USER MOD reduce.3.24.130724 H: found=0, std=0, add=1314, rem=0, adj=37 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= -3.42! K(o=-6.2!,f=-0.55) USER MOD Set 1.2: A 175 CYS SG : rot 160:sc= -2.81! USER MOD Set 2.1: A 169 THR OG1 : rot 180:sc= 0.755 USER MOD Set 2.2: A 174 ASN : amide:sc= 0.109 K(o=0.86,f=-2.8!) USER MOD Set 3.1: A 124 TYR OH : rot -94:sc= 0.0138 USER MOD Set 3.2: A 128 TYR OH : rot 180:sc= 0.731 USER MOD Set 3.3: A 168 HIS : no HD1:sc= -1.83! C(o=-1.1!,f=-6.6!) USER MOD Set 4.1: A 87 LYS NZ :NH3+ -173:sc= 1.18 (180deg=0.707) USER MOD Set 4.2: A 103 THR OG1 : rot 180:sc= 0.585 USER MOD Set 5.1: A 26 THR OG1 : rot -170:sc= 0.972 USER MOD Set 5.2: A 29 SER OG : rot 104:sc= 1.11 USER MOD Set 6.1: A 22 SER OG : rot -175:sc= 2.21 USER MOD Set 6.2: A 25 THR OG1 : rot 22:sc= 0.889 USER MOD Set 7.1: A 12 GLN : amide:sc= 1.5 K(o=1.7,f=-1.2) USER MOD Set 7.2: A 91 SER OG : rot -60:sc= 0.178 USER MOD Single : A 8 LYS NZ :NH3+ 163:sc= -0.0447 (180deg=-0.364) 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 33 HIS : no HD1:sc= -1.84! C(o=-1.8!,f=-3.1!) USER MOD Single : A 36 GLN : amide:sc= 0.887 K(o=0.89,f=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.0153 USER MOD Single : A 43 CYS SG : rot -89:sc= -0.502 USER MOD Single : A 46 MET CE :methyl 145:sc= -0.925 (180deg=-3.05!) USER MOD Single : A 50 ASN : amide:sc= 0.564 K(o=0.56,f=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.227 USER MOD Single : A 52 LYS NZ :NH3+ 173:sc= 1.07 (180deg=1.02) USER MOD Single : A 54 SER OG : rot -116:sc= 1.11 USER MOD Single : A 61 THR OG1 : rot -170:sc= -0.473 USER MOD Single : A 62 TYR OH : rot 44:sc= 0.912 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 160:sc= -2.73 (180deg=-3.49!) USER MOD Single : A 73 ASN : amide:sc= 0.0769 X(o=0.077,f=0) USER MOD Single : A 77 HIS : no HD1:sc= -0.287 K(o=-0.29,f=-4.2!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot -33:sc= 0.29 USER MOD Single : A 96 GLN : amide:sc= -1.07 K(o=-1.1,f=-0.017) USER MOD Single : A 101 HIS : no HD1:sc= -0.284 X(o=-0.28,f=-0.7) USER MOD Single : A 105 LYS NZ :NH3+ 165:sc= 0.703 (180deg=0.562) USER MOD Single : A 106 LYS NZ :NH3+ -179:sc= 0.808 (180deg=0.805) USER MOD Single : A 113 LYS NZ :NH3+ 152:sc= 0.39 (180deg=-0.196) USER MOD Single : A 116 THR OG1 : rot -130:sc= -0.548 USER MOD Single : A 119 HIS : no HD1:sc= -0.0984 X(o=-0.098,f=-0.43) USER MOD Single : A 120 HIS : no HD1:sc= 0.907 K(o=0.91,f=-4.1!) USER MOD Single : A 127 GLN : amide:sc= 0.0282 X(o=0.028,f=0) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 MET CE :methyl -166:sc= -0.142 (180deg=-0.56) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.0601 USER MOD Single : A 152 THR OG1 : rot 180:sc= -1.13 USER MOD Single : A 156 HIS : no HE2:sc= -3.33! X(o=-3.3!,f=-3.4) USER MOD Single : A 158 SER OG : rot -141:sc= 1.73 USER MOD Single : A 161 LYS NZ :NH3+ -167:sc= 1.2 (180deg=1.03) USER MOD Single : A 165 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 TYR OH : rot -102:sc= 0.833 USER MOD Single : A 171 ASN : amide:sc= -0.0385 K(o=-0.039,f=-3.8!) USER MOD Single : A 179 LYS NZ :NH3+ 147:sc= 0.842 (180deg=-1.47!) USER MOD ----------------------------------------------------------------- ATOM 92 N LYS A 8 -15.835 8.394 5.394 1.00 34.43 N ATOM 93 CA LYS A 8 -16.384 8.150 4.072 1.00 73.32 C ATOM 94 C LYS A 8 -15.372 7.426 3.195 1.00 54.10 C ATOM 95 O LYS A 8 -15.550 7.324 1.982 1.00 4.52 O ATOM 96 CB LYS A 8 -16.794 9.473 3.421 1.00 3.12 C ATOM 97 CG LYS A 8 -17.698 10.333 4.293 1.00 3.34 C ATOM 98 CD LYS A 8 -19.014 9.638 4.597 1.00 73.45 C ATOM 99 CE LYS A 8 -19.962 10.551 5.358 1.00 54.14 C ATOM 100 NZ LYS A 8 -20.336 11.753 4.568 1.00 54.24 N ATOM 0 HA LYS A 8 -17.265 7.517 4.176 1.00 73.32 H new ATOM 0 HB2 LYS A 8 -15.896 10.040 3.175 1.00 3.12 H new ATOM 0 HB3 LYS A 8 -17.305 9.262 2.482 1.00 3.12 H new ATOM 0 HG2 LYS A 8 -17.187 10.568 5.227 1.00 3.34 H new ATOM 0 HG3 LYS A 8 -17.894 11.280 3.790 1.00 3.34 H new ATOM 0 HD2 LYS A 8 -19.483 9.320 3.666 1.00 73.45 H new ATOM 0 HD3 LYS A 8 -18.825 8.738 5.182 1.00 73.45 H new ATOM 0 HE2 LYS A 8 -20.863 9.997 5.623 1.00 54.14 H new ATOM 0 HE3 LYS A 8 -19.493 10.863 6.291 1.00 54.14 H new ATOM 0 HZ1 LYS A 8 -21.183 12.192 4.983 1.00 54.24 H new ATOM 0 HZ2 LYS A 8 -19.551 12.435 4.581 1.00 54.24 H new ATOM 0 HZ3 LYS A 8 -20.537 11.475 3.586 1.00 54.24 H new ATOM 114 N GLU A 9 -14.312 6.926 3.813 1.00 22.01 N ATOM 115 CA GLU A 9 -13.309 6.156 3.097 1.00 15.45 C ATOM 116 C GLU A 9 -13.849 4.760 2.824 1.00 4.51 C ATOM 117 O GLU A 9 -14.382 4.115 3.729 1.00 34.32 O ATOM 118 CB GLU A 9 -12.000 6.060 3.897 1.00 33.23 C ATOM 119 CG GLU A 9 -11.271 7.384 4.065 1.00 71.03 C ATOM 120 CD GLU A 9 -11.915 8.278 5.101 1.00 61.02 C ATOM 121 OE1 GLU A 9 -12.053 7.843 6.258 1.00 32.03 O ATOM 122 OE2 GLU A 9 -12.297 9.412 4.755 1.00 43.12 O ATOM 0 H GLU A 9 -14.125 7.040 4.809 1.00 22.01 H new ATOM 0 HA GLU A 9 -13.091 6.663 2.157 1.00 15.45 H new ATOM 0 HB2 GLU A 9 -12.220 5.652 4.884 1.00 33.23 H new ATOM 0 HB3 GLU A 9 -11.335 5.353 3.400 1.00 33.23 H new ATOM 0 HG2 GLU A 9 -10.237 7.191 4.350 1.00 71.03 H new ATOM 0 HG3 GLU A 9 -11.246 7.904 3.107 1.00 71.03 H new ATOM 129 N PRO A 10 -13.744 4.283 1.570 1.00 63.31 N ATOM 130 CA PRO A 10 -14.192 2.940 1.206 1.00 52.32 C ATOM 131 C PRO A 10 -13.396 1.859 1.926 1.00 33.11 C ATOM 132 O PRO A 10 -12.334 2.130 2.492 1.00 71.45 O ATOM 133 CB PRO A 10 -13.951 2.865 -0.306 1.00 3.51 C ATOM 134 CG PRO A 10 -12.948 3.922 -0.596 1.00 70.10 C ATOM 135 CD PRO A 10 -13.199 5.012 0.409 1.00 45.53 C ATOM 0 HA PRO A 10 -15.232 2.771 1.485 1.00 52.32 H new ATOM 0 HB2 PRO A 10 -13.582 1.882 -0.597 1.00 3.51 H new ATOM 0 HB3 PRO A 10 -14.874 3.036 -0.860 1.00 3.51 H new ATOM 0 HG2 PRO A 10 -11.934 3.534 -0.506 1.00 70.10 H new ATOM 0 HG3 PRO A 10 -13.057 4.296 -1.614 1.00 70.10 H new ATOM 0 HD2 PRO A 10 -12.282 5.545 0.662 1.00 45.53 H new ATOM 0 HD3 PRO A 10 -13.904 5.753 0.032 1.00 45.53 H new ATOM 143 N GLU A 11 -13.911 0.641 1.875 1.00 21.51 N ATOM 144 CA GLU A 11 -13.325 -0.502 2.564 1.00 23.21 C ATOM 145 C GLU A 11 -11.840 -0.687 2.230 1.00 34.20 C ATOM 146 O GLU A 11 -11.048 -0.947 3.118 1.00 35.12 O ATOM 147 CB GLU A 11 -14.124 -1.784 2.254 1.00 65.34 C ATOM 148 CG GLU A 11 -14.033 -2.288 0.809 1.00 65.25 C ATOM 149 CD GLU A 11 -14.528 -1.290 -0.224 1.00 44.22 C ATOM 150 OE1 GLU A 11 -15.756 -1.156 -0.395 1.00 24.15 O ATOM 151 OE2 GLU A 11 -13.685 -0.618 -0.853 1.00 72.44 O ATOM 0 H GLU A 11 -14.755 0.414 1.350 1.00 21.51 H new ATOM 0 HA GLU A 11 -13.383 -0.301 3.634 1.00 23.21 H new ATOM 0 HB2 GLU A 11 -13.778 -2.576 2.918 1.00 65.34 H new ATOM 0 HB3 GLU A 11 -15.172 -1.604 2.492 1.00 65.34 H new ATOM 0 HG2 GLU A 11 -12.996 -2.541 0.588 1.00 65.25 H new ATOM 0 HG3 GLU A 11 -14.612 -3.207 0.718 1.00 65.25 H new ATOM 158 N GLN A 12 -11.469 -0.511 0.963 1.00 45.32 N ATOM 159 CA GLN A 12 -10.087 -0.718 0.526 1.00 4.33 C ATOM 160 C GLN A 12 -9.158 0.381 1.039 1.00 60.35 C ATOM 161 O GLN A 12 -7.970 0.151 1.256 1.00 23.10 O ATOM 162 CB GLN A 12 -10.026 -0.798 -1.001 1.00 30.42 C ATOM 163 CG GLN A 12 -10.383 0.500 -1.708 1.00 21.34 C ATOM 164 CD GLN A 12 -10.865 0.262 -3.118 1.00 32.01 C ATOM 165 OE1 GLN A 12 -10.087 0.278 -4.069 1.00 73.43 O ATOM 166 NE2 GLN A 12 -12.157 0.036 -3.263 1.00 41.23 N ATOM 0 H GLN A 12 -12.106 -0.225 0.219 1.00 45.32 H new ATOM 0 HA GLN A 12 -9.742 -1.661 0.950 1.00 4.33 H new ATOM 0 HB2 GLN A 12 -9.020 -1.096 -1.298 1.00 30.42 H new ATOM 0 HB3 GLN A 12 -10.704 -1.582 -1.340 1.00 30.42 H new ATOM 0 HG2 GLN A 12 -11.157 1.019 -1.143 1.00 21.34 H new ATOM 0 HG3 GLN A 12 -9.511 1.153 -1.729 1.00 21.34 H new ATOM 0 HE21 GLN A 12 -12.769 0.031 -2.447 1.00 41.23 H new ATOM 0 HE22 GLN A 12 -12.544 -0.134 -4.191 1.00 41.23 H new ATOM 175 N LEU A 13 -9.712 1.565 1.269 1.00 51.40 N ATOM 176 CA LEU A 13 -8.915 2.705 1.703 1.00 62.02 C ATOM 177 C LEU A 13 -8.720 2.692 3.213 1.00 60.11 C ATOM 178 O LEU A 13 -7.986 3.513 3.756 1.00 61.32 O ATOM 179 CB LEU A 13 -9.573 4.016 1.270 1.00 33.23 C ATOM 180 CG LEU A 13 -8.945 4.693 0.045 1.00 14.04 C ATOM 181 CD1 LEU A 13 -8.974 3.773 -1.161 1.00 45.02 C ATOM 182 CD2 LEU A 13 -9.673 5.982 -0.273 1.00 71.41 C ATOM 0 H LEU A 13 -10.707 1.760 1.163 1.00 51.40 H new ATOM 0 HA LEU A 13 -7.936 2.629 1.229 1.00 62.02 H new ATOM 0 HB2 LEU A 13 -10.625 3.823 1.058 1.00 33.23 H new ATOM 0 HB3 LEU A 13 -9.539 4.714 2.107 1.00 33.23 H new ATOM 0 HG LEU A 13 -7.905 4.918 0.281 1.00 14.04 H new ATOM 0 HD11 LEU A 13 -8.523 4.278 -2.015 1.00 45.02 H new ATOM 0 HD12 LEU A 13 -8.414 2.865 -0.939 1.00 45.02 H new ATOM 0 HD13 LEU A 13 -10.006 3.514 -1.397 1.00 45.02 H new ATOM 0 HD21 LEU A 13 -9.217 6.452 -1.144 1.00 71.41 H new ATOM 0 HD22 LEU A 13 -10.720 5.766 -0.484 1.00 71.41 H new ATOM 0 HD23 LEU A 13 -9.606 6.657 0.580 1.00 71.41 H new ATOM 194 N ARG A 14 -9.383 1.764 3.886 1.00 31.10 N ATOM 195 CA ARG A 14 -9.210 1.599 5.323 1.00 12.43 C ATOM 196 C ARG A 14 -8.885 0.146 5.664 1.00 33.20 C ATOM 197 O ARG A 14 -8.845 -0.237 6.834 1.00 34.23 O ATOM 198 CB ARG A 14 -10.460 2.068 6.078 1.00 25.30 C ATOM 199 CG ARG A 14 -11.744 1.420 5.596 1.00 70.43 C ATOM 200 CD ARG A 14 -12.966 2.043 6.246 1.00 52.44 C ATOM 201 NE ARG A 14 -14.204 1.530 5.665 1.00 63.23 N ATOM 202 CZ ARG A 14 -15.386 1.541 6.281 1.00 42.44 C ATOM 203 NH1 ARG A 14 -15.506 2.037 7.509 1.00 33.41 N ATOM 204 NH2 ARG A 14 -16.449 1.041 5.672 1.00 13.33 N ATOM 0 H ARG A 14 -10.045 1.114 3.462 1.00 31.10 H new ATOM 0 HA ARG A 14 -8.371 2.219 5.638 1.00 12.43 H new ATOM 0 HB2 ARG A 14 -10.333 1.856 7.140 1.00 25.30 H new ATOM 0 HB3 ARG A 14 -10.550 3.150 5.977 1.00 25.30 H new ATOM 0 HG2 ARG A 14 -11.817 1.519 4.513 1.00 70.43 H new ATOM 0 HG3 ARG A 14 -11.718 0.353 5.817 1.00 70.43 H new ATOM 0 HD2 ARG A 14 -12.954 1.838 7.317 1.00 52.44 H new ATOM 0 HD3 ARG A 14 -12.929 3.126 6.128 1.00 52.44 H new ATOM 0 HE ARG A 14 -14.161 1.137 4.725 1.00 63.23 H new ATOM 0 HH11 ARG A 14 -14.689 2.414 7.989 1.00 33.41 H new ATOM 0 HH12 ARG A 14 -16.415 2.040 7.971 1.00 33.41 H new ATOM 0 HH21 ARG A 14 -16.362 0.649 4.734 1.00 13.33 H new ATOM 0 HH22 ARG A 14 -17.355 1.048 6.140 1.00 13.33 H new ATOM 218 N LYS A 15 -8.690 -0.671 4.640 1.00 12.51 N ATOM 219 CA LYS A 15 -8.266 -2.047 4.841 1.00 44.55 C ATOM 220 C LYS A 15 -6.761 -2.193 4.647 1.00 52.43 C ATOM 221 O LYS A 15 -6.147 -1.494 3.839 1.00 61.54 O ATOM 222 CB LYS A 15 -9.027 -2.984 3.891 1.00 24.51 C ATOM 223 CG LYS A 15 -8.744 -4.468 4.088 1.00 61.31 C ATOM 224 CD LYS A 15 -9.722 -5.337 3.306 1.00 3.02 C ATOM 225 CE LYS A 15 -9.753 -4.979 1.826 1.00 73.11 C ATOM 226 NZ LYS A 15 -10.659 -5.868 1.059 1.00 24.31 N ATOM 0 H LYS A 15 -8.818 -0.405 3.664 1.00 12.51 H new ATOM 0 HA LYS A 15 -8.499 -2.327 5.868 1.00 44.55 H new ATOM 0 HB2 LYS A 15 -10.096 -2.814 4.016 1.00 24.51 H new ATOM 0 HB3 LYS A 15 -8.779 -2.715 2.864 1.00 24.51 H new ATOM 0 HG2 LYS A 15 -7.725 -4.690 3.770 1.00 61.31 H new ATOM 0 HG3 LYS A 15 -8.807 -4.713 5.148 1.00 61.31 H new ATOM 0 HD2 LYS A 15 -9.445 -6.385 3.419 1.00 3.02 H new ATOM 0 HD3 LYS A 15 -10.721 -5.225 3.726 1.00 3.02 H new ATOM 0 HE2 LYS A 15 -10.076 -3.944 1.710 1.00 73.11 H new ATOM 0 HE3 LYS A 15 -8.746 -5.046 1.415 1.00 73.11 H new ATOM 0 HZ1 LYS A 15 -10.651 -5.591 0.057 1.00 24.31 H new ATOM 0 HZ2 LYS A 15 -10.337 -6.853 1.148 1.00 24.31 H new ATOM 0 HZ3 LYS A 15 -11.626 -5.785 1.433 1.00 24.31 H new ATOM 240 N LEU A 16 -6.193 -3.103 5.414 1.00 40.54 N ATOM 241 CA LEU A 16 -4.786 -3.424 5.334 1.00 2.11 C ATOM 242 C LEU A 16 -4.587 -4.861 4.869 1.00 12.11 C ATOM 243 O LEU A 16 -5.357 -5.750 5.224 1.00 22.14 O ATOM 244 CB LEU A 16 -4.105 -3.220 6.693 1.00 72.10 C ATOM 245 CG LEU A 16 -4.023 -1.774 7.181 1.00 41.23 C ATOM 246 CD1 LEU A 16 -3.244 -1.694 8.483 1.00 23.31 C ATOM 247 CD2 LEU A 16 -3.392 -0.884 6.124 1.00 34.02 C ATOM 0 H LEU A 16 -6.701 -3.643 6.115 1.00 40.54 H new ATOM 0 HA LEU A 16 -4.330 -2.752 4.607 1.00 2.11 H new ATOM 0 HB2 LEU A 16 -4.641 -3.806 7.439 1.00 72.10 H new ATOM 0 HB3 LEU A 16 -3.094 -3.623 6.637 1.00 72.10 H new ATOM 0 HG LEU A 16 -5.037 -1.417 7.364 1.00 41.23 H new ATOM 0 HD11 LEU A 16 -3.196 -0.657 8.815 1.00 23.31 H new ATOM 0 HD12 LEU A 16 -3.743 -2.296 9.243 1.00 23.31 H new ATOM 0 HD13 LEU A 16 -2.234 -2.072 8.326 1.00 23.31 H new ATOM 0 HD21 LEU A 16 -3.344 0.141 6.493 1.00 34.02 H new ATOM 0 HD22 LEU A 16 -2.385 -1.238 5.904 1.00 34.02 H new ATOM 0 HD23 LEU A 16 -3.994 -0.915 5.216 1.00 34.02 H new ATOM 259 N PHE A 17 -3.553 -5.068 4.075 1.00 61.33 N ATOM 260 CA PHE A 17 -3.154 -6.389 3.634 1.00 45.40 C ATOM 261 C PHE A 17 -2.022 -6.876 4.523 1.00 50.30 C ATOM 262 O PHE A 17 -0.980 -6.237 4.616 1.00 35.11 O ATOM 263 CB PHE A 17 -2.701 -6.352 2.165 1.00 44.05 C ATOM 264 CG PHE A 17 -1.859 -7.530 1.749 1.00 34.23 C ATOM 265 CD1 PHE A 17 -2.438 -8.756 1.468 1.00 14.25 C ATOM 266 CD2 PHE A 17 -0.480 -7.405 1.636 1.00 42.30 C ATOM 267 CE1 PHE A 17 -1.660 -9.832 1.083 1.00 25.32 C ATOM 268 CE2 PHE A 17 0.300 -8.478 1.255 1.00 63.22 C ATOM 269 CZ PHE A 17 -0.291 -9.693 0.978 1.00 12.41 C ATOM 0 H PHE A 17 -2.963 -4.318 3.716 1.00 61.33 H new ATOM 0 HA PHE A 17 -4.001 -7.071 3.707 1.00 45.40 H new ATOM 0 HB2 PHE A 17 -3.583 -6.306 1.526 1.00 44.05 H new ATOM 0 HB3 PHE A 17 -2.135 -5.436 1.994 1.00 44.05 H new ATOM 0 HD1 PHE A 17 -3.508 -8.873 1.550 1.00 14.25 H new ATOM 0 HD2 PHE A 17 -0.012 -6.455 1.849 1.00 42.30 H new ATOM 0 HE1 PHE A 17 -2.124 -10.782 0.864 1.00 25.32 H new ATOM 0 HE2 PHE A 17 1.371 -8.366 1.174 1.00 63.22 H new ATOM 0 HZ PHE A 17 0.317 -10.534 0.679 1.00 12.41 H new ATOM 279 N ILE A 18 -2.227 -7.986 5.183 1.00 64.12 N ATOM 280 CA ILE A 18 -1.223 -8.510 6.086 1.00 51.54 C ATOM 281 C ILE A 18 -0.433 -9.615 5.404 1.00 1.40 C ATOM 282 O ILE A 18 -0.966 -10.685 5.126 1.00 23.12 O ATOM 283 CB ILE A 18 -1.849 -9.052 7.388 1.00 3.05 C ATOM 284 CG1 ILE A 18 -2.913 -8.089 7.937 1.00 53.24 C ATOM 285 CG2 ILE A 18 -0.763 -9.289 8.425 1.00 10.11 C ATOM 286 CD1 ILE A 18 -2.408 -6.682 8.184 1.00 41.00 C ATOM 0 H ILE A 18 -3.076 -8.547 5.116 1.00 64.12 H new ATOM 0 HA ILE A 18 -0.558 -7.687 6.348 1.00 51.54 H new ATOM 0 HB ILE A 18 -2.341 -9.998 7.163 1.00 3.05 H new ATOM 0 HG12 ILE A 18 -3.745 -8.046 7.235 1.00 53.24 H new ATOM 0 HG13 ILE A 18 -3.304 -8.492 8.871 1.00 53.24 H new ATOM 0 HG21 ILE A 18 -1.212 -9.672 9.341 1.00 10.11 H new ATOM 0 HG22 ILE A 18 -0.046 -10.015 8.042 1.00 10.11 H new ATOM 0 HG23 ILE A 18 -0.251 -8.350 8.636 1.00 10.11 H new ATOM 0 HD11 ILE A 18 -3.220 -6.066 8.571 1.00 41.00 H new ATOM 0 HD12 ILE A 18 -1.596 -6.709 8.911 1.00 41.00 H new ATOM 0 HD13 ILE A 18 -2.044 -6.257 7.249 1.00 41.00 H new ATOM 298 N GLY A 19 0.833 -9.346 5.133 1.00 65.42 N ATOM 299 CA GLY A 19 1.676 -10.314 4.469 1.00 65.22 C ATOM 300 C GLY A 19 2.640 -10.965 5.428 1.00 63.23 C ATOM 301 O GLY A 19 3.035 -10.355 6.423 1.00 1.42 O ATOM 0 H GLY A 19 1.295 -8.466 5.364 1.00 65.42 H new ATOM 0 HA2 GLY A 19 1.055 -11.079 4.003 1.00 65.22 H new ATOM 0 HA3 GLY A 19 2.233 -9.824 3.670 1.00 65.22 H new ATOM 305 N GLY A 20 3.026 -12.198 5.140 1.00 12.44 N ATOM 306 CA GLY A 20 3.986 -12.886 5.977 1.00 22.45 C ATOM 307 C GLY A 20 3.424 -13.282 7.324 1.00 32.14 C ATOM 308 O GLY A 20 4.065 -13.084 8.355 1.00 71.12 O ATOM 0 H GLY A 20 2.691 -12.735 4.340 1.00 12.44 H new ATOM 0 HA2 GLY A 20 4.336 -13.779 5.459 1.00 22.45 H new ATOM 0 HA3 GLY A 20 4.854 -12.244 6.127 1.00 22.45 H new ATOM 312 N LEU A 21 2.214 -13.823 7.321 1.00 44.53 N ATOM 313 CA LEU A 21 1.632 -14.402 8.521 1.00 72.14 C ATOM 314 C LEU A 21 2.227 -15.780 8.767 1.00 15.30 C ATOM 315 O LEU A 21 2.978 -16.301 7.938 1.00 54.15 O ATOM 316 CB LEU A 21 0.111 -14.517 8.380 1.00 34.21 C ATOM 317 CG LEU A 21 -0.653 -13.196 8.410 1.00 23.14 C ATOM 318 CD1 LEU A 21 -2.121 -13.420 8.105 1.00 71.13 C ATOM 319 CD2 LEU A 21 -0.498 -12.532 9.762 1.00 4.22 C ATOM 0 H LEU A 21 1.615 -13.873 6.497 1.00 44.53 H new ATOM 0 HA LEU A 21 1.857 -13.751 9.365 1.00 72.14 H new ATOM 0 HB2 LEU A 21 -0.112 -15.025 7.442 1.00 34.21 H new ATOM 0 HB3 LEU A 21 -0.264 -15.152 9.183 1.00 34.21 H new ATOM 0 HG LEU A 21 -0.237 -12.541 7.644 1.00 23.14 H new ATOM 0 HD11 LEU A 21 -2.648 -12.466 8.131 1.00 71.13 H new ATOM 0 HD12 LEU A 21 -2.223 -13.864 7.115 1.00 71.13 H new ATOM 0 HD13 LEU A 21 -2.549 -14.091 8.849 1.00 71.13 H new ATOM 0 HD21 LEU A 21 -1.048 -11.591 9.770 1.00 4.22 H new ATOM 0 HD22 LEU A 21 -0.892 -13.189 10.537 1.00 4.22 H new ATOM 0 HD23 LEU A 21 0.557 -12.338 9.953 1.00 4.22 H new ATOM 331 N SER A 22 1.887 -16.375 9.894 1.00 20.41 N ATOM 332 CA SER A 22 2.382 -17.697 10.217 1.00 34.23 C ATOM 333 C SER A 22 1.478 -18.757 9.601 1.00 35.32 C ATOM 334 O SER A 22 0.506 -18.440 8.907 1.00 70.01 O ATOM 335 CB SER A 22 2.452 -17.880 11.736 1.00 4.25 C ATOM 336 OG SER A 22 1.158 -17.841 12.313 1.00 42.50 O ATOM 0 H SER A 22 1.273 -15.965 10.598 1.00 20.41 H new ATOM 0 HA SER A 22 3.386 -17.807 9.806 1.00 34.23 H new ATOM 0 HB2 SER A 22 2.930 -18.832 11.969 1.00 4.25 H new ATOM 0 HB3 SER A 22 3.072 -17.097 12.172 1.00 4.25 H new ATOM 0 HG SER A 22 1.234 -17.878 13.289 1.00 42.50 H new ATOM 342 N PHE A 23 1.800 -20.011 9.854 1.00 71.03 N ATOM 343 CA PHE A 23 0.979 -21.122 9.406 1.00 45.13 C ATOM 344 C PHE A 23 -0.196 -21.324 10.360 1.00 44.43 C ATOM 345 O PHE A 23 -1.116 -22.097 10.081 1.00 10.11 O ATOM 346 CB PHE A 23 1.844 -22.384 9.337 1.00 1.15 C ATOM 347 CG PHE A 23 1.229 -23.535 8.591 1.00 40.10 C ATOM 348 CD1 PHE A 23 0.910 -23.416 7.249 1.00 71.50 C ATOM 349 CD2 PHE A 23 0.989 -24.739 9.231 1.00 34.34 C ATOM 350 CE1 PHE A 23 0.363 -24.480 6.560 1.00 4.23 C ATOM 351 CE2 PHE A 23 0.445 -25.806 8.547 1.00 13.22 C ATOM 352 CZ PHE A 23 0.130 -25.677 7.209 1.00 52.23 C ATOM 0 H PHE A 23 2.633 -20.289 10.373 1.00 71.03 H new ATOM 0 HA PHE A 23 0.577 -20.909 8.416 1.00 45.13 H new ATOM 0 HB2 PHE A 23 2.793 -22.130 8.865 1.00 1.15 H new ATOM 0 HB3 PHE A 23 2.069 -22.708 10.353 1.00 1.15 H new ATOM 0 HD1 PHE A 23 1.091 -22.483 6.737 1.00 71.50 H new ATOM 0 HD2 PHE A 23 1.231 -24.844 10.278 1.00 34.34 H new ATOM 0 HE1 PHE A 23 0.117 -24.376 5.513 1.00 4.23 H new ATOM 0 HE2 PHE A 23 0.266 -26.741 9.057 1.00 13.22 H new ATOM 0 HZ PHE A 23 -0.298 -26.510 6.671 1.00 52.23 H new ATOM 362 N GLU A 24 -0.161 -20.613 11.484 1.00 4.43 N ATOM 363 CA GLU A 24 -1.142 -20.801 12.543 1.00 23.33 C ATOM 364 C GLU A 24 -1.907 -19.518 12.871 1.00 63.13 C ATOM 365 O GLU A 24 -2.523 -19.423 13.932 1.00 72.44 O ATOM 366 CB GLU A 24 -0.427 -21.314 13.791 1.00 31.14 C ATOM 367 CG GLU A 24 0.438 -22.532 13.517 1.00 61.01 C ATOM 368 CD GLU A 24 1.464 -22.779 14.596 1.00 51.44 C ATOM 369 OE1 GLU A 24 2.544 -22.157 14.542 1.00 62.55 O ATOM 370 OE2 GLU A 24 1.205 -23.604 15.493 1.00 52.42 O ATOM 0 H GLU A 24 0.540 -19.899 11.683 1.00 4.43 H new ATOM 0 HA GLU A 24 -1.878 -21.526 12.194 1.00 23.33 H new ATOM 0 HB2 GLU A 24 0.195 -20.518 14.201 1.00 31.14 H new ATOM 0 HB3 GLU A 24 -1.167 -21.564 14.551 1.00 31.14 H new ATOM 0 HG2 GLU A 24 -0.200 -23.410 13.422 1.00 61.01 H new ATOM 0 HG3 GLU A 24 0.947 -22.402 12.562 1.00 61.01 H new ATOM 377 N THR A 25 -1.899 -18.545 11.961 1.00 53.44 N ATOM 378 CA THR A 25 -2.618 -17.297 12.192 1.00 62.43 C ATOM 379 C THR A 25 -4.117 -17.474 11.940 1.00 15.22 C ATOM 380 O THR A 25 -4.542 -17.749 10.814 1.00 62.43 O ATOM 381 CB THR A 25 -2.097 -16.156 11.295 1.00 23.33 C ATOM 382 OG1 THR A 25 -0.678 -16.033 11.425 1.00 4.24 O ATOM 383 CG2 THR A 25 -2.753 -14.838 11.673 1.00 21.51 C ATOM 0 H THR A 25 -1.409 -18.597 11.068 1.00 53.44 H new ATOM 0 HA THR A 25 -2.447 -17.030 13.235 1.00 62.43 H new ATOM 0 HB THR A 25 -2.347 -16.395 10.261 1.00 23.33 H new ATOM 0 HG1 THR A 25 -0.306 -16.874 11.763 1.00 4.24 H new ATOM 0 HG21 THR A 25 -2.373 -14.045 11.029 1.00 21.51 H new ATOM 0 HG22 THR A 25 -3.833 -14.920 11.549 1.00 21.51 H new ATOM 0 HG23 THR A 25 -2.524 -14.603 12.712 1.00 21.51 H new ATOM 391 N THR A 26 -4.907 -17.325 12.991 1.00 10.22 N ATOM 392 CA THR A 26 -6.353 -17.396 12.886 1.00 75.10 C ATOM 393 C THR A 26 -6.948 -16.000 12.794 1.00 41.02 C ATOM 394 O THR A 26 -6.309 -15.022 13.190 1.00 12.52 O ATOM 395 CB THR A 26 -6.950 -18.141 14.089 1.00 51.23 C ATOM 396 OG1 THR A 26 -6.331 -17.685 15.296 1.00 35.30 O ATOM 397 CG2 THR A 26 -6.750 -19.639 13.939 1.00 43.23 C ATOM 0 H THR A 26 -4.565 -17.152 13.936 1.00 10.22 H new ATOM 0 HA THR A 26 -6.600 -17.946 11.978 1.00 75.10 H new ATOM 0 HB THR A 26 -8.020 -17.936 14.132 1.00 51.23 H new ATOM 0 HG1 THR A 26 -6.596 -18.266 16.039 1.00 35.30 H new ATOM 0 HG21 THR A 26 -7.179 -20.151 14.800 1.00 43.23 H new ATOM 0 HG22 THR A 26 -7.243 -19.983 13.030 1.00 43.23 H new ATOM 0 HG23 THR A 26 -5.684 -19.860 13.879 1.00 43.23 H new ATOM 405 N ASP A 27 -8.168 -15.914 12.266 1.00 1.40 N ATOM 406 CA ASP A 27 -8.857 -14.642 12.053 1.00 2.41 C ATOM 407 C ASP A 27 -9.035 -13.889 13.361 1.00 22.21 C ATOM 408 O ASP A 27 -8.791 -12.686 13.435 1.00 21.30 O ATOM 409 CB ASP A 27 -10.228 -14.918 11.425 1.00 12.22 C ATOM 410 CG ASP A 27 -10.886 -13.701 10.819 1.00 1.41 C ATOM 411 OD1 ASP A 27 -11.058 -12.680 11.520 1.00 15.54 O ATOM 412 OD2 ASP A 27 -11.268 -13.782 9.642 1.00 32.23 O ATOM 0 H ASP A 27 -8.709 -16.728 11.973 1.00 1.40 H new ATOM 0 HA ASP A 27 -8.255 -14.024 11.388 1.00 2.41 H new ATOM 0 HB2 ASP A 27 -10.115 -15.679 10.653 1.00 12.22 H new ATOM 0 HB3 ASP A 27 -10.888 -15.333 12.187 1.00 12.22 H new ATOM 417 N GLU A 28 -9.422 -14.623 14.395 1.00 55.14 N ATOM 418 CA GLU A 28 -9.729 -14.026 15.688 1.00 30.43 C ATOM 419 C GLU A 28 -8.479 -13.453 16.352 1.00 71.24 C ATOM 420 O GLU A 28 -8.541 -12.419 17.007 1.00 2.42 O ATOM 421 CB GLU A 28 -10.400 -15.047 16.608 1.00 12.14 C ATOM 422 CG GLU A 28 -9.649 -16.365 16.728 1.00 41.53 C ATOM 423 CD GLU A 28 -10.289 -17.304 17.722 1.00 2.54 C ATOM 424 OE1 GLU A 28 -11.242 -18.015 17.347 1.00 20.44 O ATOM 425 OE2 GLU A 28 -9.838 -17.339 18.883 1.00 14.42 O ATOM 0 H GLU A 28 -9.531 -15.637 14.363 1.00 55.14 H new ATOM 0 HA GLU A 28 -10.422 -13.203 15.513 1.00 30.43 H new ATOM 0 HB2 GLU A 28 -10.506 -14.610 17.601 1.00 12.14 H new ATOM 0 HB3 GLU A 28 -11.406 -15.247 16.238 1.00 12.14 H new ATOM 0 HG2 GLU A 28 -9.608 -16.847 15.751 1.00 41.53 H new ATOM 0 HG3 GLU A 28 -8.620 -16.168 17.029 1.00 41.53 H new ATOM 432 N SER A 29 -7.346 -14.113 16.148 1.00 44.34 N ATOM 433 CA SER A 29 -6.092 -13.686 16.752 1.00 35.34 C ATOM 434 C SER A 29 -5.486 -12.521 15.976 1.00 33.53 C ATOM 435 O SER A 29 -4.901 -11.613 16.566 1.00 45.53 O ATOM 436 CB SER A 29 -5.116 -14.856 16.804 1.00 53.13 C ATOM 437 OG SER A 29 -5.719 -15.985 17.417 1.00 64.22 O ATOM 0 H SER A 29 -7.271 -14.948 15.567 1.00 44.34 H new ATOM 0 HA SER A 29 -6.293 -13.347 17.768 1.00 35.34 H new ATOM 0 HB2 SER A 29 -4.794 -15.113 15.795 1.00 53.13 H new ATOM 0 HB3 SER A 29 -4.224 -14.567 17.360 1.00 53.13 H new ATOM 0 HG SER A 29 -5.968 -16.637 16.729 1.00 64.22 H new ATOM 443 N LEU A 30 -5.643 -12.556 14.654 1.00 41.55 N ATOM 444 CA LEU A 30 -5.166 -11.483 13.790 1.00 22.32 C ATOM 445 C LEU A 30 -5.939 -10.200 14.076 1.00 41.43 C ATOM 446 O LEU A 30 -5.347 -9.146 14.310 1.00 25.41 O ATOM 447 CB LEU A 30 -5.324 -11.884 12.316 1.00 12.13 C ATOM 448 CG LEU A 30 -4.762 -10.892 11.292 1.00 32.53 C ATOM 449 CD1 LEU A 30 -3.260 -10.741 11.457 1.00 31.53 C ATOM 450 CD2 LEU A 30 -5.092 -11.343 9.876 1.00 62.02 C ATOM 0 H LEU A 30 -6.100 -13.321 14.158 1.00 41.55 H new ATOM 0 HA LEU A 30 -4.109 -11.307 13.993 1.00 22.32 H new ATOM 0 HB2 LEU A 30 -4.836 -12.847 12.167 1.00 12.13 H new ATOM 0 HB3 LEU A 30 -6.385 -12.029 12.110 1.00 12.13 H new ATOM 0 HG LEU A 30 -5.228 -9.922 11.468 1.00 32.53 H new ATOM 0 HD11 LEU A 30 -2.882 -10.032 10.720 1.00 31.53 H new ATOM 0 HD12 LEU A 30 -3.039 -10.374 12.459 1.00 31.53 H new ATOM 0 HD13 LEU A 30 -2.779 -11.708 11.310 1.00 31.53 H new ATOM 0 HD21 LEU A 30 -4.685 -10.627 9.162 1.00 62.02 H new ATOM 0 HD22 LEU A 30 -4.654 -12.324 9.695 1.00 62.02 H new ATOM 0 HD23 LEU A 30 -6.174 -11.401 9.755 1.00 62.02 H new ATOM 462 N ARG A 31 -7.263 -10.317 14.052 1.00 4.42 N ATOM 463 CA ARG A 31 -8.163 -9.227 14.395 1.00 61.41 C ATOM 464 C ARG A 31 -7.860 -8.644 15.769 1.00 12.10 C ATOM 465 O ARG A 31 -7.542 -7.470 15.877 1.00 65.33 O ATOM 466 CB ARG A 31 -9.593 -9.746 14.354 1.00 5.11 C ATOM 467 CG ARG A 31 -10.651 -8.697 14.622 1.00 44.41 C ATOM 468 CD ARG A 31 -12.032 -9.318 14.599 1.00 21.41 C ATOM 469 NE ARG A 31 -12.223 -10.184 13.429 1.00 23.14 N ATOM 470 CZ ARG A 31 -13.358 -10.293 12.744 1.00 62.22 C ATOM 471 NH1 ARG A 31 -14.431 -9.601 13.102 1.00 34.55 N ATOM 472 NH2 ARG A 31 -13.410 -11.104 11.696 1.00 1.13 N ATOM 0 H ARG A 31 -7.743 -11.179 13.792 1.00 4.42 H new ATOM 0 HA ARG A 31 -8.025 -8.425 13.670 1.00 61.41 H new ATOM 0 HB2 ARG A 31 -9.778 -10.188 13.375 1.00 5.11 H new ATOM 0 HB3 ARG A 31 -9.697 -10.545 15.089 1.00 5.11 H new ATOM 0 HG2 ARG A 31 -10.472 -8.231 15.591 1.00 44.41 H new ATOM 0 HG3 ARG A 31 -10.588 -7.909 13.872 1.00 44.41 H new ATOM 0 HD2 ARG A 31 -12.184 -9.898 15.509 1.00 21.41 H new ATOM 0 HD3 ARG A 31 -12.785 -8.530 14.594 1.00 21.41 H new ATOM 0 HE ARG A 31 -11.428 -10.743 13.119 1.00 23.14 H new ATOM 0 HH11 ARG A 31 -14.391 -8.978 13.909 1.00 34.55 H new ATOM 0 HH12 ARG A 31 -15.297 -9.691 12.570 1.00 34.55 H new ATOM 0 HH21 ARG A 31 -12.585 -11.637 11.422 1.00 1.13 H new ATOM 0 HH22 ARG A 31 -14.275 -11.195 11.164 1.00 1.13 H new ATOM 486 N SER A 32 -7.961 -9.483 16.800 1.00 21.35 N ATOM 487 CA SER A 32 -7.705 -9.082 18.190 1.00 32.01 C ATOM 488 C SER A 32 -6.388 -8.313 18.355 1.00 40.15 C ATOM 489 O SER A 32 -6.293 -7.413 19.190 1.00 42.51 O ATOM 490 CB SER A 32 -7.687 -10.326 19.079 1.00 75.45 C ATOM 491 OG SER A 32 -7.664 -9.990 20.454 1.00 24.14 O ATOM 0 H SER A 32 -8.223 -10.463 16.698 1.00 21.35 H new ATOM 0 HA SER A 32 -8.508 -8.407 18.487 1.00 32.01 H new ATOM 0 HB2 SER A 32 -8.566 -10.936 18.869 1.00 75.45 H new ATOM 0 HB3 SER A 32 -6.814 -10.932 18.838 1.00 75.45 H new ATOM 0 HG SER A 32 -7.655 -10.810 20.991 1.00 24.14 H new ATOM 497 N HIS A 33 -5.387 -8.660 17.554 1.00 13.24 N ATOM 498 CA HIS A 33 -4.092 -8.001 17.636 1.00 54.51 C ATOM 499 C HIS A 33 -4.161 -6.589 17.054 1.00 72.41 C ATOM 500 O HIS A 33 -3.857 -5.623 17.739 1.00 5.41 O ATOM 501 CB HIS A 33 -3.018 -8.813 16.916 1.00 12.41 C ATOM 502 CG HIS A 33 -1.632 -8.509 17.394 1.00 34.05 C ATOM 503 ND1 HIS A 33 -0.756 -7.765 16.643 1.00 73.24 N ATOM 504 CD2 HIS A 33 -1.025 -8.874 18.548 1.00 52.31 C ATOM 505 CE1 HIS A 33 0.358 -7.697 17.350 1.00 11.20 C ATOM 506 NE2 HIS A 33 0.240 -8.354 18.511 1.00 33.02 N ATOM 0 H HIS A 33 -5.448 -9.390 16.844 1.00 13.24 H new ATOM 0 HA HIS A 33 -3.823 -7.930 18.690 1.00 54.51 H new ATOM 0 HB2 HIS A 33 -3.219 -9.875 17.056 1.00 12.41 H new ATOM 0 HB3 HIS A 33 -3.078 -8.615 15.846 1.00 12.41 H new ATOM 0 HD2 HIS A 33 -1.456 -9.462 19.344 1.00 52.31 H new ATOM 0 HE1 HIS A 33 1.250 -7.178 17.032 1.00 11.20 H new ATOM 0 HE2 HIS A 33 0.957 -8.449 19.231 1.00 33.02 H new ATOM 514 N PHE A 34 -4.592 -6.469 15.802 1.00 32.35 N ATOM 515 CA PHE A 34 -4.654 -5.166 15.135 1.00 3.14 C ATOM 516 C PHE A 34 -5.744 -4.270 15.730 1.00 43.25 C ATOM 517 O PHE A 34 -5.674 -3.042 15.634 1.00 40.10 O ATOM 518 CB PHE A 34 -4.871 -5.347 13.634 1.00 4.42 C ATOM 519 CG PHE A 34 -3.615 -5.715 12.895 1.00 72.54 C ATOM 520 CD1 PHE A 34 -2.734 -4.734 12.470 1.00 13.14 C ATOM 521 CD2 PHE A 34 -3.315 -7.040 12.626 1.00 21.23 C ATOM 522 CE1 PHE A 34 -1.578 -5.069 11.792 1.00 22.30 C ATOM 523 CE2 PHE A 34 -2.161 -7.379 11.947 1.00 13.45 C ATOM 524 CZ PHE A 34 -1.290 -6.395 11.530 1.00 61.52 C ATOM 0 H PHE A 34 -4.903 -7.253 15.228 1.00 32.35 H new ATOM 0 HA PHE A 34 -3.698 -4.668 15.299 1.00 3.14 H new ATOM 0 HB2 PHE A 34 -5.620 -6.122 13.472 1.00 4.42 H new ATOM 0 HB3 PHE A 34 -5.273 -4.423 13.217 1.00 4.42 H new ATOM 0 HD1 PHE A 34 -2.953 -3.696 12.671 1.00 13.14 H new ATOM 0 HD2 PHE A 34 -3.991 -7.817 12.951 1.00 21.23 H new ATOM 0 HE1 PHE A 34 -0.899 -4.295 11.467 1.00 22.30 H new ATOM 0 HE2 PHE A 34 -1.941 -8.416 11.742 1.00 13.45 H new ATOM 0 HZ PHE A 34 -0.386 -6.659 11.001 1.00 61.52 H new ATOM 534 N GLU A 35 -6.742 -4.899 16.345 1.00 10.43 N ATOM 535 CA GLU A 35 -7.837 -4.205 17.027 1.00 45.20 C ATOM 536 C GLU A 35 -7.329 -3.270 18.131 1.00 43.50 C ATOM 537 O GLU A 35 -8.031 -2.348 18.544 1.00 14.53 O ATOM 538 CB GLU A 35 -8.785 -5.243 17.628 1.00 21.31 C ATOM 539 CG GLU A 35 -10.166 -4.714 17.959 1.00 31.33 C ATOM 540 CD GLU A 35 -11.030 -5.768 18.613 1.00 45.04 C ATOM 541 OE1 GLU A 35 -11.443 -6.716 17.920 1.00 72.02 O ATOM 542 OE2 GLU A 35 -11.300 -5.653 19.827 1.00 3.00 O ATOM 0 H GLU A 35 -6.816 -5.915 16.386 1.00 10.43 H new ATOM 0 HA GLU A 35 -8.357 -3.590 16.293 1.00 45.20 H new ATOM 0 HB2 GLU A 35 -8.885 -6.073 16.929 1.00 21.31 H new ATOM 0 HB3 GLU A 35 -8.336 -5.644 18.536 1.00 21.31 H new ATOM 0 HG2 GLU A 35 -10.076 -3.854 18.623 1.00 31.33 H new ATOM 0 HG3 GLU A 35 -10.649 -4.363 17.047 1.00 31.33 H new ATOM 549 N GLN A 36 -6.110 -3.520 18.607 1.00 10.33 N ATOM 550 CA GLN A 36 -5.485 -2.694 19.641 1.00 73.44 C ATOM 551 C GLN A 36 -5.300 -1.250 19.181 1.00 40.32 C ATOM 552 O GLN A 36 -5.329 -0.325 19.992 1.00 22.35 O ATOM 553 CB GLN A 36 -4.125 -3.269 20.038 1.00 34.00 C ATOM 554 CG GLN A 36 -4.198 -4.642 20.679 1.00 52.54 C ATOM 555 CD GLN A 36 -2.830 -5.203 21.006 1.00 41.25 C ATOM 556 OE1 GLN A 36 -2.305 -4.998 22.100 1.00 5.31 O ATOM 557 NE2 GLN A 36 -2.231 -5.895 20.051 1.00 54.30 N ATOM 0 H GLN A 36 -5.530 -4.296 18.289 1.00 10.33 H new ATOM 0 HA GLN A 36 -6.155 -2.700 20.500 1.00 73.44 H new ATOM 0 HB2 GLN A 36 -3.494 -3.327 19.151 1.00 34.00 H new ATOM 0 HB3 GLN A 36 -3.640 -2.581 20.731 1.00 34.00 H new ATOM 0 HG2 GLN A 36 -4.790 -4.582 21.592 1.00 52.54 H new ATOM 0 HG3 GLN A 36 -4.716 -5.326 20.007 1.00 52.54 H new ATOM 0 HE21 GLN A 36 -2.700 -6.043 19.157 1.00 54.30 H new ATOM 0 HE22 GLN A 36 -1.300 -6.281 20.208 1.00 54.30 H new ATOM 566 N TRP A 37 -5.130 -1.058 17.880 1.00 51.10 N ATOM 567 CA TRP A 37 -4.859 0.265 17.338 1.00 22.32 C ATOM 568 C TRP A 37 -6.136 0.929 16.842 1.00 1.00 C ATOM 569 O TRP A 37 -6.195 2.153 16.700 1.00 22.12 O ATOM 570 CB TRP A 37 -3.812 0.180 16.225 1.00 32.52 C ATOM 571 CG TRP A 37 -2.447 -0.135 16.757 1.00 23.15 C ATOM 572 CD1 TRP A 37 -1.504 0.762 17.162 1.00 54.04 C ATOM 573 CD2 TRP A 37 -1.880 -1.435 16.964 1.00 22.24 C ATOM 574 NE1 TRP A 37 -0.389 0.100 17.613 1.00 2.12 N ATOM 575 CE2 TRP A 37 -0.594 -1.249 17.499 1.00 51.44 C ATOM 576 CE3 TRP A 37 -2.335 -2.737 16.749 1.00 54.44 C ATOM 577 CZ2 TRP A 37 0.242 -2.314 17.822 1.00 63.44 C ATOM 578 CZ3 TRP A 37 -1.505 -3.794 17.071 1.00 3.02 C ATOM 579 CH2 TRP A 37 -0.230 -3.578 17.604 1.00 2.14 C ATOM 0 H TRP A 37 -5.175 -1.800 17.182 1.00 51.10 H new ATOM 0 HA TRP A 37 -4.458 0.887 18.139 1.00 22.32 H new ATOM 0 HB2 TRP A 37 -4.107 -0.587 15.508 1.00 32.52 H new ATOM 0 HB3 TRP A 37 -3.780 1.126 15.685 1.00 32.52 H new ATOM 0 HD1 TRP A 37 -1.617 1.836 17.132 1.00 54.04 H new ATOM 0 HE1 TRP A 37 0.456 0.542 17.975 1.00 2.12 H new ATOM 0 HE3 TRP A 37 -3.318 -2.915 16.338 1.00 54.44 H new ATOM 0 HZ2 TRP A 37 1.228 -2.148 18.230 1.00 63.44 H new ATOM 0 HZ3 TRP A 37 -1.847 -4.805 16.908 1.00 3.02 H new ATOM 0 HH2 TRP A 37 0.393 -4.426 17.848 1.00 2.14 H new ATOM 590 N GLY A 38 -7.155 0.125 16.570 1.00 45.11 N ATOM 591 CA GLY A 38 -8.445 0.674 16.223 1.00 73.44 C ATOM 592 C GLY A 38 -9.479 -0.401 15.978 1.00 22.14 C ATOM 593 O GLY A 38 -9.136 -1.570 15.801 1.00 23.03 O ATOM 0 H GLY A 38 -7.109 -0.894 16.584 1.00 45.11 H new ATOM 0 HA2 GLY A 38 -8.787 1.328 17.025 1.00 73.44 H new ATOM 0 HA3 GLY A 38 -8.347 1.291 15.330 1.00 73.44 H new ATOM 597 N THR A 39 -10.743 0.003 15.973 1.00 33.13 N ATOM 598 CA THR A 39 -11.852 -0.913 15.754 1.00 71.54 C ATOM 599 C THR A 39 -11.794 -1.547 14.370 1.00 55.25 C ATOM 600 O THR A 39 -11.802 -0.852 13.356 1.00 43.21 O ATOM 601 CB THR A 39 -13.201 -0.192 15.908 1.00 24.35 C ATOM 602 OG1 THR A 39 -13.281 0.416 17.200 1.00 52.34 O ATOM 603 CG2 THR A 39 -14.355 -1.163 15.719 1.00 60.52 C ATOM 0 H THR A 39 -11.026 0.972 16.120 1.00 33.13 H new ATOM 0 HA THR A 39 -11.764 -1.695 16.508 1.00 71.54 H new ATOM 0 HB THR A 39 -13.271 0.579 15.141 1.00 24.35 H new ATOM 0 HG1 THR A 39 -14.142 0.876 17.293 1.00 52.34 H new ATOM 0 HG21 THR A 39 -15.300 -0.632 15.832 1.00 60.52 H new ATOM 0 HG22 THR A 39 -14.302 -1.601 14.722 1.00 60.52 H new ATOM 0 HG23 THR A 39 -14.292 -1.954 16.467 1.00 60.52 H new ATOM 611 N LEU A 40 -11.700 -2.864 14.346 1.00 52.23 N ATOM 612 CA LEU A 40 -11.772 -3.602 13.100 1.00 72.43 C ATOM 613 C LEU A 40 -13.213 -3.936 12.754 1.00 53.30 C ATOM 614 O LEU A 40 -13.896 -4.656 13.478 1.00 50.33 O ATOM 615 CB LEU A 40 -10.922 -4.871 13.166 1.00 31.43 C ATOM 616 CG LEU A 40 -9.418 -4.633 13.314 1.00 41.04 C ATOM 617 CD1 LEU A 40 -8.670 -5.945 13.295 1.00 43.12 C ATOM 618 CD2 LEU A 40 -8.900 -3.729 12.212 1.00 35.02 C ATOM 0 H LEU A 40 -11.574 -3.444 15.176 1.00 52.23 H new ATOM 0 HA LEU A 40 -11.370 -2.968 12.309 1.00 72.43 H new ATOM 0 HB2 LEU A 40 -11.264 -5.476 14.006 1.00 31.43 H new ATOM 0 HB3 LEU A 40 -11.095 -5.454 12.262 1.00 31.43 H new ATOM 0 HG LEU A 40 -9.250 -4.142 14.273 1.00 41.04 H new ATOM 0 HD11 LEU A 40 -7.602 -5.756 13.401 1.00 43.12 H new ATOM 0 HD12 LEU A 40 -9.012 -6.571 14.119 1.00 43.12 H new ATOM 0 HD13 LEU A 40 -8.856 -6.456 12.350 1.00 43.12 H new ATOM 0 HD21 LEU A 40 -7.828 -3.576 12.341 1.00 35.02 H new ATOM 0 HD22 LEU A 40 -9.087 -4.193 11.243 1.00 35.02 H new ATOM 0 HD23 LEU A 40 -9.412 -2.768 12.259 1.00 35.02 H new ATOM 630 N THR A 41 -13.659 -3.394 11.637 1.00 74.24 N ATOM 631 CA THR A 41 -15.012 -3.607 11.166 1.00 24.11 C ATOM 632 C THR A 41 -15.098 -4.908 10.379 1.00 51.34 C ATOM 633 O THR A 41 -16.158 -5.536 10.295 1.00 35.44 O ATOM 634 CB THR A 41 -15.481 -2.432 10.291 1.00 51.22 C ATOM 635 OG1 THR A 41 -14.466 -2.094 9.336 1.00 11.42 O ATOM 636 CG2 THR A 41 -15.799 -1.219 11.149 1.00 74.55 C ATOM 0 H THR A 41 -13.095 -2.796 11.033 1.00 74.24 H new ATOM 0 HA THR A 41 -15.667 -3.672 12.035 1.00 24.11 H new ATOM 0 HB THR A 41 -16.386 -2.736 9.765 1.00 51.22 H new ATOM 0 HG1 THR A 41 -14.774 -1.346 8.783 1.00 11.42 H new ATOM 0 HG21 THR A 41 -16.129 -0.399 10.511 1.00 74.55 H new ATOM 0 HG22 THR A 41 -16.590 -1.470 11.855 1.00 74.55 H new ATOM 0 HG23 THR A 41 -14.906 -0.917 11.697 1.00 74.55 H new ATOM 644 N ASP A 42 -13.966 -5.309 9.815 1.00 25.25 N ATOM 645 CA ASP A 42 -13.871 -6.553 9.066 1.00 61.34 C ATOM 646 C ASP A 42 -12.468 -7.114 9.193 1.00 72.44 C ATOM 647 O ASP A 42 -11.515 -6.362 9.382 1.00 55.43 O ATOM 648 CB ASP A 42 -14.190 -6.315 7.588 1.00 71.32 C ATOM 649 CG ASP A 42 -14.602 -7.580 6.865 1.00 11.32 C ATOM 650 OD1 ASP A 42 -15.794 -7.942 6.923 1.00 64.24 O ATOM 651 OD2 ASP A 42 -13.737 -8.213 6.227 1.00 52.33 O ATOM 0 H ASP A 42 -13.093 -4.784 9.864 1.00 25.25 H new ATOM 0 HA ASP A 42 -14.592 -7.262 9.472 1.00 61.34 H new ATOM 0 HB2 ASP A 42 -14.990 -5.579 7.508 1.00 71.32 H new ATOM 0 HB3 ASP A 42 -13.315 -5.890 7.096 1.00 71.32 H new ATOM 656 N CYS A 43 -12.343 -8.423 9.129 1.00 40.25 N ATOM 657 CA CYS A 43 -11.043 -9.069 9.123 1.00 11.44 C ATOM 658 C CYS A 43 -11.193 -10.470 8.571 1.00 22.20 C ATOM 659 O CYS A 43 -12.193 -11.130 8.848 1.00 42.31 O ATOM 660 CB CYS A 43 -10.468 -9.118 10.545 1.00 21.43 C ATOM 661 SG CYS A 43 -9.115 -10.294 10.777 1.00 34.24 S ATOM 0 H CYS A 43 -13.132 -9.067 9.080 1.00 40.25 H new ATOM 0 HA CYS A 43 -10.356 -8.501 8.496 1.00 11.44 H new ATOM 0 HB2 CYS A 43 -10.115 -8.122 10.813 1.00 21.43 H new ATOM 0 HB3 CYS A 43 -11.271 -9.369 11.238 1.00 21.43 H new ATOM 0 HG CYS A 43 -9.600 -11.453 11.113 1.00 34.24 H new ATOM 667 N VAL A 44 -10.253 -10.895 7.739 1.00 32.24 N ATOM 668 CA VAL A 44 -10.205 -12.278 7.311 1.00 22.53 C ATOM 669 C VAL A 44 -8.777 -12.695 6.966 1.00 71.33 C ATOM 670 O VAL A 44 -8.106 -12.070 6.142 1.00 24.41 O ATOM 671 CB VAL A 44 -11.173 -12.562 6.127 1.00 31.21 C ATOM 672 CG1 VAL A 44 -10.927 -11.624 4.955 1.00 74.01 C ATOM 673 CG2 VAL A 44 -11.077 -14.017 5.685 1.00 2.33 C ATOM 0 H VAL A 44 -9.519 -10.303 7.351 1.00 32.24 H new ATOM 0 HA VAL A 44 -10.545 -12.884 8.151 1.00 22.53 H new ATOM 0 HB VAL A 44 -12.186 -12.376 6.485 1.00 31.21 H new ATOM 0 HG11 VAL A 44 -11.624 -11.857 4.150 1.00 74.01 H new ATOM 0 HG12 VAL A 44 -11.075 -10.593 5.277 1.00 74.01 H new ATOM 0 HG13 VAL A 44 -9.905 -11.749 4.597 1.00 74.01 H new ATOM 0 HG21 VAL A 44 -11.763 -14.191 4.856 1.00 2.33 H new ATOM 0 HG22 VAL A 44 -10.058 -14.233 5.364 1.00 2.33 H new ATOM 0 HG23 VAL A 44 -11.341 -14.668 6.518 1.00 2.33 H new ATOM 683 N VAL A 45 -8.303 -13.730 7.641 1.00 73.30 N ATOM 684 CA VAL A 45 -7.035 -14.345 7.294 1.00 73.23 C ATOM 685 C VAL A 45 -7.283 -15.372 6.196 1.00 72.00 C ATOM 686 O VAL A 45 -8.262 -16.120 6.243 1.00 30.43 O ATOM 687 CB VAL A 45 -6.349 -15.009 8.520 1.00 14.14 C ATOM 688 CG1 VAL A 45 -7.239 -16.068 9.141 1.00 5.05 C ATOM 689 CG2 VAL A 45 -5.002 -15.611 8.143 1.00 12.42 C ATOM 0 H VAL A 45 -8.779 -14.161 8.433 1.00 73.30 H new ATOM 0 HA VAL A 45 -6.354 -13.570 6.942 1.00 73.23 H new ATOM 0 HB VAL A 45 -6.180 -14.225 9.258 1.00 14.14 H new ATOM 0 HG11 VAL A 45 -6.731 -16.514 9.996 1.00 5.05 H new ATOM 0 HG12 VAL A 45 -8.172 -15.611 9.471 1.00 5.05 H new ATOM 0 HG13 VAL A 45 -7.454 -16.841 8.403 1.00 5.05 H new ATOM 0 HG21 VAL A 45 -4.548 -16.067 9.023 1.00 12.42 H new ATOM 0 HG22 VAL A 45 -5.145 -16.370 7.374 1.00 12.42 H new ATOM 0 HG23 VAL A 45 -4.347 -14.827 7.762 1.00 12.42 H new ATOM 699 N MET A 46 -6.434 -15.390 5.188 1.00 41.55 N ATOM 700 CA MET A 46 -6.621 -16.316 4.091 1.00 21.41 C ATOM 701 C MET A 46 -6.081 -17.679 4.451 1.00 3.21 C ATOM 702 O MET A 46 -4.877 -17.915 4.447 1.00 1.54 O ATOM 703 CB MET A 46 -5.966 -15.825 2.812 1.00 41.35 C ATOM 704 CG MET A 46 -6.522 -14.508 2.296 1.00 13.42 C ATOM 705 SD MET A 46 -7.931 -14.703 1.183 1.00 32.12 S ATOM 706 CE MET A 46 -9.244 -15.074 2.344 1.00 72.02 C ATOM 0 H MET A 46 -5.619 -14.783 5.106 1.00 41.55 H new ATOM 0 HA MET A 46 -7.694 -16.386 3.911 1.00 21.41 H new ATOM 0 HB2 MET A 46 -4.896 -15.712 2.985 1.00 41.35 H new ATOM 0 HB3 MET A 46 -6.086 -16.585 2.040 1.00 41.35 H new ATOM 0 HG2 MET A 46 -6.822 -13.893 3.144 1.00 13.42 H new ATOM 0 HG3 MET A 46 -5.731 -13.968 1.776 1.00 13.42 H new ATOM 0 HE1 MET A 46 -10.176 -14.632 1.992 1.00 72.02 H new ATOM 0 HE2 MET A 46 -9.363 -16.154 2.426 1.00 72.02 H new ATOM 0 HE3 MET A 46 -8.993 -14.661 3.321 1.00 72.02 H new ATOM 716 N ARG A 47 -6.990 -18.547 4.820 1.00 3.02 N ATOM 717 CA ARG A 47 -6.664 -19.929 5.091 1.00 21.32 C ATOM 718 C ARG A 47 -7.072 -20.778 3.907 1.00 23.23 C ATOM 719 O ARG A 47 -7.914 -20.371 3.106 1.00 1.05 O ATOM 720 CB ARG A 47 -7.360 -20.413 6.370 1.00 55.05 C ATOM 721 CG ARG A 47 -6.910 -19.664 7.614 1.00 62.34 C ATOM 722 CD ARG A 47 -7.834 -19.912 8.796 1.00 23.52 C ATOM 723 NE ARG A 47 -7.706 -21.263 9.344 1.00 74.11 N ATOM 724 CZ ARG A 47 -8.141 -21.625 10.557 1.00 33.22 C ATOM 725 NH1 ARG A 47 -8.727 -20.739 11.353 1.00 50.42 N ATOM 726 NH2 ARG A 47 -7.993 -22.877 10.965 1.00 51.40 N ATOM 0 H ARG A 47 -7.976 -18.318 4.941 1.00 3.02 H new ATOM 0 HA ARG A 47 -5.589 -20.019 5.246 1.00 21.32 H new ATOM 0 HB2 ARG A 47 -8.438 -20.300 6.255 1.00 55.05 H new ATOM 0 HB3 ARG A 47 -7.164 -21.477 6.503 1.00 55.05 H new ATOM 0 HG2 ARG A 47 -5.897 -19.971 7.875 1.00 62.34 H new ATOM 0 HG3 ARG A 47 -6.874 -18.596 7.400 1.00 62.34 H new ATOM 0 HD2 ARG A 47 -7.617 -19.185 9.579 1.00 23.52 H new ATOM 0 HD3 ARG A 47 -8.866 -19.747 8.485 1.00 23.52 H new ATOM 0 HE ARG A 47 -7.257 -21.973 8.765 1.00 74.11 H new ATOM 0 HH11 ARG A 47 -8.848 -19.775 11.042 1.00 50.42 H new ATOM 0 HH12 ARG A 47 -9.056 -21.022 12.276 1.00 50.42 H new ATOM 0 HH21 ARG A 47 -7.548 -23.563 10.355 1.00 51.40 H new ATOM 0 HH22 ARG A 47 -8.324 -23.155 11.889 1.00 51.40 H new ATOM 740 N ASP A 48 -6.470 -21.940 3.785 1.00 3.33 N ATOM 741 CA ASP A 48 -6.736 -22.807 2.659 1.00 12.42 C ATOM 742 C ASP A 48 -8.054 -23.538 2.864 1.00 40.14 C ATOM 743 O ASP A 48 -8.314 -24.040 3.947 1.00 43.42 O ATOM 744 CB ASP A 48 -5.611 -23.820 2.488 1.00 75.12 C ATOM 745 CG ASP A 48 -5.615 -24.426 1.105 1.00 3.35 C ATOM 746 OD1 ASP A 48 -4.975 -23.858 0.201 1.00 2.33 O ATOM 747 OD2 ASP A 48 -6.275 -25.460 0.910 1.00 23.23 O ATOM 0 H ASP A 48 -5.792 -22.307 4.453 1.00 3.33 H new ATOM 0 HA ASP A 48 -6.799 -22.194 1.760 1.00 12.42 H new ATOM 0 HB2 ASP A 48 -4.652 -23.334 2.670 1.00 75.12 H new ATOM 0 HB3 ASP A 48 -5.715 -24.610 3.232 1.00 75.12 H new ATOM 752 N PRO A 49 -8.923 -23.573 1.852 1.00 43.01 N ATOM 753 CA PRO A 49 -10.186 -24.319 1.925 1.00 14.31 C ATOM 754 C PRO A 49 -9.999 -25.832 2.089 1.00 11.21 C ATOM 755 O PRO A 49 -10.899 -26.519 2.567 1.00 13.24 O ATOM 756 CB PRO A 49 -10.872 -24.010 0.591 1.00 2.11 C ATOM 757 CG PRO A 49 -9.803 -23.480 -0.303 1.00 11.34 C ATOM 758 CD PRO A 49 -8.784 -22.835 0.589 1.00 33.44 C ATOM 0 HA PRO A 49 -10.761 -24.021 2.801 1.00 14.31 H new ATOM 0 HB2 PRO A 49 -11.326 -24.906 0.168 1.00 2.11 H new ATOM 0 HB3 PRO A 49 -11.670 -23.279 0.722 1.00 2.11 H new ATOM 0 HG2 PRO A 49 -9.354 -24.282 -0.889 1.00 11.34 H new ATOM 0 HG3 PRO A 49 -10.211 -22.759 -1.011 1.00 11.34 H new ATOM 0 HD2 PRO A 49 -7.778 -22.924 0.180 1.00 33.44 H new ATOM 0 HD3 PRO A 49 -8.981 -21.771 0.721 1.00 33.44 H new ATOM 766 N ASN A 50 -8.839 -26.355 1.700 1.00 70.55 N ATOM 767 CA ASN A 50 -8.606 -27.793 1.757 1.00 41.33 C ATOM 768 C ASN A 50 -8.102 -28.203 3.128 1.00 3.05 C ATOM 769 O ASN A 50 -8.693 -29.049 3.800 1.00 20.41 O ATOM 770 CB ASN A 50 -7.600 -28.235 0.696 1.00 40.25 C ATOM 771 CG ASN A 50 -8.095 -27.979 -0.707 1.00 75.21 C ATOM 772 OD1 ASN A 50 -8.684 -28.851 -1.346 1.00 25.51 O ATOM 773 ND2 ASN A 50 -7.862 -26.779 -1.186 1.00 0.24 N ATOM 0 H ASN A 50 -8.053 -25.810 1.345 1.00 70.55 H new ATOM 0 HA ASN A 50 -9.560 -28.283 1.562 1.00 41.33 H new ATOM 0 HB2 ASN A 50 -6.659 -27.707 0.849 1.00 40.25 H new ATOM 0 HB3 ASN A 50 -7.392 -29.298 0.817 1.00 40.25 H new ATOM 0 HD21 ASN A 50 -8.173 -26.536 -2.126 1.00 0.24 H new ATOM 0 HD22 ASN A 50 -7.370 -26.090 -0.618 1.00 0.24 H new ATOM 780 N THR A 51 -7.010 -27.571 3.539 1.00 60.23 N ATOM 781 CA THR A 51 -6.310 -27.941 4.758 1.00 35.41 C ATOM 782 C THR A 51 -6.727 -27.090 5.944 1.00 40.34 C ATOM 783 O THR A 51 -6.432 -27.429 7.091 1.00 4.11 O ATOM 784 CB THR A 51 -4.797 -27.801 4.555 1.00 1.51 C ATOM 785 OG1 THR A 51 -4.514 -26.587 3.847 1.00 45.24 O ATOM 786 CG2 THR A 51 -4.237 -28.988 3.791 1.00 1.04 C ATOM 0 H THR A 51 -6.587 -26.790 3.037 1.00 60.23 H new ATOM 0 HA THR A 51 -6.574 -28.976 4.975 1.00 35.41 H new ATOM 0 HB THR A 51 -4.320 -27.771 5.535 1.00 1.51 H new ATOM 0 HG1 THR A 51 -3.546 -26.500 3.721 1.00 45.24 H new ATOM 0 HG21 THR A 51 -3.162 -28.863 3.661 1.00 1.04 H new ATOM 0 HG22 THR A 51 -4.431 -29.904 4.349 1.00 1.04 H new ATOM 0 HG23 THR A 51 -4.716 -29.050 2.814 1.00 1.04 H new ATOM 794 N LYS A 52 -7.398 -25.981 5.652 1.00 35.43 N ATOM 795 CA LYS A 52 -7.888 -25.039 6.665 1.00 21.11 C ATOM 796 C LYS A 52 -6.734 -24.384 7.417 1.00 43.52 C ATOM 797 O LYS A 52 -6.891 -23.929 8.546 1.00 2.21 O ATOM 798 CB LYS A 52 -8.851 -25.726 7.648 1.00 30.02 C ATOM 799 CG LYS A 52 -9.979 -26.500 6.976 1.00 72.44 C ATOM 800 CD LYS A 52 -10.656 -25.681 5.889 1.00 15.30 C ATOM 801 CE LYS A 52 -12.058 -26.186 5.589 1.00 51.42 C ATOM 802 NZ LYS A 52 -12.049 -27.515 4.921 1.00 11.11 N ATOM 0 H LYS A 52 -7.622 -25.703 4.696 1.00 35.43 H new ATOM 0 HA LYS A 52 -8.439 -24.258 6.141 1.00 21.11 H new ATOM 0 HB2 LYS A 52 -8.282 -26.409 8.280 1.00 30.02 H new ATOM 0 HB3 LYS A 52 -9.284 -24.971 8.304 1.00 30.02 H new ATOM 0 HG2 LYS A 52 -9.583 -27.419 6.545 1.00 72.44 H new ATOM 0 HG3 LYS A 52 -10.716 -26.791 7.724 1.00 72.44 H new ATOM 0 HD2 LYS A 52 -10.705 -24.637 6.198 1.00 15.30 H new ATOM 0 HD3 LYS A 52 -10.055 -25.717 4.980 1.00 15.30 H new ATOM 0 HE2 LYS A 52 -12.624 -26.253 6.518 1.00 51.42 H new ATOM 0 HE3 LYS A 52 -12.573 -25.466 4.953 1.00 51.42 H new ATOM 0 HZ1 LYS A 52 -13.023 -27.871 4.844 1.00 11.11 H new ATOM 0 HZ2 LYS A 52 -11.637 -27.423 3.970 1.00 11.11 H new ATOM 0 HZ3 LYS A 52 -11.480 -28.181 5.481 1.00 11.11 H new ATOM 816 N ARG A 53 -5.578 -24.300 6.771 1.00 5.11 N ATOM 817 CA ARG A 53 -4.401 -23.735 7.408 1.00 62.32 C ATOM 818 C ARG A 53 -4.080 -22.390 6.790 1.00 31.44 C ATOM 819 O ARG A 53 -4.465 -22.126 5.657 1.00 33.22 O ATOM 820 CB ARG A 53 -3.204 -24.680 7.286 1.00 22.24 C ATOM 821 CG ARG A 53 -3.401 -26.030 7.967 1.00 53.24 C ATOM 822 CD ARG A 53 -3.912 -25.890 9.396 1.00 5.12 C ATOM 823 NE ARG A 53 -3.120 -24.947 10.187 1.00 3.23 N ATOM 824 CZ ARG A 53 -3.561 -24.353 11.296 1.00 45.01 C ATOM 825 NH1 ARG A 53 -4.778 -24.605 11.758 1.00 43.53 N ATOM 826 NH2 ARG A 53 -2.787 -23.493 11.936 1.00 62.01 N ATOM 0 H ARG A 53 -5.433 -24.615 5.812 1.00 5.11 H new ATOM 0 HA ARG A 53 -4.612 -23.599 8.469 1.00 62.32 H new ATOM 0 HB2 ARG A 53 -2.993 -24.846 6.230 1.00 22.24 H new ATOM 0 HB3 ARG A 53 -2.327 -24.194 7.714 1.00 22.24 H new ATOM 0 HG2 ARG A 53 -4.106 -26.626 7.388 1.00 53.24 H new ATOM 0 HG3 ARG A 53 -2.455 -26.572 7.973 1.00 53.24 H new ATOM 0 HD2 ARG A 53 -4.950 -25.559 9.376 1.00 5.12 H new ATOM 0 HD3 ARG A 53 -3.898 -26.866 9.880 1.00 5.12 H new ATOM 0 HE ARG A 53 -2.174 -24.732 9.871 1.00 3.23 H new ATOM 0 HH11 ARG A 53 -5.386 -25.258 11.264 1.00 43.53 H new ATOM 0 HH12 ARG A 53 -5.106 -24.146 12.607 1.00 43.53 H new ATOM 0 HH21 ARG A 53 -1.854 -23.285 11.581 1.00 62.01 H new ATOM 0 HH22 ARG A 53 -3.123 -23.038 12.785 1.00 62.01 H new ATOM 840 N SER A 54 -3.373 -21.550 7.529 1.00 71.31 N ATOM 841 CA SER A 54 -3.111 -20.188 7.100 1.00 42.25 C ATOM 842 C SER A 54 -2.177 -20.160 5.897 1.00 74.05 C ATOM 843 O SER A 54 -1.144 -20.830 5.884 1.00 74.11 O ATOM 844 CB SER A 54 -2.509 -19.408 8.261 1.00 55.43 C ATOM 845 OG SER A 54 -3.159 -19.753 9.473 1.00 22.44 O ATOM 0 H SER A 54 -2.969 -21.791 8.434 1.00 71.31 H new ATOM 0 HA SER A 54 -4.050 -19.726 6.796 1.00 42.25 H new ATOM 0 HB2 SER A 54 -1.443 -19.622 8.338 1.00 55.43 H new ATOM 0 HB3 SER A 54 -2.607 -18.338 8.079 1.00 55.43 H new ATOM 0 HG SER A 54 -3.618 -18.966 9.834 1.00 22.44 H new ATOM 851 N ARG A 55 -2.561 -19.385 4.887 1.00 74.51 N ATOM 852 CA ARG A 55 -1.780 -19.254 3.664 1.00 11.22 C ATOM 853 C ARG A 55 -0.710 -18.182 3.806 1.00 52.34 C ATOM 854 O ARG A 55 0.011 -17.883 2.856 1.00 34.24 O ATOM 855 CB ARG A 55 -2.690 -18.925 2.486 1.00 51.11 C ATOM 856 CG ARG A 55 -3.536 -20.097 2.039 1.00 50.53 C ATOM 857 CD ARG A 55 -4.638 -19.664 1.092 1.00 21.52 C ATOM 858 NE ARG A 55 -5.097 -20.783 0.274 1.00 64.51 N ATOM 859 CZ ARG A 55 -6.015 -20.692 -0.684 1.00 54.43 C ATOM 860 NH1 ARG A 55 -6.594 -19.530 -0.951 1.00 65.12 N ATOM 861 NH2 ARG A 55 -6.347 -21.772 -1.376 1.00 61.32 N ATOM 0 H ARG A 55 -3.419 -18.833 4.894 1.00 74.51 H new ATOM 0 HA ARG A 55 -1.286 -20.208 3.480 1.00 11.22 H new ATOM 0 HB2 ARG A 55 -3.344 -18.097 2.761 1.00 51.11 H new ATOM 0 HB3 ARG A 55 -2.081 -18.585 1.649 1.00 51.11 H new ATOM 0 HG2 ARG A 55 -2.903 -20.836 1.547 1.00 50.53 H new ATOM 0 HG3 ARG A 55 -3.975 -20.582 2.911 1.00 50.53 H new ATOM 0 HD2 ARG A 55 -5.474 -19.259 1.662 1.00 21.52 H new ATOM 0 HD3 ARG A 55 -4.275 -18.863 0.448 1.00 21.52 H new ATOM 0 HE ARG A 55 -4.684 -21.699 0.450 1.00 64.51 H new ATOM 0 HH11 ARG A 55 -6.336 -18.698 -0.420 1.00 65.12 H new ATOM 0 HH12 ARG A 55 -7.297 -19.468 -1.687 1.00 65.12 H new ATOM 0 HH21 ARG A 55 -5.899 -22.666 -1.173 1.00 61.32 H new ATOM 0 HH22 ARG A 55 -7.050 -21.710 -2.112 1.00 61.32 H new ATOM 875 N GLY A 56 -0.617 -17.607 4.995 1.00 61.22 N ATOM 876 CA GLY A 56 0.448 -16.669 5.278 1.00 51.51 C ATOM 877 C GLY A 56 0.114 -15.233 4.933 1.00 4.03 C ATOM 878 O GLY A 56 0.999 -14.386 4.915 1.00 61.23 O ATOM 0 H GLY A 56 -1.260 -17.773 5.769 1.00 61.22 H new ATOM 0 HA2 GLY A 56 0.698 -16.728 6.337 1.00 51.51 H new ATOM 0 HA3 GLY A 56 1.338 -16.967 4.723 1.00 51.51 H new ATOM 882 N PHE A 57 -1.144 -14.945 4.644 1.00 1.50 N ATOM 883 CA PHE A 57 -1.560 -13.575 4.402 1.00 2.24 C ATOM 884 C PHE A 57 -3.040 -13.395 4.727 1.00 61.20 C ATOM 885 O PHE A 57 -3.806 -14.359 4.729 1.00 34.13 O ATOM 886 CB PHE A 57 -1.262 -13.168 2.950 1.00 52.32 C ATOM 887 CG PHE A 57 -2.107 -13.853 1.899 1.00 44.11 C ATOM 888 CD1 PHE A 57 -1.874 -15.175 1.539 1.00 33.13 C ATOM 889 CD2 PHE A 57 -3.123 -13.163 1.254 1.00 13.15 C ATOM 890 CE1 PHE A 57 -2.639 -15.789 0.566 1.00 53.51 C ATOM 891 CE2 PHE A 57 -3.886 -13.772 0.276 1.00 10.44 C ATOM 892 CZ PHE A 57 -3.644 -15.087 -0.067 1.00 4.42 C ATOM 0 H PHE A 57 -1.890 -15.637 4.572 1.00 1.50 H new ATOM 0 HA PHE A 57 -0.989 -12.921 5.061 1.00 2.24 H new ATOM 0 HB2 PHE A 57 -1.399 -12.091 2.857 1.00 52.32 H new ATOM 0 HB3 PHE A 57 -0.213 -13.375 2.740 1.00 52.32 H new ATOM 0 HD1 PHE A 57 -1.085 -15.729 2.026 1.00 33.13 H new ATOM 0 HD2 PHE A 57 -3.321 -12.135 1.520 1.00 13.15 H new ATOM 0 HE1 PHE A 57 -2.450 -16.819 0.301 1.00 53.51 H new ATOM 0 HE2 PHE A 57 -4.671 -13.220 -0.219 1.00 10.44 H new ATOM 0 HZ PHE A 57 -4.240 -15.566 -0.830 1.00 4.42 H new ATOM 902 N GLY A 58 -3.424 -12.163 5.031 1.00 53.54 N ATOM 903 CA GLY A 58 -4.806 -11.852 5.347 1.00 34.41 C ATOM 904 C GLY A 58 -5.090 -10.376 5.184 1.00 51.30 C ATOM 905 O GLY A 58 -4.269 -9.650 4.631 1.00 31.34 O ATOM 0 H GLY A 58 -2.793 -11.362 5.065 1.00 53.54 H new ATOM 0 HA2 GLY A 58 -5.467 -12.425 4.697 1.00 34.41 H new ATOM 0 HA3 GLY A 58 -5.024 -12.155 6.371 1.00 34.41 H new ATOM 909 N PHE A 59 -6.253 -9.927 5.645 1.00 15.50 N ATOM 910 CA PHE A 59 -6.631 -8.519 5.539 1.00 52.22 C ATOM 911 C PHE A 59 -7.403 -8.081 6.780 1.00 61.31 C ATOM 912 O PHE A 59 -8.205 -8.842 7.320 1.00 64.24 O ATOM 913 CB PHE A 59 -7.514 -8.254 4.304 1.00 14.12 C ATOM 914 CG PHE A 59 -7.238 -9.138 3.118 1.00 0.14 C ATOM 915 CD1 PHE A 59 -7.860 -10.370 3.012 1.00 52.20 C ATOM 916 CD2 PHE A 59 -6.367 -8.744 2.116 1.00 71.43 C ATOM 917 CE1 PHE A 59 -7.620 -11.194 1.938 1.00 32.22 C ATOM 918 CE2 PHE A 59 -6.121 -9.566 1.032 1.00 74.11 C ATOM 919 CZ PHE A 59 -6.748 -10.795 0.943 1.00 24.35 C ATOM 0 H PHE A 59 -6.952 -10.517 6.096 1.00 15.50 H new ATOM 0 HA PHE A 59 -5.706 -7.950 5.444 1.00 52.22 H new ATOM 0 HB2 PHE A 59 -8.559 -8.374 4.591 1.00 14.12 H new ATOM 0 HB3 PHE A 59 -7.384 -7.215 4.001 1.00 14.12 H new ATOM 0 HD1 PHE A 59 -8.544 -10.689 3.785 1.00 52.20 H new ATOM 0 HD2 PHE A 59 -5.875 -7.785 2.182 1.00 71.43 H new ATOM 0 HE1 PHE A 59 -8.113 -12.153 1.872 1.00 32.22 H new ATOM 0 HE2 PHE A 59 -5.440 -9.249 0.256 1.00 74.11 H new ATOM 0 HZ PHE A 59 -6.557 -11.441 0.099 1.00 24.35 H new ATOM 929 N VAL A 60 -7.161 -6.853 7.221 1.00 5.30 N ATOM 930 CA VAL A 60 -7.906 -6.268 8.330 1.00 63.21 C ATOM 931 C VAL A 60 -8.487 -4.917 7.920 1.00 21.22 C ATOM 932 O VAL A 60 -7.783 -4.058 7.401 1.00 23.23 O ATOM 933 CB VAL A 60 -7.042 -6.094 9.610 1.00 44.32 C ATOM 934 CG1 VAL A 60 -6.778 -7.436 10.271 1.00 42.12 C ATOM 935 CG2 VAL A 60 -5.728 -5.392 9.302 1.00 31.11 C ATOM 0 H VAL A 60 -6.450 -6.239 6.825 1.00 5.30 H new ATOM 0 HA VAL A 60 -8.709 -6.965 8.570 1.00 63.21 H new ATOM 0 HB VAL A 60 -7.606 -5.469 10.302 1.00 44.32 H new ATOM 0 HG11 VAL A 60 -6.171 -7.288 11.165 1.00 42.12 H new ATOM 0 HG12 VAL A 60 -7.726 -7.898 10.548 1.00 42.12 H new ATOM 0 HG13 VAL A 60 -6.247 -8.086 9.575 1.00 42.12 H new ATOM 0 HG21 VAL A 60 -5.148 -5.286 10.219 1.00 31.11 H new ATOM 0 HG22 VAL A 60 -5.162 -5.980 8.580 1.00 31.11 H new ATOM 0 HG23 VAL A 60 -5.931 -4.405 8.886 1.00 31.11 H new ATOM 945 N THR A 61 -9.777 -4.743 8.129 1.00 22.14 N ATOM 946 CA THR A 61 -10.443 -3.499 7.785 1.00 42.35 C ATOM 947 C THR A 61 -10.725 -2.689 9.040 1.00 70.01 C ATOM 948 O THR A 61 -11.397 -3.164 9.954 1.00 32.12 O ATOM 949 CB THR A 61 -11.763 -3.757 7.038 1.00 22.51 C ATOM 950 OG1 THR A 61 -11.563 -4.765 6.038 1.00 15.41 O ATOM 951 CG2 THR A 61 -12.279 -2.482 6.382 1.00 70.31 C ATOM 0 H THR A 61 -10.389 -5.450 8.537 1.00 22.14 H new ATOM 0 HA THR A 61 -9.777 -2.940 7.128 1.00 42.35 H new ATOM 0 HB THR A 61 -12.505 -4.096 7.761 1.00 22.51 H new ATOM 0 HG1 THR A 61 -12.354 -4.816 5.462 1.00 15.41 H new ATOM 0 HG21 THR A 61 -13.213 -2.693 5.861 1.00 70.31 H new ATOM 0 HG22 THR A 61 -12.453 -1.724 7.146 1.00 70.31 H new ATOM 0 HG23 THR A 61 -11.541 -2.115 5.669 1.00 70.31 H new ATOM 959 N TYR A 62 -10.206 -1.477 9.079 1.00 61.35 N ATOM 960 CA TYR A 62 -10.415 -0.600 10.212 1.00 61.13 C ATOM 961 C TYR A 62 -11.678 0.220 10.023 1.00 63.31 C ATOM 962 O TYR A 62 -12.188 0.351 8.907 1.00 2.52 O ATOM 963 CB TYR A 62 -9.224 0.335 10.396 1.00 32.10 C ATOM 964 CG TYR A 62 -8.066 -0.274 11.155 1.00 53.45 C ATOM 965 CD1 TYR A 62 -8.002 -0.182 12.537 1.00 0.45 C ATOM 966 CD2 TYR A 62 -7.030 -0.924 10.493 1.00 21.20 C ATOM 967 CE1 TYR A 62 -6.942 -0.718 13.239 1.00 42.21 C ATOM 968 CE2 TYR A 62 -5.969 -1.466 11.191 1.00 65.13 C ATOM 969 CZ TYR A 62 -5.930 -1.359 12.562 1.00 51.42 C ATOM 970 OH TYR A 62 -4.874 -1.892 13.258 1.00 12.41 O ATOM 0 H TYR A 62 -9.634 -1.077 8.335 1.00 61.35 H new ATOM 0 HA TYR A 62 -10.520 -1.220 11.102 1.00 61.13 H new ATOM 0 HB2 TYR A 62 -8.872 0.654 9.415 1.00 32.10 H new ATOM 0 HB3 TYR A 62 -9.557 1.230 10.922 1.00 32.10 H new ATOM 0 HD1 TYR A 62 -8.795 0.318 13.073 1.00 0.45 H new ATOM 0 HD2 TYR A 62 -7.056 -1.006 9.416 1.00 21.20 H new ATOM 0 HE1 TYR A 62 -6.907 -0.635 14.315 1.00 42.21 H new ATOM 0 HE2 TYR A 62 -5.174 -1.971 10.663 1.00 65.13 H new ATOM 0 HH TYR A 62 -5.209 -2.371 14.044 1.00 12.41 H new ATOM 980 N ALA A 63 -12.177 0.758 11.122 1.00 41.13 N ATOM 981 CA ALA A 63 -13.344 1.619 11.102 1.00 41.20 C ATOM 982 C ALA A 63 -13.040 2.924 10.374 1.00 73.11 C ATOM 983 O ALA A 63 -13.832 3.387 9.555 1.00 31.15 O ATOM 984 CB ALA A 63 -13.805 1.897 12.526 1.00 63.11 C ATOM 0 H ALA A 63 -11.784 0.610 12.052 1.00 41.13 H new ATOM 0 HA ALA A 63 -14.144 1.111 10.564 1.00 41.20 H new ATOM 0 HB1 ALA A 63 -14.682 2.544 12.505 1.00 63.11 H new ATOM 0 HB2 ALA A 63 -14.059 0.957 13.016 1.00 63.11 H new ATOM 0 HB3 ALA A 63 -13.004 2.389 13.078 1.00 63.11 H new ATOM 990 N THR A 64 -11.878 3.498 10.664 1.00 24.15 N ATOM 991 CA THR A 64 -11.476 4.772 10.086 1.00 63.02 C ATOM 992 C THR A 64 -10.050 4.681 9.526 1.00 2.32 C ATOM 993 O THR A 64 -9.259 3.848 9.972 1.00 30.10 O ATOM 994 CB THR A 64 -11.561 5.883 11.155 1.00 21.34 C ATOM 995 OG1 THR A 64 -12.825 5.807 11.821 1.00 30.22 O ATOM 996 CG2 THR A 64 -11.401 7.267 10.550 1.00 72.50 C ATOM 0 H THR A 64 -11.192 3.095 11.303 1.00 24.15 H new ATOM 0 HA THR A 64 -12.152 5.015 9.267 1.00 63.02 H new ATOM 0 HB THR A 64 -10.745 5.727 11.860 1.00 21.34 H new ATOM 0 HG1 THR A 64 -12.879 6.511 12.501 1.00 30.22 H new ATOM 0 HG21 THR A 64 -11.467 8.018 11.337 1.00 72.50 H new ATOM 0 HG22 THR A 64 -10.430 7.340 10.060 1.00 72.50 H new ATOM 0 HG23 THR A 64 -12.191 7.438 9.818 1.00 72.50 H new ATOM 1004 N VAL A 65 -9.737 5.524 8.542 1.00 4.52 N ATOM 1005 CA VAL A 65 -8.413 5.539 7.920 1.00 11.33 C ATOM 1006 C VAL A 65 -7.325 5.982 8.912 1.00 34.43 C ATOM 1007 O VAL A 65 -6.191 5.511 8.841 1.00 64.30 O ATOM 1008 CB VAL A 65 -8.406 6.437 6.655 1.00 54.20 C ATOM 1009 CG1 VAL A 65 -8.840 7.857 6.977 1.00 30.33 C ATOM 1010 CG2 VAL A 65 -7.043 6.441 5.979 1.00 54.52 C ATOM 0 H VAL A 65 -10.387 6.209 8.157 1.00 4.52 H new ATOM 0 HA VAL A 65 -8.183 4.518 7.616 1.00 11.33 H new ATOM 0 HB VAL A 65 -9.128 6.010 5.960 1.00 54.20 H new ATOM 0 HG11 VAL A 65 -8.823 8.458 6.068 1.00 30.33 H new ATOM 0 HG12 VAL A 65 -9.851 7.845 7.385 1.00 30.33 H new ATOM 0 HG13 VAL A 65 -8.158 8.289 7.710 1.00 30.33 H new ATOM 0 HG21 VAL A 65 -7.076 7.080 5.097 1.00 54.52 H new ATOM 0 HG22 VAL A 65 -6.293 6.820 6.674 1.00 54.52 H new ATOM 0 HG23 VAL A 65 -6.782 5.426 5.681 1.00 54.52 H new ATOM 1020 N GLU A 66 -7.670 6.890 9.824 1.00 55.41 N ATOM 1021 CA GLU A 66 -6.755 7.315 10.888 1.00 34.43 C ATOM 1022 C GLU A 66 -6.256 6.133 11.719 1.00 35.20 C ATOM 1023 O GLU A 66 -5.069 6.048 12.043 1.00 53.44 O ATOM 1024 CB GLU A 66 -7.461 8.309 11.805 1.00 72.04 C ATOM 1025 CG GLU A 66 -8.182 9.423 11.065 1.00 24.01 C ATOM 1026 CD GLU A 66 -8.911 10.362 12.001 1.00 41.44 C ATOM 1027 OE1 GLU A 66 -10.092 10.103 12.307 1.00 1.15 O ATOM 1028 OE2 GLU A 66 -8.307 11.366 12.431 1.00 41.15 O ATOM 0 H GLU A 66 -8.581 7.349 9.849 1.00 55.41 H new ATOM 0 HA GLU A 66 -5.892 7.782 10.413 1.00 34.43 H new ATOM 0 HB2 GLU A 66 -8.180 7.771 12.423 1.00 72.04 H new ATOM 0 HB3 GLU A 66 -6.728 8.750 12.480 1.00 72.04 H new ATOM 0 HG2 GLU A 66 -7.461 9.990 10.476 1.00 24.01 H new ATOM 0 HG3 GLU A 66 -8.895 8.988 10.364 1.00 24.01 H new ATOM 1035 N GLU A 67 -7.177 5.236 12.061 1.00 2.45 N ATOM 1036 CA GLU A 67 -6.862 4.026 12.818 1.00 51.24 C ATOM 1037 C GLU A 67 -5.898 3.141 12.039 1.00 72.54 C ATOM 1038 O GLU A 67 -5.051 2.461 12.617 1.00 62.33 O ATOM 1039 CB GLU A 67 -8.150 3.255 13.126 1.00 63.55 C ATOM 1040 CG GLU A 67 -8.900 3.744 14.361 1.00 43.13 C ATOM 1041 CD GLU A 67 -9.067 5.247 14.417 1.00 64.25 C ATOM 1042 OE1 GLU A 67 -9.681 5.818 13.497 1.00 50.40 O ATOM 1043 OE2 GLU A 67 -8.575 5.859 15.386 1.00 64.42 O ATOM 0 H GLU A 67 -8.164 5.327 11.821 1.00 2.45 H new ATOM 0 HA GLU A 67 -6.384 4.316 13.754 1.00 51.24 H new ATOM 0 HB2 GLU A 67 -8.813 3.322 12.264 1.00 63.55 H new ATOM 0 HB3 GLU A 67 -7.905 2.201 13.259 1.00 63.55 H new ATOM 0 HG2 GLU A 67 -9.885 3.277 14.386 1.00 43.13 H new ATOM 0 HG3 GLU A 67 -8.368 3.413 15.253 1.00 43.13 H new ATOM 1050 N VAL A 68 -6.040 3.172 10.721 1.00 34.24 N ATOM 1051 CA VAL A 68 -5.142 2.465 9.823 1.00 51.20 C ATOM 1052 C VAL A 68 -3.727 3.024 9.915 1.00 24.01 C ATOM 1053 O VAL A 68 -2.770 2.275 10.085 1.00 71.02 O ATOM 1054 CB VAL A 68 -5.627 2.569 8.363 1.00 41.30 C ATOM 1055 CG1 VAL A 68 -4.556 2.115 7.398 1.00 62.05 C ATOM 1056 CG2 VAL A 68 -6.881 1.756 8.161 1.00 71.12 C ATOM 