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 171 ASN : amide:sc= -0.429 K(o=-1,f=-0.36) USER MOD Set 1.2: A 173 HIS : no HD1:sc= -0.616 K(o=-1,f=-0.36) USER MOD Set 2.1: A 124 TYR OH : rot -168:sc= 1.26 USER MOD Set 2.2: A 128 TYR OH : rot 180:sc= 0 USER MOD Set 2.3: A 168 HIS : no HD1:sc= -1.09 K(o=0.17,f=-13!) USER MOD Set 3.1: A 87 LYS NZ :NH3+ -162:sc= -1.49 (180deg=-1.45!) USER MOD Set 3.2: A 156 HIS : no HD1:sc= -5.29! K(o=-6.8!,f=-8.1) USER MOD Set 4.1: A 26 THR OG1 : rot 180:sc= 0.348 USER MOD Set 4.2: A 29 SER OG : rot 96:sc= 0.363 USER MOD Set 5.1: A 22 SER OG : rot -4:sc= 0.702 USER MOD Set 5.2: A 25 THR OG1 : rot -140:sc= 1.08 USER MOD Single : A 8 LYS NZ :NH3+ -163:sc= -0.0662 (180deg=-0.344) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=-0.0079) 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= -0.0209 X(o=-0.021,f=-0.12) USER MOD Single : A 36 GLN : amide:sc= 1.01 K(o=1,f=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 CYS SG : rot -128:sc= -0.239 USER MOD Single : A 46 MET CE :methyl 139:sc= -0.659 (180deg=-2.73!) USER MOD Single : A 50 ASN : amide:sc= 0.526 K(o=0.53,f=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 176:sc= 0.541 (180deg=0.502) USER MOD Single : A 54 SER OG : rot -116:sc= 0.976 USER MOD Single : A 61 THR OG1 : rot -155:sc= -3.1! USER MOD Single : A 62 TYR OH : rot -139:sc= 0.585 USER MOD Single : A 64 THR OG1 : rot 76:sc= 1.18 USER MOD Single : A 72 MET CE :methyl 141:sc=-0.00956 (180deg=-1.01) USER MOD Single : A 73 ASN : amide:sc= -3.91! C(o=-3.9!,f=-6.1!) USER MOD Single : A 77 HIS : no HD1:sc= 0.798 K(o=0.8,f=-5.2!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot -153:sc= 1.24 USER MOD Single : A 95 SER OG : rot -91:sc= -2.82! USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 HIS : no HE2:sc= -1.94 X(o=-1.9,f=-1.9) USER MOD Single : A 103 THR OG1 : rot -74:sc= 1.36 USER MOD Single : A 105 LYS NZ :NH3+ 155:sc= 0.568 (180deg=0.272) USER MOD Single : A 106 LYS NZ :NH3+ -174:sc= 1.23 (180deg=1.17) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot -150:sc= -0.141 USER MOD Single : A 119 HIS : no HD1:sc= -1.05 K(o=-1.1,f=-0.03) USER MOD Single : A 120 HIS : no HD1:sc= 0.683 K(o=0.68,f=-3.3!) USER MOD Single : A 127 GLN : amide:sc= 0.27 X(o=0.27,f=0) USER MOD Single : A 130 LYS NZ :NH3+ 172:sc= 1.22 (180deg=1.1) USER MOD Single : A 137 MET CE :methyl -174:sc= 0 (180deg=-0.072) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 THR OG1 : rot 180:sc= -1.71! USER MOD Single : A 158 SER OG : rot 152:sc= -1.34 USER MOD Single : A 161 LYS NZ :NH3+ 173:sc= 1.2 (180deg=1.15) USER MOD Single : A 165 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 TYR OH : rot 180:sc= 0 USER MOD Single : A 169 THR OG1 : rot 180:sc= 0 USER MOD Single : A 174 ASN : amide:sc= -0.276 X(o=-0.28,f=-0.16) USER MOD Single : A 175 CYS SG : rot 59:sc= -1.5 USER MOD Single : A 179 LYS NZ :NH3+ 155:sc= 1.99 (180deg=-0.502) USER MOD ----------------------------------------------------------------- ATOM 92 N LYS A 8 -16.101 8.072 6.438 1.00 1.44 N ATOM 93 CA LYS A 8 -16.765 8.122 5.140 1.00 32.15 C ATOM 94 C LYS A 8 -15.946 7.362 4.115 1.00 44.15 C ATOM 95 O LYS A 8 -16.292 7.304 2.933 1.00 21.11 O ATOM 96 CB LYS A 8 -16.945 9.570 4.670 1.00 54.31 C ATOM 97 CG LYS A 8 -17.567 10.488 5.707 1.00 32.23 C ATOM 98 CD LYS A 8 -16.505 11.282 6.452 1.00 55.32 C ATOM 99 CE LYS A 8 -17.121 12.281 7.415 1.00 3.04 C ATOM 100 NZ LYS A 8 -17.980 13.273 6.717 1.00 61.42 N ATOM 0 HA LYS A 8 -17.748 7.664 5.244 1.00 32.15 H new ATOM 0 HB2 LYS A 8 -15.973 9.971 4.383 1.00 54.31 H new ATOM 0 HB3 LYS A 8 -17.568 9.575 3.776 1.00 54.31 H new ATOM 0 HG2 LYS A 8 -18.261 11.173 5.220 1.00 32.23 H new ATOM 0 HG3 LYS A 8 -18.147 9.898 6.417 1.00 32.23 H new ATOM 0 HD2 LYS A 8 -15.859 10.598 7.002 1.00 55.32 H new ATOM 0 HD3 LYS A 8 -15.875 11.809 5.735 1.00 55.32 