.34 C ATOM 0 H LEU A 102 3.448 -6.089 -4.339 1.00 43.13 H new ATOM 0 HA LEU A 102 5.224 -6.927 -2.243 1.00 22.11 H new ATOM 0 HB2 LEU A 102 5.687 -5.553 -4.906 1.00 13.20 H new ATOM 0 HB3 LEU A 102 6.961 -6.138 -3.855 1.00 13.20 H new ATOM 0 HG LEU A 102 4.830 -7.853 -5.163 1.00 5.33 H new ATOM 0 HD11 LEU A 102 6.698 -8.712 -6.534 1.00 65.03 H new ATOM 0 HD12 LEU A 102 6.446 -6.967 -6.779 1.00 65.03 H new ATOM 0 HD13 LEU A 102 7.793 -7.538 -5.765 1.00 65.03 H new ATOM 0 HD21 LEU A 102 6.182 -9.758 -4.371 1.00 63.34 H new ATOM 0 HD22 LEU A 102 7.259 -8.630 -3.514 1.00 63.34 H new ATOM 0 HD23 LEU A 102 5.556 -8.783 -3.020 1.00 63.34 H new ATOM 1589 N THR A 103 6.375 -4.700 -1.524 1.00 15.50 N ATOM 1590 CA THR A 103 6.718 -3.469 -0.832 1.00 20.25 C ATOM 1591 C THR A 103 7.430 -2.506 -1.777 1.00 74.05 C ATOM 1592 O THR A 103 8.657 -2.404 -1.790 1.00 31.22 O ATOM 1593 CB THR A 103 7.593 -3.740 0.406 1.00 52.04 C ATOM 1594 OG1 THR A 103 7.105 -4.899 1.092 1.00 44.10 O ATOM 1595 CG2 THR A 103 7.567 -2.557 1.360 1.00 53.34 C ATOM 0 H THR A 103 7.024 -5.471 -1.366 1.00 15.50 H new ATOM 0 HA THR A 103 5.788 -3.013 -0.492 1.00 20.25 H new ATOM 0 HB THR A 103 8.618 -3.901 0.071 1.00 52.04 H new ATOM 0 HG1 THR A 103 7.663 -5.072 1.879 1.00 44.10 H new ATOM 0 HG21 THR A 103 8.193 -2.774 2.226 1.00 53.34 H new ATOM 0 HG22 THR A 103 7.946 -1.671 0.851 1.00 53.34 H new ATOM 0 HG23 THR A 103 6.543 -2.377 1.688 1.00 53.34 H new ATOM 1603 N VAL A 104 6.638 -1.825 -2.582 1.00 11.52 N ATOM 1604 CA VAL A 104 7.150 -0.868 -3.543 1.00 1.45 C ATOM 1605 C VAL A 104 6.801 0.541 -3.090 1.00 72.23 C ATOM 1606 O VAL A 104 5.629 0.881 -2.924 1.00 40.34 O ATOM 1607 CB VAL A 104 6.599 -1.135 -4.971 1.00 20.54 C ATOM 1608 CG1 VAL A 104 5.103 -1.386 -4.954 1.00 64.33 C ATOM 1609 CG2 VAL A 104 6.936 0.009 -5.915 1.00 71.33 C ATOM 0 H VAL A 104 5.622 -1.919 -2.588 1.00 11.52 H new ATOM 0 HA VAL A 104 8.233 -0.977 -3.591 1.00 1.45 H new ATOM 0 HB VAL A 104 7.087 -2.037 -5.339 1.00 20.54 H new ATOM 0 HG11 VAL A 104 4.753 -1.569 -5.970 1.00 64.33 H new ATOM 0 HG12 VAL A 104 4.887 -2.256 -4.334 1.00 64.33 H new ATOM 0 HG13 VAL A 104 4.592 -0.514 -4.546 1.00 64.33 H new ATOM 0 HG21 VAL A 104 6.537 -0.207 -6.906 1.00 71.33 H new ATOM 0 HG22 VAL A 104 6.495 0.932 -5.540 1.00 71.33 H new ATOM 0 HG23 VAL A 104 8.018 0.123 -5.977 1.00 71.33 H new ATOM 1619 N LYS A 105 7.816 1.346 -2.843 1.00 22.34 N ATOM 1620 CA LYS A 105 7.604 2.717 -2.425 1.00 50.05 C ATOM 1621 C LYS A 105 7.908 3.667 -3.575 1.00 53.11 C ATOM 1622 O LYS A 105 8.178 4.845 -3.375 1.00 11.53 O ATOM 1623 CB LYS A 105 8.492 3.027 -1.220 1.00 61.51 C ATOM 1624 CG LYS A 105 8.416 1.968 -0.132 1.00 62.23 C ATOM 1625 CD LYS A 105 9.249 2.344 1.078 1.00 11.23 C ATOM 1626 CE LYS A 105 9.096 1.324 2.193 1.00 52.33 C ATOM 1627 NZ LYS A 105 9.807 1.743 3.430 1.00 22.44 N ATOM 0 H LYS A 105 8.796 1.074 -2.925 1.00 22.34 H new ATOM 0 HA LYS A 105 6.561 2.851 -2.137 1.00 50.05 H new ATOM 0 HB2 LYS A 105 9.525 3.123 -1.553 1.00 61.51 H new ATOM 0 HB3 LYS A 105 8.202 3.991 -0.801 1.00 61.51 H new ATOM 0 HG2 LYS A 105 7.378 1.831 0.170 1.00 62.23 H new ATOM 0 HG3 LYS A 105 8.761 1.013 -0.529 1.00 62.23 H new ATOM 0 HD2 LYS A 105 10.298 2.418 0.791 1.00 11.23 H new ATOM 0 HD3 LYS A 105 8.947 3.328 1.438 1.00 11.23 H new ATOM 0 HE2 LYS A 105 8.038 1.183 2.413 1.00 52.33 H new ATOM 0 HE3 LYS A 105 9.484 0.361 1.860 1.00 52.33 H new ATOM 0 HZ1 LYS A 105 9.385 1.265 4.252 1.00 22.44 H new ATOM 0 HZ2 LYS A 105 10.812 1.485 3.357 1.00 22.44 H new ATOM 0 HZ3 LYS A 105 9.722 2.773 3.547 1.00 22.44 H new ATOM 1641 N LYS A 106 7.863 3.135 -4.781 1.00 11.30 N ATOM 1642 CA LYS A 106 8.114 3.919 -5.978 1.00 23.35 C ATOM 1643 C LYS A 106 6.899 3.922 -6.892 1.00 4.20 C ATOM 1644 O LYS A 106 6.235 2.898 -7.051 1.00 21.31 O ATOM 1645 CB LYS A 106 9.323 3.350 -6.715 1.00 1.32 C ATOM 1646 CG LYS A 106 10.582 4.171 -6.527 1.00 21.00 C ATOM 1647 CD LYS A 106 10.548 5.420 -7.385 1.00 44.22 C ATOM 1648 CE LYS A 106 10.911 5.113 -8.826 1.00 50.10 C ATOM 1649 NZ LYS A 106 12.376 4.951 -9.000 1.00 71.42 N ATOM 0 H LYS A 106 7.653 2.153 -4.960 1.00 11.30 H new ATOM 0 HA LYS A 106 8.317 4.949 -5.684 1.00 23.35 H new ATOM 0 HB2 LYS A 106 9.506 2.333 -6.368 1.00 1.32 H new ATOM 0 HB3 LYS A 106 9.094 3.287 -7.779 1.00 1.32 H new ATOM 0 HG2 LYS A 106 10.686 4.449 -5.478 1.00 21.00 H new ATOM 0 HG3 LYS A 106 11.454 3.571 -6.786 1.00 21.00 H new ATOM 0 HD2 LYS A 106 9.553 5.863 -7.346 1.00 44.22 H new ATOM 0 HD3 LYS A 106 11.242 6.158 -6.983 1.00 44.22 H new ATOM 0 HE2 LYS A 106 10.404 4.202 -9.143 1.00 50.10 H new ATOM 0 HE3 LYS A 106 10.555 5.917 -9.470 1.00 50.10 H new ATOM 0 HZ1 LYS A 106 12.632 5.147 -9.989 1.00 71.42 H new ATOM 0 HZ2 LYS A 106 12.875 5.615 -8.375 1.00 71.42 H new ATOM 0 HZ3 LYS A 106 12.649 3.977 -8.759 1.00 71.42 H new ATOM 1663 N ILE A 107 6.598 5.070 -7.488 1.00 14.03 N ATOM 1664 CA ILE A 107 5.500 5.163 -8.441 1.00 64.40 C ATOM 1665 C ILE A 107 5.934 5.865 -9.722 1.00 54.34 C ATOM 1666 O ILE A 107 6.831 6.716 -9.716 1.00 11.23 O ATOM 1667 CB ILE A 107 4.275 5.898 -7.860 1.00 54.24 C ATOM 1668 CG1 ILE A 107 4.713 7.129 -7.074 1.00 23.05 C ATOM 1669 CG2 ILE A 107 3.456 4.962 -6.988 1.00 31.21 C ATOM 1670 CD1 ILE A 107 3.563 7.976 -6.586 1.00 65.44 C ATOM 0 H ILE A 107 7.097 5.945 -7.329 1.00 14.03 H new ATOM 0 HA ILE A 107 5.213 4.136 -8.665 1.00 64.40 H new ATOM 0 HB ILE A 107 3.646 6.229 -8.686 1.00 54.24 H new ATOM 0 HG12 ILE A 107 5.307 6.810 -6.218 1.00 23.05 H new ATOM 0 HG13 ILE A 107 5.361 7.739 -7.703 1.00 23.05 H new ATOM 0 HG21 ILE A 107 2.596 5.498 -6.587 1.00 31.21 H new ATOM 0 HG22 ILE A 107 3.111 4.117 -7.585 1.00 31.21 H new ATOM 0 HG23 ILE A 107 4.072 4.598 -6.166 1.00 31.21 H new ATOM 0 HD11 ILE A 107 3.950 8.833 -6.036 1.00 65.44 H new ATOM 0 HD12 ILE A 107 2.981 8.325 -7.439 1.00 65.44 H new ATOM 0 HD13 ILE A 107 2.926 7.382 -5.931 1.00 65.44 H new ATOM 1682 N PHE A 108 5.294 5.472 -10.813 1.00 4.51 N ATOM 1683 CA PHE A 108 5.553 6.029 -12.129 1.00 41.13 C ATOM 1684 C PHE A 108 4.570 7.148 -12.419 1.00 30.51 C ATOM 1685 O PHE A 108 3.374 7.004 -12.183 1.00 54.34 O ATOM 1686 CB PHE A 108 5.441 4.911 -13.182 1.00 24.31 C ATOM 1687 CG PHE A 108 5.089 5.366 -14.579 1.00 2.15 C ATOM 1688 CD1 PHE A 108 6.071 5.804 -15.453 1.00 24.33 C ATOM 1689 CD2 PHE A 108 3.769 5.345 -15.017 1.00 31.40 C ATOM 1690 CE1 PHE A 108 5.745 6.212 -16.733 1.00 3.42 C ATOM 1691 CE2 PHE A 108 3.439 5.751 -16.293 1.00 0.11 C ATOM 1692 CZ PHE A 108 4.427 6.185 -17.154 1.00 72.13 C ATOM 0 H PHE A 108 4.573 4.750 -10.808 1.00 4.51 H new ATOM 0 HA PHE A 108 6.560 6.446 -12.164 1.00 41.13 H new ATOM 0 HB2 PHE A 108 6.390 4.376 -13.221 1.00 24.31 H new ATOM 0 HB3 PHE A 108 4.687 4.198 -12.850 1.00 24.31 H new ATOM 0 HD1 PHE A 108 7.102 5.827 -15.131 1.00 24.33 H new ATOM 0 HD2 PHE A 108 2.992 5.006 -14.348 1.00 31.40 H new ATOM 0 HE1 PHE A 108 6.519 6.552 -17.405 1.00 3.42 H new ATOM 0 HE2 PHE A 108 2.409 5.729 -16.618 1.00 0.11 H new ATOM 0 HZ PHE A 108 4.172 6.503 -18.154 1.00 72.13 H new ATOM 1702 N VAL A 109 5.081 8.264 -12.910 1.00 24.41 N ATOM 1703 CA VAL A 109 4.240 9.385 -13.300 1.00 54.24 C ATOM 1704 C VAL A 109 4.479 9.698 -14.772 1.00 4.43 C ATOM 1705 O VAL A 109 5.532 10.196 -15.131 1.00 31.21 O ATOM 1706 CB VAL A 109 4.559 10.645 -12.465 1.00 3.31 C ATOM 1707 CG1 VAL A 109 3.476 11.699 -12.630 1.00 11.30 C ATOM 1708 CG2 VAL A 109 4.749 10.291 -10.998 1.00 73.14 C ATOM 0 H VAL A 109 6.080 8.419 -13.049 1.00 24.41 H new ATOM 0 HA VAL A 109 3.200 9.108 -13.126 1.00 54.24 H new ATOM 0 HB VAL A 109 5.494 11.063 -12.837 1.00 3.31 H new ATOM 0 HG11 VAL A 109 3.726 12.575 -12.031 1.00 11.30 H new ATOM 0 HG12 VAL A 109 3.404 11.985 -13.679 1.00 11.30 H new ATOM 0 HG13 VAL A 109 2.520 11.294 -12.298 1.00 11.30 H new ATOM 0 HG21 VAL A 109 4.973 11.195 -10.432 1.00 73.14 H new ATOM 0 HG22 VAL A 109 3.836 9.837 -10.612 1.00 73.14 H new ATOM 0 HG23 VAL A 109 5.575 9.587 -10.898 1.00 73.14 H new ATOM 1718 N GLY A 110 3.512 9.415 -15.621 1.00 72.14 N ATOM 1719 CA GLY A 110 3.734 9.590 -17.041 1.00 11.44 C ATOM 1720 C GLY A 110 2.679 10.421 -17.722 1.00 14.10 C ATOM 1721 O GLY A 110 1.574 10.584 -17.209 1.00 0.12 O ATOM 0 H GLY A 110 2.587 9.071 -15.362 1.00 72.14 H new ATOM 0 HA2 GLY A 110 4.706 10.059 -17.192 1.00 11.44 H new ATOM 0 HA3 GLY A 110 