0 H VAL A 68 -6.781 3.688 10.246 1.00 34.24 H new ATOM 0 HA VAL A 68 -5.137 1.419 10.128 1.00 51.20 H new ATOM 0 HB VAL A 68 -5.848 3.617 8.161 1.00 41.30 H new ATOM 0 HG11 VAL A 68 -4.927 2.200 6.377 1.00 62.05 H new ATOM 0 HG12 VAL A 68 -3.671 2.741 7.516 1.00 62.05 H new ATOM 0 HG13 VAL A 68 -4.296 1.077 7.605 1.00 62.05 H new ATOM 0 HG21 VAL A 68 -7.208 1.842 7.125 1.00 71.12 H new ATOM 0 HG22 VAL A 68 -6.678 0.710 8.392 1.00 71.12 H new ATOM 0 HG23 VAL A 68 -7.665 2.127 8.821 1.00 71.12 H new ATOM 1066 N ASP A 69 -3.610 4.343 9.807 1.00 53.45 N ATOM 1067 CA ASP A 69 -2.311 5.010 9.804 1.00 74.34 C ATOM 1068 C ASP A 69 -1.546 4.738 11.098 1.00 21.14 C ATOM 1069 O ASP A 69 -0.334 4.525 11.075 1.00 14.20 O ATOM 1070 CB ASP A 69 -2.485 6.516 9.601 1.00 30.22 C ATOM 1071 CG ASP A 69 -1.307 7.141 8.878 1.00 13.24 C ATOM 1072 OD1 ASP A 69 -1.211 6.981 7.644 1.00 25.03 O ATOM 1073 OD2 ASP A 69 -0.485 7.810 9.529 1.00 23.44 O ATOM 0 H ASP A 69 -4.405 4.976 9.720 1.00 53.45 H new ATOM 0 HA ASP A 69 -1.730 4.605 8.975 1.00 74.34 H new ATOM 0 HB2 ASP A 69 -3.396 6.700 9.032 1.00 30.22 H new ATOM 0 HB3 ASP A 69 -2.611 6.999 10.570 1.00 30.22 H new ATOM 1078 N ALA A 70 -2.260 4.765 12.224 1.00 71.41 N ATOM 1079 CA ALA A 70 -1.699 4.366 13.517 1.00 73.14 C ATOM 1080 C ALA A 70 -1.093 2.960 13.471 1.00 2.54 C ATOM 1081 O ALA A 70 -0.019 2.726 14.023 1.00 73.44 O ATOM 1082 CB ALA A 70 -2.770 4.444 14.596 1.00 72.25 C ATOM 0 H ALA A 70 -3.235 5.061 12.267 1.00 71.41 H new ATOM 0 HA ALA A 70 -0.893 5.060 13.755 1.00 73.14 H new ATOM 0 HB1 ALA A 70 -2.344 4.146 15.554 1.00 72.25 H new ATOM 0 HB2 ALA A 70 -3.141 5.466 14.667 1.00 72.25 H new ATOM 0 HB3 ALA A 70 -3.593 3.776 14.341 1.00 72.25 H new ATOM 1088 N ALA A 71 -1.760 2.046 12.774 1.00 62.34 N ATOM 1089 CA ALA A 71 -1.272 0.676 12.641 1.00 41.12 C ATOM 1090 C ALA A 71 -0.073 0.620 11.695 1.00 71.43 C ATOM 1091 O ALA A 71 0.865 -0.145 11.909 1.00 30.35 O ATOM 1092 CB ALA A 71 -2.378 -0.242 12.143 1.00 32.23 C ATOM 0 H ALA A 71 -2.640 2.228 12.292 1.00 62.34 H new ATOM 0 HA ALA A 71 -0.954 0.333 13.625 1.00 41.12 H new ATOM 0 HB1 ALA A 71 -1.994 -1.258 12.051 1.00 32.23 H new ATOM 0 HB2 ALA A 71 -3.207 -0.230 12.851 1.00 32.23 H new ATOM 0 HB3 ALA A 71 -2.727 0.104 11.170 1.00 32.23 H new ATOM 1098 N MET A 72 -0.108 1.450 10.654 1.00 63.42 N ATOM 1099 CA MET A 72 0.972 1.517 9.670 1.00 51.35 C ATOM 1100 C MET A 72 2.266 2.012 10.304 1.00 45.51 C ATOM 1101 O MET A 72 3.352 1.537 9.972 1.00 40.00 O ATOM 1102 CB MET A 72 0.583 2.433 8.502 1.00 12.03 C ATOM 1103 CG MET A 72 -0.702 2.025 7.791 1.00 51.10 C ATOM 1104 SD MET A 72 -0.441 0.970 6.351 1.00 73.31 S ATOM 1105 CE MET A 72 0.446 -0.411 7.045 1.00 25.24 C ATOM 0 H MET A 72 -0.880 2.091 10.469 1.00 63.42 H new ATOM 0 HA MET A 72 1.136 0.508 9.292 1.00 51.35 H new ATOM 0 HB2 MET A 72 0.472 3.451 8.875 1.00 12.03 H new ATOM 0 HB3 MET A 72 1.398 2.446 7.778 1.00 12.03 H new ATOM 0 HG2 MET A 72 -1.347 1.504 8.499 1.00 51.10 H new ATOM 0 HG3 MET A 72 -1.233 2.924 7.478 1.00 51.10 H new ATOM 0 HE1 MET A 72 0.360 -1.270 6.380 1.00 25.24 H new ATOM 0 HE2 MET A 72 1.497 -0.147 7.162 1.00 25.24 H new ATOM 0 HE3 MET A 72 0.024 -0.662 8.018 1.00 25.24 H new ATOM 1115 N ASN A 73 2.140 2.954 11.230 1.00 13.23 N ATOM 1116 CA ASN A 73 3.298 3.520 11.916 1.00 62.21 C ATOM 1117 C ASN A 73 3.799 2.578 13.017 1.00 15.14 C ATOM 1118 O ASN A 73 4.984 2.569 13.340 1.00 12.13 O ATOM 1119 CB ASN A 73 2.949 4.914 12.475 1.00 62.13 C ATOM 1120 CG ASN A 73 3.064 5.033 13.989 1.00 35.34 C ATOM 1121 OD1 ASN A 73 4.137 5.302 14.526 1.00 3.41 O ATOM 1122 ND2 ASN A 73 1.957 4.837 14.685 1.00 34.40 N ATOM 0 H ASN A 73 1.245 3.344 11.525 1.00 13.23 H new ATOM 0 HA ASN A 73 4.111 3.635 11.199 1.00 62.21 H new ATOM 0 HB2 ASN A 73 3.606 5.652 12.014 1.00 62.13 H new ATOM 0 HB3 ASN A 73 1.930 5.166 12.180 1.00 62.13 H new ATOM 0 HD21 ASN A 73 1.975 4.907 15.702 1.00 34.40 H new ATOM 0 HD22 ASN A 73 1.085 4.616 14.204 1.00 34.40 H new ATOM 1129 N ALA A 74 2.888 1.780 13.574 1.00 63.34 N ATOM 1130 CA ALA A 74 3.225 0.838 14.645 1.00 41.43 C ATOM 1131 C ALA A 74 4.099 -0.319 14.161 1.00 65.32 C ATOM 1132 O ALA A 74 4.594 -1.107 14.968 1.00 12.10 O ATOM 1133 CB ALA A 74 1.957 0.301 15.282 1.00 54.11 C ATOM 0 H ALA A 74 1.905 1.766 13.300 1.00 63.34 H new ATOM 0 HA ALA A 74 3.807 1.389 15.384 1.00 41.43 H new ATOM 0 HB1 ALA A 74 2.217 -0.398 16.077 1.00 54.11 H new ATOM 0 HB2 ALA A 74 1.381 1.127 15.699 1.00 54.11 H new ATOM 0 HB3 ALA A 74 1.360 -0.212 14.528 1.00 54.11 H new ATOM 1139 N ARG A 75 4.263 -0.428 12.844 1.00 12.40 N ATOM 1140 CA ARG A 75 5.150 -1.421 12.242 1.00 72.33 C ATOM 1141 C ARG A 75 6.588 -1.268 12.746 1.00 2.22 C ATOM 1142 O ARG A 75 7.047 -0.154 12.998 1.00 2.21 O ATOM 1143 CB ARG A 75 5.106 -1.297 10.720 1.00 4.44 C ATOM 1144 CG ARG A 75 3.865 -1.917 10.105 1.00 32.11 C ATOM 1145 CD ARG A 75 3.679 -1.513 8.652 1.00 13.11 C ATOM 1146 NE ARG A 75 4.907 -1.640 7.869 1.00 54.14 N ATOM 1147 CZ ARG A 75 5.534 -0.614 7.292 1.00 31.03 C ATOM 1148 NH1 ARG A 75 5.056 0.622 7.409 1.00 23.54 N ATOM 1149 NH2 ARG A 75 6.649 -0.829 6.608 1.00 1.01 N ATOM 0 H ARG A 75 3.787 0.167 12.166 1.00 12.40 H new ATOM 0 HA ARG A 75 4.801 -2.411 12.536 1.00 72.33 H new ATOM 0 HB2 ARG A 75 5.151 -0.243 10.446 1.00 4.44 H new ATOM 0 HB3 ARG A 75 5.990 -1.774 10.297 1.00 4.44 H new ATOM 0 HG2 ARG A 75 3.932 -3.003 10.172 1.00 32.11 H new ATOM 0 HG3 ARG A 75 2.988 -1.616 10.679 1.00 32.11 H new ATOM 0 HD2 ARG A 75 2.902 -2.132 8.204 1.00 13.11 H new ATOM 0 HD3 ARG A 75 3.330 -0.481 8.608 1.00 13.11 H new ATOM 0 HE ARG A 75 5.309 -2.571 7.757 1.00 54.14 H new ATOM 0 HH11 ARG A 75 4.204 0.791 7.943 1.00 23.54 H new ATOM 0 HH12 ARG A 75 5.542 1.401 6.964 1.00 23.54 H new ATOM 0 HH21 ARG A 75 7.022 -1.775 6.525 1.00 1.01 H new ATOM 0 HH22 ARG A 75 7.134 -0.049 6.164 1.00 1.01 H new ATOM 1163 N PRO A 76 7.333 -2.384 12.885 1.00 32.25 N ATOM 1164 CA PRO A 76 6.871 -3.731 12.519 1.00 63.44 C ATOM 1165 C PRO A 76 5.869 -4.336 13.505 1.00 34.42 C ATOM 1166 O PRO A 76 5.858 -4.009 14.692 1.00 15.41 O ATOM 1167 CB PRO A 76 8.160 -4.570 12.501 1.00 10.21 C ATOM 1168 CG PRO A 76 9.285 -3.604 12.677 1.00 64.24 C ATOM 1169 CD PRO A 76 8.707 -2.421 13.393 1.00 1.14 C ATOM 0 HA PRO A 76 6.335 -3.704 11.570 1.00 63.44 H new ATOM 0 HB2 PRO A 76 8.154 -5.311 13.300 1.00 10.21 H new ATOM 0 HB3 PRO A 76 8.257 -5.115 11.562 1.00 10.21 H new ATOM 0 HG2 PRO A 76 10.096 -4.050 13.253 1.00 64.24 H new ATOM 0 HG3 PRO A 76 9.702 -3.311 11.713 1.00 64.24 H new ATOM 0 HD2 PRO A 76 8.736 -2.547 14.475 1.00 1.14 H new ATOM 0 HD3 PRO A 76 9.249 -1.503 13.164 1.00 1.14 H new ATOM 1177 N HIS A 77 5.037 -5.228 12.984 1.00 21.04 N ATOM 1178 CA HIS A 77 4.019 -5.906 13.787 1.00 62.02 C ATOM 1179 C HIS A 77 4.383 -7.364 13.996 1.00 11.23 C ATOM 1180 O HIS A 77 5.091 -7.958 13.182 1.00 35.23 O ATOM 1181 CB HIS A 77 2.648 -5.827 13.119 1.00 44.11 C ATOM 1182 CG HIS A 77 1.928 -4.543 13.360 1.00 23.12 C ATOM 1183 ND1 HIS A 77 0.876 -4.463 14.234 1.00 12.44 N ATOM 1184 CD2 HIS A 77 2.138 -3.331 12.812 1.00 11.35 C ATOM 1185 CE1 HIS A 77 0.471 -3.208 14.192 1.00 14.21 C ATOM 1186 NE2 HIS A 77 1.208 -2.486 13.345 1.00 65.15 N ATOM 0 H HIS A 77 5.045 -5.503 12.002 1.00 21.04 H new ATOM 0 HA HIS A 77 3.976 -5.399 14.751 1.00 62.02 H new ATOM 0 HB2 HIS A 77 2.770 -5.967 12.045 1.00 44.11 H new ATOM 0 HB3 HIS A 77 2.032 -6.650 13.480 1.00 44.11 H new ATOM 0 HD2 HIS A 77 2.898 -3.076 12.088 1.00 11.35 H new ATOM 0 HE1 HIS A 77 -0.352 -2.815 14.770 1.00 14.21 H new ATOM 0 HE2 HIS A 77 1.097 -1.494 13.136 1.00 65.15 H new ATOM 1194 N LYS A 78 3.903 -7.938 15.088 1.00 52.33 N ATOM 1195 CA LYS A 78 4.109 -9.350 15.344 1.00 25.35 C ATOM 1196 C LYS A 78 2.831 -10.011 15.849 1.00 70.40 C ATOM 1197 O LYS A 78 2.463 -9.872 17.014 1.00 42.13 O ATOM 1198 CB LYS A 78 5.258 -9.558 16.335 1.00 1.04 C ATOM 1199 CG LYS A 78 5.416 -11.002 16.779 1.00 45.13 C ATOM 1200 CD LYS A 78 6.870 -11.364 17.036 1.00 24.11 C ATOM 1201 CE LYS A 78 7.640 -11.540 15.737 1.00 15.23 C ATOM 1202 NZ LYS A 78 9.072 -11.843 15.976 1.00 25.55 N ATOM 0 H LYS A 78 3.371 -7.448 15.807 1.00 52.33 H new ATOM 0 HA LYS A 78 4.379 -9.826 14.401 1.00 25.35 H new ATOM 0 HB2 LYS A 78 6.188 -9.222 15.877 1.00 1.04 H new ATOM 0 HB3 LYS A 78 5.090 -8.932 17.211 1.00 1.04 H new ATOM 0 HG2 LYS A 78 4.836 -11.168 17.687 1.00 45.13 H new ATOM 0 HG3 LYS A 78 5.008 -11.663 16.014 1.00 45.13 H new ATOM 0 HD2 LYS A 78 7.339 -10.584 17.635 1.00 24.11 H new ATOM 0 HD3 LYS A 78 6.919 -12.285 17.617 1.00 24.11 H new ATOM 0 HE2 LYS A 78 7.191 -12.346 15.156 1.00 15.23 H new ATOM 0 HE3 LYS A 78 7.556 -10.632 15.140 1.00 15.23 H new ATOM 0 HZ1 LYS A 78 9.560 -11.955 15.064 1.00 25.55 H new ATOM 0 HZ2 LYS A 78 9.508 -11.063 16.508 1.00 25.55 H new ATOM 0 HZ3 LYS A 78 9.154 -12.724 16.523 1.00 25.55 H new ATOM 1216 N VAL A 79 2.174 -10.741 14.960 1.00 41.53 N ATOM 1217 CA VAL A 79 0.962 -11.476 15.295 1.00 0.31 C ATOM 1218 C VAL A 79 1.261 -12.966 15.333 1.00 72.03 C ATOM 1219 O VAL A 79 1.901 -13.487 14.419 1.00 3.44 O ATOM 1220 CB VAL A 79 -0.162 -11.227 14.261 1.00 65.33 C ATOM 1221 CG1 VAL A 79 -1.472 -11.847 14.723 1.00 44.40 C ATOM 1222 CG2 VAL A 79 -0.338 -9.742 13.993 1.00 42.24 C ATOM 0 H VAL A 79 2.465 -10.841 13.987 1.00 41.53 H new ATOM 0 HA VAL A 79 0.624 -11.125 16.270 1.00 0.31 H new ATOM 0 HB VAL A 79 0.132 -11.707 13.328 1.00 65.33 H new ATOM 0 HG11 VAL A 79 -2.246 -11.658 13.979 1.00 44.40 H new ATOM 0 HG12 VAL A 79 -1.342 -12.922 14.847 1.00 44.40 H new ATOM 0 HG13 VAL A 79 -1.768 -11.405 15.675 1.00 44.40 H new ATOM 0 HG21 VAL A 79 -1.134 -9.596 13.263 1.00 42.24 H new ATOM 0 HG22 VAL A 79 -0.599 -9.233 14.921 1.00 42.24 H new ATOM 0 HG23 VAL A 79 0.593 -9.330 13.603 1.00 42.24 H new ATOM 1232 N ASP A 80 0.823 -13.632 16.406 1.00 2.25 N ATOM 1233 CA ASP A 80 0.977 -15.087 16.563 1.00 14.33 C ATOM 1234 C ASP A 80 2.460 -15.464 16.663 1.00 5.44 C ATOM 1235 O ASP A 80 2.880 -16.558 16.277 1.00 55.11 O ATOM 1236 CB ASP A 80 0.298 -15.832 15.398 1.00 51.10 C ATOM 1237 CG ASP A 80 0.098 -17.306 15.685 1.00 3.44 C ATOM 1238 OD1 ASP A 80 -0.643 -17.633 16.631 1.00 43.34 O ATOM 1239 OD2 ASP A 80 0.684 -18.143 14.966 1.00 14.13 O ATOM 0 H ASP A 80 0.352 -13.181 17.191 1.00 2.25 H new ATOM 0 HA ASP A 80 0.487 -15.388 17.489 1.00 14.33 H new ATOM 0 HB2 ASP A 80 -0.668 -15.372 15.192 1.00 51.10 H new ATOM 0 HB3 ASP A 80 0.903 -15.720 14.498 1.00 51.10 H new ATOM 1244 N GLY A 81 3.250 -14.542 17.198 1.00 12.44 N ATOM 1245 CA GLY A 81 4.681 -14.749 17.296 1.00 32.43 C ATOM 1246 C GLY A 81 5.357 -14.717 15.941 1.00 4.11 C ATOM 1247 O GLY A 81 6.427 -15.296 15.760 1.00 12.31 O ATOM 0 H GLY A 81 2.922 -13.650 17.568 1.00 12.44 H new ATOM 0 HA2 GLY A 81 5.115 -13.980 17.935 1.00 32.43 H new ATOM 0 HA3 GLY A 81 4.876 -15.709 17.775 1.00 32.43 H new ATOM 1251 N ARG A 82 4.728 -14.045 14.988 1.00 61.10 N ATOM 1252 CA ARG A 82 5.256 -13.944 13.639 1.00 42.55 C ATOM 1253 C ARG A 82 5.366 -12.483 13.235 1.00 21.34 C ATOM 1254 O ARG A 82 4.463 -11.698 13.504 1.00 11.33 O ATOM 1255 CB ARG A 82 4.351 -14.684 12.649 1.00 73.43 C ATOM 1256 CG ARG A 82 4.906 -14.729 11.236 1.00 52.00 C ATOM 1257 CD ARG A 82 6.038 -15.736 11.120 1.00 64.23 C ATOM 1258 NE ARG A 82 6.642 -15.738 9.791 1.00 52.52 N ATOM 1259 CZ ARG A 82 7.903 -16.102 9.542 1.00 45.42 C ATOM 1260 NH1 ARG A 82 8.700 -16.490 10.533 1.00 62.02 N ATOM 1261 NH2 ARG A 82 8.359 -16.088 8.297 1.00 51.04 N ATOM 0 H ARG A 82 3.843 -13.558 15.128 1.00 61.10 H new ATOM 0 HA ARG A 82 6.245 -14.402 13.620 1.00 42.55 H new ATOM 0 HB2 ARG A 82 4.197 -15.703 13.003 1.00 73.43 H new ATOM 0 HB3 ARG A 82 3.374 -14.201 12.632 1.00 73.43 H new ATOM 0 HG2 ARG A 82 4.110 -14.991 10.539 1.00 52.00 H new ATOM 0 HG3 ARG A 82 5.266 -13.740 10.952 1.00 52.00 H new ATOM 0 HD2 ARG A 82 6.802 -15.508 11.864 1.00 64.23 H new ATOM 0 HD3 ARG A 82 5.660 -16.733 11.346 1.00 64.23 H new ATOM 0 HE ARG A 82 6.065 -15.443 9.003 1.00 52.52 H new ATOM 0 HH11 ARG A 82 8.350 -16.511 11.491 1.00 62.02 H new ATOM 0 HH12 ARG A 82 9.662 -16.767 10.336 1.00 62.02 H new ATOM 0 HH21 ARG A 82 7.748 -15.800 7.533 1.00 51.04 H new ATOM 0 HH22 ARG A 82 9.321 -16.365 8.103 1.00 51.04 H new ATOM 1275 N VAL A 83 6.470 -12.119 12.602 1.00 5.33 N ATOM 1276 CA VAL A 83 6.650 -10.753 12.139 1.00 72.44 C ATOM 1277 C VAL A 83 5.870 -10.544 10.838 1.00 1.01 C ATOM 1278 O VAL A 83 6.194 -11.105 9.790 1.00 1.35 O ATOM 1279 CB VAL A 83 8.149 -10.370 11.979 1.00 2.35 C ATOM 1280 CG1 VAL A 83 8.893 -11.320 11.042 1.00 52.54 C ATOM 1281 CG2 VAL A 83 8.279 -8.927 11.513 1.00 20.01 C ATOM 0 H VAL A 83 7.249 -12.745 12.398 1.00 5.33 H new ATOM 0 HA VAL A 83 6.253 -10.083 12.901 1.00 72.44 H new ATOM 0 HB VAL A 83 8.618 -10.466 12.958 1.00 2.35 H new ATOM 0 HG11 VAL A 83 9.935 -11.011 10.963 1.00 52.54 H new ATOM 0 HG12 VAL A 83 8.844 -12.334 11.438 1.00 52.54 H new ATOM 0 HG13 VAL A 83 8.431 -11.294 10.055 1.00 52.54 H new ATOM 0 HG21 VAL A 83 9.334 -8.673 11.405 1.00 20.01 H new ATOM 0 HG22 VAL A 83 7.777 -8.808 10.553 1.00 20.01 H new ATOM 0 HG23 VAL A 83 7.819 -8.265 12.247 1.00 20.01 H new ATOM 1291 N VAL A 84 4.804 -9.769 10.932 1.00 52.24 N ATOM 1292 CA VAL A 84 3.891 -9.590 9.816 1.00 75.43 C ATOM 1293 C VAL A 84 4.075 -8.221 9.183 1.00 40.51 C ATOM 1294 O VAL A 84 4.523 -7.274 9.833 1.00 34.24 O ATOM 1295 CB VAL A 84 2.416 -9.778 10.251 1.00 13.42 C ATOM 1296 CG1 VAL A 84 2.275 -11.023 11.109 1.00 22.45 C ATOM 1297 CG2 VAL A 84 1.886 -8.556 10.989 1.00 23.12 C ATOM 0 H VAL A 84 4.548 -9.252 11.773 1.00 52.24 H new ATOM 0 HA VAL A 84 4.128 -10.356 9.078 1.00 75.43 H new ATOM 0 HB VAL A 84 1.816 -9.900 9.349 1.00 13.42 H new ATOM 0 HG11 VAL A 84 1.234 -11.143 11.408 1.00 22.45 H new ATOM 0 HG12 VAL A 84 2.592 -11.896 10.538 1.00 22.45 H new ATOM 0 HG13 VAL A 84 2.898 -10.925 11.998 1.00 22.45 H new ATOM 0 HG21 VAL A 84 0.849 -8.727 11.277 1.00 23.12 H new ATOM 0 HG22 VAL A 84 2.487 -8.381 11.881 1.00 23.12 H new ATOM 0 HG23 VAL A 84 1.942 -7.684 10.337 1.00 23.12 H new ATOM 1307 N GLU A 85 3.755 -8.140 7.907 1.00 14.42 N ATOM 1308 CA GLU A 85 3.849 -6.898 7.169 1.00 10.14 C ATOM 1309 C GLU A 85 2.468 -6.391 6.783 1.00 2.45 C ATOM 1310 O GLU A 85 1.885 -6.845 5.800 1.00 34.31 O ATOM 1311 CB GLU A 85 4.693 -7.088 5.908 1.00 60.14 C ATOM 1312 CG GLU A 85 5.292 -5.794 5.370 1.00 22.04 C ATOM 1313 CD GLU A 85 6.187 -5.095 6.370 1.00 42.23 C ATOM 1314 OE1 GLU A 85 7.385 -5.436 6.439 1.00 22.02 O ATOM 1315 OE2 GLU A 85 5.701 -4.197 7.087 1.00 73.11 O ATOM 0 H GLU A 85 3.424 -8.931 7.355 1.00 14.42 H new ATOM 0 HA GLU A 85 4.327 -6.161 7.815 1.00 10.14 H new ATOM 0 HB2 GLU A 85 5.499 -7.789 6.124 1.00 60.14 H new ATOM 0 HB3 GLU A 85 4.075 -7.542 5.133 1.00 60.14 H new ATOM 0 HG2 GLU A 85 5.865 -6.013 4.469 1.00 22.04 H new ATOM 0 HG3 GLU A 85 4.486 -5.120 5.079 1.00 22.04 H new ATOM 1322 N PRO A 86 1.915 -5.467 7.567 1.00 74.33 N ATOM 1323 CA PRO A 86 0.685 -4.790 7.211 1.00 34.02 C ATOM 1324 C PRO A 86 0.942 -3.760 6.121 1.00 63.02 C ATOM 1325 O PRO A 86 1.877 -2.967 6.211 1.00 34.05 O ATOM 1326 CB PRO A 86 0.225 -4.115 8.506 1.00 73.53 C ATOM 1327 CG PRO A 86 1.241 -4.453 9.549 1.00 54.52 C ATOM 1328 CD PRO A 86 2.445 -5.005 8.848 1.00 44.42 C ATOM 0 HA PRO A 86 -0.068 -5.473 6.817 1.00 34.02 H new ATOM 0 HB2 PRO A 86 0.149 -3.036 8.374 1.00 73.53 H new ATOM 0 HB3 PRO A 86 -0.763 -4.470 8.798 1.00 73.53 H new ATOM 0 HG2 PRO A 86 1.507 -3.567 10.126 1.00 54.52 H new ATOM 0 HG3 PRO A 86 0.839 -5.183 10.252 1.00 54.52 H new ATOM 0 HD2 PRO A 86 3.214 -4.244 8.713 1.00 44.42 H new ATOM 0 HD3 PRO A 86 2.899 -5.820 9.412 1.00 44.42 H new ATOM 1336 N LYS A 87 0.138 -3.824 5.079 1.00 31.44 N ATOM 1337 CA LYS A 87 0.252 -2.933 3.936 1.00 50.13 C ATOM 1338 C LYS A 87 -1.135 -2.461 3.580 1.00 13.35 C ATOM 1339 O LYS A 87 -2.084 -2.860 4.227 1.00 21.33 O ATOM 1340 CB LYS A 87 0.909 -3.655 2.746 1.00 12.22 C ATOM 1341 CG LYS A 87 2.099 -4.515 3.150 1.00 21.20 C ATOM 1342 CD LYS A 87 3.021 -4.843 1.991 1.00 43.23 C ATOM 1343 CE LYS A 87 3.690 -6.191 2.215 1.00 4.12 C ATOM 1344 NZ LYS A 87 4.649 -6.540 1.141 1.00 14.53 N ATOM 0 H LYS A 87 -0.621 -4.501 4.998 1.00 31.44 H new ATOM 0 HA LYS A 87 0.885 -2.081 4.183 1.00 50.13 H new ATOM 0 HB2 LYS A 87 0.166 -4.282 2.254 1.00 12.22 H new ATOM 0 HB3 LYS A 87 1.235 -2.915 2.015 1.00 12.22 H new ATOM 0 HG2 LYS A 87 2.667 -3.997 3.923 1.00 21.20 H new ATOM 0 HG3 LYS A 87 1.735 -5.443 3.590 1.00 21.20 H new ATOM 0 HD2 LYS A 87 2.454 -4.861 1.060 1.00 43.23 H new ATOM 0 HD3 LYS A 87 3.778 -4.066 1.888 1.00 43.23 H new ATOM 0 HE2 LYS A 87 4.212 -6.178 3.172 1.00 4.12 H new ATOM 0 HE3 LYS A 87 2.925 -6.965 2.279 1.00 4.12 H new ATOM 0 HZ1 LYS A 87 4.986 -7.514 1.279 1.00 14.53 H new ATOM 0 HZ2 LYS A 87 4.178 -6.465 0.217 1.00 14.53 H new ATOM 0 HZ3 LYS A 87 5.457 -5.887 1.172 1.00 14.53 H new ATOM 1358 N ARG A 88 -1.269 -1.629 2.573 1.00 10.24 N ATOM 1359 CA ARG A 88 -2.587 -1.152 2.185 1.00 1.45 C ATOM 1360 C ARG A 88 -3.299 -2.223 1.358 1.00 34.51 C ATOM 1361 O ARG A 88 -2.670 -3.164 0.867 1.00 45.05 O ATOM 1362 CB ARG A 88 -2.458 0.152 1.392 1.00 44.24 C ATOM 1363 CG ARG A 88 -3.770 0.889 1.128 1.00 44.12 C ATOM 1364 CD ARG A 88 -4.454 1.316 2.418 1.00 35.11 C ATOM 1365 NE ARG A 88 -3.568 2.119 3.259 1.00 64.10 N ATOM 1366 CZ ARG A 88 -3.967 3.046 4.126 1.00 43.54 C ATOM 1367 NH1 ARG A 88 -5.254 3.319 4.285 1.00 10.12 N ATOM 1368 NH2 ARG A 88 -3.061 3.699 4.838 1.00 14.23 N ATOM 0 H ARG A 88 -0.497 -1.270 2.011 1.00 10.24 H new ATOM 0 HA ARG A 88 -3.179 -0.952 3.078 1.00 1.45 H new ATOM 0 HB2 ARG A 88 -1.787 0.821 1.931 1.00 44.24 H new ATOM 0 HB3 ARG A 88 -1.986 -0.069 0.435 1.00 44.24 H new ATOM 0 HG2 ARG A 88 -3.575 1.768 0.513 1.00 44.12 H new ATOM 0 HG3 ARG A 88 -4.440 0.244 0.559 1.00 44.12 H new ATOM 0 HD2 ARG A 88 -5.350 1.889 2.182 1.00 35.11 H new ATOM 0 HD3 ARG A 88 -4.777 0.432 2.969 1.00 35.11 H new ATOM 0 HE ARG A 88 -2.565 1.956 3.174 1.00 64.10 H new ATOM 0 HH11 ARG A 88 -5.953 2.816 3.739 1.00 10.12 H new ATOM 0 HH12 ARG A 88 -5.545 4.032 4.953 1.00 10.12 H new ATOM 0 HH21 ARG A 88 -2.070 3.489 4.718 1.00 14.23 H new ATOM 0 HH22 ARG A 88 -3.354 4.412 5.506 1.00 14.23 H new ATOM 1382 N ALA A 89 -4.609 -2.096 1.232 1.00 43.52 N ATOM 1383 CA ALA A 89 -5.376 -3.000 0.406 1.00 13.43 C ATOM 1384 C ALA A 89 -5.677 -2.337 -0.924 1.00 44.32 C ATOM 1385 O ALA A 89 -6.650 -1.593 -1.062 1.00 73.03 O ATOM 1386 CB ALA A 89 -6.652 -3.415 1.105 1.00 45.21 C ATOM 0 H ALA A 89 -5.160 -1.373 1.694 1.00 43.52 H new ATOM 0 HA ALA A 89 -4.791 -3.902 0.227 1.00 13.43 H new ATOM 0 HB1 ALA A 89 -7.213 -4.095 0.464 1.00 45.21 H new ATOM 0 HB2 ALA A 89 -6.407 -3.917 2.041 1.00 45.21 H new ATOM 0 HB3 ALA A 89 -7.256 -2.532 1.314 1.00 45.21 H new ATOM 1392 N VAL A 90 -4.812 -2.594 -1.882 1.00 33.32 N ATOM 1393 CA VAL A 90 -4.923 -2.012 -3.205 1.00 52.12 C ATOM 1394 C VAL A 90 -6.098 -2.610 -3.981 1.00 61.11 C ATOM 1395 O VAL A 90 -6.542 -3.731 -3.708 1.00 21.14 O ATOM 1396 CB VAL A 90 -3.604 -2.201 -4.002 1.00 22.30 C ATOM 1397 CG1 VAL A 90 -3.378 -3.660 -4.382 1.00 51.05 C ATOM 1398 CG2 VAL A 90 -3.578 -1.308 -5.231 1.00 22.32 C ATOM 0 H VAL A 90 -4.010 -3.213 -1.766 1.00 33.32 H new ATOM 0 