H new ATOM 0 HE2 LYS A 8 -17.714 11.749 8.159 1.00 3.04 H new ATOM 0 HE3 LYS A 8 -16.329 12.802 7.952 1.00 3.04 H new ATOM 0 HZ1 LYS A 8 -18.145 14.089 7.340 1.00 61.42 H new ATOM 0 HZ2 LYS A 8 -17.506 13.591 5.848 1.00 61.42 H new ATOM 0 HZ3 LYS A 8 -18.891 12.834 6.474 1.00 61.42 H new ATOM 114 N GLU A 9 -14.852 6.793 4.581 1.00 62.12 N ATOM 115 CA GLU A 9 -13.926 6.084 3.722 1.00 53.34 C ATOM 116 C GLU A 9 -14.454 4.695 3.415 1.00 25.42 C ATOM 117 O GLU A 9 -14.955 4.006 4.304 1.00 60.21 O ATOM 118 CB GLU A 9 -12.546 5.975 4.381 1.00 50.10 C ATOM 119 CG GLU A 9 -11.990 7.302 4.857 1.00 14.10 C ATOM 120 CD GLU A 9 -12.450 7.664 6.259 1.00 60.21 C ATOM 121 OE1 GLU A 9 -11.897 7.113 7.233 1.00 25.25 O ATOM 122 OE2 GLU A 9 -13.358 8.511 6.390 1.00 12.00 O ATOM 0 H GLU A 9 -14.581 6.809 5.564 1.00 62.12 H new ATOM 0 HA GLU A 9 -13.827 6.646 2.794 1.00 53.34 H new ATOM 0 HB2 GLU A 9 -12.611 5.294 5.229 1.00 50.10 H new ATOM 0 HB3 GLU A 9 -11.848 5.533 3.670 1.00 50.10 H new ATOM 0 HG2 GLU A 9 -10.901 7.263 4.836 1.00 14.10 H new ATOM 0 HG3 GLU A 9 -12.295 8.087 4.165 1.00 14.10 H new ATOM 129 N PRO A 10 -14.371 4.276 2.144 1.00 51.22 N ATOM 130 CA PRO A 10 -14.710 2.915 1.754 1.00 2.24 C ATOM 131 C PRO A 10 -13.777 1.912 2.413 1.00 43.21 C ATOM 132 O PRO A 10 -12.679 2.274 2.845 1.00 44.11 O ATOM 133 CB PRO A 10 -14.535 2.892 0.233 1.00 72.13 C ATOM 134 CG PRO A 10 -13.771 4.115 -0.121 1.00 55.43 C ATOM 135 CD PRO A 10 -13.958 5.103 1.000 1.00 31.42 C ATOM 0 HA PRO A 10 -15.720 2.642 2.061 1.00 2.24 H new ATOM 0 HB2 PRO A 10 -14.001 1.996 -0.083 1.00 72.13 H new ATOM 0 HB3 PRO A 10 -15.503 2.880 -0.269 1.00 72.13 H new ATOM 0 HG2 PRO A 10 -12.715 3.882 -0.255 1.00 55.43 H new ATOM 0 HG3 PRO A 10 -14.128 4.531 -1.063 1.00 55.43 H new ATOM 0 HD2 PRO A 10 -13.036 5.644 1.212 1.00 31.42 H new ATOM 0 HD3 PRO A 10 -14.715 5.847 0.753 1.00 31.42 H new ATOM 143 N GLU A 11 -14.207 0.660 2.475 1.00 60.23 N ATOM 144 CA GLU A 11 -13.449 -0.390 3.148 1.00 41.30 C ATOM 145 C GLU A 11 -12.022 -0.507 2.607 1.00 35.35 C ATOM 146 O GLU A 11 -11.106 -0.780 3.360 1.00 12.44 O ATOM 147 CB GLU A 11 -14.177 -1.743 3.039 1.00 42.51 C ATOM 148 CG GLU A 11 -14.160 -2.373 1.647 1.00 22.31 C ATOM 149 CD GLU A 11 -14.922 -1.569 0.611 1.00 1.41 C ATOM 150 OE1 GLU A 11 -16.156 -1.716 0.529 1.00 34.43 O ATOM 151 OE2 GLU A 11 -14.287 -0.782 -0.123 1.00 52.15 O ATOM 0 H GLU A 11 -15.085 0.343 2.064 1.00 60.23 H new ATOM 0 HA GLU A 11 -13.378 -0.111 4.199 1.00 41.30 H new ATOM 0 HB2 GLU A 11 -13.724 -2.441 3.743 1.00 42.51 H new ATOM 0 HB3 GLU A 11 -15.214 -1.607 3.348 1.00 42.51 H new ATOM 0 HG2 GLU A 11 -13.126 -2.485 1.320 1.00 22.31 H new ATOM 0 HG3 GLU A 11 -14.587 -3.374 1.705 1.00 22.31 H new ATOM 158 N GLN A 12 -11.836 -0.253 1.315 1.00 1.11 N ATOM 159 CA GLN A 12 -10.529 -0.409 0.677 1.00 61.50 C ATOM 160 C GLN A 12 -9.496 0.597 1.204 1.00 34.11 C ATOM 161 O GLN A 12 -8.314 0.281 1.311 1.00 22.10 O ATOM 162 CB GLN A 12 -10.675 -0.280 -0.842 1.00 2.53 C ATOM 163 CG GLN A 12 -10.904 1.145 -1.333 1.00 14.12 C ATOM 164 CD GLN A 12 -11.414 1.196 -2.757 1.00 4.44 C ATOM 165 OE1 GLN A 12 -10.635 1.198 -3.711 1.00 14.03 O ATOM 166 NE2 GLN A 12 -12.726 1.251 -2.909 1.00 42.21 N ATOM 0 H GLN A 12 -12.575 0.063 0.686 1.00 1.11 H new ATOM 0 HA GLN A 12 -10.158 -1.403 0.927 1.00 61.50 H new ATOM 0 HB2 GLN A 12 -9.776 -0.675 -1.316 1.00 2.53 H new ATOM 0 HB3 GLN A 12 -11.508 -0.902 -1.169 1.00 2.53 H new ATOM 0 HG2 GLN A 12 -11.620 1.641 -0.677 1.00 14.12 H new ATOM 0 HG3 GLN A 12 -9.970 1.703 -1.265 1.00 14.12 H new ATOM 0 HE21 GLN A 12 -13.335 1.247 -2.091 1.00 42.21 H new ATOM 0 HE22 GLN A 12 -13.130 1.297 -3.845 1.00 42.21 H new ATOM 175 N LEU A 13 -9.948 1.795 1.565 1.00 25.12 N ATOM 176 CA LEU A 13 -9.037 2.847 2.007 1.00 54.02 C ATOM 177 C LEU A 13 -8.624 2.628 3.452 1.00 44.14 C ATOM 178 O LEU A 13 -7.628 3.182 3.916 