3.775 8.610 -17.517 1.00 11.44 H new ATOM 1725 N GLY A 111 3.030 10.955 -18.881 1.00 74.31 N ATOM 1726 CA GLY A 111 2.084 11.724 -19.655 1.00 32.53 C ATOM 1727 C GLY A 111 2.277 13.213 -19.486 1.00 41.14 C ATOM 1728 O GLY A 111 1.477 14.002 -19.985 1.00 23.13 O ATOM 0 H GLY A 111 3.956 10.868 -19.299 1.00 74.31 H new ATOM 0 HA2 GLY A 111 2.185 11.465 -20.709 1.00 32.53 H new ATOM 0 HA3 GLY A 111 1.071 11.455 -19.356 1.00 32.53 H new ATOM 1732 N ILE A 112 3.336 13.602 -18.784 1.00 33.14 N ATOM 1733 CA ILE A 112 3.648 15.012 -18.604 1.00 74.50 C ATOM 1734 C ILE A 112 4.030 15.634 -19.944 1.00 75.14 C ATOM 1735 O ILE A 112 4.919 15.144 -20.648 1.00 33.43 O ATOM 1736 CB ILE A 112 4.761 15.235 -17.550 1.00 35.23 C ATOM 1737 CG1 ILE A 112 6.009 14.405 -17.873 1.00 31.13 C ATOM 1738 CG2 ILE A 112 4.238 14.891 -16.162 1.00 62.21 C ATOM 1739 CD1 ILE A 112 7.159 14.623 -16.912 1.00 42.20 C ATOM 0 H ILE A 112 3.990 12.962 -18.333 1.00 33.14 H new ATOM 0 HA ILE A 112 2.754 15.506 -18.223 1.00 74.50 H new ATOM 0 HB ILE A 112 5.047 16.286 -17.574 1.00 35.23 H new ATOM 0 HG12 ILE A 112 5.741 13.348 -17.869 1.00 31.13 H new ATOM 0 HG13 ILE A 112 6.342 14.646 -18.883 1.00 31.13 H new ATOM 0 HG21 ILE A 112 5.026 15.050 -15.426 1.00 62.21 H new ATOM 0 HG22 ILE A 112 3.387 15.529 -15.925 1.00 62.21 H new ATOM 0 HG23 ILE A 112 3.926 13.847 -16.139 1.00 62.21 H new ATOM 0 HD11 ILE A 112 8.004 14.001 -17.208 1.00 42.20 H new ATOM 0 HD12 ILE A 112 7.456 15.672 -16.932 1.00 42.20 H new ATOM 0 HD13 ILE A 112 6.846 14.354 -15.903 1.00 42.20 H new ATOM 1751 N LYS A 113 3.326 16.693 -20.309 1.00 52.25 N ATOM 1752 CA LYS A 113 3.427 17.246 -21.653 1.00 3.40 C ATOM 1753 C LYS A 113 4.489 18.332 -21.752 1.00 11.44 C ATOM 1754 O LYS A 113 4.991 18.609 -22.837 1.00 71.32 O ATOM 1755 CB LYS A 113 2.059 17.766 -22.131 1.00 41.40 C ATOM 1756 CG LYS A 113 1.284 18.582 -21.097 1.00 30.45 C ATOM 1757 CD LYS A 113 1.570 20.075 -21.193 1.00 14.01 C ATOM 1758 CE LYS A 113 1.106 20.649 -22.521 1.00 73.10 C ATOM 1759 NZ LYS A 113 0.852 22.112 -22.437 1.00 13.04 N ATOM 0 H LYS A 113 2.679 17.188 -19.695 1.00 52.25 H new ATOM 0 HA LYS A 113 3.741 16.437 -22.312 1.00 3.40 H new ATOM 0 HB2 LYS A 113 2.210 18.381 -23.018 1.00 41.40 H new ATOM 0 HB3 LYS A 113 1.448 16.915 -22.433 1.00 41.40 H new ATOM 0 HG2 LYS A 113 0.216 18.411 -21.232 1.00 30.45 H new ATOM 0 HG3 LYS A 113 1.539 18.231 -20.097 1.00 30.45 H new ATOM 0 HD2 LYS A 113 1.069 20.595 -20.376 1.00 14.01 H new ATOM 0 HD3 LYS A 113 2.639 20.250 -21.074 1.00 14.01 H new ATOM 0 HE2 LYS A 113 1.861 20.455 -23.283 1.00 73.10 H new ATOM 0 HE3 LYS A 113 0.195 20.140 -22.837 1.00 73.10 H new ATOM 0 HZ1 LYS A 113 0.220 22.400 -23.212 1.00 13.04 H new ATOM 0 HZ2 LYS A 113 0.405 22.335 -21.525 1.00 13.04 H new ATOM 0 HZ3 LYS A 113 1.753 22.626 -22.516 1.00 13.04 H new ATOM 1773 N GLU A 114 4.842 18.930 -20.627 1.00 43.02 N ATOM 1774 CA GLU A 114 5.834 19.994 -20.609 1.00 13.04 C ATOM 1775 C GLU A 114 6.710 19.883 -19.372 1.00 4.40 C ATOM 1776 O GLU A 114 6.664 18.868 -18.672 1.00 41.54 O ATOM 1777 CB GLU A 114 5.155 21.362 -20.653 1.00 1.54 C ATOM 1778 CG GLU A 114 4.855 21.845 -22.060 1.00 23.22 C ATOM 1779 CD GLU A 114 4.391 23.282 -22.088 1.00 24.02 C ATOM 1780 OE1 GLU A 114 5.247 24.180 -22.198 1.00 65.34 O ATOM 1781 OE2 GLU A 114 3.169 23.519 -21.996 1.00 63.02 O ATOM 0 H GLU A 114 4.456 18.697 -19.712 1.00 43.02 H new ATOM 0 HA GLU A 114 6.463 19.890 -21.493 1.00 13.04 H new ATOM 0 HB2 GLU A 114 4.224 21.315 -20.088 1.00 1.54 H new ATOM 0 HB3 GLU A 114 5.794 22.092 -20.155 1.00 1.54 H new ATOM 0 HG2 GLU A 114 5.749 21.743 -22.675 1.00 23.22 H new ATOM 0 HG3 GLU A 114 4.088 21.210 -22.504 1.00 23.22 H new ATOM 1788 N ASP A 115 7.498 20.935 -19.117 1.00 61.45 N ATOM 1789 CA ASP A 115 8.417 20.987 -17.980 1.00 71.43 C ATOM 1790 C ASP A 115 7.687 20.741 -16.664 1.00 41.24 C ATOM 1791 O ASP A 115 6.993 21.619 -16.144 1.00 61.01 O ATOM 1792 CB ASP A 115 9.128 22.348 -17.934 1.00 35.23 C ATOM 1793 CG ASP A 115 10.169 22.436 -16.827 1.00 73.54 C ATOM 1794 OD1 ASP A 115 9.810 22.769 -15.678 1.00 5.43 O ATOM 1795 OD2 ASP A 115 11.358 22.186 -17.104 1.00 2.14 O ATOM 0 H ASP A 115 7.514 21.774 -19.696 1.00 61.45 H new ATOM 0 HA ASP A 115 9.156 20.197 -18.113 1.00 71.43 H new ATOM 0 HB2 ASP A 115 9.610 22.533 -18.894 1.00 35.23 H new ATOM 0 HB3 ASP A 115 8.387 23.135 -17.792 1.00 35.23 H new ATOM 1800 N THR A 116 7.813 19.530 -16.160 1.00 61.11 N ATOM 1801 CA THR A 116 7.290 19.188 -14.857 1.00 64.24 C ATOM 1802 C THR A 116 8.454 18.980 -13.907 1.00 40.55 C ATOM 1803 O THR A 116 9.342 18.166 -14.159 1.00 22.14 O ATOM 1804 CB THR A 116 6.403 17.930 -14.913 1.00 42.51 C ATOM 1805 OG1 THR A 116 5.508 18.035 -16.032 1.00 33.31 O ATOM 1806 CG2 THR A 116 5.598 17.769 -13.623 1.00 24.22 C ATOM 0 H THR A 116 8.279 18.760 -16.641 1.00 61.11 H new ATOM 0 HA THR A 116 6.660 20.004 -14.502 1.00 64.24 H new ATOM 0 HB THR A 116 7.043 17.055 -15.026 1.00 42.51 H new ATOM 0 HG1 THR A 116 4.678 17.554 -15.833 1.00 33.31 H new ATOM 0 HG21 THR A 116 4.980 16.873 -13.689 1.00 24.22 H new ATOM 0 HG22 THR A 116 6.280 17.678 -12.778 1.00 24.22 H new ATOM 0 HG23 THR A 116 4.959 18.641 -13.482 1.00 24.22 H new ATOM 1814 N GLU A 117 8.437 19.715 -12.821 1.00 41.42 N ATOM 1815 CA GLU A 117 9.593 19.769 -11.952 1.00 45.31 C ATOM 1816 C GLU A 117 9.311 19.127 -10.604 1.00 54.20 C ATOM 1817 O GLU A 117 8.210 18.612 -10.358 1.00 15.40 O ATOM 1818 CB GLU A 117 10.134 21.201 -11.826 1.00 62.54 C ATOM 1819 CG GLU A 117 9.114 22.245 -11.410 1.00 64.15 C ATOM 1820 CD GLU A 117 9.038 22.412 -9.910 1.00 23.20 C ATOM 1821 OE1 GLU A 117 10.092 22.328 -9.243 1.00 35.53 O ATOM 1822 OE2 GLU A 117 7.930 22.612 -9.392 1.00 42.01 O ATOM 0 H GLU A 117 7.644 20.280 -12.518 1.00 41.42 H new ATOM 0 HA GLU A 117 10.384 19.178 -12.413 1.00 45.31 H new ATOM 0 HB2 GLU A 117 10.947 21.202 -11.100 1.00 62.54 H new ATOM 0 HB3 GLU A 117 10.561 21.496 -12.784 1.00 62.54 H new ATOM 0 HG2 GLU A 117 9.370 23.201 -11.867 1.00 64.15 H new ATOM 0 HG3 GLU A 117 8.133 21.962 -11.791 1.00 64.15 H new ATOM 1829 N GLU A 118 10.325 19.152 -9.750 1.00 51.02 N ATOM 1830 CA GLU A 118 10.293 18.439 -8.485 1.00 25.14 C ATOM 1831 C GLU A 118 9.137 18.902 -7.614 1.00 23.42 C ATOM 1832 O GLU A 118 8.317 18.090 -7.210 1.00 14.12 O ATOM 1833 CB GLU A 118 11.617 18.598 -7.737 1.00 34.04 C ATOM 1834 CG GLU A 118 11.629 17.924 -6.377 1.00 3.20 C ATOM 1835 CD GLU A 118 12.927 18.127 -5.631 1.00 70.34 C ATOM 1836 OE1 GLU A 118 13.920 17.449 -5.959 1.00 61.22 O ATOM 1837 OE2 GLU A 118 12.964 18.968 -4.710 1.00 14.13 O ATOM 0 H GLU A 118 11.190 19.666 -9.916 1.00 51.02 H new ATOM 0 HA GLU A 118 10.144 17.383 -8.710 1.00 25.14 H new ATOM 0 HB2 GLU A 118 12.421 18.184 -8.346 1.00 34.04 H new ATOM 0 HB3 GLU A 118 11.828 19.660 -7.609 1.00 34.04 H new ATOM 0 HG2 GLU A 118 10.806 18.313 -5.777 1.00 3.20 H new ATOM 0 HG3 GLU A 118 11.453 16.856 -6.505 1.00 3.20 H new ATOM 1844 N HIS A 119 9.044 20.208 -7.376 1.00 5.41 N ATOM 1845 CA HIS A 119 8.049 20.744 -6.450 1.00 13.40 C ATOM 1846 C HIS A 119 6.629 20.497 -6.961 1.00 5.21 C ATOM 1847 O HIS A 119 5.707 20.369 -6.164 1.00 64.54 O ATOM 1848 CB HIS A 119 8.285 22.241 -6.196 1.00 40.25 C ATOM 1849 CG HIS A 119 7.358 22.835 -5.175 1.00 12.15 C ATOM 1850 ND1 HIS A 119 6.302 23.629 -5.549 1.00 62.41 N ATOM 1851 CD2 HIS A 119 7.358 22.707 -3.826 1.00 53.41 C ATOM 1852 CE1 HIS A 119 5.683 23.961 -4.432 1.00 63.34 C ATOM 1853 NE2 HIS A 119 6.287 23.428 -3.362 1.00 31.32 N ATOM 0 H HIS A 119 9.642 20.912 -7.809 1.00 5.41 H new ATOM 0 HA HIS A 119 8.160 20.217 -5.502 1.00 13.40 H new ATOM 0 HB2 HIS A 119 9.314 22.387 -5.867 1.00 40.25 H new ATOM 0 HB3 HIS A 119 8.171 22.782 -7.135 1.00 40.25 H new ATOM 0 HD2 HIS A 119 8.064 22.146 -3.231 1.00 53.41 H new ATOM 0 HE1 HIS A 119 4.802 24.583 -4.386 1.00 63.34 H new ATOM 0 HE2 HIS A 119 6.005 23.537 -2.388 1.00 31.32 H new ATOM 1861 N HIS A 120 6.461 20.413 -8.281 1.00 13.33 N ATOM 1862 CA HIS A 120 5.165 20.079 -8.873 1.00 21.44 C ATOM 1863 C HIS A 120 4.626 18.784 -8.285 1.00 1.02 C ATOM 1864 O HIS A 120 3.603 18.774 -7.583 1.00 11.45 O ATOM 1865 CB HIS A 120 5.279 19.910 -10.393 1.00 44.33 C ATOM 1866 CG HIS A 120 5.325 21.190 -11.169 1.00 15.51 C ATOM 1867 ND1 HIS A 120 5.733 21.211 -12.479 1.00 32.31 N ATOM 1868 CD2 HIS A 120 4.990 