HA VAL A 90 -5.107 -0.945 -3.079 1.00 52.12 H new ATOM 0 HB VAL A 90 -2.784 -1.904 -3.349 1.00 22.30 H new ATOM 0 HG11 VAL A 90 -2.445 -3.751 -4.938 1.00 51.05 H new ATOM 0 HG12 VAL A 90 -3.322 -4.267 -3.478 1.00 51.05 H new ATOM 0 HG13 VAL A 90 -4.205 -4.007 -5.001 1.00 51.05 H new ATOM 0 HG21 VAL A 90 -2.644 -1.460 -5.771 1.00 22.32 H new ATOM 0 HG22 VAL A 90 -4.417 -1.558 -5.880 1.00 22.32 H new ATOM 0 HG23 VAL A 90 -3.654 -0.265 -4.924 1.00 22.32 H new ATOM 1408 N SER A 91 -6.610 -1.837 -4.933 1.00 60.13 N ATOM 1409 CA SER A 91 -7.630 -2.303 -5.851 1.00 20.51 C ATOM 1410 C SER A 91 -7.112 -3.498 -6.648 1.00 44.32 C ATOM 1411 O SER A 91 -5.921 -3.573 -6.968 1.00 34.31 O ATOM 1412 CB SER A 91 -8.011 -1.168 -6.797 1.00 45.12 C ATOM 1413 OG SER A 91 -8.148 0.049 -6.087 1.00 15.31 O ATOM 0 H SER A 91 -6.326 -0.869 -5.086 1.00 60.13 H new ATOM 0 HA SER A 91 -8.509 -2.616 -5.288 1.00 20.51 H new ATOM 0 HB2 SER A 91 -7.250 -1.061 -7.570 1.00 45.12 H new ATOM 0 HB3 SER A 91 -8.947 -1.407 -7.302 1.00 45.12 H new ATOM 0 HG SER A 91 -8.854 -0.043 -5.414 1.00 15.31 H new ATOM 1419 N ARG A 92 -8.009 -4.416 -6.982 1.00 2.02 N ATOM 1420 CA ARG A 92 -7.641 -5.646 -7.677 1.00 71.33 C ATOM 1421 C ARG A 92 -7.117 -5.355 -9.086 1.00 64.32 C ATOM 1422 O ARG A 92 -6.425 -6.178 -9.681 1.00 0.34 O ATOM 1423 CB ARG A 92 -8.847 -6.592 -7.738 1.00 53.20 C ATOM 1424 CG ARG A 92 -8.481 -8.042 -8.022 1.00 23.13 C ATOM 1425 CD ARG A 92 -7.680 -8.655 -6.883 1.00 74.24 C ATOM 1426 NE ARG A 92 -7.344 -10.055 -7.136 1.00 44.34 N ATOM 1427 CZ ARG A 92 -6.858 -10.879 -6.209 1.00 71.23 C ATOM 1428 NH1 ARG A 92 -6.656 -10.443 -4.970 1.00 23.34 N ATOM 1429 NH2 ARG A 92 -6.591 -12.144 -6.518 1.00 61.00 N ATOM 0 H ARG A 92 -9.006 -4.332 -6.781 1.00 2.02 H new ATOM 0 HA ARG A 92 -6.838 -6.126 -7.118 1.00 71.33 H new ATOM 0 HB2 ARG A 92 -9.384 -6.542 -6.791 1.00 53.20 H new ATOM 0 HB3 ARG A 92 -9.532 -6.242 -8.511 1.00 53.20 H new ATOM 0 HG2 ARG A 92 -9.390 -8.622 -8.181 1.00 23.13 H new ATOM 0 HG3 ARG A 92 -7.903 -8.097 -8.944 1.00 23.13 H new ATOM 0 HD2 ARG A 92 -6.763 -8.084 -6.737 1.00 74.24 H new ATOM 0 HD3 ARG A 92 -8.252 -8.582 -5.958 1.00 74.24 H new ATOM 0 HE ARG A 92 -7.490 -10.422 -8.076 1.00 44.34 H new ATOM 0 HH11 ARG A 92 -6.873 -9.476 -4.728 1.00 23.34 H new ATOM 0 HH12 ARG A 92 -6.284 -11.075 -4.261 1.00 23.34 H new ATOM 0 HH21 ARG A 92 -6.758 -12.484 -7.465 1.00 61.00 H new ATOM 0 HH22 ARG A 92 -6.219 -12.775 -5.808 1.00 61.00 H new ATOM 1443 N GLU A 93 -7.436 -4.170 -9.593 1.00 35.23 N ATOM 1444 CA GLU A 93 -6.978 -3.738 -10.907 1.00 54.24 C ATOM 1445 C GLU A 93 -5.458 -3.546 -10.941 1.00 12.00 C ATOM 1446 O GLU A 93 -4.811 -3.905 -11.920 1.00 65.15 O ATOM 1447 CB GLU A 93 -7.691 -2.446 -11.303 1.00 63.30 C ATOM 1448 CG GLU A 93 -9.197 -2.615 -11.442 1.00 40.34 C ATOM 1449 CD GLU A 93 -9.921 -1.305 -11.671 1.00 3.35 C ATOM 1450 OE1 GLU A 93 -9.907 -0.802 -12.813 1.00 63.22 O ATOM 1451 OE2 GLU A 93 -10.512 -0.771 -10.713 1.00 73.23 O ATOM 0 H GLU A 93 -8.016 -3.485 -9.108 1.00 35.23 H new ATOM 0 HA GLU A 93 -7.222 -4.520 -11.626 1.00 54.24 H new ATOM 0 HB2 GLU A 93 -7.485 -1.680 -10.555 1.00 63.30 H new ATOM 0 HB3 GLU A 93 -7.283 -2.087 -12.248 1.00 63.30 H new ATOM 0 HG2 GLU A 93 -9.406 -3.289 -12.272 1.00 40.34 H new ATOM 0 HG3 GLU A 93 -9.589 -3.088 -10.541 1.00 40.34 H new ATOM 1458 N ASP A 94 -4.891 -2.998 -9.863 1.00 71.42 N ATOM 1459 CA ASP A 94 -3.436 -2.819 -9.768 1.00 51.54 C ATOM 1460 C ASP A 94 -2.767 -4.142 -9.415 1.00 2.03 C ATOM 1461 O ASP A 94 -1.597 -4.367 -9.722 1.00 64.02 O ATOM 1462 CB ASP A 94 -3.085 -1.748 -8.725 1.00 63.25 C ATOM 1463 CG ASP A 94 -1.584 -1.590 -8.511 1.00 42.12 C ATOM 1464 OD1 ASP A 94 -0.912 -0.978 -9.371 1.00 22.03 O ATOM 1465 OD2 ASP A 94 -1.075 -2.071 -7.469 1.00 74.25 O ATOM 0 H ASP A 94 -5.411 -2.672 -9.048 1.00 71.42 H new ATOM 0 HA ASP A 94 -3.066 -2.484 -10.737 1.00 51.54 H new ATOM 0 HB2 ASP A 94 -3.504 -0.792 -9.040 1.00 63.25 H new ATOM 0 HB3 ASP A 94 -3.556 -2.005 -7.776 1.00 63.25 H new ATOM 1470 N SER A 95 -3.553 -5.044 -8.825 1.00 74.13 N ATOM 1471 CA SER A 95 -3.079 -6.374 -8.450 1.00 53.22 C ATOM 1472 C SER A 95 -2.830 -7.246 -9.690 1.00 41.34 C ATOM 1473 O SER A 95 -2.420 -8.402 -9.578 1.00 10.01 O ATOM 1474 CB SER A 95 -4.095 -7.043 -7.514 1.00 74.20 C ATOM 1475 OG SER A 95 -3.592 -8.250 -6.967 1.00 61.00 O ATOM 0 H SER A 95 -4.532 -4.873 -8.595 1.00 74.13 H new ATOM 0 HA SER A 95 -2.129 -6.267 -7.927 1.00 53.22 H new ATOM 0 HB2 SER A 95 -4.352 -6.357 -6.707 1.00 74.20 H new ATOM 0 HB3 SER A 95 -5.014 -7.248 -8.062 1.00 74.20 H new ATOM 0 HG SER A 95 -3.002 -8.684 -7.619 1.00 61.00 H new ATOM 1481 N GLN A 96 -3.085 -6.682 -10.868 1.00 50.01 N ATOM 1482 CA GLN A 96 -2.779 -7.334 -12.133 1.00 51.45 C ATOM 1483 C GLN A 96 -1.266 -7.370 -12.357 1.00 42.13 C ATOM 1484 O GLN A 96 -0.752 -8.233 -13.072 1.00 12.24 O ATOM 1485 CB GLN A 96 -3.465 -6.582 -13.276 1.00 51.21 C ATOM 1486 CG GLN A 96 -3.316 -7.242 -14.640 1.00 24.44 C ATOM 1487 CD GLN A 96 -3.867 -6.394 -15.775 1.00 74.34 C ATOM 1488 OE1 GLN A 96 -4.401 -6.923 -16.751 1.00 33.31 O ATOM 1489 NE2 GLN A 96 -3.724 -5.080 -15.675 1.00 63.22 N ATOM 0 H GLN A 96 -3.510 -5.760 -10.970 1.00 50.01 H new ATOM 0 HA GLN A 96 -3.149 -8.359 -12.106 1.00 51.45 H new ATOM 0 HB2 GLN A 96 -4.526 -6.485 -13.046 1.00 51.21 H new ATOM 0 HB3 GLN A 96 -3.057 -5.573 -13.327 1.00 51.21 H new ATOM 0 HG2 GLN A 96 -2.261 -7.446 -14.825 1.00 24.44 H new ATOM 0 HG3 GLN A 96 -3.830 -8.203 -14.630 1.00 24.44 H new ATOM 0 HE21 GLN A 96 -3.277 -4.677 -14.852 1.00 63.22 H new ATOM 0 HE22 GLN A 96 -4.061 -4.472 -16.421 1.00 63.22 H new ATOM 1498 N ARG A 97 -0.559 -6.433 -11.735 1.00 54.25 N ATOM 1499 CA ARG A 97 0.891 -6.353 -11.862 1.00 62.12 C ATOM 1500 C ARG A 97 1.557 -7.410 -10.983 1.00 21.30 C ATOM 1501 O ARG A 97 1.045 -7.747 -9.912 1.00 73.24 O ATOM 1502 CB ARG A 97 1.396 -4.954 -11.479 1.00 53.41 C ATOM 1503 CG ARG A 97 0.705 -3.820 -12.228 1.00 3.14 C ATOM 1504 CD ARG A 97 0.904 -3.942 -13.733 1.00 42.14 C ATOM 1505 NE ARG A 97 0.210 -2.891 -14.474 1.00 40.14 N ATOM 1506 CZ ARG A 97 0.209 -2.790 -15.803 1.00 24.10 C ATOM 1507 NH1 ARG A 97 0.869 -3.674 -16.548 1.00 43.43 N ATOM 1508 NH2 ARG A 97 -0.447 -1.798 -16.385 1.00 13.12 N ATOM 0 H ARG A 97 -0.968 -5.716 -11.136 1.00 54.25 H new ATOM 0 HA ARG A 97 1.153 -6.540 -12.903 1.00 62.12 H new ATOM 0 HB2 ARG A 97 1.254 -4.808 -10.408 1.00 53.41 H new ATOM 0 HB3 ARG A 97 2.468 -4.901 -11.669 1.00 53.41 H new ATOM 0 HG2 ARG A 97 -0.361 -3.828 -11.999 1.00 3.14 H new ATOM 0 HG3 ARG A 97 1.098 -2.863 -11.884 1.00 3.14 H new ATOM 0 HD2 ARG A 97 1.969 -3.900 -13.960 1.00 42.14 H new ATOM 0 HD3 ARG A 97 0.545 -4.916 -14.066 1.00 42.14 H new ATOM 0 HE ARG A 97 -0.306 -2.191 -13.941 1.00 40.14 H new ATOM 0 HH11 ARG A 97 1.380 -4.436 -16.102 1.00 43.43 H new ATOM 0 HH12 ARG A 97 0.863 -3.590 -17.564 1.00 43.43 H new ATOM 0 HH21 ARG A 97 -0.949 -1.115 -15.817 1.00 13.12 H new ATOM 0 HH22 ARG A 97 -0.451 -1.716 -17.402 1.00 13.12 H new ATOM 1522 N PRO A 98 2.698 -7.959 -11.433 1.00 74.12 N ATOM 1523 CA PRO A 98 3.430 -8.986 -10.686 1.00 3.44 C ATOM 1524 C PRO A 98 4.072 -8.429 -9.418 1.00 61.23 C ATOM 1525 O PRO A 98 4.973 -7.587 -9.476 1.00 1.05 O ATOM 1526 CB PRO A 98 4.502 -9.450 -11.675 1.00 54.32 C ATOM 1527 CG PRO A 98 4.690 -8.313 -12.617 1.00 30.33 C ATOM 1528 CD PRO A 98 3.360 -7.618 -12.705 1.00 32.24 C ATOM 0 HA PRO A 98 2.776 -9.788 -10.344 1.00 3.44 H new ATOM 0 HB2 PRO A 98 5.432 -9.692 -11.161 1.00 54.32 H new ATOM 0 HB3 PRO A 98 4.186 -10.350 -12.203 1.00 54.32 H new ATOM 0 HG2 PRO A 98 5.462 -7.633 -12.257 1.00 30.33 H new ATOM 0 HG3 PRO A 98 5.010 -8.668 -13.597 1.00 30.33 H new ATOM 0 HD2 PRO A 98 3.479 -6.540 -12.817 1.00 32.24 H new ATOM 0 HD3 PRO A 98 2.783 -7.966 -13.562 1.00 32.24 H new ATOM 1536 N GLY A 99 3.605 -8.906 -8.274 1.00 53.54 N ATOM 1537 CA GLY A 99 4.126 -8.436 -7.008 1.00 63.31 C ATOM 1538 C GLY A 99 3.511 -7.116 -6.591 1.00 64.41 C ATOM 1539 O GLY A 99 4.203 -6.229 -6.089 1.00 54.10 O ATOM 0 H GLY A 99 2.873 -9.612 -8.200 1.00 53.54 H new ATOM 0 HA2 GLY A 99 3.934 -9.183 -6.238 1.00 63.31 H new ATOM 0 HA3 GLY A 99 5.208 -8.324 -7.081 1.00 63.31 H new ATOM 1543 N ALA A 100 2.206 -6.996 -6.790 1.00 12.10 N ATOM 1544 CA ALA A 100 1.479 -5.780 -6.448 1.00 51.20 C ATOM 1545 C ALA A 100 1.325 -5.633 -4.938 1.00 44.42 C ATOM 1546 O ALA A 100 1.216 -4.526 -4.424 1.00 25.12 O ATOM 1547 CB ALA A 100 0.116 -5.781 -7.115 1.00 1.34 C ATOM 0 H ALA A 100 1.624 -7.732 -7.190 1.00 12.10 H new ATOM 0 HA ALA A 100 2.055 -4.929 -6.812 1.00 51.20 H new ATOM 0 HB1 ALA A 100 -0.418 -4.868 -6.852 1.00 1.34 H new ATOM 0 HB2 ALA A 100 0.240 -5.830 -8.197 1.00 1.34 H new ATOM 0 HB3 ALA A 100 -0.455 -6.645 -6.776 1.00 1.34 H new ATOM 1553 N HIS A 101 1.321 -6.751 -4.229 1.00 53.40 N ATOM 1554 CA HIS A 101 1.213 -6.718 -2.778 1.00 34.33 C ATOM 1555 C HIS A 101 2.578 -6.888 -2.125 1.00 70.41 C ATOM 1556 O HIS A 101 2.678 -7.095 -0.915 1.00 22.33 O ATOM 1557 CB HIS A 101 0.235 -7.781 -2.277 1.00 52.12 C ATOM 1558 CG HIS A 101 -1.173 -7.281 -2.152 1.00 42.55 C ATOM 1559 ND1 HIS A 101 -2.237 -7.999 -2.641 1.00 64.54 N ATOM 1560 CD2 HIS A 101 -1.639 -6.142 -1.577 1.00 72.03 C ATOM 1561 CE1 HIS A 101 -3.316 -7.291 -2.356 1.00 43.41 C ATOM 1562 NE2 HIS A 101 -3.003 -6.161 -1.713 1.00 22.41 N ATOM 0 H HIS A 101 1.391 -7.686 -4.630 1.00 53.40 H new ATOM 0 HA HIS A 101 0.823 -5.740 -2.495 1.00 34.33 H new ATOM 0 HB2 HIS A 101 0.252 -8.631 -2.960 1.00 52.12 H new ATOM 0 HB3 HIS A 101 0.571 -8.145 -1.306 1.00 52.12 H new ATOM 0 HD2 HIS A 101 -1.049 -5.371 -1.104 1.00 72.03 H new ATOM 0 HE1 HIS A 101 -4.323 -7.587 -2.610 1.00 43.41 H new ATOM 0 HE2 HIS A 101 -3.655 -5.448 -1.386 1.00 22.41 H new ATOM 1570 N LEU A 102 3.632 -6.790 -2.926 1.00 45.43 N ATOM 1571 CA LEU A 102 4.984 -6.779 -2.391 1.00 15.23 C ATOM 1572 C LEU A 102 5.310 -5.376 -1.900 1.00 14.11 C ATOM 1573 O LEU A 102 4.575 -4.429 -2.185 1.00 63.54 O ATOM 1574 CB LEU A 102 6.012 -7.229 -3.437 1.00 63.54 C ATOM 1575 CG LEU A 102 5.877 -8.678 -3.922 1.00 45.13 C ATOM 1576 CD1 LEU A 102 6.998 -9.018 -4.894 1.00 4.25 C ATOM 1577 CD2 LEU A 102 5.881 -9.653 -2.752 1.00 33.20 C ATOM 0 H LEU A 102 3.576 -6.718 -3.942 1.00 45.43 H new ATOM 0 HA LEU A 102 5.036 -7.486 -1.563 1.00 15.23 H new ATOM 0 HB2 LEU A 102 5.938 -6.568 -4.300 1.00 63.54 H new ATOM 0 HB3 LEU A 102 7.010 -7.097 -3.019 1.00 63.54 H new ATOM 0 HG LEU A 102 4.921 -8.772 -4.437 1.00 45.13 H new ATOM 0 HD11 LEU A 102 6.889 -10.049 -5.229 1.00 4.25 H new ATOM 0 HD12 LEU A 102 6.949 -8.350 -5.754 1.00 4.25 H new ATOM 0 HD13 LEU A 102 7.960 -8.899 -4.396 1.00 4.25 H new ATOM 0 HD21 LEU A 102 5.784 -10.672 -3.127 1.00 33.20 H new ATOM 0 HD22 LEU A 102 6.817 -9.557 -2.201 1.00 33.20 H new ATOM 0 HD23 LEU A 102 5.045 -9.429 -2.089 1.00 33.20 H new ATOM 1589 N THR A 103 6.391 -5.243 -1.152 1.00 63.12 N ATOM 1590 CA THR A 103 6.763 -3.963 -0.575 1.00 31.35 C ATOM 1591 C THR A 103 7.361 -3.038 -1.632 1.00 21.20 C ATOM 1592 O THR A 103 8.566 -3.046 -1.878 1.00 41.22 O ATOM 1593 CB THR A 103 7.750 -4.160 0.582 1.00 73.53 C ATOM 1594 OG1 THR A 103 7.282 -5.220 1.423 1.00 74.32 O ATOM 1595 CG2 THR A 103 7.888 -2.890 1.402 1.00 3.14 C ATOM 0 H THR A 103 7.028 -6.008 -0.929 1.00 63.12 H new ATOM 0 HA THR A 103 5.859 -3.495 -0.186 1.00 31.35 H new ATOM 0 HB THR A 103 8.727 -4.410 0.168 1.00 73.53 H new ATOM 0 HG1 THR A 103 7.910 -5.352 2.164 1.00 74.32 H new ATOM 0 HG21 THR A 103 8.594 -3.057 2.216 1.00 3.14 H new ATOM 0 HG22 THR A 103 8.253 -2.084 0.765 1.00 3.14 H new ATOM 0 HG23 THR A 103 6.917 -2.616 1.814 1.00 3.14 H new ATOM 1603 N VAL A 104 6.494 -2.268 -2.263 1.00 62.33 N ATOM 1604 CA VAL A 104 6.886 -1.346 -3.315 1.00 44.20 C ATOM 1605 C VAL A 104 6.691 0.085 -2.845 1.00 10.03 C ATOM 1606 O VAL A 104 5.563 0.486 -2.561 1.00 30.11 O ATOM 1607 CB VAL A 104 6.033 -1.564 -4.581 1.00 4.51 C ATOM 1608 CG1 VAL A 104 6.429 -0.593 -5.682 1.00 21.03 C ATOM 1609 CG2 VAL A 104 6.141 -2.997 -5.061 1.00 23.41 C ATOM 0 H VAL A 104 5.494 -2.264 -2.060 1.00 62.33 H new ATOM 0 HA VAL A 104 7.935 -1.529 -3.549 1.00 44.20 H new ATOM 0 HB VAL A 104 4.992 -1.369 -4.322 1.00 4.51 H new ATOM 0 HG11 VAL A 104 5.811 -0.770 -6.562 1.00 21.03 H new ATOM 0 HG12 VAL A 104 6.282 0.430 -5.335 1.00 21.03 H new ATOM 0 HG13 VAL A 104 7.478 -0.742 -5.939 1.00 21.03 H new ATOM 0 HG21 VAL A 104 5.531 -3.128 -5.955 1.00 23.41 H new ATOM 0 HG22 VAL A 104 7.181 -3.225 -5.294 1.00 23.41 H new ATOM 0 HG23 VAL A 104 5.788 -3.670 -4.279 1.00 23.41 H new ATOM 1619 N LYS A 105 7.766 0.855 -2.721 1.00 30.34 N ATOM 1620 CA LYS A 105 7.644 2.251 -2.330 1.00 5.30 C ATOM 1621 C LYS A 105 7.958 3.176 -3.503 1.00 34.43 C ATOM 1622 O LYS A 105 8.306 4.339 -3.319 1.00 50.03 O ATOM 1623 CB LYS A 105 8.591 2.543 -1.170 1.00 63.04 C ATOM 1624 CG LYS A 105 8.569 1.481 -0.086 1.00 2.05 C ATOM 1625 CD LYS A 105 9.428 1.885 1.091 1.00 45.11 C ATOM 1626 CE LYS A 105 9.346 0.873 2.219 1.00 44.32 C ATOM 1627 NZ LYS A 105 10.273 1.218 3.328 1.00 23.24 N ATOM 0 H LYS A 105 8.722 0.539 -2.884 1.00 30.34 H new ATOM 0 HA LYS A 105 6.616 2.434 -2.017 1.00 5.30 H new ATOM 0 HB2 LYS A 105 9.606 2.636 -1.555 1.00 63.04 H new ATOM 0 HB3 LYS A 105 8.328 3.505 -0.730 1.00 63.04 H new ATOM 0 HG2 LYS A 105 7.544 1.318 0.247 1.00 2.05 H new ATOM 0 HG3 LYS A 105 8.926 0.535 -0.493 1.00 2.05 H new ATOM 0 HD2 LYS A 105 10.464 1.986 0.768 1.00 45.11 H new ATOM 0 HD3 LYS A 105 9.111 2.862 1.455 1.00 45.11 H new ATOM 0 HE2 LYS A 105 8.325 0.830 2.597 1.00 44.32 H new ATOM 0 HE3 LYS A 105 9.587 -0.119 1.837 1.00 44.32 H new ATOM 0 HZ1 LYS A 105 10.019 0.671 4.175 1.00 23.24 H new ATOM 0 HZ2 LYS A 105 11.249 0.991 3.048 1.00 23.24 H new ATOM 0 HZ3 LYS A 105 10.201 2.234 3.538 1.00 23.24 H new ATOM 1641 N LYS A 106 7.830 2.652 -4.708 1.00 53.44 N ATOM 1642 CA LYS A 106 8.072 3.436 -5.908 1.00 12.03 C ATOM 1643 C LYS A 106 6.858 3.428 -6.835 1.00 2.14 C ATOM 1644 O LYS A 106 6.191 2.404 -6.983 1.00 52.31 O ATOM 1645 CB LYS A 106 9.297 2.879 -6.627 1.00 43.21 C ATOM 1646 CG LYS A 106 10.544 3.724 -6.438 1.00 11.03 C ATOM 1647 CD LYS A 106 10.524 4.950 -7.332 1.00 21.12 C ATOM 1648 CE LYS A 106 10.702 4.580 -8.792 1.00 0.11 C ATOM 1649 NZ LYS A 106 12.070 4.081 -9.079 1.00 71.10 N ATOM 0 H LYS A 106 7.559 1.684 -4.883 1.00 53.44 H new ATOM 0 HA LYS A 106 8.252 4.472 -5.620 1.00 12.03 H new ATOM 0 HB2 LYS A 106 9.493 1.869 -6.266 1.00 43.21 H new ATOM 0 HB3 LYS A 106 9.079 2.800 -7.692 1.00 43.21 H new ATOM 0 HG2 LYS A 106 10.621 4.033 -5.396 1.00 11.03 H new ATOM 0 HG3 LYS A 106 11.428 3.125 -6.659 1.00 11.03 H new ATOM 0 HD2 LYS A 106 9.580 5.480 -7.203 1.00 21.12 H new ATOM 0 HD3 LYS A 106 11.317 5.634 -7.030 1.00 21.12 H new ATOM 0 HE2 LYS A 106 9.974 3.816 -9.063 1.00 0.11 H new ATOM 0 HE3 LYS A 106 10.497 5.451 -9.414 1.00 0.11 H new ATOM 0 HZ1 LYS A 106 12.152 3.856 -10.091 1.00 71.10 H new ATOM 0 HZ2 LYS A 106 12.766 4.812 -8.829 1.00 71.10 H new ATOM 0 HZ3 LYS A 106 12.252 3.224 -8.518 1.00 71.10 H new ATOM 1663 N ILE A 107 6.560 4.578 -7.448 1.00 62.34 N ATOM 1664 CA ILE A 107 5.462 4.672 -8.414 1.00 72.15 C ATOM 1665 C ILE A 107 5.917 5.292 -9.730 1.00 21.12 C ATOM 1666 O ILE A 107 6.881 6.061 -9.774 1.00 3.12 O ATOM 1667 CB ILE A 107 4.274 5.510 -7.893 1.00 23.33 C ATOM 1668 CG1 ILE A 107 4.772 6.784 -7.218 1.00 13.53 C ATOM 1669 CG2 ILE A 107 3.410 4.692 -6.954 1.00 14.01 C ATOM 1670 CD1 ILE A 107 3.663 7.736 -6.847 1.00 21.31 C ATOM 0 H ILE A 107 7.061 5.453 -7.293 1.00 62.34 H new ATOM 0 HA ILE A 107 5.138 3.643 -8.569 1.00 72.15 H new ATOM 0 HB ILE A 107 3.657 5.800 -8.743 1.00 23.33 H new ATOM 0 HG12 ILE A 107 5.328 6.517 -6.319 1.00 13.53 H new ATOM 0 HG13 ILE A 107 5.469 7.291 -7.885 1.00 13.53 H new ATOM 0 HG21 ILE A 107 2.579 5.302 -6.599 1.00 14.01 H new ATOM 0 HG22 ILE A 107 3.021 3.822 -7.483 1.00 14.01 H new ATOM 0 HG23 ILE A 107 4.007 4.363 -6.104 1.00 14.01 H new ATOM 0 HD11 ILE A 107 4.087 8.620 -6.371 1.00 21.31 H new ATOM 0 HD12 ILE A 107 3.121 8.032 -7.746 1.00 21.31 H new ATOM 0 HD13 ILE A 107 2.978 7.245 -6.156 1.00 21.31 H new ATOM 1682 N PHE A 108 5.203 4.939 -10.787 1.00 31.21 N ATOM 1683 CA PHE A 108 5.423 5.489 -12.115 1.00 65.20 C ATOM 1684 C PHE A 108 4.387 6.572 -12.392 1.00 21.52 C ATOM 1685 O PHE A 108 3.216 6.408 -12.060 1.00 20.22 O ATOM 1686 CB PHE A 108 5.337 4.358 -13.158 1.00 52.44 C ATOM 1687 CG PHE A 108 4.938 4.789 -14.548 1.00 22.45 C ATOM 1688 CD1 PHE A 108 5.889 5.202 -15.466 1.00 21.31 C ATOM 1689 CD2 PHE A 108 3.604 4.768 -14.937 1.00 30.14 C ATOM 1690 CE1 PHE A 108 5.518 5.588 -16.742 1.00 22.04 C ATOM 1691 CE2 PHE A 108 3.227 5.150 -16.206 1.00 24.22 C ATOM 1692 CZ PHE A 108 4.185 5.561 -17.112 1.00 51.35 C ATOM 0 H PHE A 108 4.447 4.256 -10.747 1.00 31.21 H new ATOM 0 HA PHE A 108 6.414 5.938 -12.176 1.00 65.20 H new ATOM 0 HB2 PHE A 108 6.307 3.863 -13.214 1.00 52.44 H new ATOM 0 HB3 PHE A 108 4.620 3.616 -12.806 1.00 52.44 H new ATOM 0 HD1 PHE A 108 6.931 5.223 -15.183 1.00 21.31 H new ATOM 0 HD2 PHE A 108 2.850 4.447 -14.233 1.00 30.14 H new ATOM 0 HE1 PHE A 108 6.268 5.910 -17.449 1.00 22.04 H new ATOM 0 HE2 PHE A 108 2.186 5.128 -16.491 1.00 24.22 H new ATOM 0 HZ PHE A 108 3.894 5.861 -18.108 1.00 51.35 H new ATOM 1702 N VAL A 109 4.826 7.677 -12.974 1.00 33.41 N ATOM 1703 CA VAL A 109 3.928 8.764 -13.352 1.00 52.30 C ATOM 1704 C VAL A 109 4.119 9.093 -14.829 1.00 73.10 C ATOM 1705 O VAL A 109 5.172 9.572 -15.223 1.00 45.04 O ATOM 1706 CB VAL A 109 4.191 10.040 -12.513 1.00 0.11 C ATOM 1707 CG1 VAL A 109 3.111 11.086 -12.755 1.00 50.00 C ATOM 1708 CG2 VAL A 109 4.291 9.709 -11.032 1.00 23.14 C ATOM 0 H VAL A 109 5.806 7.848 -13.198 1.00 33.41 H new ATOM 0 HA VAL A 109 2.907 8.433 -13.163 1.00 52.30 H new ATOM 0 HB VAL A 109 5.146 10.456 -12.834 1.00 0.11 H new ATOM 0 HG11 VAL A 109 3.320 11.971 -12.154 1.00 50.00 H new ATOM 0 HG12 VAL A 109 3.099 11.359 -13.810 1.00 50.00 H new ATOM 0 HG13 VAL A 109 2.140 10.678 -12.474 1.00 50.00 H new ATOM 0 HG21 VAL A 109 4.476 10.622 -10.467 1.00 23.14 H new ATOM 0 HG22 VAL A 109 3.358 9.257 -10.696 1.00 23.14 H new ATOM 0 HG23 VAL A 109 5.111 9.010 -10.870 1.00 23.14 H new ATOM 1718 N GLY A 110 3.115 8.835 -15.649 1.00 64.32 N ATOM 1719 CA GLY A 110 3.264 9.065 -17.073 1.00 3.20 C ATOM 1720 C GLY A 110 2.154 9.909 -17.656 1.00 61.23 C ATOM 1721 O GLY A 110 1.038 9.926 -17.139 1.00 61.31 O ATOM 0 H GLY A 110 2.206 8.474 -15.360 1.00 64.32 H new ATOM 0 HA2 GLY A 110 4.220 9.555 -17.258 1.00 3.20 H new ATOM 0 HA3 GLY A 110 3.292 8.105 -17.589 1.00 3.20 H new ATOM 1725 N GLY A 111 2.463 10.615 -18.737 1.00 52.10 N ATOM 1726 CA GLY A 111 1.463 11.430 -19.401 1.00 75.22 C ATOM 1727 C GLY A 111 1.741 12.912 -19.272 1.00 63.15 C ATOM 1728 O GLY A 111 0.928 13.743 -19.685 1.00 70.25 O ATOM 0 H GLY A 111 3.388 10.638 -19.166 1.00 52.10 H new ATOM 0 HA2 GLY A 111 1.424 11.162 -20.457 1.00 75.22 H new ATOM 0 HA3 GLY A 111 0.482 11.210 -18.980 1.00 75.22 H new ATOM 1732 N ILE A 112 2.892 13.245 -18.705 1.00 22.11 N ATOM 1733 CA ILE A 112 3.271 14.635 -18.508 1.00 31.45 C ATOM 1734 C ILE A 112 3.818 15.238 -19.803 1.00 3.44 C ATOM 1735 O ILE A 112 4.966 15.023 -20.181 1.00 63.21 O ATOM 1736 CB ILE A 112 