1.00 10.52 O ATOM 179 CB LEU A 13 -9.689 4.226 1.876 1.00 63.22 C ATOM 180 CG LEU A 13 -10.148 4.624 0.473 1.00 61.42 C ATOM 181 CD1 LEU A 13 -10.588 6.076 0.448 1.00 34.41 C ATOM 182 CD2 LEU A 13 -9.061 4.389 -0.552 1.00 42.30 C ATOM 0 H LEU A 13 -10.933 2.061 1.560 1.00 25.12 H new ATOM 0 HA LEU A 13 -8.155 2.806 1.368 1.00 54.02 H new ATOM 0 HB2 LEU A 13 -10.551 4.262 2.542 1.00 63.22 H new ATOM 0 HB3 LEU A 13 -8.981 4.975 2.230 1.00 63.22 H new ATOM 0 HG LEU A 13 -10.998 3.993 0.212 1.00 61.42 H new ATOM 0 HD11 LEU A 13 -10.911 6.341 -0.559 1.00 34.41 H new ATOM 0 HD12 LEU A 13 -11.415 6.218 1.144 1.00 34.41 H new ATOM 0 HD13 LEU A 13 -9.754 6.714 0.741 1.00 34.41 H new ATOM 0 HD21 LEU A 13 -9.421 4.683 -1.538 1.00 42.30 H new ATOM 0 HD22 LEU A 13 -8.184 4.982 -0.295 1.00 42.30 H new ATOM 0 HD23 LEU A 13 -8.794 3.332 -0.563 1.00 42.30 H new ATOM 194 N ARG A 14 -9.379 1.795 4.149 1.00 62.12 N ATOM 195 CA ARG A 14 -9.155 1.584 5.567 1.00 52.31 C ATOM 196 C ARG A 14 -8.906 0.110 5.881 1.00 30.42 C ATOM 197 O ARG A 14 -8.817 -0.277 7.042 1.00 72.14 O ATOM 198 CB ARG A 14 -10.327 2.129 6.392 1.00 13.24 C ATOM 199 CG ARG A 14 -11.696 1.691 5.904 1.00 71.41 C ATOM 200 CD ARG A 14 -12.798 2.358 6.709 1.00 71.03 C ATOM 201 NE ARG A 14 -14.135 2.031 6.211 1.00 23.43 N ATOM 202 CZ ARG A 14 -15.038 1.326 6.893 1.00 43.12 C ATOM 203 NH1 ARG A 14 -14.757 0.855 8.098 1.00 53.10 N ATOM 204 NH2 ARG A 14 -16.236 1.110 6.374 1.00 34.20 N ATOM 0 H ARG A 14 -10.150 1.256 3.756 1.00 62.12 H new ATOM 0 HA ARG A 14 -8.257 2.136 5.845 1.00 52.31 H new ATOM 0 HB2 ARG A 14 -10.205 1.811 7.427 1.00 13.24 H new ATOM 0 HB3 ARG A 14 -10.284 3.218 6.386 1.00 13.24 H new ATOM 0 HG2 ARG A 14 -11.808 1.942 4.849 1.00 71.41 H new ATOM 0 HG3 ARG A 14 -11.786 0.608 5.985 1.00 71.41 H new ATOM 0 HD2 ARG A 14 -12.718 2.051 7.752 1.00 71.03 H new ATOM 0 HD3 ARG A 14 -12.659 3.439 6.683 1.00 71.03 H new ATOM 0 HE ARG A 14 -14.393 2.364 5.282 1.00 23.43 H new ATOM 0 HH11 ARG A 14 -13.842 1.030 8.514 1.00 53.10 H new ATOM 0 HH12 ARG A 14 -15.455 0.317 8.611 1.00 53.10 H new ATOM 0 HH21 ARG A 14 -16.468 1.483 5.453 1.00 34.20 H new ATOM 0 HH22 ARG A 14 -16.928 0.571 6.895 1.00 34.20 H new ATOM 218 N LYS A 15 -8.830 -0.719 4.855 1.00 24.10 N ATOM 219 CA LYS A 15 -8.430 -2.104 5.036 1.00 31.45 C ATOM 220 C LYS A 15 -6.962 -2.288 4.689 1.00 4.04 C ATOM 221 O LYS A 15 -6.407 -1.568 3.856 1.00 40.12 O ATOM 222 CB LYS A 15 -9.318 -3.025 4.186 1.00 42.22 C ATOM 223 CG LYS A 15 -9.017 -4.511 4.324 1.00 40.33 C ATOM 224 CD LYS A 15 -10.158 -5.368 3.794 1.00 30.05 C ATOM 225 CE LYS A 15 -10.553 -4.994 2.377 1.00 11.42 C ATOM 226 NZ LYS A 15 -11.823 -5.647 1.968 1.00 52.41 N ATOM 0 H LYS A 15 -9.039 -0.459 3.891 1.00 24.10 H new ATOM 0 HA LYS A 15 -8.560 -2.373 6.084 1.00 31.45 H new ATOM 0 HB2 LYS A 15 -10.360 -2.853 4.458 1.00 42.22 H new ATOM 0 HB3 LYS A 15 -9.211 -2.743 3.139 1.00 42.22 H new ATOM 0 HG2 LYS A 15 -8.101 -4.749 3.782 1.00 40.33 H new ATOM 0 HG3 LYS A 15 -8.839 -4.750 5.372 1.00 40.33 H new ATOM 0 HD2 LYS A 15 -9.864 -6.417 3.821 1.00 30.05 H new ATOM 0 HD3 LYS A 15 -11.023 -5.262 4.449 1.00 30.05 H new ATOM 0 HE2 LYS A 15 -10.660 -3.912 2.303 1.00 11.42 H new ATOM 0 HE3 LYS A 15 -9.758 -5.283 1.690 1.00 11.42 H new ATOM 0 HZ1 LYS A 15 -12.059 -5.367 0.995 1.00 52.41 H new ATOM 0 HZ2 LYS A 15 -11.713 -6.680 2.014 1.00 52.41 H new ATOM 0 HZ3 LYS A 15 -12.587 -5.352 2.608 1.00 52.41 H new ATOM 240 N LEU A 16 -6.346 -3.243 5.359 1.00 75.30 N ATOM 241 CA LEU A 16 -4.941 -3.548 5.175 1.00 72.11 C ATOM 242 C LEU A 16 -4.777 -4.951 4.628 1.00 15.30 C ATOM 243 O LEU A 16 -5.500 -5.862 5.020 1.00 24.54 O ATOM 244 CB LEU A 16 -4.177 -3.423 6.503 1.00 72.21 C ATOM 245 CG LEU A 16 -3.538 -2.059 6.784 1.00 60.53 C ATOM 246 CD1 LEU A 16 -4.555 -0.954 6.639 1.00 73.51 C ATOM 247 CD2 LEU A 16 -2.922 -2.033 8.173 1.00 72.54 C ATOM 0 H