22.444 -10.791 1.00 64.31 C ATOM 1869 CE1 HIS A 120 5.633 22.469 -12.868 1.00 42.15 C ATOM 1870 NE2 HIS A 120 5.189 23.255 -11.878 1.00 3.52 N ATOM 0 H HIS A 120 7.205 20.571 -8.960 1.00 13.33 H new ATOM 0 HA HIS A 120 4.486 20.902 -8.649 1.00 21.44 H new ATOM 0 HB2 HIS A 120 6.179 19.336 -10.613 1.00 44.33 H new ATOM 0 HB3 HIS A 120 4.432 19.321 -10.743 1.00 44.33 H new ATOM 0 HD2 HIS A 120 4.634 22.749 -9.818 1.00 64.31 H new ATOM 0 HE1 HIS A 120 5.878 22.820 -13.859 1.00 42.15 H new ATOM 0 HE2 HIS A 120 5.030 24.261 -11.924 1.00 3.52 H new ATOM 1878 N LEU A 121 5.353 17.701 -8.505 1.00 63.15 N ATOM 1879 CA LEU A 121 4.863 16.403 -8.097 1.00 24.24 C ATOM 1880 C LEU A 121 5.176 16.122 -6.631 1.00 64.24 C ATOM 1881 O LEU A 121 4.457 15.380 -5.981 1.00 52.51 O ATOM 1882 CB LEU A 121 5.393 15.296 -9.017 1.00 33.53 C ATOM 1883 CG LEU A 121 6.910 15.141 -9.116 1.00 52.40 C ATOM 1884 CD1 LEU A 121 7.443 14.277 -7.984 1.00 10.14 C ATOM 1885 CD2 LEU A 121 7.275 14.536 -10.456 1.00 34.42 C ATOM 0 H LEU A 121 6.268 17.697 -8.956 1.00 63.15 H new ATOM 0 HA LEU A 121 3.777 16.413 -8.194 1.00 24.24 H new ATOM 0 HB2 LEU A 121 4.977 14.347 -8.679 1.00 33.53 H new ATOM 0 HB3 LEU A 121 5.005 15.475 -10.020 1.00 33.53 H new ATOM 0 HG LEU A 121 7.367 16.127 -9.030 1.00 52.40 H new ATOM 0 HD11 LEU A 121 8.525 14.182 -8.077 1.00 10.14 H new ATOM 0 HD12 LEU A 121 7.200 14.740 -7.028 1.00 10.14 H new ATOM 0 HD13 LEU A 121 6.986 13.289 -8.035 1.00 10.14 H new ATOM 0 HD21 LEU A 121 8.357 14.427 -10.523 1.00 34.42 H new ATOM 0 HD22 LEU A 121 6.805 13.557 -10.554 1.00 34.42 H new ATOM 0 HD23 LEU A 121 6.926 15.188 -11.257 1.00 34.42 H new ATOM 1897 N ARG A 122 6.234 16.733 -6.105 1.00 70.51 N ATOM 1898 CA ARG A 122 6.619 16.521 -4.716 1.00 51.52 C ATOM 1899 C ARG A 122 5.568 17.108 -3.788 1.00 32.20 C ATOM 1900 O ARG A 122 5.119 16.444 -2.868 1.00 55.52 O ATOM 1901 CB ARG A 122 8.002 17.132 -4.432 1.00 22.13 C ATOM 1902 CG ARG A 122 8.560 16.831 -3.044 1.00 14.34 C ATOM 1903 CD ARG A 122 8.119 17.852 -2.011 1.00 23.34 C ATOM 1904 NE ARG A 122 8.876 19.100 -2.095 1.00 15.43 N ATOM 1905 CZ ARG A 122 9.009 19.958 -1.083 1.00 12.12 C ATOM 1906 NH1 ARG A 122 8.433 19.710 0.087 1.00 14.24 N ATOM 1907 NH2 ARG A 122 9.717 21.070 -1.242 1.00 63.01 N ATOM 0 H ARG A 122 6.837 17.376 -6.618 1.00 70.51 H new ATOM 0 HA ARG A 122 6.685 15.448 -4.533 1.00 51.52 H new ATOM 0 HB2 ARG A 122 8.706 16.766 -5.179 1.00 22.13 H new ATOM 0 HB3 ARG A 122 7.939 18.213 -4.557 1.00 22.13 H new ATOM 0 HG2 ARG A 122 8.235 15.838 -2.732 1.00 14.34 H new ATOM 0 HG3 ARG A 122 9.649 16.811 -3.089 1.00 14.34 H new ATOM 0 HD2 ARG A 122 7.059 18.065 -2.146 1.00 23.34 H new ATOM 0 HD3 ARG A 122 8.235 17.428 -1.014 1.00 23.34 H new ATOM 0 HE ARG A 122 9.329 19.328 -2.980 1.00 15.43 H new ATOM 0 HH11 ARG A 122 7.885 18.859 0.216 1.00 14.24 H new ATOM 0 HH12 ARG A 122 8.538 20.370 0.857 1.00 14.24 H new ATOM 0 HH21 ARG A 122 10.160 21.269 -2.139 1.00 63.01 H new ATOM 0 HH22 ARG A 122 9.818 21.726 -0.467 1.00 63.01 H new ATOM 1921 N ASP A 123 5.166 18.346 -4.052 1.00 13.34 N ATOM 1922 CA ASP A 123 4.155 19.014 -3.236 1.00 40.53 C ATOM 1923 C ASP A 123 2.813 18.299 -3.357 1.00 11.51 C ATOM 1924 O ASP A 123 2.021 18.276 -2.417 1.00 31.31 O ATOM 1925 CB ASP A 123 4.027 20.481 -3.660 1.00 71.15 C ATOM 1926 CG ASP A 123 2.958 21.239 -2.902 1.00 61.43 C ATOM 1927 OD1 ASP A 123 3.205 21.620 -1.737 1.00 24.12 O ATOM 1928 OD2 ASP A 123 1.877 21.478 -3.475 1.00 73.02 O ATOM 0 H ASP A 123 5.524 18.909 -4.824 1.00 13.34 H new ATOM 0 HA ASP A 123 4.465 18.978 -2.192 1.00 40.53 H new ATOM 0 HB2 ASP A 123 4.986 20.978 -3.514 1.00 71.15 H new ATOM 0 HB3 ASP A 123 3.805 20.524 -4.726 1.00 71.15 H new ATOM 1933 N TYR A 124 2.581 17.683 -4.512 1.00 70.31 N ATOM 1934 CA TYR A 124 1.356 16.950 -4.743 1.00 71.25 C ATOM 1935 C TYR A 124 1.366 15.575 -4.053 1.00 22.05 C ATOM 1936 O TYR A 124 0.477 15.262 -3.269 1.00 24.35 O ATOM 1937 CB TYR A 124 1.135 16.790 -6.239 1.00 71.53 C ATOM 1938 CG TYR A 124 -0.073 15.965 -6.556 1.00 54.35 C ATOM 1939 CD1 TYR A 124 -1.341 16.497 -6.406 1.00 44.24 C ATOM 1940 CD2 TYR A 124 0.051 14.648 -6.966 1.00 55.53 C ATOM 1941 CE1 TYR A 124 -2.462 15.746 -6.663 1.00 3.51 C ATOM 1942 CE2 TYR A 124 -1.068 13.883 -7.220 1.00 3.34 C ATOM 1943 CZ TYR A 124 -2.323 14.442 -7.067 1.00 70.52 C ATOM 1944 OH TYR A 124 -3.446 13.695 -7.310 1.00 22.23 O ATOM 0 H TYR A 124 3.230 17.681 -5.299 1.00 70.31 H new ATOM 0 HA TYR A 124 0.535 17.520 -4.308 1.00 71.25 H new ATOM 0 HB2 TYR A 124 1.028 17.775 -6.694 1.00 71.53 H new ATOM 0 HB3 TYR A 124 2.015 16.326 -6.685 1.00 71.53 H new ATOM 0 HD1 TYR A 124 -1.452 17.521 -6.081 1.00 44.24 H new ATOM 0 HD2 TYR A 124 1.033 14.216 -7.088 1.00 55.53 H new ATOM 0 HE1 TYR A 124 -3.445 16.178 -6.548 1.00 3.51 H new ATOM 0 HE2 TYR A 124 -0.965 12.855 -7.536 1.00 3.34 H new ATOM 0 HH TYR A 124 -3.224 12.742 -7.252 1.00 22.23 H new ATOM 1954 N PHE A 125 2.359 14.753 -4.367 1.00 51.53 N ATOM 1955 CA PHE A 125 2.442 13.396 -3.829 1.00 0.41 C ATOM 1956 C PHE A 125 2.707 13.381 -2.318 1.00 33.41 C ATOM 1957 O PHE A 125 2.380 12.410 -1.640 1.00 54.45 O ATOM 1958 CB PHE A 125 3.519 12.592 -4.568 1.00 45.10 C ATOM 1959 CG PHE A 125 3.130 12.154 -5.959 1.00 33.40 C ATOM 1960 CD1 PHE A 125 2.070 11.279 -6.167 1.00 45.23 C ATOM 1961 CD2 PHE A 125 3.832 12.614 -7.058 1.00 70.31 C ATOM 1962 CE1 PHE A 125 1.726 10.875 -7.449 1.00 3.50 C ATOM 1963 CE2 PHE A 125 3.490 12.215 -8.336 1.00 34.41 C ATOM 1964 CZ PHE A 125 2.438 11.345 -8.531 1.00 34.20 C ATOM 0 H PHE A 125 3.123 15.002 -4.995 1.00 51.53 H new ATOM 0 HA PHE A 125 1.471 12.928 -3.989 1.00 0.41 H new ATOM 0 HB2 PHE A 125 4.425 13.195 -4.631 1.00 45.10 H new ATOM 0 HB3 PHE A 125 3.764 11.709 -3.978 1.00 45.10 H new ATOM 0 HD1 PHE A 125 1.508 10.910 -5.322 1.00 45.23 H new ATOM 0 HD2 PHE A 125 4.659 13.294 -6.916 1.00 70.31 H new ATOM 0 HE1 PHE A 125 0.902 10.193 -7.599 1.00 3.50 H new ATOM 0 HE2 PHE A 125 4.048 12.585 -9.184 1.00 34.41 H new ATOM 0 HZ PHE A 125 2.173 11.033 -9.530 1.00 34.20 H new ATOM 1974 N GLU A 126 3.260 14.472 -1.790 1.00 41.53 N ATOM 1975 CA GLU A 126 3.584 14.546 -0.362 1.00 23.04 C ATOM 1976 C GLU A 126 2.324 14.594 0.496 1.00 3.32 C ATOM 1977 O GLU A 126 2.373 14.316 1.694 1.00 62.01 O ATOM 1978 CB GLU A 126 4.454 15.756 -0.037 1.00 50.11 C ATOM 1979 CG GLU A 126 5.872 15.390 0.361 1.00 24.53 C ATOM 1980 CD GLU A 126 6.502 16.418 1.274 1.00 50.24 C ATOM 1981 OE1 GLU A 126 6.981 17.455 0.780 1.00 20.41 O ATOM 1982 OE2 GLU A 126 6.530 16.190 2.501 1.00 73.44 O ATOM 0 H GLU A 126 3.492 15.311 -2.322 1.00 41.53 H new ATOM 0 HA GLU A 126 4.142 13.639 -0.130 1.00 23.04 H new ATOM 0 HB2 GLU A 126 4.487 16.414 -0.905 1.00 50.11 H new ATOM 0 HB3 GLU A 126 3.991 16.320 0.773 1.00 50.11 H new ATOM 0 HG2 GLU A 126 5.867 14.421 0.860 1.00 24.53 H new ATOM 0 HG3 GLU A 126 6.482 15.284 -0.536 1.00 24.53 H new ATOM 1989 N GLN A 127 1.205 14.972 -0.117 1.00 31.42 N ATOM 1990 CA GLN A 127 -0.098 14.930 0.550 1.00 64.41 C ATOM 1991 C GLN A 127 -0.412 13.518 1.051 1.00 45.34 C ATOM 1992 O GLN A 127 -1.101 13.341 2.052 1.00 63.14 O ATOM 1993 CB GLN A 127 -1.207 15.383 -0.405 1.00 3.55 C ATOM 1994 CG GLN A 127 -1.004 16.773 -0.998 1.00 72.21 C ATOM 1995 CD GLN A 127 -2.117 17.154 -1.953 1.00 41.32 C ATOM 1996 OE1 GLN A 127 -3.118 17.759 -1.568 1.00 43.31 O ATOM 1997 NE2 GLN A 127 -1.956 16.789 -3.210 1.00 42.20 N ATOM 0 H GLN A 127 1.173 15.312 -1.078 1.00 31.42 H new ATOM 0 HA GLN A 127 -0.054 15.608 1.402 1.00 64.41 H new ATOM 0 HB2 GLN A 127 -1.284 14.662 -1.219 1.00 3.55 H new ATOM 0 HB3 GLN A 127 -2.158 15.365 0.128 1.00 3.55 H new ATOM 0 HG2 GLN A 127 -0.951 17.506 -0.193 1.00 72.21 H new ATOM 0 HG3 GLN A 127 -0.049 16.807 -1.523 1.00 72.21 H new ATOM 0 HE21 GLN A 127 -1.113 16.289 -3.492 1.00 42.20 H new ATOM 0 HE22 GLN A 127 -2.675 17.007 -3.900 1.00 42.20 H new ATOM 2006 N TYR A 128 0.110 12.522 0.344 1.00 5.44 N ATOM 2007 CA TYR A 128 -0.125 11.125 0.676 1.00 43.01 C ATOM 2008 C TYR A 128 0.867 10.620 1.726 1.00 24.14 C ATOM 2009 O TYR A 128 0.545 9.738 2.523 1.00 3.30 O ATOM 2010 CB TYR A 128 -0.026 10.272 -0.585 1.00 41.33 C ATOM 2011 CG TYR A 128 -1.009 10.662 -1.669 1.00 13.20 C ATOM 2012 CD1 TYR A 128 -2.290 10.127 -1.697 1.00 21.23 C ATOM 2013 CD2 TYR A 128 -0.647 11.549 -2.679 1.00 70.13 C ATOM 2014 CE1 