4.292 14.795 -17.351 1.00 53.22 C ATOM 1737 CG1 ILE A 112 5.476 13.834 -17.501 1.00 22.44 C ATOM 1738 CG2 ILE A 112 3.603 14.556 -16.018 1.00 63.24 C ATOM 1739 CD1 ILE A 112 6.565 14.041 -16.470 1.00 11.21 C ATOM 0 H ILE A 112 3.580 12.569 -18.373 1.00 22.11 H new ATOM 0 HA ILE A 112 2.371 15.182 -18.226 1.00 31.45 H new ATOM 0 HB ILE A 112 4.681 15.813 -17.390 1.00 53.22 H new ATOM 0 HG12 ILE A 112 5.111 12.809 -17.430 1.00 22.44 H new ATOM 0 HG13 ILE A 112 5.904 13.952 -18.497 1.00 22.44 H new ATOM 0 HG21 ILE A 112 4.325 14.670 -15.210 1.00 63.24 H new ATOM 0 HG22 ILE A 112 2.798 15.279 -15.890 1.00 63.24 H new ATOM 0 HG23 ILE A 112 3.191 13.547 -15.997 1.00 63.24 H new ATOM 0 HD11 ILE A 112 7.369 13.325 -16.641 1.00 11.21 H new ATOM 0 HD12 ILE A 112 6.958 15.054 -16.554 1.00 11.21 H new ATOM 0 HD13 ILE A 112 6.153 13.894 -15.471 1.00 11.21 H new ATOM 1751 N LYS A 113 2.976 15.988 -20.490 1.00 74.31 N ATOM 1752 CA LYS A 113 3.334 16.539 -21.793 1.00 60.40 C ATOM 1753 C LYS A 113 3.919 17.940 -21.657 1.00 1.02 C ATOM 1754 O LYS A 113 4.234 18.594 -22.652 1.00 75.12 O ATOM 1755 CB LYS A 113 2.117 16.544 -22.720 1.00 63.02 C ATOM 1756 CG LYS A 113 0.871 17.164 -22.105 1.00 15.44 C ATOM 1757 CD LYS A 113 -0.368 16.915 -22.952 1.00 42.13 C ATOM 1758 CE LYS A 113 -0.743 15.440 -22.985 1.00 12.13 C ATOM 1759 NZ LYS A 113 -0.963 14.883 -21.622 1.00 11.43 N ATOM 0 H LYS A 113 2.038 16.232 -20.171 1.00 74.31 H new ATOM 0 HA LYS A 113 4.102 15.902 -22.233 1.00 60.40 H new ATOM 0 HB2 LYS A 113 2.369 17.088 -23.630 1.00 63.02 H new ATOM 0 HB3 LYS A 113 1.893 15.518 -23.013 1.00 63.02 H new ATOM 0 HG2 LYS A 113 0.716 16.753 -21.107 1.00 15.44 H new ATOM 0 HG3 LYS A 113 1.020 18.237 -21.988 1.00 15.44 H new ATOM 0 HD2 LYS A 113 -1.202 17.493 -22.555 1.00 42.13 H new ATOM 0 HD3 LYS A 113 -0.191 17.268 -23.968 1.00 42.13 H new ATOM 0 HE2 LYS A 113 -1.648 15.311 -23.579 1.00 12.13 H new ATOM 0 HE3 LYS A 113 0.047 14.877 -23.482 1.00 12.13 H new ATOM 0 HZ1 LYS A 113 -1.638 14.093 -21.674 1.00 11.43 H new ATOM 0 HZ2 LYS A 113 -0.059 14.542 -21.236 1.00 11.43 H new ATOM 0 HZ3 LYS A 113 -1.346 15.625 -21.002 1.00 11.43 H new ATOM 1773 N GLU A 114 4.069 18.386 -20.421 1.00 45.00 N ATOM 1774 CA GLU A 114 4.691 19.664 -20.133 1.00 1.33 C ATOM 1775 C GLU A 114 5.875 19.443 -19.201 1.00 32.10 C ATOM 1776 O GLU A 114 6.011 18.357 -18.625 1.00 2.33 O ATOM 1777 CB GLU A 114 3.672 20.615 -19.495 1.00 41.40 C ATOM 1778 CG GLU A 114 4.022 22.087 -19.658 1.00 74.21 C ATOM 1779 CD GLU A 114 4.164 22.486 -21.110 1.00 4.00 C ATOM 1780 OE1 GLU A 114 3.134 22.771 -21.755 1.00 1.02 O ATOM 1781 OE2 GLU A 114 5.306 22.509 -21.616 1.00 74.42 O ATOM 0 H GLU A 114 3.764 17.874 -19.593 1.00 45.00 H new ATOM 0 HA GLU A 114 5.044 20.117 -21.059 1.00 1.33 H new ATOM 0 HB2 GLU A 114 2.692 20.433 -19.937 1.00 41.40 H new ATOM 0 HB3 GLU A 114 3.590 20.386 -18.433 1.00 41.40 H new ATOM 0 HG2 GLU A 114 3.248 22.696 -19.190 1.00 74.21 H new ATOM 0 HG3 GLU A 114 4.954 22.297 -19.133 1.00 74.21 H new ATOM 1788 N ASP A 115 6.736 20.449 -19.065 1.00 61.33 N ATOM 1789 CA ASP A 115 7.871 20.365 -18.151 1.00 53.40 C ATOM 1790 C ASP A 115 7.388 20.315 -16.711 1.00 14.52 C ATOM 1791 O ASP A 115 7.036 21.336 -16.121 1.00 72.43 O ATOM 1792 CB ASP A 115 8.828 21.544 -18.330 1.00 43.44 C ATOM 1793 CG ASP A 115 9.770 21.367 -19.499 1.00 4.25 C ATOM 1794 OD1 ASP A 115 10.845 20.760 -19.315 1.00 10.34 O ATOM 1795 OD2 ASP A 115 9.450 21.850 -20.605 1.00 21.03 O ATOM 0 H ASP A 115 6.669 21.330 -19.575 1.00 61.33 H new ATOM 0 HA ASP A 115 8.412 19.448 -18.386 1.00 53.40 H new ATOM 0 HB2 ASP A 115 8.249 22.457 -18.472 1.00 43.44 H new ATOM 0 HB3 ASP A 115 9.410 21.674 -17.418 1.00 43.44 H new ATOM 1800 N THR A 116 7.357 19.119 -16.156 1.00 70.50 N ATOM 1801 CA THR A 116 6.879 18.925 -14.807 1.00 15.30 C ATOM 1802 C THR A 116 8.039 19.023 -13.835 1.00 51.13 C ATOM 1803 O THR A 116 9.142 18.545 -14.106 1.00 61.00 O ATOM 1804 CB THR A 116 6.165 17.570 -14.663 1.00 32.53 C ATOM 1805 OG1 THR A 116 5.304 17.379 -15.791 1.00 73.24 O ATOM 1806 CG2 THR A 116 5.346 17.516 -13.374 1.00 1.13 C ATOM 0 H THR A 116 7.660 18.265 -16.624 1.00 70.50 H new ATOM 0 HA THR A 116 6.155 19.707 -14.578 1.00 15.30 H new ATOM 0 HB THR A 116 6.913 16.778 -14.621 1.00 32.53 H new ATOM 0 HG1 THR A 116 4.410 17.124 -15.481 1.00 73.24 H new ATOM 0 HG21 THR A 116 4.852 16.548 -13.297 1.00 1.13 H new ATOM 0 HG22 THR A 116 6.006 17.656 -12.518 1.00 1.13 H new ATOM 0 HG23 THR A 116 4.595 18.306 -13.386 1.00 1.13 H new ATOM 1814 N GLU A 117 7.787 19.663 -12.717 1.00 42.25 N ATOM 1815 CA GLU A 117 8.815 19.893 -11.738 1.00 51.13 C ATOM 1816 C GLU A 117 8.654 18.965 -10.563 1.00 20.23 C ATOM 1817 O GLU A 117 7.606 18.329 -10.378 1.00 12.12 O ATOM 1818 CB GLU A 117 8.788 21.341 -11.264 1.00 33.32 C ATOM 1819 CG GLU A 117 9.255 22.316 -12.323 1.00 70.41 C ATOM 1820 CD GLU A 117 10.763 22.436 -12.409 1.00 23.23 C ATOM 1821 OE1 GLU A 117 11.466 21.450 -12.111 1.00 44.41 O ATOM 1822 OE2 GLU A 117 11.257 23.511 -12.801 1.00 70.14 O ATOM 0 H GLU A 117 6.871 20.035 -12.465 1.00 42.25 H new ATOM 0 HA GLU A 117 9.778 19.693 -12.209 1.00 51.13 H new ATOM 0 HB2 GLU A 117 7.774 21.600 -10.961 1.00 33.32 H new ATOM 0 HB3 GLU A 117 9.420 21.441 -10.381 1.00 33.32 H new ATOM 0 HG2 GLU A 117 8.867 22.001 -13.292 1.00 70.41 H new ATOM 0 HG3 GLU A 117 8.831 23.298 -12.114 1.00 70.41 H new ATOM 1829 N GLU A 118 9.706 18.907 -9.777 1.00 31.34 N ATOM 1830 CA GLU A 118 9.697 18.145 -8.543 1.00 50.25 C ATOM 1831 C GLU A 118 8.626 18.710 -7.628 1.00 73.40 C ATOM 1832 O GLU A 118 7.785 17.978 -7.130 1.00 13.45 O ATOM 1833 CB GLU A 118 11.072 18.190 -7.866 1.00 35.53 C ATOM 1834 CG GLU A 118 11.130 17.475 -6.520 1.00 13.44 C ATOM 1835 CD GLU A 118 11.249 18.424 -5.343 1.00 11.03 C ATOM 1836 OE1 GLU A 118 10.211 18.885 -4.827 1.00 70.33 O ATOM 1837 OE2 GLU A 118 12.387 18.709 -4.922 1.00 64.25 O ATOM 0 H GLU A 118 10.587 19.382 -9.971 1.00 31.34 H new ATOM 0 HA GLU A 118 9.475 17.100 -8.761 1.00 50.25 H new ATOM 0 HB2 GLU A 118 11.808 17.743 -8.534 1.00 35.53 H new ATOM 0 HB3 GLU A 118 11.361 19.231 -7.724 1.00 35.53 H new ATOM 0 HG2 GLU A 118 10.233 16.868 -6.400 1.00 13.44 H new ATOM 0 HG3 GLU A 118 11.980 16.792 -6.515 1.00 13.44 H new ATOM 1844 N HIS A 119 8.631 20.037 -7.492 1.00 12.34 N ATOM 1845 CA HIS A 119 7.686 20.757 -6.638 1.00 64.34 C ATOM 1846 C HIS A 119 6.236 20.433 -6.991 1.00 62.00 C ATOM 1847 O HIS A 119 5.369 20.448 -6.123 1.00 72.30 O ATOM 1848 CB HIS A 119 7.898 22.272 -6.765 1.00 72.03 C ATOM 1849 CG HIS A 119 9.186 22.775 -6.179 1.00 23.25 C ATOM 1850 ND1 HIS A 119 9.196 23.696 -5.159 1.00 43.54 N ATOM 1851 CD2 HIS A 119 10.462 22.476 -6.516 1.00 34.41 C ATOM 1852 CE1 HIS A 119 10.471 23.936 -4.902 1.00 2.22 C ATOM 1853 NE2 HIS A 119 11.272 23.219 -5.700 1.00 33.25 N ATOM 0 H HIS A 119 9.294 20.645 -7.973 1.00 12.34 H new ATOM 0 HA HIS A 119 7.875 20.435 -5.614 1.00 64.34 H new ATOM 0 HB2 HIS A 119 7.864 22.543 -7.820 1.00 72.03 H new ATOM 0 HB3 HIS A 119 7.068 22.784 -6.278 1.00 72.03 H new ATOM 0 HD2 HIS A 119 10.780 21.784 -7.282 1.00 34.41 H new ATOM 0 HE1 HIS A 119 10.821 24.622 -4.145 1.00 2.22 H new ATOM 0 HE2 HIS A 119 12.292 23.225 -5.700 1.00 33.25 H new ATOM 1861 N HIS A 120 5.983 20.139 -8.265 1.00 22.23 N ATOM 1862 CA HIS A 120 4.634 19.837 -8.729 1.00 12.15 C ATOM 1863 C HIS A 120 4.134 18.529 -8.128 1.00 31.11 C ATOM 1864 O HIS A 120 3.188 18.510 -7.330 1.00 2.21 O ATOM 1865 CB HIS A 120 4.595 19.734 -10.261 1.00 23.15 C ATOM 1866 CG HIS A 120 4.863 21.024 -10.980 1.00 53.41 C ATOM 1867 ND1 HIS A 120 5.168 21.042 -12.318 1.00 44.23 N ATOM 1868 CD2 HIS A 120 4.856 22.298 -10.514 1.00 74.32 C ATOM 1869 CE1 HIS A 120 5.338 22.314 -12.635 1.00 42.11 C ATOM 1870 NE2 HIS A 120 5.160 23.113 -11.574 1.00 52.33 N ATOM 0 H HIS A 120 6.696 20.104 -8.993 1.00 22.23 H new ATOM 0 HA HIS A 120 3.986 20.652 -8.406 1.00 12.15 H new ATOM 0 HB2 HIS A 120 5.330 18.995 -10.581 1.00 23.15 H new ATOM 0 HB3 HIS A 120 3.616 19.362 -10.562 1.00 23.15 H new ATOM 0 HD2 HIS A 120 4.650 22.611 -9.501 1.00 74.32 H new ATOM 0 HE1 HIS A 120 5.589 22.665 -13.625 1.00 42.11 H new ATOM 0 HE2 HIS A 120 5.236 24.130 -11.558 1.00 52.33 H new ATOM 1878 N LEU A 121 4.819 17.439 -8.445 1.00 32.43 N ATOM 1879 CA LEU A 121 4.323 16.133 -8.060 1.00 73.54 C ATOM 1880 C LEU A 121 4.689 15.800 -6.615 1.00 13.30 C ATOM 1881 O LEU A 121 4.009 15.014 -5.976 1.00 24.20 O ATOM 1882 CB LEU A 121 4.801 15.052 -9.041 1.00 32.12 C ATOM 1883 CG LEU A 121 6.297 15.022 -9.358 1.00 24.12 C ATOM 1884 CD1 LEU A 121 7.071 14.333 -8.252 1.00 61.25 C ATOM 1885 CD2 LEU A 121 6.530 14.318 -10.681 1.00 64.14 C ATOM 0 H LEU A 121 5.701 17.435 -8.957 1.00 32.43 H new ATOM 0 HA LEU A 121 3.234 16.158 -8.111 1.00 73.54 H new ATOM 0 HB2 LEU A 121 4.519 14.079 -8.638 1.00 32.12 H new ATOM 0 HB3 LEU A 121 4.258 15.179 -9.977 1.00 32.12 H new ATOM 0 HG LEU A 121 6.655 16.049 -9.432 1.00 24.12 H new ATOM 0 HD11 LEU A 121 8.132 14.325 -8.501 1.00 61.25 H new ATOM 0 HD12 LEU A 121 6.923 14.870 -7.315 1.00 61.25 H new ATOM 0 HD13 LEU A 121 6.716 13.308 -8.143 1.00 61.25 H new ATOM 0 HD21 LEU A 121 7.597 14.300 -10.901 1.00 64.14 H new ATOM 0 HD22 LEU A 121 6.155 13.296 -10.621 1.00 64.14 H new ATOM 0 HD23 LEU A 121 6.005 14.851 -11.474 1.00 64.14 H new ATOM 1897 N ARG A 122 5.747 16.422 -6.097 1.00 60.53 N ATOM 1898 CA ARG A 122 6.156 16.213 -4.710 1.00 71.42 C ATOM 1899 C ARG A 122 5.102 16.758 -3.765 1.00 63.13 C ATOM 1900 O ARG A 122 4.676 16.070 -2.848 1.00 1.25 O ATOM 1901 CB ARG A 122 7.512 16.876 -4.439 1.00 30.33 C ATOM 1902 CG ARG A 122 7.988 16.795 -2.994 1.00 3.51 C ATOM 1903 CD ARG A 122 7.613 18.048 -2.223 1.00 11.14 C ATOM 1904 NE ARG A 122 8.240 19.244 -2.783 1.00 32.42 N ATOM 1905 CZ ARG A 122 7.772 20.483 -2.618 1.00 22.03 C ATOM 1906 NH1 ARG A 122 6.674 20.700 -1.905 1.00 4.41 N ATOM 1907 NH2 ARG A 122 8.413 21.508 -3.159 1.00 5.52 N ATOM 0 H ARG A 122 6.335 17.074 -6.616 1.00 60.53 H new ATOM 0 HA ARG A 122 6.260 15.142 -4.539 1.00 71.42 H new ATOM 0 HB2 ARG A 122 8.262 16.412 -5.080 1.00 30.33 H new ATOM 0 HB3 ARG A 122 7.451 17.925 -4.728 1.00 30.33 H new ATOM 0 HG2 ARG A 122 7.548 15.922 -2.511 1.00 3.51 H new ATOM 0 HG3 ARG A 122 9.069 16.660 -2.971 1.00 3.51 H new ATOM 0 HD2 ARG A 122 6.530 18.169 -2.232 1.00 11.14 H new ATOM 0 HD3 ARG A 122 7.913 17.936 -1.181 1.00 11.14 H new ATOM 0 HE ARG A 122 9.089 19.124 -3.335 1.00 32.42 H new ATOM 0 HH11 ARG A 122 6.180 19.916 -1.478 1.00 4.41 H new ATOM 0 HH12 ARG A 122 6.324 21.650 -1.784 1.00 4.41 H new ATOM 0 HH21 ARG A 122 9.263 21.350 -3.701 1.00 5.52 H new ATOM 0 HH22 ARG A 122 8.057 22.456 -3.034 1.00 5.52 H new ATOM 1921 N ASP A 123 4.677 17.995 -4.009 1.00 60.03 N ATOM 1922 CA ASP A 123 3.686 18.653 -3.160 1.00 41.45 C ATOM 1923 C ASP A 123 2.364 17.897 -3.187 1.00 21.44 C ATOM 1924 O ASP A 123 1.617 17.881 -2.209 1.00 53.24 O ATOM 1925 CB ASP A 123 3.477 20.093 -3.622 1.00 71.13 C ATOM 1926 CG ASP A 123 2.557 20.873 -2.709 1.00 2.03 C ATOM 1927 OD1 ASP A 123 3.017 21.322 -1.640 1.00 55.45 O ATOM 1928 OD2 ASP A 123 1.376 21.057 -3.059 1.00 73.42 O ATOM 0 H ASP A 123 5.004 18.564 -4.790 1.00 60.03 H new ATOM 0 HA ASP A 123 4.058 18.657 -2.135 1.00 41.45 H new ATOM 0 HB2 ASP A 123 4.442 20.597 -3.675 1.00 71.13 H new ATOM 0 HB3 ASP A 123 3.064 20.090 -4.631 1.00 71.13 H new ATOM 1933 N TYR A 124 2.093 17.251 -4.309 1.00 11.43 N ATOM 1934 CA TYR A 124 0.886 16.475 -4.459 1.00 64.45 C ATOM 1935 C TYR A 124 1.004 15.087 -3.812 1.00 53.24 C ATOM 1936 O TYR A 124 0.179 14.707 -2.984 1.00 62.11 O ATOM 1937 CB TYR A 124 0.565 16.340 -5.932 1.00 25.45 C ATOM 1938 CG TYR A 124 -0.600 15.443 -6.185 1.00 2.53 C ATOM 1939 CD1 TYR A 124 -1.871 15.833 -5.813 1.00 12.14 C ATOM 1940 CD2 TYR A 124 -0.424 14.203 -6.768 1.00 3.30 C ATOM 1941 CE1 TYR A 124 -2.950 15.013 -6.016 1.00 1.43 C ATOM 1942 CE2 TYR A 124 -1.497 13.368 -6.974 1.00 35.43 C ATOM 1943 CZ TYR A 124 -2.761 13.782 -6.595 1.00 52.45 C ATOM 1944 OH TYR A 124 -3.839 12.963 -6.784 1.00 11.33 O ATOM 0 H TYR A 124 2.699 17.253 -5.129 1.00 11.43 H new ATOM 0 HA TYR A 124 0.080 16.998 -3.944 1.00 64.45 H new ATOM 0 HB2 TYR A 124 0.356 17.326 -6.347 1.00 25.45 H new ATOM 0 HB3 TYR A 124 1.438 15.952 -6.456 1.00 25.45 H new ATOM 0 HD1 TYR A 124 -2.017 16.800 -5.355 1.00 12.14 H new ATOM 0 HD2 TYR A 124 0.565 13.887 -7.065 1.00 3.30 H new ATOM 0 HE1 TYR A 124 -3.940 15.332 -5.723 1.00 1.43 H new ATOM 0 HE2 TYR A 124 -1.354 12.398 -7.427 1.00 35.43 H new ATOM 0 HH TYR A 124 -3.920 12.349 -6.025 1.00 11.33 H new ATOM 1954 N PHE A 125 2.025 14.336 -4.207 1.00 54.21 N ATOM 1955 CA PHE A 125 2.216 12.958 -3.750 1.00 71.05 C ATOM 1956 C PHE A 125 2.574 12.873 -2.261 1.00 51.12 C ATOM 1957 O PHE A 125 2.341 11.844 -1.629 1.00 32.43 O ATOM 1958 CB PHE A 125 3.309 12.280 -4.581 1.00 41.23 C ATOM 1959 CG PHE A 125 2.850 11.746 -5.916 1.00 44.14 C ATOM 1960 CD1 PHE A 125 1.832 10.803 -6.014 1.00 10.54 C ATOM 1961 CD2 PHE A 125 3.460 12.178 -7.077 1.00 3.25 C ATOM 1962 CE1 PHE A 125 1.438 10.310 -7.254 1.00 32.24 C ATOM 1963 CE2 PHE A 125 3.071 11.693 -8.308 1.00 24.24 C ATOM 1964 CZ PHE A 125 2.063 10.758 -8.397 1.00 40.32 C ATOM 0 H PHE A 125 2.745 14.661 -4.852 1.00 54.21 H new ATOM 0 HA PHE A 125 1.265 12.442 -3.885 1.00 71.05 H new ATOM 0 HB2 PHE A 125 4.114 12.995 -4.749 1.00 41.23 H new ATOM 0 HB3 PHE A 125 3.729 11.458 -4.002 1.00 41.23 H new ATOM 0 HD1 PHE A 125 1.342 10.450 -5.118 1.00 10.54 H new ATOM 0 HD2 PHE A 125 4.254 12.907 -7.020 1.00 3.25 H new ATOM 0 HE1 PHE A 125 0.646 9.579 -7.320 1.00 32.24 H new ATOM 0 HE2 PHE A 125 3.558 12.047 -9.205 1.00 24.24 H new ATOM 0 HZ PHE A 125 1.763 10.377 -9.362 1.00 40.32 H new ATOM 1974 N GLU A 126 3.114 13.955 -1.702 1.00 62.44 N ATOM 1975 CA GLU A 126 3.519 13.969 -0.290 1.00 44.34 C ATOM 1976 C GLU A 126 2.307 13.910 0.634 1.00 61.03 C ATOM 1977 O GLU A 126 2.419 13.510 1.790 1.00 23.10 O ATOM 1978 CB GLU A 126 4.358 15.205 0.044 1.00 2.42 C ATOM 1979 CG GLU A 126 5.844 14.918 0.161 1.00 72.01 C ATOM 1980 CD GLU A 126 6.539 15.837 1.138 1.00 33.32 C ATOM 1981 OE1 GLU A 126 6.947 16.943 0.740 1.00 62.23 O ATOM 1982 OE2 GLU A 126 6.689 15.451 2.314 1.00 22.14 O ATOM 0 H GLU A 126 3.282 14.830 -2.198 1.00 62.44 H new ATOM 0 HA GLU A 126 4.130 13.081 -0.130 1.00 44.34 H new ATOM 0 HB2 GLU A 126 4.202 15.959 -0.728 1.00 2.42 H new ATOM 0 HB3 GLU A 126 4.004 15.631 0.983 1.00 2.42 H new ATOM 0 HG2 GLU A 126 5.987 13.884 0.476 1.00 72.01 H new ATOM 0 HG3 GLU A 126 6.308 15.019 -0.820 1.00 72.01 H new ATOM 1989 N GLN A 127 1.158 14.331 0.119 1.00 12.42 N ATOM 1990 CA GLN A 127 -0.105 14.253 0.856 1.00 32.31 C ATOM 1991 C GLN A 127 -0.464 12.805 1.208 1.00 60.44 C ATOM 1992 O GLN A 127 -1.196 12.547 2.164 1.00 70.45 O ATOM 1993 CB GLN A 127 -1.230 14.884 0.035 1.00 63.01 C ATOM 1994 CG GLN A 127 -0.899 16.275 -0.482 1.00 2.13 C ATOM 1995 CD GLN A 127 -2.060 16.927 -1.201 1.00 20.45 C ATOM 1996 OE1 GLN A 127 -2.872 17.621 -0.593 1.00 13.13 O ATOM 1997 NE2 GLN A 127 -2.152 16.699 -2.499 1.00 60.10 N ATOM 0 H GLN A 127 1.071 14.734 -0.814 1.00 12.42 H new ATOM 0 HA GLN A 127 0.019 14.804 1.788 1.00 32.31 H new ATOM 0 HB2 GLN A 127 -1.459 14.236 -0.811 1.00 63.01 H new ATOM 0 HB3 GLN A 127 -2.130 14.938 0.648 1.00 63.01 H new ATOM 0 HG2 GLN A 127 -0.596 16.905 0.354 1.00 2.13 H new ATOM 0 HG3 GLN A 127 -0.047 16.212 -1.159 1.00 2.13 H new ATOM 0 HE21 GLN A 127 -1.456 16.117 -2.965 1.00 60.10 H new ATOM 0 HE22 GLN A 127 -2.919 17.105 -3.035 1.00 60.10 H new ATOM 2006 N TYR A 128 0.048 11.865 0.424 1.00 12.03 N ATOM 2007 CA TYR A 128 -0.189 10.448 0.668 1.00 71.42 C ATOM 2008 C TYR A 128 0.815 9.880 1.672 1.00 63.01 C ATOM 2009 O TYR A 128 0.520 8.913 2.378 1.00 53.45 O ATOM 2010 CB TYR A 128 -0.113 9.671 -0.647 1.00 60.45 C ATOM 2011 CG TYR A 128 -1.143 10.094 -1.672 1.00 23.14 C ATOM 2012 CD1 TYR A 128 -0.900 11.153 -2.542 1.00 73.04 C ATOM 2013 CD2 TYR A 128 -2.354 9.423 -1.778 1.00 53.23 C ATOM 2014 CE1 TYR A 128 -1.837 11.532 -3.482 1.00 51.21 C ATOM 2015 CE2 TYR A 128 -3.293 9.797 -2.717 1.00 61.31 C ATOM 2016 CZ TYR A 128 -3.029 10.850 -3.567 1.00 3.23 C ATOM 2017 OH TYR A 128 -3.965 11.224 -4.499 1.00 44.10 O ATOM 0 H TYR A 128 0.632 12.059 -0.389 1.00 12.03 H new ATOM 0 HA TYR A 128 -1.187 10.341 1.094 1.00 71.42 H new ATOM 0 HB2 TYR A 128 0.882 9.796 -1.074 1.00 60.45 H new ATOM 0 HB3 TYR A 128 -0.239 8.609 -0.437 1.00 60.45 H new ATOM 0 HD1 TYR A 128 0.037 11.687 -2.481 1.00 73.04 H new ATOM 0 HD2 TYR A 128 -2.564 8.596 -1.116 1.00 53.23 H new ATOM 0 HE1 TYR A 128 -1.636 12.359 -4.147 1.00 51.21 H new ATOM 0 HE2 TYR A 128 -4.231 9.267 -2.786 1.00 61.31 H new ATOM 0 HH TYR A 128 -4.749 10.640 -4.428 1.00 44.10 H new ATOM 2027 N GLY A 129 1.998 10.484 1.729 1.00 64.14 N ATOM 2028 CA GLY A 129 3.026 10.018 2.645 1.00 74.11 C ATOM 2029 C GLY A 129 4.372 10.674 2.416 1.00 21.22 C ATOM 2030 O GLY A 129 4.512 11.537 1.549 1.00 35.34 O ATOM 0 H GLY A 129 2.264 11.287 1.159 1.00 64.14 H new ATOM 0 HA2 GLY A 129 2.705 10.210 3.669 1.00 74.11 H new ATOM 0 HA3 GLY A 129 3.133 8.938 2.542 1.00 74.11 H new ATOM 2034 N LYS A 130 5.367 10.256 3.194 1.00 43.31 N ATOM 2035 CA LYS A 130 6.706 10.831 3.121 1.00 41.12 C ATOM 2036 C LYS A 130 7.441 10.361 1.868 1.00 21.11 C ATOM 2037 O LYS A 130 7.456 9.170 1.551 1.00 70.40 O ATOM 2038 CB LYS A 130 7.512 10.455 4.375 1.00 54.13 C ATOM 2039 CG LYS A 130 8.975 10.867 4.309 1.00 34.23 C ATOM 2040 CD LYS A 130 9.755 10.406 5.526 1.00 70.44 C ATOM 2041 CE LYS A 130 11.239 10.681 5.356 1.00 23.14 C ATOM 2042 NZ LYS A 130 12.036 10.212 6.519 1.00 23.23 N ATOM 0 H LYS A 130 5.269 9.515 3.888 1.00 43.31 H new ATOM 0 HA LYS A 130 6.605 11.915 3.069 1.00 41.12 H new ATOM 0 HB2 LYS A 130 7.051 10.922 5.246 1.00 54.13 H new ATOM 0 HB3 LYS A 130 7.454 9.377 4.523 1.00 54.13 H new ATOM 0 HG2 LYS A 130 9.428 10.450 3.410 1.00 34.23 H new ATOM 0 HG3 LYS A 130 9.042 11.952 4.226 1.00 34.23 H new ATOM 0 HD2 LYS A 130 9.386 10.918 6.415 1.00 70.44 H new ATOM 0 HD3 LYS A 130 9.595 9.339 5.683 1.00 70.44 H new ATOM 0 HE2 LYS A 130 11.596 10.189 4.451 1.00 23.14 H new ATOM 0 HE3 LYS A 130 11.395 11.751 5.219 1.00 23.14 H new ATOM 0 HZ1 LYS A 130 13.042 10.421 6.358 1.00 23.23 H new ATOM 0 HZ2 LYS A 130 11.715 10.700 7.379 1.00 23.23 H new ATOM 0 HZ3 LYS A 130 11.910 9.186 6.635 1.00 23.23 H new ATOM 2056 N ILE A 131 8.060 11.305 1.177 1.00 73.20 N ATOM 2057 CA ILE A 131 8.829 11.019 -0.021 1.00 52.02 C ATOM 2058 C ILE A 131 10.325 11.070 0.299 1.00 64.34 C ATOM 2059 O ILE A 131 10.772 11.927 1.060 1.00 44.14 O ATOM 2060 CB ILE A 131 8.491 12.024 -1.154 1.00 14.52 C ATOM 2061 CG1 ILE A 131 7.021 11.890 -1.565 1.00 31.22 C ATOM 2062 CG2 ILE A 131 9.398 11.816 -2.358 1.00 62.11 C ATOM 2063 CD1 ILE A 131 6.605 12.813 -2.694 1.00 22.45 C ATOM 0 H ILE A 131 8.043 12.292 1.432 1.00 73.20 H new ATOM 0 HA ILE A 131 8.567 10.019 -0.367 1.00 52.02 H new ATOM 0 HB ILE A 131 8.659 13.031 -0.773 1.00 14.52 H new ATOM 0 HG12 ILE A 131 6.832 10.859 -1.865 1.00 31.22 H new ATOM 0 HG13 ILE A 131 6.393 12.090 -0.697 1.00 31.22 H new ATOM 0 HG21 ILE A 131 9.139 12.533 -3.137 1.00 62.11 H new ATOM 0 HG22 ILE A 131 10.436 11.962 -2.061 1.00 62.11 H new