LEU A 16 -6.810 -3.832 6.050 1.00 75.30 H new ATOM 0 HA LEU A 16 -4.530 -2.832 4.464 1.00 72.11 H new ATOM 0 HB2 LEU A 16 -4.863 -3.655 7.317 1.00 72.21 H new ATOM 0 HB3 LEU A 16 -3.393 -4.180 6.521 1.00 72.21 H new ATOM 0 HG LEU A 16 -2.747 -1.897 6.052 1.00 60.53 H new ATOM 0 HD11 LEU A 16 -4.081 0.006 6.843 1.00 73.51 H new ATOM 0 HD12 LEU A 16 -4.951 -0.955 5.623 1.00 73.51 H new ATOM 0 HD13 LEU A 16 -5.369 -1.114 7.346 1.00 73.51 H new ATOM 0 HD21 LEU A 16 -2.473 -1.056 8.354 1.00 72.54 H new ATOM 0 HD22 LEU A 16 -3.696 -2.220 8.918 1.00 72.54 H new ATOM 0 HD23 LEU A 16 -2.155 -2.804 8.245 1.00 72.54 H new ATOM 259 N PHE A 17 -3.830 -5.116 3.727 1.00 60.31 N ATOM 260 CA PHE A 17 -3.479 -6.427 3.222 1.00 43.33 C ATOM 261 C PHE A 17 -2.270 -6.929 3.989 1.00 42.41 C ATOM 262 O PHE A 17 -1.190 -6.355 3.913 1.00 52.30 O ATOM 263 CB PHE A 17 -3.185 -6.376 1.717 1.00 14.51 C ATOM 264 CG PHE A 17 -2.418 -7.567 1.198 1.00 55.12 C ATOM 265 CD1 PHE A 17 -3.055 -8.772 0.950 1.00 52.01 C ATOM 266 CD2 PHE A 17 -1.059 -7.471 0.946 1.00 51.02 C ATOM 267 CE1 PHE A 17 -2.347 -9.856 0.468 1.00 13.04 C ATOM 268 CE2 PHE A 17 -0.347 -8.550 0.469 1.00 53.31 C ATOM 269 CZ PHE A 17 -0.993 -9.744 0.224 1.00 2.31 C ATOM 0 H PHE A 17 -3.286 -4.352 3.327 1.00 60.31 H new ATOM 0 HA PHE A 17 -4.317 -7.109 3.364 1.00 43.33 H new ATOM 0 HB2 PHE A 17 -4.128 -6.301 1.176 1.00 14.51 H new ATOM 0 HB3 PHE A 17 -2.619 -5.470 1.499 1.00 14.51 H new ATOM 0 HD1 PHE A 17 -4.115 -8.865 1.135 1.00 52.01 H new ATOM 0 HD2 PHE A 17 -0.550 -6.536 1.126 1.00 51.02 H new ATOM 0 HE1 PHE A 17 -2.853 -10.792 0.282 1.00 13.04 H new ATOM 0 HE2 PHE A 17 0.714 -8.461 0.287 1.00 53.31 H new ATOM 0 HZ PHE A 17 -0.440 -10.590 -0.158 1.00 2.31 H new ATOM 279 N ILE A 18 -2.455 -7.979 4.744 1.00 25.24 N ATOM 280 CA ILE A 18 -1.390 -8.495 5.571 1.00 1.23 C ATOM 281 C ILE A 18 -0.648 -9.594 4.837 1.00 22.12 C ATOM 282 O ILE A 18 -1.193 -10.669 4.608 1.00 21.23 O ATOM 283 CB ILE A 18 -1.922 -9.047 6.906 1.00 44.25 C ATOM 284 CG1 ILE A 18 -2.933 -8.080 7.531 1.00 54.23 C ATOM 285 CG2 ILE A 18 -0.765 -9.293 7.862 1.00 43.12 C ATOM 286 CD1 ILE A 18 -2.377 -6.695 7.780 1.00 53.14 C ATOM 0 H ILE A 18 -3.332 -8.496 4.806 1.00 25.24 H new ATOM 0 HA ILE A 18 -0.714 -7.668 5.787 1.00 1.23 H new ATOM 0 HB ILE A 18 -2.431 -9.991 6.713 1.00 44.25 H new ATOM 0 HG12 ILE A 18 -3.800 -8.001 6.875 1.00 54.23 H new ATOM 0 HG13 ILE A 18 -3.284 -8.496 8.475 1.00 54.23 H new ATOM 0 HG21 ILE A 18 -1.149 -9.683 8.805 1.00 43.12 H new ATOM 0 HG22 ILE A 18 -0.077 -10.016 7.423 1.00 43.12 H new ATOM 0 HG23 ILE A 18 -0.239 -8.356 8.045 1.00 43.12 H new ATOM 0 HD11 ILE A 18 -3.150 -6.067 8.223 1.00 53.14 H new ATOM 0 HD12 ILE A 18 -1.528 -6.761 8.461 1.00 53.14 H new ATOM 0 HD13 ILE A 18 -2.052 -6.258 6.836 1.00 53.14 H new ATOM 298 N GLY A 19 0.587 -9.318 4.464 1.00 3.44 N ATOM 299 CA GLY A 19 1.377 -10.298 3.766 1.00 63.13 C ATOM 300 C GLY A 19 2.374 -10.954 4.686 1.00 70.30 C ATOM 301 O GLY A 19 2.791 -10.354 5.677 1.00 1.31 O ATOM 0 H GLY A 19 1.057 -8.429 4.634 1.00 3.44 H new ATOM 0 HA2 GLY A 19 0.723 -11.056 3.336 1.00 63.13 H new ATOM 0 HA3 GLY A 19 1.902 -9.822 2.938 1.00 63.13 H new ATOM 305 N GLY A 20 2.748 -12.182 4.374 1.00 72.12 N ATOM 306 CA GLY A 20 3.742 -12.872 5.164 1.00 24.31 C ATOM 307 C GLY A 20 3.231 -13.298 6.522 1.00 34.32 C ATOM 308 O GLY A 20 3.907 -13.094 7.530 1.00 11.40 O ATOM 0 H GLY A 20 2.380 -12.715 3.586 1.00 72.12 H new ATOM 0 HA2 GLY A 20 4.084 -13.752 4.619 1.00 24.31 H new ATOM 0 HA3 GLY A 20 4.607 -12.223 5.296 1.00 24.31 H new ATOM 312 N LEU A 21 2.037 -13.878 6.558 1.00 40.23 N ATOM 313 CA LEU A 21 1.505 -14.466 7.778 1.00 44.53 C ATOM 314 C LEU A 21 2.120 -15.840 7.998 1.00 44.42 C ATOM 315 O LEU A 21 2.867 -16.339 7.149 1.00 53.53 O ATOM 316 CB LEU A 21 -0.019 -14.606 7.688 1.00 43.10 C ATOM 317 CG LEU A 21 -0.815 -13.306 7.731 