TYR A 128 -3.180 10.459 -2.700 1.00 61.52 C ATOM 2015 CE2 TYR A 128 -1.535 11.891 -3.680 1.00 64.12 C ATOM 2016 CZ TYR A 128 -2.797 11.341 -3.688 1.00 73.14 C ATOM 2017 OH TYR A 128 -3.677 11.666 -4.695 1.00 64.21 O ATOM 0 H TYR A 128 0.706 12.661 -0.472 1.00 5.44 H new ATOM 0 HA TYR A 128 -1.127 11.044 1.098 1.00 43.01 H new ATOM 0 HB2 TYR A 128 0.986 10.345 -0.983 1.00 41.33 H new ATOM 0 HB3 TYR A 128 -0.189 9.228 -0.319 1.00 41.33 H new ATOM 0 HD1 TYR A 128 -2.596 9.440 -0.922 1.00 21.23 H new ATOM 0 HD2 TYR A 128 0.345 11.977 -2.680 1.00 70.13 H new ATOM 0 HE1 TYR A 128 -4.171 10.030 -2.710 1.00 61.52 H new ATOM 0 HE2 TYR A 128 -1.241 12.586 -4.452 1.00 64.12 H new ATOM 0 HH TYR A 128 -3.490 12.574 -5.012 1.00 64.21 H new ATOM 2027 N GLY A 129 2.072 11.174 1.716 1.00 73.30 N ATOM 2028 CA GLY A 129 3.084 10.763 2.673 1.00 14.31 C ATOM 2029 C GLY A 129 4.443 11.366 2.390 1.00 14.52 C ATOM 2030 O GLY A 129 4.577 12.221 1.516 1.00 73.31 O ATOM 0 H GLY A 129 2.368 11.900 1.064 1.00 73.30 H new ATOM 0 HA2 GLY A 129 2.767 11.050 3.675 1.00 14.31 H new ATOM 0 HA3 GLY A 129 3.165 9.676 2.664 1.00 14.31 H new ATOM 2034 N LYS A 130 5.453 10.914 3.125 1.00 23.32 N ATOM 2035 CA LYS A 130 6.802 11.450 2.995 1.00 31.22 C ATOM 2036 C LYS A 130 7.497 10.929 1.741 1.00 11.42 C ATOM 2037 O LYS A 130 7.443 9.738 1.430 1.00 35.40 O ATOM 2038 CB LYS A 130 7.640 11.095 4.228 1.00 73.13 C ATOM 2039 CG LYS A 130 9.093 11.515 4.104 1.00 50.23 C ATOM 2040 CD LYS A 130 9.936 11.034 5.267 1.00 44.41 C ATOM 2041 CE LYS A 130 11.370 11.516 5.128 1.00 0.55 C ATOM 2042 NZ LYS A 130 11.455 13.002 5.083 1.00 30.51 N ATOM 0 H LYS A 130 5.361 10.174 3.821 1.00 23.32 H new ATOM 0 HA LYS A 130 6.714 12.533 2.912 1.00 31.22 H new ATOM 0 HB2 LYS A 130 7.204 11.573 5.105 1.00 73.13 H new ATOM 0 HB3 LYS A 130 7.592 10.019 4.394 1.00 73.13 H new ATOM 0 HG2 LYS A 130 9.504 11.121 3.174 1.00 50.23 H new ATOM 0 HG3 LYS A 130 9.150 12.602 4.043 1.00 50.23 H new ATOM 0 HD2 LYS A 130 9.514 11.399 6.204 1.00 44.41 H new ATOM 0 HD3 LYS A 130 9.916 9.945 5.311 1.00 44.41 H new ATOM 0 HE2 LYS A 130 11.961 11.144 5.965 1.00 0.55 H new ATOM 0 HE3 LYS A 130 11.806 11.100 4.220 1.00 0.55 H new ATOM 0 HZ1 LYS A 130 12.432 13.300 5.277 1.00 30.51 H new ATOM 0 HZ2 LYS A 130 11.171 13.338 4.140 1.00 30.51 H new ATOM 0 HZ3 LYS A 130 10.821 13.408 5.800 1.00 30.51 H new ATOM 2056 N ILE A 131 8.162 11.835 1.043 1.00 21.10 N ATOM 2057 CA ILE A 131 8.942 11.492 -0.130 1.00 34.45 C ATOM 2058 C ILE A 131 10.436 11.561 0.196 1.00 21.02 C ATOM 2059 O ILE A 131 10.886 12.470 0.894 1.00 13.23 O ATOM 2060 CB ILE A 131 8.609 12.444 -1.301 1.00 4.04 C ATOM 2061 CG1 ILE A 131 7.134 12.309 -1.687 1.00 65.44 C ATOM 2062 CG2 ILE A 131 9.502 12.158 -2.498 1.00 54.51 C ATOM 2063 CD1 ILE A 131 6.681 13.306 -2.731 1.00 22.43 C ATOM 0 H ILE A 131 8.175 12.828 1.275 1.00 21.10 H new ATOM 0 HA ILE A 131 8.690 10.475 -0.430 1.00 34.45 H new ATOM 0 HB ILE A 131 8.794 13.468 -0.978 1.00 4.04 H new ATOM 0 HG12 ILE A 131 6.957 11.300 -2.061 1.00 65.44 H new ATOM 0 HG13 ILE A 131 6.522 12.430 -0.793 1.00 65.44 H new ATOM 0 HG21 ILE A 131 9.250 12.839 -3.311 1.00 54.51 H new ATOM 0 HG22 ILE A 131 10.545 12.299 -2.216 1.00 54.51 H new ATOM 0 HG23 ILE A 131 9.351 11.130 -2.827 1.00 54.51 H new ATOM 0 HD11 ILE A 131 5.625 13.147 -2.952 1.00 22.43 H new ATOM 0 HD12 ILE A 131 6.825 14.318 -2.354 1.00 22.43 H new ATOM 0 HD13 ILE A 131 7.266 13.172 -3.641 1.00 22.43 H new ATOM 2075 N GLU A 132 11.193 10.589 -0.300 1.00 45.31 N ATOM 2076 CA GLU A 132 12.629 10.532 -0.048 1.00 54.55 C ATOM 2077 C GLU A 132 13.404 11.299 -1.117 1.00 65.20 C ATOM 2078 O GLU A 132 14.304 12.079 -0.804 1.00 22.14 O ATOM 2079 CB GLU A 132 13.122 9.086 0.003 1.00 74.24 C ATOM 2080 CG GLU A 132 12.412 8.228 1.034 1.00 14.11 C ATOM 2081 CD GLU A 132 13.193 6.978 1.373 1.00 21.31 C ATOM 2082 OE1 GLU A 132 13.049 5.964 0.662 1.00 44.03 O ATOM 2083 OE2 GLU A 132 13.968 7.008 2.350 1.00 41.02 O ATOM 0 H GLU A 132 10.836 9.829 -0.879 1.00 45.31 H new ATOM 0 HA GLU A 132 12.807 10.999 0.921 1.00 54.55 H new ATOM 0 HB2 GLU A 132 12.994 8.634 -0.981 1.00 74.24 H new ATOM 0 HB3 GLU A 132 14.191 9.085 0.218 1.00 74.24 H new ATOM 0 HG2 GLU A 132 12.251 8.811 1.941 1.00 14.11 H new ATOM 0 HG3 GLU A 132 11.428 7.949 0.656 1.00 14.11 H new ATOM 2090 N VAL A 133 13.063 11.064 -2.379 1.00 12.40 N ATOM 2091 CA VAL A 133 13.726 11.744 -3.485 1.00 34.51 C ATOM 2092 C VAL A 133 12.819 11.763 -4.718 1.00 75.11 C ATOM 2093 O VAL A 133 11.930 10.920 -4.862 1.00 11.32 O ATOM 2094 CB VAL A 133 15.094 11.085 -3.826 1.00 63.41 C ATOM 2095 CG1 VAL A 133 14.923 9.806 -4.630 1.00 34.44 C ATOM 2096 CG2 VAL A 133 16.008 12.061 -4.555 1.00 2.31 C ATOM 0 H VAL A 133 12.333 10.410 -2.661 1.00 12.40 H new ATOM 0 HA VAL A 133 13.923 12.770 -3.174 1.00 34.51 H new ATOM 0 HB VAL A 133 15.564 10.817 -2.880 1.00 63.41 H new ATOM 0 HG11 VAL A 133 15.902 9.379 -4.847 1.00 34.44 H new ATOM 0 HG12 VAL A 133 14.334 9.091 -4.055 1.00 34.44 H new ATOM 0 HG13 VAL A 133 14.410 10.030 -5.565 1.00 34.44 H new ATOM 0 HG21 VAL A 133 16.956 11.573 -4.780 1.00 2.31 H new ATOM 0 HG22 VAL A 133 15.534 12.379 -5.484 1.00 2.31 H new ATOM 0 HG23 VAL A 133 16.189 12.931 -3.924 1.00 2.31 H new ATOM 2106 N ILE A 134 13.032 12.737 -5.588 1.00 12.54 N ATOM 2107 CA ILE A 134 12.248 12.871 -6.801 1.00 54.02 C ATOM 2108 C ILE A 134 13.130 12.651 -8.018 1.00 73.51 C ATOM 2109 O ILE A 134 14.206 13.242 -8.141 1.00 63.43 O ATOM 2110 CB ILE A 134 11.554 14.257 -6.897 1.00 54.12 C ATOM 2111 CG1 ILE A 134 10.373 14.343 -5.929 1.00 34.11 C ATOM 2112 CG2 ILE A 134 11.080 14.550 -8.314 1.00 2.15 C ATOM 2113 CD1 ILE A 134 10.758 14.686 -4.510 1.00 51.43 C ATOM 0 H ILE A 134 13.750 13.453 -5.473 1.00 12.54 H new ATOM 0 HA ILE A 134 11.467 12.112 -6.770 1.00 54.02 H new ATOM 0 HB ILE A 134 12.296 15.007 -6.622 1.00 54.12 H new ATOM 0 HG12 ILE A 134 9.672 15.093 -6.295 1.00 34.11 H new ATOM 0 HG13 ILE A 134 9.847 13.388 -5.930 1.00 34.11 H new ATOM 0 HG21 ILE A 134 10.600 15.528 -8.342 1.00 2.15 H new ATOM 0 HG22 ILE A 134 11.934 14.546 -8.992 1.00 2.15 H new ATOM 0 HG23 ILE A 134 10.367 13.786 -8.624 1.00 2.15 H new ATOM 0 HD11 ILE A 134 9.863 14.727 -3.890 1.00 51.43 H new ATOM 0 HD12 ILE A 134 11.434 13.924 -4.122 1.00 51.43 H new ATOM 0 HD13 ILE A 134 11.256 15.655 -4.492 1.00 51.43 H new ATOM 2125 N GLU A 135 12.681 11.772 -8.888 1.00 62.51 N ATOM 2126 CA GLU A 135 13.387 11.469 -10.111 1.00 0.10 C ATOM 2127 C GLU A 135 12.731 12.153 -11.306 1.00 70.32 C ATOM 2128 O GLU A 135 11.686 11.728 -11.786 1.00 12.53 O ATOM 2129 CB GLU A 135 13.384 9.958 -10.292 1.00 12.13 C ATOM 2130 CG GLU A 135 14.285 9.240 -9.312 1.00 44.21 C ATOM 2131 CD GLU A 135 13.859 7.810 -9.086 1.00 53.43 C ATOM 2132 OE1 GLU A 135 14.295 6.926 -9.851 1.00 33.53 O ATOM 2133 OE2 GLU A 135 13.080 7.559 -8.147 1.00 61.30 O ATOM 0 H GLU A 135 11.815 11.247 -8.766 1.00 62.51 H new ATOM 0 HA GLU A 135 14.410 11.841 -10.049 1.00 0.10 H new ATOM 0 HB2 GLU A 135 12.365 9.587 -10.179 1.00 12.13 H new ATOM 0 HB3 GLU A 135 13.699 9.719 -11.308 1.00 12.13 H new ATOM 0 HG2 GLU A 135 15.310 9.257 -9.684 1.00 44.21 H new ATOM 0 HG3 GLU A 135 14.282 9.773 -8.361 1.00 44.21 H new ATOM 2140 N ILE A 136 13.351 13.212 -11.786 1.00 70.31 N ATOM 2141 CA ILE A 136 12.861 13.904 -12.966 1.00 63.21 C ATOM 2142 C ILE A 136 13.531 13.326 -14.200 1.00 15.33 C ATOM 2143 O ILE A 136 14.758 13.308 -14.291 1.00 23.13 O ATOM 2144 CB ILE A 136 13.138 15.424 -12.899 1.00 55.21 C ATOM 2145 CG1 ILE A 136 12.550 16.039 -11.618 1.00 52.02 C ATOM 2146 CG2 ILE A 136 12.579 16.119 -14.132 1.00 5.34 C ATOM 2147 CD1 ILE A 136 11.035 16.043 -11.561 1.00 2.33 C ATOM 0 H ILE A 136 14.195 13.614 -11.379 1.00 70.31 H new ATOM 0 HA ILE A 136 11.781 13.762 -13.014 1.00 63.21 H new ATOM 0 HB ILE A 136 14.218 15.571 -12.875 1.00 55.21 H new ATOM 0 HG12 ILE A 136 12.932 15.489 -10.758 1.00 52.02 H new ATOM 0 HG13 ILE A 136 12.907 17.065 -11.525 1.00 52.02 H new ATOM 0 HG21 ILE A 136 12.782 17.188 -14.070 1.00 5.34 H new ATOM 0 HG22 ILE A 136 13.052 15.711 -15.025 1.00 5.34 H new ATOM 0 HG23 ILE A 136 11.503 15.956 -14.185 1.00 5.34 H new ATOM 0 HD11 ILE A 136 10.707 16.494 -10.624 1.00 2.33 H new ATOM 0 HD12 ILE A 136 10.641 16.619 -12.399 1.00 2.33 H new ATOM 0 HD13 ILE A 136 10.666 15.019 -11.619 1.00 