ATOM 0 HG23 ILE A 131 9.269 10.803 -2.740 1.00 62.11 H new ATOM 0 HD11 ILE A 131 5.551 12.655 -2.924 1.00 22.45 H new ATOM 0 HD12 ILE A 131 6.759 13.849 -2.393 1.00 22.45 H new ATOM 0 HD13 ILE A 131 7.205 12.599 -3.579 1.00 22.45 H new ATOM 2075 N GLU A 132 11.087 10.139 -0.260 1.00 3.44 N ATOM 2076 CA GLU A 132 12.535 10.131 -0.075 1.00 4.03 C ATOM 2077 C GLU A 132 13.198 11.029 -1.106 1.00 30.15 C ATOM 2078 O GLU A 132 14.009 11.895 -0.774 1.00 21.01 O ATOM 2079 CB GLU A 132 13.108 8.722 -0.211 1.00 44.51 C ATOM 2080 CG GLU A 132 12.474 7.699 0.710 1.00 43.01 C ATOM 2081 CD GLU A 132 13.286 6.425 0.791 1.00 4.40 C ATOM 2082 OE1 GLU A 132 13.384 5.708 -0.225 1.00 22.41 O ATOM 2083 OE2 GLU A 132 13.848 6.143 1.867 1.00 63.12 O ATOM 0 H GLU A 132 10.730 9.382 -0.843 1.00 3.44 H new ATOM 0 HA GLU A 132 12.738 10.498 0.931 1.00 4.03 H new ATOM 0 HB2 GLU A 132 12.985 8.391 -1.242 1.00 44.51 H new ATOM 0 HB3 GLU A 132 14.179 8.757 -0.013 1.00 44.51 H new ATOM 0 HG2 GLU A 132 12.369 8.126 1.708 1.00 43.01 H new ATOM 0 HG3 GLU A 132 11.470 7.466 0.356 1.00 43.01 H new ATOM 2090 N VAL A 133 12.836 10.813 -2.362 1.00 65.42 N ATOM 2091 CA VAL A 133 13.430 11.538 -3.467 1.00 52.12 C ATOM 2092 C VAL A 133 12.469 11.541 -4.655 1.00 1.02 C ATOM 2093 O VAL A 133 11.575 10.694 -4.746 1.00 54.32 O ATOM 2094 CB VAL A 133 14.803 10.923 -3.873 1.00 4.02 C ATOM 2095 CG1 VAL A 133 14.629 9.619 -4.635 1.00 60.44 C ATOM 2096 CG2 VAL A 133 15.634 11.909 -4.681 1.00 24.13 C ATOM 0 H VAL A 133 12.127 10.134 -2.639 1.00 65.42 H new ATOM 0 HA VAL A 133 13.611 12.565 -3.150 1.00 52.12 H new ATOM 0 HB VAL A 133 15.340 10.702 -2.951 1.00 4.02 H new ATOM 0 HG11 VAL A 133 15.608 9.220 -4.901 1.00 60.44 H new ATOM 0 HG12 VAL A 133 14.102 8.899 -4.009 1.00 60.44 H new ATOM 0 HG13 VAL A 133 14.053 9.802 -5.542 1.00 60.44 H new ATOM 0 HG21 VAL A 133 16.585 11.449 -4.948 1.00 24.13 H new ATOM 0 HG22 VAL A 133 15.095 12.181 -5.588 1.00 24.13 H new ATOM 0 HG23 VAL A 133 15.818 12.803 -4.086 1.00 24.13 H new ATOM 2106 N ILE A 134 12.636 12.500 -5.544 1.00 53.21 N ATOM 2107 CA ILE A 134 11.800 12.593 -6.724 1.00 62.41 C ATOM 2108 C ILE A 134 12.637 12.358 -7.966 1.00 41.54 C ATOM 2109 O ILE A 134 13.684 12.978 -8.158 1.00 11.34 O ATOM 2110 CB ILE A 134 11.069 13.954 -6.821 1.00 14.34 C ATOM 2111 CG1 ILE A 134 9.867 13.994 -5.876 1.00 53.41 C ATOM 2112 CG2 ILE A 134 10.614 14.246 -8.246 1.00 33.33 C ATOM 2113 CD1 ILE A 134 10.202 14.438 -4.475 1.00 34.04 C ATOM 0 H ILE A 134 13.346 13.229 -5.471 1.00 53.21 H new ATOM 0 HA ILE A 134 11.033 11.822 -6.645 1.00 62.41 H new ATOM 0 HB ILE A 134 11.781 14.724 -6.525 1.00 14.34 H new ATOM 0 HG12 ILE A 134 9.115 14.667 -6.289 1.00 53.41 H new ATOM 0 HG13 ILE A 134 9.418 13.002 -5.834 1.00 53.41 H new ATOM 0 HG21 ILE A 134 10.105 15.209 -8.275 1.00 33.33 H new ATOM 0 HG22 ILE A 134 11.481 14.273 -8.906 1.00 33.33 H new ATOM 0 HG23 ILE A 134 9.930 13.464 -8.577 1.00 33.33 H new ATOM 0 HD11 ILE A 134 9.297 14.440 -3.868 1.00 34.04 H new ATOM 0 HD12 ILE A 134 10.929 13.753 -4.040 1.00 34.04 H new ATOM 0 HD13 ILE A 134 10.622 15.443 -4.503 1.00 34.04 H new ATOM 2125 N GLU A 135 12.171 11.446 -8.790 1.00 55.03 N ATOM 2126 CA GLU A 135 12.829 11.122 -10.032 1.00 40.30 C ATOM 2127 C GLU A 135 12.141 11.831 -11.194 1.00 34.24 C ATOM 2128 O GLU A 135 10.932 11.713 -11.390 1.00 30.33 O ATOM 2129 CB GLU A 135 12.809 9.610 -10.230 1.00 30.05 C ATOM 2130 CG GLU A 135 13.771 8.865 -9.320 1.00 12.51 C ATOM 2131 CD GLU A 135 13.772 7.372 -9.567 1.00 31.45 C ATOM 2132 OE1 GLU A 135 14.388 6.930 -10.558 1.00 12.04 O ATOM 2133 OE2 GLU A 135 13.167 6.632 -8.769 1.00 60.34 O ATOM 0 H GLU A 135 11.322 10.908 -8.615 1.00 55.03 H new ATOM 0 HA GLU A 135 13.864 11.462 -9.998 1.00 40.30 H new ATOM 0 HB2 GLU A 135 11.798 9.242 -10.055 1.00 30.05 H new ATOM 0 HB3 GLU A 135 13.055 9.384 -11.268 1.00 30.05 H new ATOM 0 HG2 GLU A 135 14.779 9.254 -9.467 1.00 12.51 H new ATOM 0 HG3 GLU A 135 13.504 9.057 -8.281 1.00 12.51 H new ATOM 2140 N ILE A 136 12.917 12.565 -11.965 1.00 52.42 N ATOM 2141 CA ILE A 136 12.387 13.319 -13.088 1.00 13.35 C ATOM 2142 C ILE A 136 13.056 12.818 -14.355 1.00 33.20 C ATOM 2143 O ILE A 136 14.269 12.969 -14.521 1.00 2.02 O ATOM 2144 CB ILE A 136 12.638 14.844 -12.949 1.00 30.23 C ATOM 2145 CG1 ILE A 136 12.091 15.394 -11.620 1.00 70.34 C ATOM 2146 CG2 ILE A 136 12.021 15.596 -14.122 1.00 22.04 C ATOM 2147 CD1 ILE A 136 10.577 15.481 -11.549 1.00 44.23 C ATOM 0 H ILE A 136 13.924 12.657 -11.835 1.00 52.42 H new ATOM 0 HA ILE A 136 11.308 13.170 -13.119 1.00 13.35 H new ATOM 0 HB ILE A 136 13.717 14.998 -12.954 1.00 30.23 H new ATOM 0 HG12 ILE A 136 12.444 14.760 -10.807 1.00 70.34 H new ATOM 0 HG13 ILE A 136 12.507 16.388 -11.454 1.00 70.34 H new ATOM 0 HG21 ILE A 136 12.207 16.664 -14.008 1.00 22.04 H new ATOM 0 HG22 ILE A 136 12.468 15.247 -15.053 1.00 22.04 H new ATOM 0 HG23 ILE A 136 10.946 15.415 -14.145 1.00 22.04 H new ATOM 0 HD11 ILE A 136 10.281 15.879 -10.578 1.00 44.23 H new ATOM 0 HD12 ILE A 136 10.213 16.140 -12.338 1.00 44.23 H new ATOM 0 HD13 ILE A 136 10.149 14.487 -11.680 1.00 44.23 H new ATOM 2159 N MET A 137 12.290 12.208 -15.242 1.00 50.01 N ATOM 2160 CA MET A 137 12.863 11.622 -16.436 1.00 63.53 C ATOM 2161 C MET A 137 12.855 12.648 -17.555 1.00 73.34 C ATOM 2162 O MET A 137 11.800 13.155 -17.940 1.00 32.31 O ATOM 2163 CB MET A 137 12.084 10.375 -16.850 1.00 5.14 C ATOM 2164 CG MET A 137 11.842 9.399 -15.705 1.00 2.32 C ATOM 2165 SD MET A 137 13.364 8.710 -15.027 1.00 1.53 S ATOM 2166 CE MET A 137 13.979 7.802 -16.439 1.00 4.44 C ATOM 0 H MET A 137 11.279 12.107 -15.158 1.00 50.01 H new ATOM 0 HA MET A 137 13.891 11.324 -16.229 1.00 63.53 H new ATOM 0 HB2 MET A 137 11.124 10.678 -17.267 1.00 5.14 H new ATOM 0 HB3 MET A 137 12.629 9.863 -17.644 1.00 5.14 H new ATOM 0 HG2 MET A 137 11.296 9.908 -14.911 1.00 2.32 H new ATOM 0 HG3 MET A 137 11.208 8.586 -16.057 1.00 2.32 H new ATOM 0 HE1 MET A 137 14.771 7.124 -16.119 1.00 4.44 H new ATOM 0 HE2 MET A 137 13.167 7.227 -16.884 1.00 4.44 H new ATOM 0 HE3 MET A 137 14.375 8.500 -17.176 1.00 4.44 H new ATOM 2176 N THR A 138 14.028 12.961 -18.064 1.00 41.05 N ATOM 2177 CA THR A 138 14.163 13.997 -19.064 1.00 63.00 C ATOM 2178 C THR A 138 14.136 13.437 -20.478 1.00 74.33 C ATOM 2179 O THR A 138 14.630 12.338 -20.738 1.00 42.42 O ATOM 2180 CB THR A 138 15.460 14.797 -18.857 1.00 51.24 C ATOM 2181 OG1 THR A 138 16.489 13.937 -18.350 1.00 34.11 O ATOM 2182 CG2 THR A 138 15.231 15.955 -17.899 1.00 70.34 C ATOM 0 H THR A 138 14.904 12.510 -17.800 1.00 41.05 H new ATOM 0 HA THR A 138 13.305 14.658 -18.943 1.00 63.00 H new ATOM 0 HB THR A 138 15.773 15.203 -19.819 1.00 51.24 H new ATOM 0 HG1 THR A 138 17.313 14.452 -18.222 1.00 34.11 H new ATOM 0 HG21 THR A 138 16.161 16.507 -17.767 1.00 70.34 H new ATOM 0 HG22 THR A 138 14.469 16.619 -18.307 1.00 70.34 H new ATOM 0 HG23 THR A 138 14.898 15.570 -16.935 1.00 70.34 H new ATOM 2319 N GLY A 147 7.249 13.548 -20.448 1.00 22.35 N ATOM 2320 CA GLY A 147 7.011 12.205 -20.924 1.00 2.33 C ATOM 2321 C GLY A 147 6.663 11.240 -19.815 1.00 63.44 C ATOM 2322 O GLY A 147 5.673 10.516 -19.925 1.00 61.20 O ATOM 0 HA2 GLY A 147 6.200 12.222 -21.652 1.00 2.33 H new ATOM 0 HA3 GLY A 147 7.899 11.847 -21.445 1.00 2.33 H new ATOM 2326 N PHE A 148 7.423 11.266 -18.721 1.00 42.42 N ATOM 2327 CA PHE A 148 7.128 10.453 -17.548 1.00 54.21 C ATOM 2328 C PHE A 148 8.078 10.822 -16.412 1.00 44.22 C ATOM 2329 O PHE A 148 9.137 11.404 -16.640 1.00 1.24 O ATOM 2330 CB PHE A 148 7.212 8.939 -17.855 1.00 64.22 C ATOM 2331 CG PHE A 148 8.550 8.437 -18.352 1.00 71.35 C ATOM 2332 CD1 PHE A 148 9.023 8.784 -19.611 1.00 54.33 C ATOM 2333 CD2 PHE A 148 9.318 7.593 -17.570 1.00 74.20 C ATOM 2334 CE1 PHE A 148 10.235 8.307 -20.070 1.00 23.30 C ATOM 2335 CE2 PHE A 148 10.530 7.107 -18.029 1.00 22.10 C ATOM 2336 CZ PHE A 148 10.988 7.466 -19.280 1.00 44.31 C ATOM 0 H PHE A 148 8.255 11.848 -18.625 1.00 42.42 H new ATOM 0 HA PHE A 148 6.102 10.662 -17.246 1.00 54.21 H new ATOM 0 HB2 PHE A 148 6.954 8.390 -16.950 1.00 64.22 H new ATOM 0 HB3 PHE A 148 6.455 8.697 -18.601 1.00 64.22 H new ATOM 0 HD1 PHE A 148 8.435 9.436 -20.240 1.00 54.33 H new ATOM 0 HD2 PHE A 148 8.967 7.310 -16.589 1.00 74.20 H new ATOM 0 HE1 PHE A 148 10.593 8.593 -21.048 1.00 23.30 H new ATOM 0 HE2 PHE A 148 11.117 6.447 -17.408 1.00 22.10 H new ATOM 0 HZ PHE A 148 11.934 7.089 -19.639 1.00 44.31 H new ATOM 2346 N ALA A 149 7.670 10.509 -15.196 1.00 43.21 N ATOM 2347 CA ALA A 149 8.464 10.763 -14.010 1.00 45.12 C ATOM 2348 C ALA A 149 8.315 9.593 -13.044 1.00 61.04 C ATOM 2349 O ALA A 149 7.519 8.682 -13.279 1.00 4.04 O ATOM 2350 CB ALA A 149 8.037 12.073 -13.349 1.00 4.23 C ATOM 0 H ALA A 149 6.771 10.068 -15.003 1.00 43.21 H new ATOM 0 HA ALA A 149 9.513 10.860 -14.291 1.00 45.12 H new ATOM 0 HB1 ALA A 149 8.644 12.247 -12.460 1.00 4.23 H new ATOM 0 HB2 ALA A 149 8.175 12.896 -14.050 1.00 4.23 H new ATOM 0 HB3 ALA A 149 6.987 12.011 -13.064 1.00 4.23 H new ATOM 2356 N PHE A 150 9.082 9.620 -11.970 1.00 55.13 N ATOM 2357 CA PHE A 150 9.047 8.565 -10.971 1.00 55.01 C ATOM 2358 C PHE A 150 9.098 9.167 -9.569 1.00 70.02 C ATOM 2359 O PHE A 150 9.750 10.178 -9.342 1.00 54.21 O ATOM 2360 CB PHE A 150 10.215 7.596 -11.177 1.00 61.31 C ATOM 2361 CG PHE A 150 9.987 6.569 -12.246 1.00 34.52 C ATOM 2362 CD1 PHE A 150 9.258 5.423 -11.980 1.00 31.34 C ATOM 2363 CD2 PHE A 150 10.507 6.746 -13.516 1.00 42.53 C ATOM 2364 CE1 PHE A 150 9.050 4.474 -12.961 1.00 35.15 C ATOM 2365 CE2 PHE A 150 10.304 5.803 -14.500 1.00 52.44 C ATOM 2366 CZ PHE A 150 9.574 4.664 -14.225 1.00 14.03 C ATOM 0 H PHE A 150 9.744 10.369 -11.765 1.00 55.13 H new ATOM 0 HA PHE A 150 8.115 8.011 -11.081 1.00 55.01 H new ATOM 0 HB2 PHE A 150 11.108 8.170 -11.426 1.00 61.31 H new ATOM 0 HB3 PHE A 150 10.417 7.084 -10.236 1.00 61.31 H new ATOM 0 HD1 PHE A 150 8.847 5.269 -10.993 1.00 31.34 H new ATOM 0 HD2 PHE A 150 11.079 7.634 -13.739 1.00 42.53 H new ATOM 0 HE1 PHE A 150 8.479 3.585 -12.741 1.00 35.15 H new ATOM 0 HE2 PHE A 150 10.716 5.955 -15.487 1.00 52.44 H new ATOM 0 HZ PHE A 150 9.413 3.924 -14.995 1.00 14.03 H new ATOM 2376 N VAL A 151 8.392 8.566 -8.632 1.00 71.13 N ATOM 2377 CA VAL A 151 8.339 9.102 -7.274 1.00 0.15 C ATOM 2378 C VAL A 151 8.711 8.033 -6.255 1.00 52.30 C ATOM 2379 O VAL A 151 8.158 6.932 -6.262 1.00 1.23 O ATOM 2380 CB VAL A 151 6.948 9.700 -6.943 1.00 2.14 C ATOM 2381 CG1 VAL A 151 6.931 10.305 -5.546 1.00 33.42 C ATOM 2382 CG2 VAL A 151 6.561 10.745 -7.975 1.00 21.44 C ATOM 0 H VAL A 151 7.850 7.714 -8.777 1.00 71.13 H new ATOM 0 HA VAL A 151 9.069 9.910 -7.219 1.00 0.15 H new ATOM 0 HB VAL A 151 6.218 8.891 -6.971 1.00 2.14 H new ATOM 0 HG11 VAL A 151 5.943 10.717 -5.340 1.00 33.42 H new ATOM 0 HG12 VAL A 151 7.162 9.533 -4.812 1.00 33.42 H new ATOM 0 HG13 VAL A 151 7.675 11.099 -5.484 1.00 33.42 H new ATOM 0 HG21 VAL A 151 5.582 11.155 -7.728 1.00 21.44 H new ATOM 0 HG22 VAL A 151 7.300 11.546 -7.976 1.00 21.44 H new ATOM 0 HG23 VAL A 151 6.523 10.285 -8.962 1.00 21.44 H new ATOM 2392 N THR A 152 9.663 8.368 -5.394 1.00 61.02 N ATOM 2393 CA THR A 152 10.186 7.434 -4.411 1.00 35.50 C ATOM 2394 C THR A 152 9.695 7.776 -3.009 1.00 25.21 C ATOM 2395 O THR A 152 9.975 8.854 -2.496 1.00 14.25 O ATOM 2396 CB THR A 152 11.719 7.469 -4.419 1.00 64.41 C ATOM 2397 OG1 THR A 152 12.205 7.186 -5.732 1.00 63.23 O ATOM 2398 CG2 THR A 152 12.294 6.477 -3.427 1.00 4.34 C ATOM 0 H THR A 152 10.092 9.293 -5.359 1.00 61.02 H new ATOM 0 HA THR A 152 9.831 6.439 -4.677 1.00 35.50 H new ATOM 0 HB THR A 152 12.039 8.468 -4.123 1.00 64.41 H new ATOM 0 HG1 THR A 152 13.185 7.212 -5.731 1.00 63.23 H new ATOM 0 HG21 THR A 152 13.383 6.524 -3.455 1.00 4.34 H new ATOM 0 HG22 THR A 152 11.946 6.722 -2.424 1.00 4.34 H new ATOM 0 HG23 THR A 152 11.968 5.470 -3.688 1.00 4.34 H new ATOM 2406 N PHE A 153 8.995 6.846 -2.384 1.00 62.12 N ATOM 2407 CA PHE A 153 8.437 7.071 -1.062 1.00 34.11 C ATOM 2408 C PHE A 153 9.245 6.374 0.013 1.00 64.11 C ATOM 2409 O PHE A 153 10.002 5.444 -0.259 1.00 41.14 O ATOM 2410 CB PHE A 153 6.999 6.581 -0.996 1.00 10.11 C ATOM 2411 CG PHE A 153 6.019 7.527 -1.606 1.00 15.11 C ATOM 2412 CD1 PHE A 153 5.533 8.596 -0.879 1.00 32.31 C ATOM 2413 CD2 PHE A 153 5.573 7.339 -2.897 1.00 74.22 C ATOM 2414 CE1 PHE A 153 4.617 9.462 -1.432 1.00 53.05 C ATOM 2415 CE2 PHE A 153 4.653 8.196 -3.453 1.00 3.32 C ATOM 2416 CZ PHE A 153 4.176 9.259 -2.720 1.00 61.32 C ATOM 0 H PHE A 153 8.799 5.924 -2.773 1.00 62.12 H new ATOM 0 HA PHE A 153 8.469 8.146 -0.882 1.00 34.11 H new ATOM 0 HB2 PHE A 153 6.928 5.619 -1.504 1.00 10.11 H new ATOM 0 HB3 PHE A 153 6.729 6.412 0.046 1.00 10.11 H new ATOM 0 HD1 PHE A 153 5.875 8.754 0.133 1.00 32.31 H new ATOM 0 HD2 PHE A 153 5.950 6.510 -3.477 1.00 74.22 H new ATOM 0 HE1 PHE A 153 4.246 10.298 -0.857 1.00 53.05 H new ATOM 0 HE2 PHE A 153 4.305 8.036 -4.463 1.00 3.32 H new ATOM 0 HZ PHE A 153 3.455 9.935 -3.156 1.00 61.32 H new ATOM 2426 N ASP A 154 9.059 6.835 1.242 1.00 33.33 N ATOM 2427 CA ASP A 154 9.720 6.253 2.403 1.00 74.20 C ATOM 2428 C ASP A 154 8.998 4.987 2.857 1.00 34.33 C ATOM 2429 O ASP A 154 9.603 4.078 3.431 1.00 42.20 O ATOM 2430 CB ASP A 154 9.763 7.277 3.543 1.00 65.23 C ATOM 2431 CG ASP A 154 10.307 6.697 4.833 1.00 23.43 C ATOM 2432 OD1 ASP A 154 11.534 6.501 4.933 1.00 33.24 O ATOM 2433 OD2 ASP A 154 9.509 6.443 5.756 1.00 5.43 O ATOM 0 H ASP A 154 8.447 7.621 1.463 1.00 33.33 H new ATOM 0 HA ASP A 154 10.739 5.983 2.126 1.00 74.20 H new ATOM 0 HB2 ASP A 154 10.380 8.123 3.242 1.00 65.23 H new ATOM 0 HB3 ASP A 154 8.758 7.661 3.718 1.00 65.23 H new ATOM 2438 N ASP A 155 7.702 4.924 2.576 1.00 51.04 N ATOM 2439 CA ASP A 155 6.898 3.780 2.977 1.00 4.12 C ATOM 2440 C ASP A 155 6.098 3.243 1.795 1.00 31.24 C ATOM 2441 O ASP A 155 5.807 3.974 0.848 1.00 71.10 O ATOM 2442 CB ASP A 155 5.958 4.147 4.127 1.00 61.12 C ATOM 2443 CG ASP A 155 5.592 2.938 4.962 1.00 31.42 C ATOM 2444 OD1 ASP A 155 4.745 2.143 4.526 1.00 71.34 O ATOM 2445 OD2 ASP A 155 6.185 2.765 6.051 1.00 33.15 O ATOM 0 H ASP A 155 7.189 5.649 2.074 1.00 51.04 H new ATOM 0 HA ASP A 155 7.576 3.000 3.323 1.00 4.12 H new ATOM 0 HB2 ASP A 155 6.434 4.896 4.760 1.00 61.12 H new ATOM 0 HB3 ASP A 155 5.051 4.599 3.725 1.00 61.12 H new ATOM 2450 N HIS A 156 5.748 1.965 1.866 1.00 20.12 N ATOM 2451 CA HIS A 156 5.039 1.282 0.789 1.00 33.32 C ATOM 2452 C HIS A 156 3.561 1.656 0.797 1.00 2.03 C ATOM 2453 O HIS A 156 2.905 1.675 -0.248 1.00 2.13 O ATOM 2454 CB HIS A 156 5.203 -0.244 0.925 1.00 64.44 C ATOM 2455 CG HIS A 156 4.787 -0.795 2.266 1.00 34.41 C ATOM 2456 ND1 HIS A 156 3.470 -0.881 2.633 1.00 30.43 N ATOM 2457 CD2 HIS A 156 5.553 -1.224 3.294 1.00 31.35 C ATOM 2458 CE1 HIS A 156 3.469 -1.344 3.867 1.00 73.25 C ATOM 2459 NE2 HIS A 156 4.706 -1.568 4.309 1.00 23.33 N ATOM 0 H HIS A 156 5.947 1.372 2.672 1.00 20.12 H new ATOM 0 HA HIS A 156 5.470 1.598 -0.161 1.00 33.32 H new ATOM 0 HB2 HIS A 156 4.616 -0.732 0.147 1.00 64.44 H new ATOM 0 HB3 HIS A 156 6.247 -0.503 0.747 1.00 64.44 H new ATOM 0 HD1 HIS A 156 2.657 -0.637 2.067 1.00 30.43 H new ATOM 0 HD2 HIS A 156 6.631 -1.284 3.310 1.00 31.35 H new ATOM 0 HE1 HIS A 156 2.576 -1.520 4.448 1.00 73.25 H new ATOM 2467 N ASP A 157 3.070 1.969 1.996 1.00 23.12 N ATOM 2468 CA ASP A 157 1.670 2.295 2.225 1.00 14.43 C ATOM 2469 C ASP A 157 1.215 3.454 1.352 1.00 65.04 C ATOM 2470 O ASP A 157 0.145 3.405 0.744 1.00 11.30 O ATOM 2471 CB ASP A 157 1.464 2.632 3.702 1.00 21.34 C ATOM 2472 CG ASP A 157 0.069 3.126 3.989 1.00 54.44 C ATOM 2473 OD1 ASP A 157 -0.892 2.527 3.472 1.00 54.12 O ATOM 2474 OD2 ASP A 157 -0.077 4.123 4.725 1.00 23.14 O ATOM 0 H ASP A 157 3.641 2.003 2.840 1.00 23.12 H new ATOM 0 HA ASP A 157 1.067 1.428 1.957 1.00 14.43 H new ATOM 0 HB2 ASP A 157 1.664 1.747 4.305 1.00 21.34 H new ATOM 0 HB3 ASP A 157 2.185 3.392 4.002 1.00 21.34 H new ATOM 2479 N SER A 158 2.054 4.477 1.267 1.00 13.34 N ATOM 2480 CA SER A 158 1.745 5.665 0.497 1.00 21.54 C ATOM 2481 C SER A 158 1.598 5.341 -0.989 1.00 24.20 C ATOM 2482 O SER A 158 0.725 5.884 -1.666 1.00 54.41 O ATOM 2483 CB SER A 158 2.844 6.699 0.702 1.00 72.24 C ATOM 2484 OG SER A 158 2.521 7.908 0.057 1.00 73.24 O ATOM 0 H SER A 158 2.963 4.503 1.729 1.00 13.34 H new ATOM 0 HA SER A 158 0.793 6.066 0.845 1.00 21.54 H new ATOM 0 HB2 SER A 158 2.987 6.877 1.768 1.00 72.24 H new ATOM 0 HB3 SER A 158 3.787 6.315 0.313 1.00 72.24 H new ATOM 0 HG SER A 158 3.329 8.290 -0.346 1.00 73.24 H new ATOM 2490 N VAL A 159 2.419 4.414 -1.470 1.00 1.22 N ATOM 2491 CA VAL A 159 2.431 4.053 -2.876 1.00 14.25 C ATOM 2492 C VAL A 159 1.165 3.301 -3.228 1.00 41.15 C ATOM 2493 O VAL A 159 0.560 3.528 -4.276 1.00 63.31 O ATOM 2494 CB VAL A 159 3.676 3.197 -3.196 1.00 25.41 C ATOM 2495 CG1 VAL A 159 3.474 2.300 -4.415 1.00 4.01 C ATOM 2496 CG2 VAL A 159 4.862 4.106 -3.400 1.00 44.34 C ATOM 0 H VAL A 159 3.088 3.898 -0.899 1.00 1.22 H new ATOM 0 HA VAL A 159 2.474 4.962 -3.475 1.00 14.25 H new ATOM 0 HB VAL A 159 3.853 2.533 -2.350 1.00 25.41 H new ATOM 0 HG11 VAL A 159 4.380 1.721 -4.595 1.00 4.01 H new ATOM 0 HG12 VAL A 159 2.640 1.622 -4.234 1.00 4.01 H new ATOM 0 HG13 VAL A 159 3.258 2.916 -5.288 1.00 4.01 H new ATOM 0 HG21 VAL A 159 5.744 3.508 -3.626 1.00 44.34 H new ATOM 0 HG22 VAL A 159 4.662 4.785 -4.229 1.00 44.34 H new ATOM 0 HG23 VAL A 159 5.038 4.683 -2.492 1.00 44.34 H new ATOM 2506 N ASP A 160 0.759 2.438 -2.318 1.00 33.33 N ATOM 2507 CA ASP A 160 -0.395 1.596 -2.532 1.00 64.11 C ATOM 2508 C ASP A 160 -1.683 2.422 -2.543 1.00 62.20 C ATOM 2509 O ASP A 160 -2.606 2.118 -3.291 1.00 42.01 O ATOM 2510 CB ASP A 160 -0.441 0.514 -1.470 1.00 75.12 C ATOM 2511 CG ASP A 160 -1.244 -0.686 -1.920 1.00 33.24 C ATOM 2512 OD1 ASP A 160 -0.694 -1.510 -2.684 1.00 71.32 O ATOM 2513 OD2 ASP A 160 -2.413 -0.801 -1.521 1.00 32.31 O ATOM 0 H ASP A 160 1.217 2.303 -1.417 1.00 33.33 H new ATOM 0 HA ASP A 160 -0.310 1.120 -3.509 1.00 64.11 H new ATOM 0 HB2 ASP A 160 0.574 0.201 -1.227 1.00 75.12 H new ATOM 0 HB3 ASP A 160 -0.876 0.920 -0.557 1.00 75.12 H new ATOM 2518 N LYS A 161 -1.718 3.495 -1.740 1.00 13.21 N ATOM 2519 CA LYS A 161 -2.839 4.449 -1.761 1.00 44.42 C ATOM 2520 C LYS A 161 -3.000 5.061 -3.147 1.00 44.51 C ATOM 2521 O LYS A 161 -4.112 5.249 -3.644 1.00 72.43 O ATOM 2522 CB LYS A 161 -2.607 5.605 -0.785 1.00 53.45 C ATOM 2523 CG LYS A 161 -2.444 5.200 0.667 1.00 40.24 C ATOM 2524 CD LYS A 161 -2.089 6.408 1.520 1.00 0.02 C ATOM 2525 CE LYS A 161 -1.667 5.994 2.912 1.00 70.31 C ATOM 2526 NZ LYS A 161 -1.225 7.149 3.734 1.00 63.12 N ATOM 0 H LYS A 161 -0.985 3.725 -1.069 1.00 13.21 H new ATOM 0 HA LYS A 161 -3.729 3.888 -1.477 1.00 44.42 H new ATOM 0 HB2 LYS A 161 -1.715 6.149 -1.096 1.00 53.45 H new ATOM 0 HB3 LYS A 161 -3.445 6.297 -0.861 1.00 53.45 H new ATOM 0 HG2 LYS A 161 -3.367 4.749 1.031 1.00 40.24 H new ATOM 0 HG3 LYS A 161 -1.664 4.444 0.754 1.00 40.24 H new ATOM 0 HD2 LYS A 161 -1.283 6.967 1.045 1.00 0.02 H new ATOM 0 HD3 LYS A 161 -2.947 7.077 1.582 1.00 0.02 H new ATOM 0 HE2 LYS A 161 -2.499 5.495 3.408 1.00 70.31 H new ATOM 0 HE3 LYS A 161 -0.856 5.269 2.843 1.00 70.31 H new ATOM 0 HZ1 LYS A 161 -0.743 6.803 4.588 1.00 63.12 