1.00 21.13 C ATOM 318 CD1 LEU A 21 -2.300 -13.586 7.577 1.00 21.22 C ATOM 319 CD2 LEU A 21 -0.553 -12.567 9.025 1.00 52.53 C ATOM 0 H LEU A 21 1.418 -13.953 5.751 1.00 40.23 H new ATOM 0 HA LEU A 21 1.754 -13.811 8.613 1.00 44.53 H new ATOM 0 HB2 LEU A 21 -0.262 -15.127 6.762 1.00 43.10 H new ATOM 0 HB3 LEU A 21 -0.354 -15.241 8.508 1.00 43.10 H new ATOM 0 HG LEU A 21 -0.492 -12.678 6.901 1.00 21.13 H new ATOM 0 HD11 LEU A 21 -2.853 -12.647 7.610 1.00 21.22 H new ATOM 0 HD12 LEU A 21 -2.480 -14.080 6.622 1.00 21.22 H new ATOM 0 HD13 LEU A 21 -2.634 -14.233 8.388 1.00 21.22 H new ATOM 0 HD21 LEU A 21 -1.129 -11.642 9.039 1.00 52.53 H new ATOM 0 HD22 LEU A 21 -0.850 -13.192 9.867 1.00 52.53 H new ATOM 0 HD23 LEU A 21 0.509 -12.334 9.103 1.00 52.53 H new ATOM 331 N SER A 22 1.806 -16.461 9.121 1.00 60.21 N ATOM 332 CA SER A 22 2.265 -17.810 9.371 1.00 52.22 C ATOM 333 C SER A 22 1.226 -18.802 8.871 1.00 72.04 C ATOM 334 O SER A 22 0.146 -18.413 8.424 1.00 61.43 O ATOM 335 CB SER A 22 2.551 -18.039 10.863 1.00 22.42 C ATOM 336 OG SER A 22 1.464 -17.626 11.673 1.00 74.23 O ATOM 0 H SER A 22 1.240 -16.055 9.866 1.00 60.21 H new ATOM 0 HA SER A 22 3.200 -17.961 8.832 1.00 52.22 H new ATOM 0 HB2 SER A 22 2.754 -19.096 11.037 1.00 22.42 H new ATOM 0 HB3 SER A 22 3.448 -17.491 11.150 1.00 22.42 H new ATOM 0 HG SER A 22 0.774 -17.216 11.111 1.00 74.23 H new ATOM 342 N PHE A 23 1.554 -20.080 8.947 1.00 21.24 N ATOM 343 CA PHE A 23 0.625 -21.140 8.579 1.00 43.52 C ATOM 344 C PHE A 23 -0.433 -21.314 9.671 1.00 64.43 C ATOM 345 O PHE A 23 -1.421 -22.032 9.498 1.00 35.34 O ATOM 346 CB PHE A 23 1.410 -22.439 8.366 1.00 41.12 C ATOM 347 CG PHE A 23 0.673 -23.504 7.600 1.00 25.41 C ATOM 348 CD1 PHE A 23 0.373 -23.332 6.258 1.00 23.45 C ATOM 349 CD2 PHE A 23 0.295 -24.683 8.221 1.00 51.13 C ATOM 350 CE1 PHE A 23 -0.291 -24.315 5.550 1.00 61.44 C ATOM 351 CE2 PHE A 23 -0.366 -25.670 7.518 1.00 52.32 C ATOM 352 CZ PHE A 23 -0.660 -25.487 6.181 1.00 54.02 C ATOM 0 H PHE A 23 2.465 -20.413 9.263 1.00 21.24 H new ATOM 0 HA PHE A 23 0.112 -20.879 7.654 1.00 43.52 H new ATOM 0 HB2 PHE A 23 2.335 -22.206 7.838 1.00 41.12 H new ATOM 0 HB3 PHE A 23 1.691 -22.841 9.339 1.00 41.12 H new ATOM 0 HD1 PHE A 23 0.662 -22.418 5.760 1.00 23.45 H new ATOM 0 HD2 PHE A 23 0.520 -24.832 9.267 1.00 51.13 H new ATOM 0 HE1 PHE A 23 -0.521 -24.167 4.505 1.00 61.44 H new ATOM 0 HE2 PHE A 23 -0.653 -26.586 8.014 1.00 52.32 H new ATOM 0 HZ PHE A 23 -1.177 -26.259 5.630 1.00 54.02 H new ATOM 362 N GLU A 24 -0.224 -20.622 10.789 1.00 44.10 N ATOM 363 CA GLU A 24 -1.075 -20.773 11.957 1.00 54.25 C ATOM 364 C GLU A 24 -1.870 -19.502 12.259 1.00 14.11 C ATOM 365 O GLU A 24 -2.513 -19.418 13.304 1.00 25.21 O ATOM 366 CB GLU A 24 -0.221 -21.126 13.177 1.00 44.01 C ATOM 367 CG GLU A 24 0.781 -22.239 12.930 1.00 13.11 C ATOM 368 CD GLU A 24 1.584 -22.578 14.166 1.00 24.34 C ATOM 369 OE1 GLU A 24 2.570 -21.873 14.454 1.00 3.50 O ATOM 370 OE2 GLU A 24 1.237 -23.557 14.854 1.00 70.10 O ATOM 0 H GLU A 24 0.533 -19.949 10.906 1.00 44.10 H new ATOM 0 HA GLU A 24 -1.783 -21.573 11.740 1.00 54.25 H new ATOM 0 HB2 GLU A 24 0.315 -20.234 13.502 1.00 44.01 H new ATOM 0 HB3 GLU A 24 -0.879 -21.419 13.995 1.00 44.01 H new ATOM 0 HG2 GLU A 24 0.254 -23.129 12.587 1.00 13.11 H new ATOM 0 HG3 GLU A 24 1.459 -21.942 12.130 1.00 13.11 H new ATOM 377 N THR A 25 -1.844 -18.522 11.359 1.00 4.14 N ATOM 378 CA THR A 25 -2.526 -17.257 11.622 1.00 54.02 C ATOM 379 C THR A 25 -4.032 -17.395 11.436 1.00 32.14 C ATOM 380 O THR A 25 -4.505 -17.747 10.354 1.00 60.45 O ATOM 381 CB THR A 25 -2.019 -16.116 10.720 1.00 24.24 C ATOM 382 OG1 THR A 25 -0.590 -16.065 10.744 1.00 40.21 O ATOM 383 CG2 THR A 25 -2.578 -14.780 11.186 1.00 71.02 C ATOM 0 H THR A 25 -1.368 -18.576 10.458 1.00 4.14 H new ATOM 0 HA THR A 25 -2.301 -17.005 12.658 1.00 54.02 H new ATOM 0 HB THR A 25 -2.358 -16.310 9.702 1.00 24.24 H new ATOM 0 HG1 THR A 25 -0.296 -15.130 10.763 1.00 40.21 H new ATOM 0 HG21 THR A 25 -2.209 -13.985 10.537 1.00 71.02 H new ATOM 0 HG22 THR A 25 -3.667 -14.807 11.144 1.00 71.02 H new ATOM 0 HG23 THR A 25 -2.259 -14.589 12.211 1.00 71.02 H new ATOM 391 N THR A 26 -4.776 -17.121 12.494 1.00 32.40 N ATOM 392 CA THR A 26 -6.225 -17.172 12.436 1.00 64.43 C ATOM 393 C THR A 26 -6.806 -15.764 12.378 1.00 3.14 C ATOM 394 O THR A 26 -6.135 -14.793 12.742 1.00 71.31 O ATOM 395 CB THR A 26 -6.807 -17.922 13.648 1.00 61.45 C ATOM 396 OG1 THR A 26 -6.272 -17.380 14.858 1.00 65.03 O ATOM 397 CG2 THR A 26 -6.490 -19.408 13.569 1.00 53.22 C ATOM 0 H THR A 26 -4.398 -16.860 13.405 1.00 32.40 H new ATOM 0 HA THR A 26 -6.500 -17.713 11.531 1.00 64.43 H new ATOM 0 HB THR A 26 -7.890 -17.798 13.640 1.00 61.45 H new ATOM 0 HG1 THR A 26 -6.647 -17.860 15.626 1.00 65.03 H new ATOM 0 HG21 THR A 26 -6.911 -19.917 14.436 1.00 53.22 H new ATOM 0 HG22 THR A 26 -6.922 -19.824 12.659 1.00 53.22 H new ATOM 0 HG23 THR A 26 -5.409 -19.549 13.555 1.00 53.22 H new ATOM 405 N ASP A 27 -8.049 -15.664 11.915 1.00 21.43 N ATOM 406 CA ASP A 27 -8.738 -14.380 11.773 1.00 41.34 C ATOM 407 C ASP A 27 -8.862 -13.680 13.114 1.00 73.21 C ATOM 408 O ASP A 27 -8.711 -12.461 13.202 1.00 43.41 O ATOM 409 CB ASP A 27 -10.143 -14.576 11.196 1.00 65.33 C ATOM 410 CG ASP A 27 -10.181 -15.477 9.984 1.00 14.43 C ATOM 411 OD1 ASP A 27 -10.045 -16.709 10.149 1.00 11.50 O ATOM 412 OD2 ASP A 27 -10.379 -14.968 8.870 1.00 20.25 O ATOM 0 H ASP A 27 -8.608 -16.467 11.628 1.00 21.43 H new ATOM 0 HA ASP A 27 -8.144 -13.769 11.094 1.00 41.34 H new ATOM 0 HB2 ASP A 27 -10.789 -14.994 11.969 1.00 65.33 H new ATOM 0 HB3 ASP A 27 -10.555 -13.603 10.928 1.00 65.33 H new ATOM 417 N GLU A 28 -9.127 -14.465 14.152 1.00 53.12 N ATOM 418 CA GLU A 28 -9.325 -13.934 15.497 1.00 32.23 C ATOM 419 C GLU A 28 -8.046 -13.305 16.051 1.00 12.44 C ATOM 420 O GLU A 28 -8.092 -12.251 16.682 1.00 3.50 O ATOM 421 CB GLU A 28 -9.825 -15.038 16.434 1.00 74.22 C ATOM 422 CG GLU A 28 -8.953 -16.281 16.435 1.00 61.44 C ATOM 423 CD GLU A 28 -9.330 -17.258 17.523 1.00 63.41 C ATOM 424 OE1 GLU A 28 -8.986 -17.006 18.694 1.00 30.40 O ATOM 425 OE2 GLU A 28 -9.971 -18.276 17.212 1.00 3.12 O ATOM 0 H GLU A 28 -9.210 -15.480 14.087 1.00 53.12 H new ATOM 0 HA GLU A 28 -10.078 -13.149 15.436 1.00 32.23 H new ATOM 0 HB2 GLU A 28 -9.880 -14.643 17.449 1.00 74.22 H new ATOM 0 HB3 GLU A 28 -10.838 -15.316 16.144 1.00 74.22 H new ATOM 0 HG2 GLU A 28 -9.031 -16.775 15.466 1.00 61.44 H new ATOM 0 HG3 GLU A 28 -7.911 -15.988 16.561 1.00 61.44 H new ATOM 432 N SER A 29 -6.910 -13.937 15.783 1.00 62.32 N ATOM 433 CA SER A 29 -5.633 -13.451 16.277 1.00 40.11 C ATOM 434 C SER A 29 -5.168 -12.246 15.471 1.00 65.32 C ATOM 435 O SER A 29 -4.659 -11.277 16.034 1.00 4.33 O ATOM 436 CB SER A 29 -4.589 -14.563 16.228 1.00 40.35 C ATOM 437 OG SER A 29 -4.998 -15.676 17.009 1.00 40.23 O ATOM 0 H SER A 29 -6.850 -14.789 15.225 1.00 62.32 H new ATOM 0 HA SER A 29 -5.760 -13.139 17.314 1.00 40.11 H new ATOM 0 HB2 SER A 29 -4.433 -14.876 15.196 1.00 40.35 H new ATOM 0 HB3 SER A 29 -3.634 -14.187 16.595 1.00 40.35 H new ATOM 0 HG SER A 29 -5.428 -16.341 16.431 1.00 40.23 H new ATOM 443 N LEU A 30 -5.380 -12.304 14.158 1.00 35.53 N ATOM 444 CA LEU A 30 -5.001 -11.215 13.267 1.00 3.15 C ATOM 445 C LEU A 30 -5.783 -9.956 13.621 1.00 42.31 C ATOM 446 O LEU A 30 -5.207 -8.872 13.747 1.00 63.32 O ATOM 447 CB LEU A 30 -5.243 -11.607 11.803 1.00 51.34 C ATOM 448 CG LEU A 30 -4.702 -10.622 10.759 1.00 71.11 C ATOM 449 CD1 LEU A 30 -3.198 -10.473 10.890 1.00 51.33 C ATOM 450 CD2 LEU A 30 -5.059 -11.071 9.350 1.00 53.23 C ATOM 0 H LEU A 30 -5.814 -13.098 13.688 1.00 35.53 H new ATOM 0 HA LEU A 30 -3.937 -11.013 13.393 1.00 3.15 H new ATOM 0 HB2 LEU A 30 -4.790 -12.582 11.626 1.00 51.34 H new ATOM 