2.33 H new ATOM 2159 N MET A 137 12.742 12.843 -15.144 1.00 35.44 N ATOM 2160 CA MET A 137 13.295 12.204 -16.324 1.00 30.14 C ATOM 2161 C MET A 137 13.165 13.123 -17.528 1.00 65.23 C ATOM 2162 O MET A 137 12.170 13.836 -17.676 1.00 72.02 O ATOM 2163 CB MET A 137 12.581 10.876 -16.602 1.00 34.24 C ATOM 2164 CG MET A 137 12.373 10.004 -15.368 1.00 43.31 C ATOM 2165 SD MET A 137 13.905 9.590 -14.511 1.00 50.20 S ATOM 2166 CE MET A 137 14.710 8.554 -15.728 1.00 54.51 C ATOM 0 H MET A 137 11.723 12.881 -15.117 1.00 35.44 H new ATOM 0 HA MET A 137 14.351 12.002 -16.142 1.00 30.14 H new ATOM 0 HB2 MET A 137 11.611 11.086 -17.052 1.00 34.24 H new ATOM 0 HB3 MET A 137 13.158 10.314 -17.337 1.00 34.24 H new ATOM 0 HG2 MET A 137 11.708 10.520 -14.676 1.00 43.31 H new ATOM 0 HG3 MET A 137 11.872 9.083 -15.665 1.00 43.31 H new ATOM 0 HE1 MET A 137 15.572 8.063 -15.275 1.00 54.51 H new ATOM 0 HE2 MET A 137 14.009 7.800 -16.085 1.00 54.51 H new ATOM 0 HE3 MET A 137 15.041 9.167 -16.566 1.00 54.51 H new ATOM 2176 N THR A 138 14.179 13.125 -18.373 1.00 42.44 N ATOM 2177 CA THR A 138 14.157 13.914 -19.588 1.00 52.25 C ATOM 2178 C THR A 138 14.017 13.020 -20.813 1.00 34.15 C ATOM 2179 O THR A 138 14.450 11.867 -20.801 1.00 24.41 O ATOM 2180 CB THR A 138 15.431 14.769 -19.724 1.00 74.05 C ATOM 2181 OG1 THR A 138 16.540 14.105 -19.101 1.00 11.40 O ATOM 2182 CG2 THR A 138 15.239 16.140 -19.098 1.00 40.34 C ATOM 0 H THR A 138 15.033 12.585 -18.238 1.00 42.44 H new ATOM 0 HA THR A 138 13.294 14.577 -19.526 1.00 52.25 H new ATOM 0 HB THR A 138 15.636 14.900 -20.786 1.00 74.05 H new ATOM 0 HG1 THR A 138 17.345 14.656 -19.194 1.00 11.40 H new ATOM 0 HG21 THR A 138 16.154 16.722 -19.209 1.00 40.34 H new ATOM 0 HG22 THR A 138 14.418 16.656 -19.597 1.00 40.34 H new ATOM 0 HG23 THR A 138 15.007 16.027 -18.039 1.00 40.34 H new ATOM 2319 N GLY A 147 7.425 13.644 -20.896 1.00 74.51 N ATOM 2320 CA GLY A 147 7.106 12.263 -21.181 1.00 52.41 C ATOM 2321 C GLY A 147 6.802 11.441 -19.952 1.00 72.35 C ATOM 2322 O GLY A 147 5.781 10.747 -19.924 1.00 35.14 O ATOM 0 HA2 GLY A 147 6.247 12.229 -21.851 1.00 52.41 H new ATOM 0 HA3 GLY A 147 7.942 11.809 -21.712 1.00 52.41 H new ATOM 2326 N PHE A 148 7.631 11.540 -18.909 1.00 3.52 N ATOM 2327 CA PHE A 148 7.378 10.831 -17.661 1.00 45.01 C ATOM 2328 C PHE A 148 8.382 11.256 -16.591 1.00 75.45 C ATOM 2329 O PHE A 148 9.447 11.794 -16.898 1.00 74.12 O ATOM 2330 CB PHE A 148 7.439 9.301 -17.858 1.00 0.34 C ATOM 2331 CG PHE A 148 8.735 8.785 -18.435 1.00 1.53 C ATOM 2332 CD1 PHE A 148 8.935 8.747 -19.807 1.00 13.42 C ATOM 2333 CD2 PHE A 148 9.748 8.332 -17.604 1.00 41.23 C ATOM 2334 CE1 PHE A 148 10.118 8.271 -20.338 1.00 43.43 C ATOM 2335 CE2 PHE A 148 10.932 7.854 -18.130 1.00 23.44 C ATOM 2336 CZ PHE A 148 11.119 7.825 -19.498 1.00 72.15 C ATOM 0 H PHE A 148 8.481 12.104 -18.908 1.00 3.52 H new ATOM 0 HA PHE A 148 6.372 11.093 -17.333 1.00 45.01 H new ATOM 0 HB2 PHE A 148 7.269 8.818 -16.895 1.00 0.34 H new ATOM 0 HB3 PHE A 148 6.621 9.001 -18.514 1.00 0.34 H new ATOM 0 HD1 PHE A 148 8.155 9.094 -20.469 1.00 13.42 H new ATOM 0 HD2 PHE A 148 9.610 8.353 -16.533 1.00 41.23 H new ATOM 0 HE1 PHE A 148 10.260 8.248 -21.408 1.00 43.43 H new ATOM 0 HE2 PHE A 148 11.712 7.503 -17.471 1.00 23.44 H new ATOM 0 HZ PHE A 148 12.046 7.454 -19.910 1.00 72.15 H new ATOM 2346 N ALA A 149 8.017 11.018 -15.344 1.00 61.03 N ATOM 2347 CA ALA A 149 8.863 11.282 -14.198 1.00 22.00 C ATOM 2348 C ALA A 149 8.664 10.177 -13.162 1.00 30.15 C ATOM 2349 O ALA A 149 7.819 9.295 -13.339 1.00 31.13 O ATOM 2350 CB ALA A 149 8.545 12.650 -13.598 1.00 11.23 C ATOM 0 H ALA A 149 7.107 10.629 -15.097 1.00 61.03 H new ATOM 0 HA ALA A 149 9.906 11.293 -14.515 1.00 22.00 H new ATOM 0 HB1 ALA A 149 9.191 12.829 -12.739 1.00 11.23 H new ATOM 0 HB2 ALA A 149 8.714 13.424 -14.347 1.00 11.23 H new ATOM 0 HB3 ALA A 149 7.503 12.674 -13.280 1.00 11.23 H new ATOM 2356 N PHE A 150 9.434 10.228 -12.092 1.00 62.30 N ATOM 2357 CA PHE A 150 9.374 9.219 -11.047 1.00 12.42 C ATOM 2358 C PHE A 150 9.523 9.867 -9.677 1.00 2.24 C ATOM 2359 O PHE A 150 10.086 10.950 -9.549 1.00 43.21 O ATOM 2360 CB PHE A 150 10.467 8.163 -11.252 1.00 33.14 C ATOM 2361 CG PHE A 150 10.160 7.157 -12.325 1.00 61.43 C ATOM 2362 CD1 PHE A 150 9.397 6.037 -12.046 1.00 13.52 C ATOM 2363 CD2 PHE A 150 10.641 7.334 -13.612 1.00 63.22 C ATOM 2364 CE1 PHE A 150 9.116 5.111 -13.032 1.00 13.53 C ATOM 2365 CE2 PHE A 150 10.363 6.413 -14.601 1.00 11.04 C ATOM 2366 CZ PHE A 150 9.599 5.301 -14.311 1.00 41.51 C ATOM 0 H PHE A 150 10.117 10.966 -11.921 1.00 62.30 H new ATOM 0 HA PHE A 150 8.403 8.728 -11.101 1.00 12.42 H new ATOM 0 HB2 PHE A 150 11.401 8.667 -11.499 1.00 33.14 H new ATOM 0 HB3 PHE A 150 10.628 7.636 -10.311 1.00 33.14 H new ATOM 0 HD1 PHE A 150 9.017 5.885 -11.047 1.00 13.52 H new ATOM 0 HD2 PHE A 150 11.240 8.202 -13.844 1.00 63.22 H new ATOM 0 HE1 PHE A 150 8.520 4.240 -12.803 1.00 13.53 H new ATOM 0 HE2 PHE A 150 10.743 6.562 -15.601 1.00 11.04 H new ATOM 0 HZ PHE A 150 9.379 4.580 -15.084 1.00 41.51 H new ATOM 2376 N VAL A 151 8.990 9.219 -8.661 1.00 13.33 N ATOM 2377 CA VAL A 151 9.093 9.732 -7.302 1.00 12.11 C ATOM 2378 C VAL A 151 9.212 8.592 -6.285 1.00 12.34 C ATOM 2379 O VAL A 151 8.467 7.609 -6.333 1.00 71.25 O ATOM 2380 CB VAL A 151 7.898 10.668 -6.965 1.00 21.35 C ATOM 2381 CG1 VAL A 151 6.568 10.009 -7.279 1.00 1.10 C ATOM 2382 CG2 VAL A 151 7.934 11.114 -5.515 1.00 1.12 C ATOM 0 H VAL A 151 8.482 8.339 -8.746 1.00 13.33 H new ATOM 0 HA VAL A 151 10.006 10.324 -7.239 1.00 12.11 H new ATOM 0 HB VAL A 151 7.998 11.550 -7.597 1.00 21.35 H new ATOM 0 HG11 VAL A 151 5.756 10.692 -7.031 1.00 1.10 H new ATOM 0 HG12 VAL A 151 6.525 9.764 -8.340 1.00 1.10 H new ATOM 0 HG13 VAL A 151 6.467 9.096 -6.692 1.00 1.10 H new ATOM 0 HG21 VAL A 151 7.085 11.767 -5.314 1.00 1.12 H new ATOM 0 HG22 VAL A 151 7.883 10.241 -4.864 1.00 1.12 H new ATOM 0 HG23 VAL A 151 8.861 11.655 -5.324 1.00 1.12 H new ATOM 2392 N THR A 152 10.179 8.732 -5.384 1.00 50.14 N ATOM 2393 CA THR A 152 10.475 7.721 -4.380 1.00 32.14 C ATOM 2394 C THR A 152 9.888 8.113 -3.021 1.00 63.15 C ATOM 2395 O THR A 152 10.160 9.196 -2.512 1.00 75.21 O ATOM 2396 CB THR A 152 12.004 7.544 -4.242 1.00 73.31 C ATOM 2397 OG1 THR A 152 12.548 6.950 -5.429 1.00 5.14 O ATOM 2398 CG2 THR A 152 12.363 6.694 -3.034 1.00 41.43 C ATOM 0 H THR A 152 10.781 9.554 -5.331 1.00 50.14 H new ATOM 0 HA THR A 152 10.023 6.783 -4.702 1.00 32.14 H new ATOM 0 HB THR A 152 12.436 8.535 -4.101 1.00 73.31 H new ATOM 0 HG1 THR A 152 12.471 7.581 -6.175 1.00 5.14 H new ATOM 0 HG21 THR A 152 13.446 6.592 -2.970 1.00 41.43 H new ATOM 0 HG22 THR A 152 11.990 7.172 -2.129 1.00 41.43 H new ATOM 0 HG23 THR A 152 11.911 5.707 -3.136 1.00 41.43 H new ATOM 2406 N PHE A 153 9.110 7.216 -2.431 1.00 22.21 N ATOM 2407 CA PHE A 153 8.458 7.475 -1.152 1.00 20.20 C ATOM 2408 C PHE A 153 9.195 6.798 -0.004 1.00 71.13 C ATOM 2409 O PHE A 153 9.928 5.830 -0.207 1.00 51.44 O ATOM 2410 CB PHE A 153 7.020 6.970 -1.184 1.00 51.22 C ATOM 2411 CG PHE A 153 6.022 8.022 -1.547 1.00 54.54 C ATOM 2412 CD1 PHE A 153 5.808 8.374 -2.869 1.00 13.21 C ATOM 2413 CD2 PHE A 153 5.291 8.654 -0.560 1.00 71.42 C ATOM 2414 CE1 PHE A 153 4.879 9.339 -3.194 1.00 52.32 C ATOM 2415 CE2 PHE A 153 4.365 9.619 -0.877 1.00 24.34 C ATOM 2416 CZ PHE A 153 4.156 9.961 -2.194 1.00 12.41 C ATOM 0 H PHE A 153 8.913 6.294 -2.821 1.00 22.21 H new ATOM 0 HA PHE A 153 8.472 8.553 -0.989 1.00 20.20 H new ATOM 0 HB2 PHE A 153 6.948 6.151 -1.899 1.00 51.22 H new ATOM 0 HB3 PHE A 153 6.766 6.562 -0.206 1.00 51.22 H new ATOM 0 HD1 PHE A 153 6.373 7.889 -3.651 1.00 13.21 H new ATOM 0 HD2 PHE A 153 5.449 8.386 0.474 1.00 71.42 H new ATOM 0 HE1 PHE A 153 4.717 9.608 -4.227 1.00 52.32 H new ATOM 0 HE2 PHE A 153 3.803 10.108 -0.095 1.00 24.34 H new ATOM 0 HZ PHE A 153 3.426 10.716 -2.446 1.00 12.41 H new ATOM 2426 N ASP A 154 8.981 7.314 1.199 1.00 31.30 N ATOM 2427 CA ASP A 154 9.560 6.737 2.411 1.00 60.43 C ATOM 2428 C ASP A 154 8.789 5.490 2.832 1.00 12.31 C ATOM 2429 O ASP A 154 9.348 4.561 3.421 1.00 4.40 O ATOM 2430 CB ASP A 154 9.544 7.777 3.540 1.00 14.23 C ATOM 2431 CG ASP A 154 10.081 7.244 4.857 1.00 13.22 C ATOM 2432 OD1 ASP A 154 9.286 6.713 5.661 1.00 53.25 O ATOM 2433 OD2 ASP A 154 11.295 7.370 5.104 1.00 30.20 O ATOM 0 H