H new ATOM 0 HZ2 LYS A 161 -0.570 7.738 3.181 1.00 63.12 H new ATOM 0 HZ3 LYS A 161 -2.052 7.716 4.009 1.00 63.12 H new ATOM 2540 N ILE A 162 -1.865 5.369 -3.748 1.00 62.55 N ATOM 2541 CA ILE A 162 -1.814 6.071 -5.016 1.00 32.42 C ATOM 2542 C ILE A 162 -2.191 5.165 -6.183 1.00 21.33 C ATOM 2543 O ILE A 162 -2.949 5.564 -7.062 1.00 14.03 O ATOM 2544 CB ILE A 162 -0.407 6.672 -5.215 1.00 14.31 C ATOM 2545 CG1 ILE A 162 -0.250 7.884 -4.312 1.00 25.14 C ATOM 2546 CG2 ILE A 162 -0.150 7.046 -6.665 1.00 44.54 C ATOM 2547 CD1 ILE A 162 1.164 8.106 -3.859 1.00 71.01 C ATOM 0 H ILE A 162 -0.948 5.137 -3.367 1.00 62.55 H new ATOM 0 HA ILE A 162 -2.549 6.875 -4.993 1.00 32.42 H new ATOM 0 HB ILE A 162 0.332 5.916 -4.948 1.00 14.31 H new ATOM 0 HG12 ILE A 162 -0.598 8.771 -4.841 1.00 25.14 H new ATOM 0 HG13 ILE A 162 -0.890 7.763 -3.438 1.00 25.14 H new ATOM 0 HG21 ILE A 162 0.852 7.465 -6.761 1.00 44.54 H new ATOM 0 HG22 ILE A 162 -0.232 6.157 -7.290 1.00 44.54 H new ATOM 0 HG23 ILE A 162 -0.885 7.785 -6.986 1.00 44.54 H new ATOM 0 HD11 ILE A 162 1.207 8.986 -3.218 1.00 71.01 H new ATOM 0 HD12 ILE A 162 1.509 7.235 -3.302 1.00 71.01 H new ATOM 0 HD13 ILE A 162 1.805 8.258 -4.728 1.00 71.01 H new ATOM 2559 N VAL A 163 -1.727 3.929 -6.156 1.00 10.11 N ATOM 2560 CA VAL A 163 -1.928 3.023 -7.285 1.00 14.23 C ATOM 2561 C VAL A 163 -3.348 2.450 -7.286 1.00 4.42 C ATOM 2562 O VAL A 163 -3.773 1.808 -8.246 1.00 53.51 O ATOM 2563 CB VAL A 163 -0.891 1.885 -7.282 1.00 42.12 C ATOM 2564 CG1 VAL A 163 0.510 2.459 -7.355 1.00 42.15 C ATOM 2565 CG2 VAL A 163 -1.042 1.023 -6.047 1.00 41.15 C ATOM 0 H VAL A 163 -1.211 3.526 -5.373 1.00 10.11 H new ATOM 0 HA VAL A 163 -1.791 3.604 -8.197 1.00 14.23 H new ATOM 0 HB VAL A 163 -1.064 1.258 -8.157 1.00 42.12 H new ATOM 0 HG11 VAL A 163 1.237 1.647 -7.352 1.00 42.15 H new ATOM 0 HG12 VAL A 163 0.618 3.040 -8.271 1.00 42.15 H new ATOM 0 HG13 VAL A 163 0.684 3.104 -6.494 1.00 42.15 H new ATOM 0 HG21 VAL A 163 -0.299 0.226 -6.067 1.00 41.15 H new ATOM 0 HG22 VAL A 163 -0.895 1.634 -5.157 1.00 41.15 H new ATOM 0 HG23 VAL A 163 -2.041 0.587 -6.027 1.00 41.15 H new ATOM 2575 N ILE A 164 -4.071 2.696 -6.191 1.00 61.43 N ATOM 2576 CA ILE A 164 -5.502 2.417 -6.115 1.00 2.23 C ATOM 2577 C ILE A 164 -6.250 3.224 -7.185 1.00 4.14 C ATOM 2578 O ILE A 164 -7.240 2.766 -7.761 1.00 61.20 O ATOM 2579 CB ILE A 164 -6.044 2.752 -4.696 1.00 30.54 C ATOM 2580 CG1 ILE A 164 -5.666 1.633 -3.718 1.00 60.14 C ATOM 2581 CG2 ILE A 164 -7.554 2.972 -4.699 1.00 13.14 C ATOM 2582 CD1 ILE A 164 -5.979 1.944 -2.270 1.00 44.21 C ATOM 0 H ILE A 164 -3.680 3.093 -5.336 1.00 61.43 H new ATOM 0 HA ILE A 164 -5.666 1.356 -6.301 1.00 2.23 H new ATOM 0 HB ILE A 164 -5.584 3.686 -4.374 1.00 30.54 H new ATOM 0 HG12 ILE A 164 -6.192 0.722 -4.004 1.00 60.14 H new ATOM 0 HG13 ILE A 164 -4.600 1.428 -3.812 1.00 60.14 H new ATOM 0 HG21 ILE A 164 -7.890 3.203 -3.688 1.00 13.14 H new ATOM 0 HG22 ILE A 164 -7.799 3.802 -5.362 1.00 13.14 H new ATOM 0 HG23 ILE A 164 -8.053 2.068 -5.049 1.00 13.14 H new ATOM 0 HD11 ILE A 164 -5.681 1.102 -1.645 1.00 44.21 H new ATOM 0 HD12 ILE A 164 -5.432 2.836 -1.963 1.00 44.21 H new ATOM 0 HD13 ILE A 164 -7.049 2.118 -2.158 1.00 44.21 H new ATOM 2594 N GLN A 165 -5.738 4.413 -7.473 1.00 24.13 N ATOM 2595 CA GLN A 165 -6.337 5.285 -8.467 1.00 12.41 C ATOM 2596 C GLN A 165 -5.384 5.438 -9.645 1.00 22.21 C ATOM 2597 O GLN A 165 -4.361 6.106 -9.537 1.00 63.41 O ATOM 2598 CB GLN A 165 -6.672 6.646 -7.855 1.00 14.42 C ATOM 2599 CG GLN A 165 -7.388 6.547 -6.516 1.00 62.04 C ATOM 2600 CD GLN A 165 -7.727 7.900 -5.922 1.00 34.40 C ATOM 2601 OE1 GLN A 165 -7.995 8.861 -6.641 1.00 23.04 O ATOM 2602 NE2 GLN A 165 -7.700 7.984 -4.600 1.00 4.21 N ATOM 0 H GLN A 165 -4.904 4.795 -7.028 1.00 24.13 H new ATOM 0 HA GLN A 165 -7.268 4.842 -8.821 1.00 12.41 H new ATOM 0 HB2 GLN A 165 -5.751 7.214 -7.725 1.00 14.42 H new ATOM 0 HB3 GLN A 165 -7.296 7.206 -8.552 1.00 14.42 H new ATOM 0 HG2 GLN A 165 -8.305 5.972 -6.643 1.00 62.04 H new ATOM 0 HG3 GLN A 165 -6.761 5.996 -5.815 1.00 62.04 H new ATOM 0 HE21 GLN A 165 -7.473 7.161 -4.041 1.00 4.21 H new ATOM 0 HE22 GLN A 165 -7.907 8.871 -4.141 1.00 4.21 H new ATOM 2611 N LYS A 166 -5.728 4.783 -10.752 1.00 61.24 N ATOM 2612 CA LYS A 166 -4.873 4.714 -11.942 1.00 43.30 C ATOM 2613 C LYS A 166 -4.426 6.089 -12.446 1.00 14.31 C ATOM 2614 O LYS A 166 -3.323 6.235 -12.959 1.00 73.11 O ATOM 2615 CB LYS A 166 -5.599 3.962 -13.057 1.00 74.22 C ATOM 2616 CG LYS A 166 -4.733 3.706 -14.277 1.00 13.35 C ATOM 2617 CD LYS A 166 -5.473 2.913 -15.340 1.00 71.31 C ATOM 2618 CE LYS A 166 -5.643 1.457 -14.939 1.00 62.13 C ATOM 2619 NZ LYS A 166 -6.427 0.691 -15.944 1.00 62.23 N ATOM 0 H LYS A 166 -6.611 4.282 -10.852 1.00 61.24 H new ATOM 0 HA LYS A 166 -3.969 4.179 -11.650 1.00 43.30 H new ATOM 0 HB2 LYS A 166 -5.957 3.008 -12.668 1.00 74.22 H new ATOM 0 HB3 LYS A 166 -6.477 4.533 -13.358 1.00 74.22 H new ATOM 0 HG2 LYS A 166 -4.406 4.657 -14.696 1.00 13.35 H new ATOM 0 HG3 LYS A 166 -3.836 3.164 -13.978 1.00 13.35 H new ATOM 0 HD2 LYS A 166 -6.452 3.360 -15.511 1.00 71.31 H new ATOM 0 HD3 LYS A 166 -4.927 2.970 -16.282 1.00 71.31 H new ATOM 0 HE2 LYS A 166 -4.662 0.997 -14.817 1.00 62.13 H new ATOM 0 HE3 LYS A 166 -6.142 1.403 -13.972 1.00 62.13 H new ATOM 0 HZ1 LYS A 166 -6.520 -0.297 -15.632 1.00 62.23 H new ATOM 0 HZ2 LYS A 166 -7.372 1.113 -16.042 1.00 62.23 H new ATOM 0 HZ3 LYS A 166 -5.938 0.720 -16.861 1.00 62.23 H new ATOM 2633 N TYR A 167 -5.280 7.086 -12.316 1.00 23.31 N ATOM 2634 CA TYR A 167 -4.928 8.436 -12.738 1.00 14.11 C ATOM 2635 C TYR A 167 -5.104 9.416 -11.589 1.00 51.05 C ATOM 2636 O TYR A 167 -6.020 9.272 -10.777 1.00 22.51 O ATOM 2637 CB TYR A 167 -5.798 8.888 -13.920 1.00 73.23 C ATOM 2638 CG TYR A 167 -5.534 8.152 -15.216 1.00 75.44 C ATOM 2639 CD1 TYR A 167 -6.133 6.928 -15.478 1.00 53.21 C ATOM 2640 CD2 TYR A 167 -4.688 8.685 -16.179 1.00 4.11 C ATOM 2641 CE1 TYR A 167 -5.895 6.254 -16.658 1.00 24.20 C ATOM 2642 CE2 TYR A 167 -4.448 8.015 -17.365 1.00 70.20 C ATOM 2643 CZ TYR A 167 -5.055 6.801 -17.596 1.00 52.12 C ATOM 2644 OH TYR A 167 -4.811 6.125 -18.768 1.00 21.42 O ATOM 0 H TYR A 167 -6.217 6.992 -11.925 1.00 23.31 H new ATOM 0 HA TYR A 167 -3.884 8.422 -13.050 1.00 14.11 H new ATOM 0 HB2 TYR A 167 -6.847 8.760 -13.652 1.00 73.23 H new ATOM 0 HB3 TYR A 167 -5.639 9.954 -14.084 1.00 73.23 H new ATOM 0 HD1 TYR A 167 -6.798 6.495 -14.745 1.00 53.21 H new ATOM 0 HD2 TYR A 167 -4.210 9.637 -15.999 1.00 4.11 H new ATOM 0 HE1 TYR A 167 -6.367 5.301 -16.843 1.00 24.20 H new ATOM 0 HE2 TYR A 167 -3.788 8.442 -18.106 1.00 70.20 H new ATOM 0 HH TYR A 167 -3.931 5.695 -18.721 1.00 21.42 H new ATOM 2654 N HIS A 168 -4.219 10.406 -11.521 1.00 22.14 N ATOM 2655 CA HIS A 168 -4.317 11.464 -10.520 1.00 11.41 C ATOM 2656 C HIS A 168 -4.145 12.833 -11.158 1.00 34.12 C ATOM 2657 O HIS A 168 -3.460 12.974 -12.172 1.00 64.32 O ATOM 2658 CB HIS A 168 -3.264 11.295 -9.428 1.00 14.50 C ATOM 2659 CG HIS A 168 -3.505 10.137 -8.517 1.00 0.20 C ATOM 2660 ND1 HIS A 168 -4.396 10.202 -7.474 1.00 35.54 N ATOM 2661 CD2 HIS A 168 -2.937 8.922 -8.534 1.00 23.42 C ATOM 2662 CE1 HIS A 168 -4.336 9.025 -6.882 1.00 45.21 C ATOM 2663 NE2 HIS A 168 -3.465 8.217 -7.492 1.00 72.32 N ATOM 0 H HIS A 168 -3.422 10.498 -12.151 1.00 22.14 H new ATOM 0 HA HIS A 168 -5.309 11.390 -10.075 1.00 11.41 H new ATOM 0 HB2 HIS A 168 -2.287 11.177 -9.897 1.00 14.50 H new ATOM 0 HB3 HIS A 168 -3.224 12.208 -8.834 1.00 14.50 H new ATOM 0 HD2 HIS A 168 -2.200 8.568 -9.240 1.00 23.42 H new ATOM 0 HE1 HIS A 168 -4.917 8.750 -6.014 1.00 45.21 H new ATOM 0 HE2 HIS A 168 -3.238 7.258 -7.230 1.00 72.32 H new ATOM 2671 N THR A 169 -4.752 13.845 -10.555 1.00 43.11 N ATOM 2672 CA THR A 169 -4.635 15.203 -11.060 1.00 3.12 C ATOM 2673 C THR A 169 -3.776 16.053 -10.128 1.00 11.33 C ATOM 2674 O THR A 169 -3.982 16.066 -8.914 1.00 25.04 O ATOM 2675 CB THR A 169 -6.015 15.863 -11.231 1.00 5.50 C ATOM 2676 OG1 THR A 169 -6.949 14.913 -11.764 1.00 64.45 O ATOM 2677 CG2 THR A 169 -5.926 17.064 -12.163 1.00 4.20 C ATOM 0 H THR A 169 -5.328 13.751 -9.719 1.00 43.11 H new ATOM 0 HA THR A 169 -4.157 15.144 -12.038 1.00 3.12 H new ATOM 0 HB THR A 169 -6.356 16.202 -10.253 1.00 5.50 H new ATOM 0 HG1 THR A 169 -7.825 15.339 -11.869 1.00 64.45 H new ATOM 0 HG21 THR A 169 -6.912 17.515 -12.270 1.00 4.20 H new ATOM 0 HG22 THR A 169 -5.235 17.797 -11.747 1.00 4.20 H new ATOM 0 HG23 THR A 169 -5.567 16.740 -13.140 1.00 4.20 H new ATOM 2685 N VAL A 170 -2.804 16.739 -10.710 1.00 2.05 N ATOM 2686 CA VAL A 170 -1.906 17.622 -9.978 1.00 43.21 C ATOM 2687 C VAL A 170 -1.568 18.824 -10.859 1.00 10.23 C ATOM 2688 O VAL A 170 -1.381 18.657 -12.055 1.00 23.32 O ATOM 2689 CB VAL A 170 -0.613 16.869 -9.544 1.00 22.12 C ATOM 2690 CG1 VAL A 170 -0.058 16.010 -10.671 1.00 61.53 C ATOM 2691 CG2 VAL A 170 0.455 17.830 -9.052 1.00 61.35 C ATOM 0 H VAL A 170 -2.614 16.699 -11.711 1.00 2.05 H new ATOM 0 HA VAL A 170 -2.400 17.966 -9.069 1.00 43.21 H new ATOM 0 HB VAL A 170 -0.895 16.215 -8.719 1.00 22.12 H new ATOM 0 HG11 VAL A 170 0.843 15.501 -10.330 1.00 61.53 H new ATOM 0 HG12 VAL A 170 -0.803 15.271 -10.966 1.00 61.53 H new ATOM 0 HG13 VAL A 170 0.184 16.642 -11.525 1.00 61.53 H new ATOM 0 HG21 VAL A 170 1.342 17.269 -8.758 1.00 61.35 H new ATOM 0 HG22 VAL A 170 0.714 18.526 -9.850 1.00 61.35 H new ATOM 0 HG23 VAL A 170 0.077 18.386 -8.194 1.00 61.35 H new ATOM 2701 N ASN A 171 -1.499 20.030 -10.271 1.00 4.35 N ATOM 2702 CA ASN A 171 -1.277 21.284 -11.025 1.00 64.21 C ATOM 2703 C ASN A 171 -2.192 21.430 -12.246 1.00 1.24 C ATOM 2704 O ASN A 171 -1.825 22.071 -13.234 1.00 23.41 O ATOM 2705 CB ASN A 171 0.191 21.406 -11.457 1.00 64.11 C ATOM 2706 CG ASN A 171 1.118 21.734 -10.304 1.00 14.51 C ATOM 2707 OD1 ASN A 171 1.651 20.845 -9.646 1.00 13.24 O ATOM 2708 ND2 ASN A 171 1.309 23.017 -10.040 1.00 41.24 N ATOM 0 H ASN A 171 -1.594 20.167 -9.265 1.00 4.35 H new ATOM 0 HA ASN A 171 -1.529 22.094 -10.340 1.00 64.21 H new ATOM 0 HB2 ASN A 171 0.508 20.470 -11.917 1.00 64.11 H new ATOM 0 HB3 ASN A 171 0.278 22.181 -12.218 1.00 64.11 H new ATOM 0 HD21 ASN A 171 1.916 23.294 -9.268 1.00 41.24 H new ATOM 0 HD22 ASN A 171 0.849 23.729 -10.608 1.00 41.24 H new ATOM 2715 N GLY A 172 -3.387 20.859 -12.165 1.00 14.31 N ATOM 2716 CA GLY A 172 -4.335 20.957 -13.258 1.00 63.12 C ATOM 2717 C GLY A 172 -4.115 19.937 -14.365 1.00 43.33 C ATOM 2718 O GLY A 172 -4.866 19.918 -15.341 1.00 23.22 O ATOM 0 H GLY A 172 -3.717 20.328 -11.359 1.00 14.31 H new ATOM 0 HA2 GLY A 172 -5.343 20.836 -12.862 1.00 63.12 H new ATOM 0 HA3 GLY A 172 -4.279 21.958 -13.685 1.00 63.12 H new ATOM 2722 N HIS A 173 -3.097 19.088 -14.237 1.00 33.42 N ATOM 2723 CA HIS A 173 -2.843 18.065 -15.246 1.00 0.43 C ATOM 2724 C HIS A 173 -3.068 16.667 -14.672 1.00 24.24 C ATOM 2725 O HIS A 173 -2.658 16.365 -13.551 1.00 42.22 O ATOM 2726 CB HIS A 173 -1.434 18.204 -15.873 1.00 20.30 C ATOM 2727 CG HIS A 173 -0.268 18.181 -14.919 1.00 60.52 C ATOM 2728 ND1 HIS A 173 0.408 19.329 -14.589 1.00 73.44 N ATOM 2729 CD2 HIS A 173 0.325 17.134 -14.300 1.00 43.23 C ATOM 2730 CE1 HIS A 173 1.388 18.959 -13.784 1.00 34.40 C ATOM 2731 NE2 HIS A 173 1.378 17.637 -13.579 1.00 43.13 N ATOM 0 H HIS A 173 -2.443 19.088 -13.454 1.00 33.42 H new ATOM 0 HA HIS A 173 -3.560 18.216 -16.053 1.00 0.43 H new ATOM 0 HB2 HIS A 173 -1.301 17.398 -16.594 1.00 20.30 H new ATOM 0 HB3 HIS A 173 -1.400 19.140 -16.431 1.00 20.30 H new ATOM 0 HD2 HIS A 173 0.026 16.098 -14.362 1.00 43.23 H new ATOM 0 HE1 HIS A 173 2.106 19.637 -13.347 1.00 34.40 H new ATOM 0 HE2 HIS A 173 2.028 17.106 -12.999 1.00 43.13 H new ATOM 2739 N ASN A 174 -3.755 15.830 -15.438 1.00 12.34 N ATOM 2740 CA ASN A 174 -4.075 14.476 -15.003 1.00 65.12 C ATOM 2741 C ASN A 174 -3.102 13.475 -15.619 1.00 10.51 C ATOM 2742 O ASN A 174 -3.034 13.326 -16.840 1.00 33.42 O ATOM 2743 CB ASN A 174 -5.520 14.123 -15.380 1.00 42.41 C ATOM 2744 CG ASN A 174 -5.964 12.776 -14.836 1.00 53.35 C ATOM 2745 OD1 ASN A 174 -5.805 11.746 -15.487 1.00 53.24 O ATOM 2746 ND2 ASN A 174 -6.531 12.772 -13.643 1.00 52.24 N ATOM 0 H ASN A 174 -4.103 16.066 -16.367 1.00 12.34 H new ATOM 0 HA ASN A 174 -3.978 14.427 -13.918 1.00 65.12 H new ATOM 0 HB2 ASN A 174 -6.187 14.898 -15.004 1.00 42.41 H new ATOM 0 HB3 ASN A 174 -5.616 14.119 -16.466 1.00 42.41 H new ATOM 0 HD21 ASN A 174 -6.853 11.895 -13.234 1.00 52.24 H new ATOM 0 HD22 ASN A 174 -6.647 13.646 -13.130 1.00 52.24 H new ATOM 2753 N CYS A 175 -2.335 12.815 -14.764 1.00 71.42 N ATOM 2754 CA CYS A 175 -1.331 11.857 -15.203 1.00 43.12 C ATOM 2755 C CYS A 175 -1.649 10.458 -14.694 1.00 43.40 C ATOM 2756 O CYS A 175 -2.359 10.295 -13.701 1.00 3.23 O ATOM 2757 CB CYS A 175 0.041 12.288 -14.706 1.00 13.52 C ATOM 2758 SG CYS A 175 0.464 13.977 -15.160 1.00 1.15 S ATOM 0 H CYS A 175 -2.390 12.927 -13.752 1.00 71.42 H new ATOM 0 HA CYS A 175 -1.334 11.832 -16.293 1.00 43.12 H new ATOM 0 HB2 CYS A 175 0.073 12.192 -13.621 1.00 13.52 H new ATOM 0 HB3 CYS A 175 0.795 11.611 -15.109 1.00 13.52 H new ATOM 0 HG CYS A 175 1.406 14.414 -14.378 1.00 1.15 H new ATOM 2764 N GLU A 176 -1.116 9.457 -15.382 1.00 50.03 N ATOM 2765 CA GLU A 176 -1.324 8.066 -15.015 1.00 41.34 C ATOM 2766 C GLU A 176 -0.265 7.617 -14.021 1.00 60.42 C ATOM 2767 O GLU A 176 0.900 7.999 -14.128 1.00 43.32 O ATOM 2768 CB GLU A 176 -1.273 7.177 -16.257 1.00 10.32 C ATOM 2769 CG GLU A 176 -1.754 5.759 -16.009 1.00 15.14 C ATOM 2770 CD GLU A 176 -1.552 4.857 -17.204 1.00 2.34 C ATOM 2771 OE1 GLU A 176 -2.200 5.086 -18.247 1.00 1.52 O ATOM 2772 OE2 GLU A 176 -0.750 3.908 -17.104 1.00 13.44 O ATOM 0 H GLU A 176 -0.530 9.587 -16.207 1.00 50.03 H new ATOM 0 HA GLU A 176 -2.307 7.976 -14.552 1.00 41.34 H new ATOM 0 HB2 GLU A 176 -1.883 7.627 -17.041 1.00 10.32 H new ATOM 0 HB3 GLU A 176 -0.249 7.145 -16.629 1.00 10.32 H new ATOM 0 HG2 GLU A 176 -1.223 5.344 -15.152 1.00 15.14 H new ATOM 0 HG3 GLU A 176 -2.812 5.779 -15.749 1.00 15.14 H new ATOM 2779 N VAL A 177 -0.677 6.807 -13.065 1.00 72.30 N ATOM 2780 CA VAL A 177 0.233 6.280 -12.069 1.00 1.21 C ATOM 2781 C VAL A 177 0.066 4.770 -11.917 1.00 2.42 C ATOM 2782 O VAL A 177 -0.944 4.198 -12.337 1.00 12.23 O ATOM 2783 CB VAL A 177 0.061 6.956 -10.688 1.00 61.41 C ATOM 2784 CG1 VAL A 177 0.022 8.473 -10.804 1.00 60.15 C ATOM 2785 CG2 VAL A 177 -1.167 6.429 -9.976 1.00 34.11 C ATOM 0 H VAL A 177 -1.643 6.498 -12.958 1.00 72.30 H new ATOM 0 HA VAL A 177 1.237 6.503 -12.429 1.00 1.21 H new ATOM 0 HB VAL A 177 0.934 6.701 -10.088 1.00 61.41 H new ATOM 0 HG11 VAL A 177 -0.100 8.911 -9.813 1.00 60.15 H new ATOM 0 HG12 VAL A 177 0.953 8.828 -11.246 1.00 60.15 H new ATOM 0 HG13 VAL A 177 -0.815 8.768 -11.436 1.00 60.15 H new ATOM 0 HG21 VAL A 177 -1.265 6.920 -9.008 1.00 34.11 H new ATOM 0 HG22 VAL A 177 -2.052 6.633 -10.578 1.00 34.11 H new ATOM 0 HG23 VAL A 177 -1.069 5.353 -9.829 1.00 34.11 H new ATOM 2795 N ARG A 178 1.080 4.151 -11.322 1.00 3.24 N ATOM 2796 CA ARG A 178 1.075 2.703 -11.063 1.00 33.33 C ATOM 2797 C ARG A 178 2.284 2.274 -10.246 1.00 34.54 C ATOM 2798 O ARG A 178 3.190 3.072 -10.003 1.00 22.33 O ATOM 2799 CB ARG A 178 1.027 1.910 -12.377 1.00 54.04 C ATOM 2800 CG ARG A 178 2.348 1.837 -13.120 1.00 33.42 C ATOM 2801 CD ARG A 178 2.143 1.408 -14.561 1.00 55.20 C ATOM 2802 NE ARG A 178 3.409 1.275 -15.284 1.00 14.03 N ATOM 2803 CZ ARG A 178 3.555 1.517 -16.587 1.00 14.21 C ATOM 2804 NH1 ARG A 178 2.514 1.899 -17.321 1.00 41.42 N ATOM 2805 NH2 ARG A 178 4.748 1.377 -17.157 1.00 43.24 N ATOM 0 H ARG A 178 1.925 4.627 -11.006 1.00 3.24 H new ATOM 0 HA ARG A 178 0.177 2.486 -10.484 1.00 33.33 H new ATOM 0 HB2 ARG A 178 0.690 0.896 -12.162 1.00 54.04 H new ATOM 0 HB3 ARG A 178 0.282 2.362 -13.032 1.00 54.04 H new ATOM 0 HG2 ARG A 178 2.838 2.811 -13.094 1.00 33.42 H new ATOM 0 HG3 ARG A 178 3.012 1.133 -12.619 1.00 33.42 H new ATOM 0 HD2 ARG A 178 1.612 0.456 -14.583 1.00 55.20 H new ATOM 0 HD3 ARG A 178 1.511 2.137 -15.069 1.00 55.20 H new ATOM 0 HE ARG A 178 4.231 0.979 -14.758 1.00 14.03 H new ATOM 0 HH11 ARG A 178 1.597 2.008 -16.888 1.00 41.42 H new ATOM 0 HH12 ARG A 178 2.632 2.083 -18.317 1.00 41.42 H new ATOM 0 HH21 ARG A 178 5.549 1.085 -16.598 1.00 43.24 H new ATOM 0 HH22 ARG A 178 4.862 1.562 -18.154 1.00 43.24 H new ATOM 2819 N LYS A 179 2.279 1.010 -9.818 1.00 44.13 N ATOM 2820 CA LYS A 179 3.407 0.422 -9.103 1.00 34.54 C ATOM 2821 C LYS A 179 4.659 0.440 -9.968 1.00 13.33 C ATOM 2822 O LYS A 179 4.630 0.017 -11.125 1.00 73.13 O ATOM 2823 CB LYS A 179 3.105 -1.029 -8.716 1.00 42.31 C ATOM 2824 CG LYS A 179 2.000 -1.194 -7.687 1.00 23.34 C ATOM 2825 CD LYS A 179 2.425 -0.706 -6.311 1.00 50.13 C ATOM 2826 CE LYS A 179 1.985 -1.670 -5.221 1.00 15.22 C ATOM 2827 NZ LYS A 179 0.506 -1.856 -5.177 1.00 11.11 N ATOM 0 H LYS A 179 1.497 0.371 -9.957 1.00 44.13 H new ATOM 0 HA LYS A 179 3.572 1.016 -8.204 1.00 34.54 H new ATOM 0 HB2 LYS A 179 2.831 -1.581 -9.615 1.00 42.31 H new ATOM 0 HB3 LYS A 179 4.016 -1.484 -8.327 1.00 42.31 H new ATOM 0 HG2 LYS A 179 1.118 -0.642 -8.011 1.00 23.34 H new ATOM 0 HG3 LYS A 179 1.715 -2.244 -7.627 1.00 23.34 H new ATOM 0 HD2 LYS A 179 3.509 -0.592 -6.282 1.00 50.13 H new ATOM 0 HD3 LYS A 179 1.996 0.278 -6.124 1.00 50.13 H new ATOM 0 HE2 LYS A 179 2.464 -2.636 -5.382 1.00 15.22 H new ATOM 0 HE3 LYS A 179 2.329 -1.301 -4.255 1.00 15.22 H new ATOM 0 HZ1 LYS A 179 0.287 -2.829 -4.881 1.00 11.11 H new ATOM 0 HZ2 LYS A 179 0.092 -1.186 -4.498 1.00 11.11 H new ATOM 0 HZ3 LYS A 179 0.106 -1.683 -6.121 1.00 11.11 H new ATOM 2841 N ALA A 180 5.750 0.932 -9.413 1.00 61.20 N ATOM 2842 CA ALA A 180 7.019 0.920 -10.115 1.00 24.43 C ATOM 2843 C ALA A 180 7.986 0.006 -9.399 1.00 14.12 C ATOM 2844 O ALA A 180 8.382 0.258 -8.263 1.00 44.33 O ATOM 2845 CB ALA A 180 7.594 2.321 -10.240 1.00 74.20 C ATOM 0 H ALA A 180 5.783 1.344 -8.481 1.00 61.20 H new ATOM 0 HA ALA A 180 6.854 0.545 -11.125 1.00 24.43 H new ATOM 0 HB1 ALA A 180 8.545 2.278 -10.771 1.00 74.20 H new ATOM 0 HB2 ALA A 180 6.898 2.952 -10.793 1.00 74.20 H new ATOM 0 HB3 ALA A 180 7.752 2.740 -9.246 1.00 74.20 H new ATOM 2851 N LEU A 181 8.343 -1.066 -10.067 1.00 42.34 N ATOM 2852 CA LEU A 181 9.238 -2.050 -9.500 1.00 51.53 C ATOM 2853 C LEU A 181 10.651 -1.799 -9.989 1.00 33.32 C ATOM 2854 O LEU A 181 10.850 -1.116 -10.997 1.00 61.22 O ATOM 2855 CB LEU A 181 8.797 -3.460 -9.902 1.00 44.24 C ATOM 2856 CG LEU A 181 7.304 -3.761 -9.744 1.00 64.43 C ATOM 2857 CD1 LEU A 181 6.958 -5.077 -10.418 1.00 0.34 C ATOM 2858 CD2 LEU A 181 6.920 -3.804 -8.276 1.00 42.23 C ATOM 0 H LEU A 181 8.025 -1.281 -11.012 1.00 42.34 H new ATOM 0 HA LEU A 181 9.210 -1.967 -8.414 1.00 51.53 H new ATOM 0 HB2 LEU A 181 9.073 -3.624 -10.944 1.00 44.24 H new ATOM 0 HB3 LEU A 181 9.359 -4.180 -9.306 1.00 44.24 H new ATOM 0 HG LEU A 181 6.739 -2.962 -10.224 1.00 64.43 H new ATOM 0 HD11 LEU A 181 5.894 -5.279 -10.298 1.00 0.34 H new ATOM 0 HD12 LEU A 181 7.198 -5.016 -11.479 1.00 0.34 H new ATOM 0 HD13 LEU A 181 7.533 -5.882 -9.961 1.00 0.34 H new ATOM 0 HD21 LEU A 181 5.855 -4.019 -8.185 1.00 42.23 H new ATOM 0 HD22 LEU A 181 7.492 -4.583 -7.773 1.00 42.23 H new ATOM 0 HD23 LEU A 181 7.136 -2.840 -7.815 1.00 42.23 H new