0 HB3 LEU A 30 -6.316 -11.721 11.648 1.00 51.34 H new ATOM 0 HG LEU A 30 -5.168 -9.654 10.943 1.00 71.11 H new ATOM 0 HD11 LEU A 30 -2.835 -9.770 10.140 1.00 51.33 H new ATOM 0 HD12 LEU A 30 -2.955 -10.100 11.885 1.00 51.33 H new ATOM 0 HD13 LEU A 30 -2.722 -11.442 10.739 1.00 51.33 H new ATOM 0 HD21 LEU A 30 -4.664 -10.355 8.629 1.00 53.23 H new ATOM 0 HD22 LEU A 30 -4.626 -12.053 9.161 1.00 53.23 H new ATOM 0 HD23 LEU A 30 -6.143 -11.126 9.249 1.00 53.23 H new ATOM 462 N ARG A 31 -7.097 -10.110 13.790 1.00 11.23 N ATOM 463 CA ARG A 31 -7.946 -9.021 14.252 1.00 32.33 C ATOM 464 C ARG A 31 -7.478 -8.486 15.598 1.00 31.02 C ATOM 465 O ARG A 31 -7.122 -7.322 15.703 1.00 71.52 O ATOM 466 CB ARG A 31 -9.404 -9.472 14.371 1.00 50.22 C ATOM 467 CG ARG A 31 -10.332 -8.386 14.896 1.00 53.25 C ATOM 468 CD ARG A 31 -11.720 -8.927 15.196 1.00 13.12 C ATOM 469 NE ARG A 31 -12.377 -9.462 14.001 1.00 22.43 N ATOM 470 CZ ARG A 31 -13.520 -8.993 13.496 1.00 72.41 C ATOM 471 NH1 ARG A 31 -14.144 -7.970 14.076 1.00 1.54 N ATOM 472 NH2 ARG A 31 -14.038 -9.553 12.410 1.00 52.33 N ATOM 0 H ARG A 31 -7.594 -10.983 13.612 1.00 11.23 H new ATOM 0 HA ARG A 31 -7.875 -8.226 13.510 1.00 32.33 H new ATOM 0 HB2 ARG A 31 -9.756 -9.799 13.393 1.00 50.22 H new ATOM 0 HB3 ARG A 31 -9.456 -10.336 15.034 1.00 50.22 H new ATOM 0 HG2 ARG A 31 -9.908 -7.951 15.801 1.00 53.25 H new ATOM 0 HG3 ARG A 31 -10.405 -7.584 14.161 1.00 53.25 H new ATOM 0 HD2 ARG A 31 -11.647 -9.711 15.950 1.00 13.12 H new ATOM 0 HD3 ARG A 31 -12.334 -8.132 15.621 1.00 13.12 H new ATOM 0 HE ARG A 31 -11.931 -10.245 13.523 1.00 22.43 H new ATOM 0 HH11 ARG A 31 -13.749 -7.539 14.912 1.00 1.54 H new ATOM 0 HH12 ARG A 31 -15.017 -7.617 13.684 1.00 1.54 H new ATOM 0 HH21 ARG A 31 -13.563 -10.338 11.965 1.00 52.33 H new ATOM 0 HH22 ARG A 31 -14.911 -9.198 12.020 1.00 52.33 H new ATOM 486 N SER A 32 -7.467 -9.352 16.608 1.00 55.54 N ATOM 487 CA SER A 32 -7.134 -8.960 17.978 1.00 30.45 C ATOM 488 C SER A 32 -5.810 -8.201 18.058 1.00 42.33 C ATOM 489 O SER A 32 -5.681 -7.254 18.835 1.00 44.20 O ATOM 490 CB SER A 32 -7.075 -10.200 18.871 1.00 75.20 C ATOM 491 OG SER A 32 -7.018 -9.848 20.245 1.00 44.10 O ATOM 0 H SER A 32 -7.688 -10.342 16.502 1.00 55.54 H new ATOM 0 HA SER A 32 -7.918 -8.287 18.325 1.00 30.45 H new ATOM 0 HB2 SER A 32 -7.951 -10.823 18.690 1.00 75.20 H new ATOM 0 HB3 SER A 32 -6.201 -10.796 18.610 1.00 75.20 H new ATOM 0 HG SER A 32 -6.983 -10.662 20.790 1.00 44.10 H new ATOM 497 N HIS A 33 -4.848 -8.597 17.239 1.00 74.44 N ATOM 498 CA HIS A 33 -3.541 -7.966 17.256 1.00 44.15 C ATOM 499 C HIS A 33 -3.608 -6.558 16.669 1.00 64.30 C ATOM 500 O HIS A 33 -3.270 -5.593 17.340 1.00 53.53 O ATOM 501 CB HIS A 33 -2.519 -8.808 16.499 1.00 72.22 C ATOM 502 CG HIS A 33 -1.110 -8.484 16.875 1.00 74.13 C ATOM 503 ND1 HIS A 33 -0.254 -7.870 15.998 1.00 50.30 N ATOM 504 CD2 HIS A 33 -0.468 -8.689 18.050 1.00 51.24 C ATOM 505 CE1 HIS A 33 0.880 -7.714 16.653 1.00 24.14 C ATOM 506 NE2 HIS A 33 0.798 -8.193 17.901 1.00 35.14 N ATOM 0 H HIS A 33 -4.948 -9.349 16.558 1.00 74.44 H new ATOM 0 HA HIS A 33 -3.222 -7.891 18.295 1.00 44.15 H new ATOM 0 HB2 HIS A 33 -2.709 -9.864 16.694 1.00 72.22 H new ATOM 0 HB3 HIS A 33 -2.649 -8.653 15.428 1.00 72.22 H new ATOM 0 HD2 HIS A 33 -0.877 -9.155 18.934 1.00 51.24 H new ATOM 0 HE1 HIS A 33 1.765 -7.257 16.235 1.00 24.14 H new ATOM 0 HE2 HIS A 33 1.537 -8.189 18.604 1.00 35.14 H new ATOM 514 N PHE A 34 -4.079 -6.434 15.437 1.00 23.03 N ATOM 515 CA PHE A 34 -4.127 -5.133 14.769 1.00 10.02 C ATOM 516 C PHE A 34 -5.154 -4.198 15.415 1.00 13.35 C ATOM 517 O PHE A 34 -5.025 -2.974 15.345 1.00 63.14 O ATOM 518 CB PHE A 34 -4.425 -5.315 13.279 1.00 44.54 C ATOM 519 CG PHE A 34 -3.211 -5.684 12.467 1.00 50.23 C ATOM 520 CD1 PHE A 34 -2.748 -6.990 12.436 1.00 50.20 C ATOM 521 CD2 PHE A 34 -2.533 -4.720 11.738 1.00 20.35 C ATOM 522 