ASP A 154 8.405 8.139 1.365 1.00 31.30 H new ATOM 0 HA ASP A 154 10.591 6.449 2.205 1.00 60.43 H new ATOM 0 HB2 ASP A 154 10.136 8.641 3.237 1.00 14.23 H new ATOM 0 HB3 ASP A 154 8.522 8.127 3.687 1.00 14.23 H new ATOM 2438 N ASP A 155 7.505 5.465 2.505 1.00 1.53 N ATOM 2439 CA ASP A 155 6.651 4.348 2.872 1.00 2.11 C ATOM 2440 C ASP A 155 5.868 3.844 1.666 1.00 3.42 C ATOM 2441 O ASP A 155 5.632 4.586 0.713 1.00 34.23 O ATOM 2442 CB ASP A 155 5.691 4.753 3.987 1.00 51.13 C ATOM 2443 CG ASP A 155 5.289 3.574 4.843 1.00 11.04 C ATOM 2444 OD1 ASP A 155 4.516 2.723 4.364 1.00 74.40 O ATOM 2445 OD2 ASP A 155 5.769 3.477 5.992 1.00 72.34 O ATOM 0 H ASP A 155 7.033 6.206 1.986 1.00 1.53 H new ATOM 0 HA ASP A 155 7.289 3.540 3.232 1.00 2.11 H new ATOM 0 HB2 ASP A 155 6.161 5.512 4.613 1.00 51.13 H new ATOM 0 HB3 ASP A 155 4.800 5.206 3.552 1.00 51.13 H new ATOM 2450 N HIS A 156 5.462 2.579 1.717 1.00 33.11 N ATOM 2451 CA HIS A 156 4.732 1.961 0.618 1.00 55.23 C ATOM 2452 C HIS A 156 3.247 2.305 0.707 1.00 71.43 C ATOM 2453 O HIS A 156 2.551 2.337 -0.307 1.00 71.25 O ATOM 2454 CB HIS A 156 4.929 0.426 0.614 1.00 73.54 C ATOM 2455 CG HIS A 156 4.308 -0.284 1.790 1.00 73.34 C ATOM 2456 ND1 HIS A 156 4.887 -0.800 2.898 1.00 13.11 N flip ATOM 2457 CD2 HIS A 156 2.952 -0.447 1.884 1.00 63.45 C flip ATOM 2458 CE1 HIS A 156 3.876 -1.278 3.689 1.00 11.42 C flip ATOM 2459 NE2 HIS A 156 2.736 -1.036 3.036 1.00 4.30 N flip ATOM 0 H HIS A 156 5.628 1.961 2.511 1.00 33.11 H new ATOM 0 HA HIS A 156 5.129 2.356 -0.317 1.00 55.23 H new ATOM 0 HB2 HIS A 156 4.506 0.020 -0.305 1.00 73.54 H new ATOM 0 HB3 HIS A 156 5.997 0.209 0.596 1.00 73.54 H new ATOM 0 HD1 HIS A 156 5.885 -0.828 3.105 1.00 13.11 H new ATOM 0 HD2 HIS A 156 2.210 -0.151 1.157 1.00 63.45 H new ATOM 0 HE1 HIS A 156 3.980 -1.757 4.652 1.00 11.42 H new ATOM 2467 N ASP A 157 2.776 2.578 1.928 1.00 30.10 N ATOM 2468 CA ASP A 157 1.353 2.807 2.173 1.00 70.12 C ATOM 2469 C ASP A 157 0.882 4.061 1.461 1.00 51.21 C ATOM 2470 O ASP A 157 -0.225 4.100 0.929 1.00 60.32 O ATOM 2471 CB ASP A 157 1.067 2.908 3.676 1.00 24.30 C ATOM 2472 CG ASP A 157 -0.413 3.075 3.982 1.00 31.20 C ATOM 2473 OD1 ASP A 157 -1.165 2.086 3.890 1.00 42.13 O ATOM 2474 OD2 ASP A 157 -0.830 4.202 4.322 1.00 20.24 O ATOM 0 H ASP A 157 3.361 2.645 2.761 1.00 30.10 H new ATOM 0 HA ASP A 157 0.801 1.955 1.775 1.00 70.12 H new ATOM 0 HB2 ASP A 157 1.438 2.012 4.173 1.00 24.30 H new ATOM 0 HB3 ASP A 157 1.617 3.753 4.090 1.00 24.30 H new ATOM 2479 N SER A 158 1.742 5.075 1.423 1.00 61.24 N ATOM 2480 CA SER A 158 1.439 6.315 0.726 1.00 55.35 C ATOM 2481 C SER A 158 1.398 6.092 -0.785 1.00 42.20 C ATOM 2482 O SER A 158 0.596 6.703 -1.492 1.00 41.20 O ATOM 2483 CB SER A 158 2.482 7.366 1.084 1.00 21.32 C ATOM 2484 OG SER A 158 2.624 7.473 2.493 1.00 12.14 O ATOM 0 H SER A 158 2.659 5.059 1.870 1.00 61.24 H new ATOM 0 HA SER A 158 0.455 6.666 1.038 1.00 55.35 H new ATOM 0 HB2 SER A 158 3.440 7.102 0.636 1.00 21.32 H new ATOM 0 HB3 SER A 158 2.191 8.331 0.669 1.00 21.32 H new ATOM 0 HG SER A 158 3.570 7.598 2.718 1.00 12.14 H new ATOM 2490 N VAL A 159 2.230 5.168 -1.253 1.00 1.14 N ATOM 2491 CA VAL A 159 2.295 4.829 -2.666 1.00 42.34 C ATOM 2492 C VAL A 159 1.017 4.116 -3.084 1.00 62.42 C ATOM 2493 O VAL A 159 0.467 4.372 -4.157 1.00 24.12 O ATOM 2494 CB VAL A 159 3.545 3.953 -2.960 1.00 72.32 C ATOM 2495 CG1 VAL A 159 3.316 2.955 -4.094 1.00 12.32 C ATOM 2496 CG2 VAL A 159 4.725 4.848 -3.279 1.00 42.13 C ATOM 0 H VAL A 159 2.874 4.637 -0.666 1.00 1.14 H new ATOM 0 HA VAL A 159 2.387 5.746 -3.248 1.00 42.34 H new ATOM 0 HB VAL A 159 3.750 3.366 -2.065 1.00 72.32 H new ATOM 0 HG11 VAL A 159 4.223 2.372 -4.254 1.00 12.32 H new ATOM 0 HG12 VAL A 159 2.496 2.287 -3.830 1.00 12.32 H new ATOM 0 HG13 VAL A 159 3.065 3.494 -5.008 1.00 12.32 H new ATOM 0 HG21 VAL A 159 5.602 4.234 -3.485 1.00 42.13 H new ATOM 0 HG22 VAL A 159 4.494 5.457 -4.153 1.00 42.13 H new ATOM 0 HG23 VAL A 159 4.929 5.498 -2.428 1.00 42.13 H new ATOM 2506 N ASP A 160 0.541 3.249 -2.204 1.00 44.13 N ATOM 2507 CA ASP A 160 -0.672 2.503 -2.472 1.00 33.14 C ATOM 2508 C ASP A 160 -1.894 3.414 -2.451 1.00 3.02 C ATOM 2509 O ASP A 160 -2.831 3.201 -3.216 1.00 10.34 O ATOM 2510 CB ASP A 160 -0.858 1.351 -1.505 1.00 72.33 C ATOM 2511 CG ASP A 160 -1.598 0.219 -2.178 1.00 74.40 C ATOM 2512 OD1 ASP A 160 -1.019 -0.388 -3.104 1.00 1.33 O ATOM 2513 OD2 ASP A 160 -2.758 -0.040 -1.817 1.00 44.03 O ATOM 0 H ASP A 160 0.976 3.047 -1.303 1.00 44.13 H new ATOM 0 HA ASP A 160 -0.568 2.082 -3.472 1.00 33.14 H new ATOM 0 HB2 ASP A 160 0.113 1.002 -1.153 1.00 72.33 H new ATOM 0 HB3 ASP A 160 -1.413 1.688 -0.629 1.00 72.33 H new ATOM 2518 N LYS A 161 -1.865 4.446 -1.591 1.00 64.12 N ATOM 2519 CA LYS A 161 -2.909 5.483 -1.584 1.00 35.12 C ATOM 2520 C LYS A 161 -3.075 6.075 -2.978 1.00 31.10 C ATOM 2521 O LYS A 161 -4.181 6.372 -3.432 1.00 41.41 O ATOM 2522 CB LYS A 161 -2.555 6.636 -0.641 1.00 3.24 C ATOM 2523 CG LYS A 161 -2.376 6.268 0.821 1.00 53.44 C ATOM 2524 CD LYS A 161 -1.945 7.494 1.619 1.00 62.01 C ATOM 2525 CE LYS A 161 -1.350 7.131 2.968 1.00 75.14 C ATOM 2526 NZ LYS A 161 -2.372 6.644 3.923 1.00 0.22 N ATOM 0 H LYS A 161 -1.133 4.584 -0.894 1.00 64.12 H new ATOM 0 HA LYS A 161 -3.827 5.001 -1.249 1.00 35.12 H new ATOM 0 HB2 LYS A 161 -1.633 7.098 -0.994 1.00 3.24 H new ATOM 0 HB3 LYS A 161 -3.338 7.391 -0.712 1.00 3.24 H new ATOM 0 HG2 LYS A 161 -3.309 5.873 1.222 1.00 53.44 H new ATOM 0 HG3 LYS A 161 -1.629 5.480 0.917 1.00 53.44 H new ATOM 0 HD2 LYS A 161 -1.212 8.059 1.043 1.00 62.01 H new ATOM 0 HD3 LYS A 161 -2.805 8.147 1.769 1.00 62.01 H new ATOM 0 HE2 LYS A 161 -0.589 6.363 2.832 1.00 75.14 H new ATOM 0 HE3 LYS A 161 -0.850 8.004 3.388 1.00 75.14 H new ATOM 0 HZ1 LYS A 161 -2.004 5.816 4.433 1.00 0.22 H new ATOM 0 HZ2 LYS A 161 -2.598 7.397 4.604 1.00 0.22 H new ATOM 0 HZ3 LYS A 161 -3.233 6.377 3.404 1.00 0.22 H new ATOM 2540 N ILE A 162 -1.943 6.241 -3.639 1.00 1.41 N ATOM 2541 CA ILE A 162 -1.877 6.889 -4.933 1.00 4.24 C ATOM 2542 C ILE A 162 -2.328 5.981 -6.081 1.00 62.44 C ATOM 2543 O ILE A 162 -3.135 6.392 -6.908 1.00 13.20 O ATOM 2544 CB ILE A 162 -0.443 7.389 -5.171 1.00 33.30 C ATOM 2545 CG1 ILE A 162 -0.128 8.494 -4.176 1.00 72.14 C ATOM 2546 CG2 ILE A 162 -0.271 7.883 -6.588 1.00 11.33 C ATOM 2547 CD1 ILE A 162 1.339 8.640 -3.864 1.00 30.32 C ATOM 0 H ILE A 162 -1.038 5.927 -3.289 1.00 1.41 H new ATOM 0 HA ILE A 162 -2.573 7.728 -4.920 1.00 4.24 H new ATOM 0 HB ILE A 162 0.251 6.562 -5.025 1.00 33.30 H new ATOM 0 HG12 ILE A 162 -0.501 9.440 -4.569 1.00 72.14 H new ATOM 0 HG13 ILE A 162 -0.668 8.299 -3.249 1.00 72.14 H new ATOM 0 HG21 ILE A 162 0.752 8.231 -6.730 1.00 11.33 H new ATOM 0 HG22 ILE A 162 -0.478 7.070 -7.284 1.00 11.33 H new ATOM 0 HG23 ILE A 162 -0.963 8.705 -6.773 1.00 11.33 H new ATOM 0 HD11 ILE A 162 1.480 9.449 -3.147 1.00 30.32 H new ATOM 0 HD12 ILE A 162 1.715 7.709 -3.439 1.00 30.32 H new ATOM 0 HD13 ILE A 162 1.885 8.868 -4.780 1.00 30.32 H new ATOM 2559 N VAL A 163 -1.869 4.732 -6.102 1.00 74.44 N ATOM 2560 CA VAL A 163 -2.114 3.848 -7.253 1.00 0.43 C ATOM 2561 C VAL A 163 -3.555 3.333 -7.274 1.00 53.23 C ATOM 2562 O VAL A 163 -3.970 2.635 -8.201 1.00 22.23 O ATOM 2563 CB VAL A 163 -1.141 2.657 -7.276 1.00 34.10 C ATOM 2564 CG1 VAL A 163 0.291 3.159 -7.308 1.00 73.34 C ATOM 2565 CG2 VAL A 163 -1.376 1.747 -6.083 1.00 12.34 C ATOM 0 H VAL A 163 -1.331 4.307 -5.347 1.00 74.44 H new ATOM 0 HA VAL A 163 -1.945 4.452 -8.145 1.00 0.43 H new ATOM 0 HB VAL A 163 -1.322 2.072 -8.178 1.00 34.10 H new ATOM 0 HG11 VAL A 163 0.974 2.310 -7.324 1.00 73.34 H new ATOM 0 HG12 VAL A 163 0.444 3.765 -8.201 1.00 73.34 H new ATOM 0 HG13 VAL A 163 0.485 3.763 -6.422 1.00 73.34 H new ATOM 0 HG21 VAL A 163 -0.677 0.911 -6.119 1.00 12.34 H new ATOM 0 HG22 VAL A 163 -1.223 2.308 -5.161 1.00 12.34 H new ATOM 0 HG23 VAL A 163 -2.397 1.367 -6.111 1.00 12.34 H new ATOM 2575 N ILE A 164 -4.297 3.680 -6.227 1.00 1.23 N ATOM 2576 CA ILE A 164 -5.739 3.480 -6.183 1.00 11.11 C ATOM 2577 C ILE A 164 -6.398 4.220 -7.349 1.00 2.10 C ATOM 2578 O ILE A 164 -7.391 3.763 -7.921 1.00 41.50 O ATOM 2579 CB ILE A 164 -6.298 3.981 -4.828 1.00 73.22 C ATOM 2580 CG1 ILE A 164 -6.000 2.953 -3.736 1.00 31.44 C ATOM 2581 CG2 ILE A 164 -7.792 4.272 -4.900 1.00 64.51 C ATOM 2582 CD1 ILE A 164 -5.885 3.560 -2.361 1.00 34.42 C ATOM 0 H ILE A 164 -3.913 4.108 -5.385 1.00 1.23 H new ATOM 0 HA ILE A 164 -5.962 2.417 -6.276 1.00 11.11 H new ATOM 0 HB ILE A 164 -5.802 4.921 -4.585 1.00 73.22 H new ATOM 0 HG12 ILE A 164 -6.790 2.202 -3.729 1.00 31.44 H new ATOM 0 HG13 ILE A 164 -5.071 2.437 -3.977 1.00 31.44 H new ATOM 0 HG21 ILE A 164 -8.142 4.621 -3.928 1.00 64.51 H new ATOM 0 HG22 ILE A 164 -7.977 5.041 -5.650 1.00 64.51 H new ATOM 0 HG23 ILE A 164 -8.327 3.363 -5.173 1.00 64.51 H new ATOM 0 HD11 ILE A 164 -5.673 2.776 -1.634 1.00 34.42 H new ATOM 0 HD12 ILE A 164 -5.077 4.291 -2.352 1.00 34.42 H new ATOM 0 HD13 ILE A 164 -6.822 4.052 -2.101 1.00 34.42 H new ATOM 2594 N GLN A 165 -5.794 5.336 -7.727 1.00 12.34 N ATOM 2595 CA GLN A 165 -6.279 6.142 -8.829 1.00 32.21 C ATOM 2596 C GLN A 165 -5.280 6.056 -9.977 1.00 62.20 C ATOM 2597 O GLN A 165 -4.080 5.908 -9.750 1.00 64.21 O ATOM 2598 CB GLN A 165 -6.461 7.594 -8.379 1.00 11.43 C ATOM 2599 CG GLN A 165 -7.170 7.725 -7.037 1.00 21.30 C ATOM 2600 CD GLN A 165 -7.253 9.157 -6.550 1.00 24.41 C ATOM 2601 OE1 GLN A 165 -7.355 10.093 -7.338 1.00 73.44 O ATOM 2602 NE2 GLN A 165 -7.203 9.340 -5.242 1.00 14.15 N ATOM 0 H GLN A 165 -4.956 5.705 -7.278 1.00 12.34 H new ATOM 0 HA GLN A 165 -7.247 5.769 -9.164 1.00 32.21 H new ATOM 0 HB2 GLN A 165 -5.484 8.072 -8.314 1.00 11.43 H new ATOM 0 HB3 GLN A 165 -7.030 8.133 -9.137 1.00 11.43 H new ATOM 0 HG2 GLN A 165 -8.177 7.317 -7.123 1.00 21.30 H new ATOM 0 HG3 GLN A 165 -6.645 7.124 -6.294 1.00 21.30 H new ATOM 0 HE21 GLN A 165 -7.118 8.538 -4.618 1.00 14.15 H new ATOM 0 HE22 GLN A 165 -7.249 10.283 -4.857 1.00 14.15 H new ATOM 2611 N LYS A 166 -5.769 6.149 -11.200 1.00 63.13 N ATOM 2612 CA LYS A 166 -4.925 5.932 -12.367 1.00 20.02 C ATOM 2613 C LYS A 166 -4.313 7.238 -12.850 1.00 12.42 C ATOM 2614 O LYS A 166 -3.171 7.273 -13.300 1.00 65.53 O ATOM 2615 CB LYS A 166 -5.726 5.278 -13.489 1.00 14.41 C ATOM 2616 CG LYS A 166 -4.884 4.881 -14.690 1.00 64.54 C ATOM 2617 CD LYS A 166 -5.690 4.068 -15.687 1.00 50.54 C ATOM 2618 CE LYS A 166 -6.022 2.689 -15.141 1.00 1.22 C ATOM 2619 NZ LYS A 166 -6.773 1.867 -16.125 1.00 51.15 N ATOM 0 H LYS A 166 -6.741 6.372 -11.414 1.00 63.13 H new ATOM 0 HA LYS A 166 -4.115 5.264 -12.077 1.00 20.02 H new ATOM 0 HB2 LYS A 166 -6.225 4.392 -13.098 1.00 14.41 H new ATOM 0 HB3 LYS A 166 -6.506 5.966 -13.815 1.00 14.41 H new ATOM 0 HG2 LYS A 166 -4.497 5.776 -15.177 1.00 64.54 H new ATOM 0 HG3 LYS A 166 -4.023 4.301 -14.357 1.00 64.54 H new ATOM 0 HD2 LYS A 166 -6.612 4.597 -15.928 1.00 50.54 H new ATOM 0 HD3 LYS A 166 -5.128 3.967 -16.615 1.00 50.54 H new ATOM 0 HE2 LYS A 166 -5.100 2.175 -14.868 1.00 1.22 H new ATOM 0 HE3 LYS A 166 -6.611 2.792 -14.230 1.00 1.22 H new ATOM 0 HZ1 LYS A 166 -6.979 0.935 -15.713 1.00 51.15 H new ATOM 0 HZ2 LYS A 166 -7.665 2.344 -16.367 1.00 51.15 H new ATOM 0 HZ3 LYS A 166 -6.201 1.746 -16.985 1.00 51.15 H new ATOM 2633 N TYR A 167 -5.082 8.308 -12.765 1.00 32.13 N ATOM 2634 CA TYR A 167 -4.622 9.611 -13.208 1.00 31.23 C ATOM 2635 C TYR A 167 -4.707 10.612 -12.067 1.00 51.55 C ATOM 2636 O TYR A 167 -5.728 10.706 -11.385 1.00 62.44 O ATOM 2637 CB TYR A 167 -5.448 10.105 -14.401 1.00 24.11 C ATOM 2638 CG TYR A 167 -5.280 9.258 -15.644 1.00 54.52 C ATOM 2639 CD1 TYR A 167 -4.278 9.535 -16.565 1.00 75.24 C ATOM 2640 CD2 TYR A 167 -6.115 8.174 -15.891 1.00 42.24 C ATOM 2641 CE1 TYR A 167 -4.112 8.756 -17.693 1.00 43.22 C ATOM 2642 CE2 TYR A 167 -5.951 7.390 -17.015 1.00 41.13 C ATOM 2643 CZ TYR A 167 -4.949 7.686 -17.911 1.00 63.14 C ATOM 2644 OH TYR A 167 -4.775 6.894 -19.024 1.00 33.13 O ATOM 0 H TYR A 167 -6.031 8.300 -12.392 1.00 32.13 H new ATOM 0 HA TYR A 167 -3.583 9.517 -13.524 1.00 31.23 H new ATOM 0 HB2 TYR A 167 -6.501 10.121 -14.122 1.00 24.11 H new ATOM 0 HB3 TYR A 167 -5.163 11.132 -14.630 1.00 24.11 H new ATOM 0 HD1 TYR A 167 -3.618 10.373 -16.396 1.00 75.24 H new ATOM 0 HD2 TYR A 167 -6.905 7.942 -15.192 1.00 42.24 H new ATOM 0 HE1 TYR A 167 -3.329 8.986 -18.401 1.00 43.22 H new ATOM 0 HE2 TYR A 167 -6.605 6.549 -17.191 1.00 41.13 H new ATOM 0 HH TYR A 167 -3.932 6.400 -18.945 1.00 33.13 H new ATOM 2654 N HIS A 168 -3.633 11.353 -11.864 1.00 61.32 N ATOM 2655 CA HIS A 168 -3.565 12.342 -10.801 1.00 2.25 C ATOM 2656 C HIS A 168 -3.271 13.717 -11.377 1.00 23.12 C ATOM 2657 O HIS A 168 -2.469 13.851 -12.299 1.00 52.14 O ATOM 2658 CB HIS A 168 -2.494 11.962 -9.776 1.00 52.52 C ATOM 2659 CG HIS A 168 -2.865 10.786 -8.927 1.00 30.45 C ATOM 2660 ND1 HIS A 168 -3.554 10.934 -7.745 1.00 52.21 N ATOM 2661 CD2 HIS A 168 -2.644 9.474 -9.142 1.00 31.02 C ATOM 2662 CE1 HIS A 168 -3.738 9.711 -7.283 1.00 11.25 C ATOM 2663 NE2 HIS A 168 -3.203 8.803 -8.097 1.00 54.11 N ATOM 0 H HIS A 168 -2.786 11.288 -12.428 1.00 61.32 H new ATOM 0 HA HIS A 168 -4.532 12.369 -10.298 1.00 2.25 H new ATOM 0 HB2 HIS A 168 -1.564 11.742 -10.300 1.00 52.52 H new ATOM 0 HB3 HIS A 168 -2.301 12.819 -9.130 1.00 52.52 H new ATOM 0 HD2 HIS A 168 -2.123 9.038 -9.982 1.00 31.02 H new ATOM 0 HE1 HIS A 168 -4.255 9.477 -6.364 1.00 11.25 H new ATOM 0 HE2 HIS A 168 -3.210 7.792 -7.963 1.00 54.11 H new ATOM 2671 N THR A 169 -3.914 14.733 -10.831 1.00 75.41 N ATOM 2672 CA THR A 169 -3.787 16.080 -11.359 1.00 5.02 C ATOM 2673 C THR A 169 -2.634 16.831 -10.698 1.00 63.45 C ATOM 2674 O THR A 169 -2.715 17.226 -9.534 1.00 52.13 O ATOM 2675 CB THR A 169 -5.096 16.868 -11.173 1.00 4.13 C ATOM 2676 OG1 THR A 169 -6.207 16.041 -11.544 1.00 72.12 O ATOM 2677 CG2 THR A 169 -5.101 18.132 -12.021 1.00 21.32 C ATOM 0 H THR A 169 -4.530 14.651 -10.022 1.00 75.41 H new ATOM 0 HA THR A 169 -3.575 15.991 -12.424 1.00 5.02 H new ATOM 0 HB THR A 169 -5.177 17.157 -10.125 1.00 4.13 H new ATOM 0 HG1 THR A 169 -7.041 16.541 -11.425 1.00 72.12 H new ATOM 0 HG21 THR A 169 -6.038 18.668 -11.869 1.00 21.32 H new ATOM 0 HG22 THR A 169 -4.267 18.769 -11.729 1.00 21.32 H new ATOM 0 HG23 THR A 169 -5.002 17.865 -13.073 1.00 21.32 H new ATOM 2685 N VAL A 170 -1.561 17.002 -11.454 1.00 42.24 N ATOM 2686 CA VAL A 170 -0.395 17.745 -11.004 1.00 12.12 C ATOM 2687 C VAL A 170 -0.175 18.936 -11.930 1.00 53.11 C ATOM 2688 O VAL A 170 -0.146 18.766 -13.148 1.00 72.14 O ATOM 2689 CB VAL A 170 0.877 16.863 -11.005 1.00 42.24 C ATOM 2690 CG1 VAL A 170 2.032 17.580 -10.332 1.00 33.21 C ATOM 2691 CG2 VAL A 170 0.621 15.522 -10.332 1.00 12.01 C ATOM 0 H VAL A 170 -1.474 16.628 -12.399 1.00 42.24 H new ATOM 0 HA VAL A 170 -0.578 18.079 -9.983 1.00 12.12 H new ATOM 0 HB VAL A 170 1.145 16.674 -12.044 1.00 42.24 H new ATOM 0 HG11 VAL A 170 2.914 16.940 -10.345 1.00 33.21 H new ATOM 0 HG12 VAL A 170 2.247 18.505 -10.866 1.00 33.21 H new ATOM 0 HG13 VAL A 170 1.766 17.810 -9.300 1.00 33.21 H new ATOM 0 HG21 VAL A 170 1.534 14.926 -10.349 1.00 12.01 H new ATOM 0 HG22 VAL A 170 0.314 15.686 -9.299 1.00 12.01 H new ATOM 0 HG23 VAL A 170 -0.168 14.992 -10.865 1.00 12.01 H new ATOM 2701 N ASN A 171 -0.006 20.131 -11.351 1.00 11.22 N ATOM 2702 CA ASN A 171 0.104 21.383 -12.117 1.00 20.21 C ATOM 2703 C ASN A 171 -1.038 21.525 -13.140 1.00 15.32 C ATOM 2704 O ASN A 171 -0.837 21.945 -14.283 1.00 3.41 O ATOM 2705 CB ASN A 171 1.487 21.465 -12.795 1.00 74.33 C ATOM 2706 CG ASN A 171 1.857 22.875 -13.230 1.00 62.01 C ATOM 2707 OD1 ASN A 171 2.280 23.693 -12.416 1.00 61.13 O ATOM 2708 ND2 ASN A 171 1.728 23.163 -14.517 1.00 24.02 N ATOM 0 H ASN A 171 0.058 20.259 -10.341 1.00 11.22 H new ATOM 0 HA ASN A 171 0.009 22.220 -11.425 1.00 20.21 H new ATOM 0 HB2 ASN A 171 2.245 21.093 -12.106 1.00 74.33 H new ATOM 0 HB3 ASN A 171 1.498 20.808 -13.665 1.00 74.33 H new ATOM 0 HD21 ASN A 171 1.983 24.089 -14.861 1.00 24.02 H new ATOM 0 HD22 ASN A 171 1.373 22.459 -15.164 1.00 24.02 H new ATOM 2715 N GLY A 172 -2.243 21.164 -12.710 1.00 20.43 N ATOM 2716 CA GLY A 172 -3.414 21.264 -13.563 1.00 41.13 C ATOM 2717 C GLY A 172 -3.386 20.302 -14.740 1.00 2.22 C ATOM 2718 O GLY A 172 -4.109 20.492 -15.720 1.00 11.21 O ATOM 0 H GLY A 172 -2.430 20.800 -11.776 1.00 20.43 H new ATOM 0 HA2 GLY A 172 -4.306 21.072 -12.967 1.00 41.13 H new ATOM 0 HA3 GLY A 172 -3.495 22.284 -13.939 1.00 41.13 H new ATOM 2722 N HIS A 173 -2.555 19.273 -14.651 1.00 30.20 N ATOM 2723 CA HIS A 173 -2.427 18.294 -15.717 1.00 23.02 C ATOM 2724 C HIS A 173 -2.630 16.887 -15.174 1.00 13.23 C ATOM 2725 O HIS A 173 -2.036 16.512 -14.162 1.00 23.32 O ATOM 2726 CB HIS A 173 -1.047 18.410 -16.378 1.00 50.43 C ATOM 2727 CG HIS A 173 -0.857 17.485 -17.541 1.00 23.23 C ATOM 2728 ND1 HIS A 173 -1.643 17.576 -18.664 1.00 24.02 N ATOM 2729 CD2 HIS A 173 0.012 16.456 -17.689 1.00 2.44 C ATOM 2730 CE1 HIS A 173 -1.241 16.604 -19.464 1.00 13.10 C ATOM 2731 NE2 HIS A 173 -0.242 15.903 -18.913 1.00 51.10 N ATOM 0 H HIS A 173 -1.956 19.095 -13.845 1.00 30.20 H new ATOM 0 HA HIS A 173 -3.195 18.493 -16.465 1.00 23.02 H new ATOM 0 HB2 HIS A 173 -0.900 19.437 -16.714 1.00 50.43 H new ATOM 0 HB3 HIS A 173 -0.278 18.205 -15.633 1.00 50.43 H new ATOM 0 HD2 HIS A 173 0.760 16.135 -16.979 1.00 2.44 H new ATOM 0 HE1 HIS A 173 -1.664 16.401 -20.437 1.00 13.10 H new ATOM 0 HE2 HIS A 173 0.239 15.106 -19.329 1.00 51.10 H new ATOM 2739 N ASN A 174 -3.465 16.110 -15.845 1.00 72.22 N ATOM 2740 CA ASN A 174 -3.726 14.744 -15.418 1.00 71.01 C ATOM 2741 C ASN A 174 -2.597 13.837 -15.882 1.00 61.22 C ATOM 2742 O ASN A 174 -2.459 13.560 -17.073 1.00 71.42 O ATOM 2743 CB ASN A 174 -5.059 14.236 -15.982 1.00 14.23 C ATOM 2744 CG ASN A 174 -6.198 15.218 -15.787 1.00 55.20 C ATOM 2745 OD1 ASN A 174 -6.452 16.067 -16.646 1.00 22.12 O ATOM 2746 ND2 ASN A 174 -6.892 15.117 -14.664 1.00 71.12 N ATOM 0 H ASN A 174 -3.971 16.399 -16.682 1.00 72.22 H new ATOM 0 HA ASN A 174 -3.785 14.731 -14.330 1.00 71.01 H new ATOM 0 HB2 ASN A 174 -4.942 14.030 -17.046 1.00 14.23 H new ATOM 0 HB3 ASN A 174 -5.314 13.292 -15.501 1.00 14.23 H new ATOM 0 HD21 ASN A 174 -7.668 15.755 -14.485 1.00 71.12 H new ATOM 0 HD22 ASN A 174 -6.651 14.402 -13.978 1.00 71.12 H new ATOM 2753 N CYS A 175 -1.782 13.395 -14.943 1.00 1.24 N ATOM 2754 CA CYS A 175 -0.685 12.495 -15.242 1.00 2.44 C ATOM 2755 C CYS A 175 -1.045 11.085 -14.808 1.00 21.02 C ATOM 2756 O CYS A 175 -1.750 10.903 -13.819 1.00 62.32 O ATOM 2757 CB CYS A 175 0.577 12.959 -14.519 1.00 71.03 C ATOM 2758 SG CYS A 175 0.885 14.734 -14.653 1.00 63.54 S ATOM 0 H CYS A 175 -1.861 13.648 -13.958 1.00 1.24 H new ATOM 0 HA CYS A 175 -0.499 12.499 -16.316 1.00 2.44 H new ATOM 0 HB2 CYS A 175 0.499 12.692 -13.465 1.00 71.03 H new ATOM 0 HB3 CYS A 175 1.434 12.420 -14.922 1.00 71.03 H new ATOM 0 HG CYS A 175 -0.226 15.383 -14.467 1.00 63.54 H new ATOM 2764 N GLU A 176 -0.564 10.095 -15.535 1.00 63.02 N ATOM 2765 CA GLU A 176 -0.874 8.713 -15.225 1.00 72.22 C ATOM 2766 C GLU A 176 0.107 8.172 -14.196 1.00 53.22 C ATOM 2767 O GLU A 176 1.318 8.328 -14.337 1.00 4.02 O ATOM 2768 CB GLU A 176 -0.827 7.861 -16.487 1.00 13.35 C ATOM 2769 CG GLU A 176 -1.528 6.528 -16.341 1.00 34.00 C ATOM 2770 CD GLU A 176 -1.350 5.652 -17.560 1.00 62.13 C ATOM 2771 OE1 GLU A 176 -0.305 4.982 -17.671 1.00 23.44 O ATOM 2772 OE2 GLU A 176 -2.256 5.636 -18.422 1.00 31.11 O ATOM 0 H GLU A 176 0.043 10.222 -16.345 1.00 63.02 H new ATOM 0 HA GLU A 176 -1.881 8.670 -14.811 1.00 72.22 H new ATOM 0 HB2 GLU A 176 -1.284 8.415 -17.307 1.00 13.35 H new ATOM 0 HB3 GLU A 176 0.214 7.687 -16.760 1.00 13.35 H new ATOM 0 HG2 GLU A 176 -1.140 6.010 -15.464 1.00 34.00 H new ATOM 0 HG3 GLU A 176 -2.591 6.696 -16.168 1.00 34.00 H new ATOM 2779 N VAL A 177 -0.425 7.532 -13.173 1.00 12.13 N ATOM 2780 CA VAL A 177 0.377 7.081 -12.052 1.00 5.01 C ATOM 2781 C VAL A 177 0.118 5.608 -11.750 1.00 23.45 C ATOM 2782 O VAL A 177 -1.018 5.136 -11.827 1.00 3.42 O ATOM 2783 CB VAL A 177 0.097 7.924 -10.792 1.00 52.24 C ATOM 2784 CG1 VAL A 177 1.027 7.547 -9.659 1.00 11.34 C ATOM 2785 CG2 VAL A 177 0.213 9.413 -11.089 1.00 73.21 C ATOM 0 H VAL A 177 -1.418 7.311 -13.095 1.00 12.13 H new ATOM 0 HA VAL A 177 1.423 7.205 -12.332 1.00 5.01 H new ATOM 0 HB VAL A 177 -0.926 7.711 -10.483 1.00 52.24 H new ATOM 0 HG11 VAL A 177 0.803 8.160 -8.786 1.00 11.34 H new ATOM 0 HG12 VAL A 177 0.889 6.495 -9.409 1.00 11.34 H new ATOM 0 HG13 VAL A 177 2.060 7.714 -9.965 1.00 11.34 H new ATOM 0 HG21 VAL A 177 0.010 9.982 -10.182 1.00 73.21 H new ATOM 0 HG22 VAL A 177 1.220 9.637 -11.440 1.00 73.21 H new ATOM 0 HG23 VAL A 177 -0.509 9.688 -11.858 1.00 73.21 H new ATOM 2795 N ARG A 178 1.187 4.892 -11.434 1.00 63.12 N ATOM 2796 CA ARG A 178 1.096 3.461 -11.136 1.00 12.24 C ATOM 2797 C ARG A 178 2.284 2.994 -10.300 1.00 65.52 C ATOM 2798 O ARG A 178 3.231 3.749 -10.094 1.00 21.41 O ATOM 2799 CB ARG A 178 1.031 2.660 -12.444 1.00 53.22 C ATOM 2800 CG ARG A 178 2.376 2.503 -13.136 1.00 24.11 C ATOM 2801 CD ARG A 178 2.223 1.982 -14.553 1.00 0.23 C ATOM 2802 NE ARG A 178 3.505 1.922 -15.248 1.00 54.03 N ATOM 2803 CZ ARG A 178 3.649 2.042 -16.569 1.00 73.13 C ATOM 2804 NH1 ARG A 178 2.584 2.223 -17.345 1.00 44.30 N ATOM 2805 NH2 ARG A 178 4.860 2.005 -17.109 1.00 2.30 N ATOM 0 H ARG A 178 2.131 5.274 -11.376 1.00 63.12 H new ATOM 0 HA ARG A 178 0.187 3.291 -10.558 1.00 12.24 H new ATOM 0 HB2 ARG A 178 0.624 1.671 -12.233 1.00 53.22 H new ATOM 0 HB3 ARG A 178 0.337 3.152 -13.126 1.00 53.22 H new ATOM 0 HG2 ARG A 178 2.889 3.464 -13.156 1.00 24.11 H new ATOM 0 HG3 ARG A 178 3.002 1.819 -12.563 1.00 24.11 H new ATOM 0 HD2 ARG A 178 1.775 0.988 -14.529 1.00 0.23 H new ATOM 0 HD3 ARG A 178 1.539 2.626 -15.106 1.00 0.23 H new ATOM 0 HE ARG A 178 4.345 1.779 -14.688 1.00 54.03 H new ATOM 0 HH11 ARG A 178 1.653 2.271 -16.931 1.00 44.30 H new ATOM 0 HH12 ARG A 178 2.698 2.314 -18.354 1.00 44.30 H new ATOM 0 HH21 ARG A 178 5.680 1.885 -16.514 1.00 2.30 H new ATOM 0 HH22 ARG A 178 4.971 2.097 -18.119 1.00 2.30 H new ATOM 2819 N LYS A 179 2.223 1.749 -9.821 1.00 65.30 N ATOM 2820 CA LYS A 179 3.338 1.133 -9.097 1.00 14.13 C ATOM 2821 C LYS A 179 4.561 1.054 -10.001 1.00 45.33 C ATOM 2822 O LYS A 179 4.502 0.475 -11.085 1.00 42.43 O ATOM 2823 CB LYS A 179 2.963 -0.283 -8.637 1.00 32.31 C ATOM 2824 CG LYS A 179 1.732 -0.355 -7.740 1.00 75.53 C ATOM 2825 CD LYS A 179 2.033 0.104 -6.318 1.00 61.11 C ATOM 2826 CE LYS A 179 1.722 -0.985 -5.300 1.00 44.50 C ATOM 2827 NZ LYS A 179 0.275 -1.333 -5.247 1.00 72.35 N ATOM 0 H LYS A 179 1.408 1.144 -9.922 1.00 65.30 H new ATOM 0 HA LYS A 179 3.562 1.746 -8.224 1.00 14.13 H new ATOM 0 HB2 LYS A 179 2.792 -0.903 -9.517 1.00 32.31 H new ATOM 0 HB3 LYS A 179 3.810 -0.714 -8.104 1.00 32.31 H new ATOM 0 HG2 LYS A 179 0.940 0.265 -8.161 1.00 75.53 H new ATOM 0 HG3 LYS A 179 1.358 -1.379 -7.719 1.00 75.53 H new ATOM 0 HD2 LYS A 179 3.083 0.386 -6.241 1.00 61.11 H new ATOM 0 HD3 LYS A 179 1.446 0.994 -6.090 1.00 61.11 H new ATOM 0 HE2 LYS A 179 2.297 -1.878 -5.544 1.00 44.50 H new ATOM 0 HE3 LYS A 179 2.048 -0.656 -4.313 1.00 44.50 H new ATOM 0 HZ1 LYS A 179 0.164 -2.305 -4.894 1.00 72.35 H new ATOM 0 HZ2 LYS A 179 -0.217 -0.675 -4.609 1.00 72.35 H new ATOM 0 HZ3 LYS A 179 -0.134 -1.262 -6.200 1.00 72.35 H new ATOM 2841 N ALA A 180 5.662 1.645 -9.568 1.00 11.34 N ATOM 2842 CA ALA A 180 6.888 1.584 -10.339 1.00 4.21 C ATOM 2843 C ALA A 180 7.848 0.612 -9.700 1.00 0.11 C ATOM 2844 O ALA A 180 8.394 0.864 -8.627 1.00 5.31 O ATOM 2845 CB ALA A 180 7.534 2.952 -10.462 1.00 61.43 C ATOM 0 H ALA A 180 5.731 2.167 -8.695 1.00 11.34 H new ATOM 0 HA ALA A 180 6.640 1.241 -11.343 1.00 4.21 H new ATOM 0 HB1 ALA A 180 8.451 2.870 -11.046 1.00 61.43 H new ATOM 0 HB2 ALA A 180 6.846 3.636 -10.960 1.00 61.43 H new ATOM 0 HB3 ALA A 180 7.769 3.334 -9.469 1.00 61.43 H new ATOM 2851 N LEU A 181 8.076 -0.482 -10.382 1.00 4.22 N ATOM 2852 CA LEU A 181 8.941 -1.521 -9.876 1.00 35.23 C ATOM 2853 C LEU A 181 10.321 -1.365 -10.480 1.00 62.31 C ATOM 2854 O LEU A 181 10.461 -0.848 -11.591 1.00 44.43 O ATOM 2855 CB LEU A 181 8.366 -2.901 -10.206 1.00 40.12 C ATOM 2856 CG LEU A 181 6.943 -3.159 -9.701 1.00 61.54 C ATOM 2857 CD1 LEU A 181 6.458 -4.528 -10.147 1.00 23.23 C ATOM 2858 CD2 LEU A 181 6.880 -3.041 -8.184 1.00 32.04 C ATOM 0 H LEU A 181 7.671 -0.678 -11.297 1.00 4.22 H new ATOM 0 HA LEU A 181 9.012 -1.433 -8.792 1.00 35.23 H new ATOM 0 HB2 LEU A 181 8.378 -3.031 -11.288 1.00 40.12 H new ATOM 0 HB3 LEU A 181 9.025 -3.660 -9.786 1.00 40.12 H new ATOM 0 HG LEU A 181 6.287 -2.403 -10.132 1.00 61.54 H new ATOM 0 HD11 LEU A 181 5.445 -4.693 -9.779 1.00 23.23 H new ATOM 0 HD12 LEU A 181 6.461 -4.578 -11.236 1.00 23.23 H new ATOM 0 HD13 LEU A 181 7.119 -5.296 -9.747 1.00 23.23 H new ATOM 0 HD21 LEU A 181 5.861 -3.228 -7.847 1.00 32.04 H new ATOM 0 HD22 LEU A 181 7.551 -3.773 -7.734 1.00 32.04 H new ATOM 0 HD23 LEU A 181 7.183 -2.038 -7.884 1.00 32.04 H new