CE1 PHE A 34 -1.632 -7.328 11.691 1.00 24.11 C ATOM 523 CE2 PHE A 34 -1.418 -5.051 10.992 1.00 53.23 C ATOM 524 CZ PHE A 34 -0.966 -6.357 10.969 1.00 10.33 C ATOM 0 H PHE A 34 -4.433 -7.211 14.879 1.00 23.03 H new ATOM 0 HA PHE A 34 -3.149 -4.666 14.881 1.00 10.02 H new ATOM 0 HB2 PHE A 34 -5.182 -6.090 13.159 1.00 44.54 H new ATOM 0 HB3 PHE A 34 -4.849 -4.391 12.885 1.00 44.54 H new ATOM 0 HD1 PHE A 34 -3.264 -7.753 13.000 1.00 50.20 H new ATOM 0 HD2 PHE A 34 -2.880 -3.697 11.753 1.00 20.35 H new ATOM 0 HE1 PHE A 34 -1.282 -8.350 11.674 1.00 24.11 H new ATOM 0 HE2 PHE A 34 -0.900 -4.290 10.427 1.00 53.23 H new ATOM 0 HZ PHE A 34 -0.094 -6.618 10.388 1.00 10.33 H new ATOM 534 N GLU A 35 -6.157 -4.780 16.061 1.00 70.34 N ATOM 535 CA GLU A 35 -7.206 -4.014 16.731 1.00 33.34 C ATOM 536 C GLU A 35 -6.660 -3.193 17.908 1.00 60.40 C ATOM 537 O GLU A 35 -7.329 -2.287 18.401 1.00 70.33 O ATOM 538 CB GLU A 35 -8.313 -4.955 17.213 1.00 41.33 C ATOM 539 CG GLU A 35 -9.591 -4.242 17.613 1.00 13.45 C ATOM 540 CD GLU A 35 -10.753 -5.184 17.821 1.00 35.54 C ATOM 541 OE1 GLU A 35 -11.405 -5.556 16.828 1.00 14.21 O ATOM 542 OE2 GLU A 35 -11.035 -5.535 18.984 1.00 43.14 O ATOM 0 H GLU A 35 -6.268 -5.791 16.136 1.00 70.34 H new ATOM 0 HA GLU A 35 -7.614 -3.310 16.005 1.00 33.34 H new ATOM 0 HB2 GLU A 35 -8.539 -5.670 16.422 1.00 41.33 H new ATOM 0 HB3 GLU A 35 -7.945 -5.527 18.065 1.00 41.33 H new ATOM 0 HG2 GLU A 35 -9.416 -3.682 18.532 1.00 13.45 H new ATOM 0 HG3 GLU A 35 -9.852 -3.517 16.842 1.00 13.45 H new ATOM 549 N GLN A 36 -5.444 -3.506 18.353 1.00 11.22 N ATOM 550 CA GLN A 36 -4.805 -2.757 19.439 1.00 11.03 C ATOM 551 C GLN A 36 -4.578 -1.298 19.044 1.00 42.00 C ATOM 552 O GLN A 36 -4.597 -0.405 19.891 1.00 25.35 O ATOM 553 CB GLN A 36 -3.458 -3.381 19.820 1.00 4.12 C ATOM 554 CG GLN A 36 -3.543 -4.824 20.291 1.00 62.34 C ATOM 555 CD GLN A 36 -2.174 -5.419 20.564 1.00 60.52 C ATOM 556 OE1 GLN A 36 -1.693 -5.411 21.697 1.00 73.53 O ATOM 557 NE2 GLN A 36 -1.525 -5.912 19.521 1.00 35.31 N ATOM 0 H GLN A 36 -4.881 -4.271 17.981 1.00 11.22 H new ATOM 0 HA GLN A 36 -5.479 -2.799 20.295 1.00 11.03 H new ATOM 0 HB2 GLN A 36 -2.792 -3.332 18.958 1.00 4.12 H new ATOM 0 HB3 GLN A 36 -3.004 -2.781 20.608 1.00 4.12 H new ATOM 0 HG2 GLN A 36 -4.146 -4.874 21.197 1.00 62.34 H new ATOM 0 HG3 GLN A 36 -4.053 -5.422 19.536 1.00 62.34 H new ATOM 0 HE21 GLN A 36 -1.959 -5.900 18.598 1.00 35.31 H new ATOM 0 HE22 GLN A 36 -0.591 -6.304 19.640 1.00 35.31 H new ATOM 566 N TRP A 37 -4.387 -1.064 17.753 1.00 10.20 N ATOM 567 CA TRP A 37 -4.049 0.264 17.263 1.00 14.33 C ATOM 568 C TRP A 37 -5.276 0.996 16.742 1.00 71.14 C ATOM 569 O TRP A 37 -5.291 2.227 16.677 1.00 31.43 O ATOM 570 CB TRP A 37 -2.972 0.167 16.183 1.00 74.52 C ATOM 571 CG TRP A 37 -1.646 -0.248 16.740 1.00 43.41 C ATOM 572 CD1 TRP A 37 -0.701 0.570 17.282 1.00 3.22 C ATOM 573 CD2 TRP A 37 -1.120 -1.579 16.823 1.00 51.03 C ATOM 574 NE1 TRP A 37 0.377 -0.168 17.705 1.00 10.13 N ATOM 575 CE2 TRP A 37 0.146 -1.488 17.429 1.00 54.03 C ATOM 576 CE3 TRP A 37 -1.596 -2.834 16.444 1.00 15.43 C ATOM 577 CZ2 TRP A 37 0.939 -2.605 17.667 1.00 73.44 C ATOM 578 CZ3 TRP A 37 -0.806 -3.943 16.679 1.00 72.11 C ATOM 579 CH2 TRP A 37 0.450 -3.823 17.284 1.00 41.43 C ATOM 0 H TRP A 37 -4.460 -1.776 17.027 1.00 10.20 H new ATOM 0 HA TRP A 37 -3.657 0.844 18.098 1.00 14.33 H new ATOM 0 HB2 TRP A 37 -3.285 -0.550 15.424 1.00 74.52 H new ATOM 0 HB3 TRP A 37 -2.870 1.132 15.687 1.00 74.52 H new ATOM 0 HD1 TRP A 37 -0.787 1.643 17.367 1.00 3.22 H new ATOM 0 HE1 TRP A 37 1.214 0.207 18.152 1.00 10.13 H new ATOM 0 HE3 TRP A 37 -2.564 -2.937 15.976 1.00 15.43 H new ATOM 0 HZ2 TRP A 37 1.907 -2.514 18.138 1.00 73.44 H new ATOM 0 HZ3 TRP A 37 -1.164 -4.920 16.391 1.00 72.11 H new ATOM 0 HH2 TRP A 37 1.044 -4.709 17.452 1.00 41.43 H new ATOM 590 N GLY A 38 -6.303 0.245 16.378 1.00 73.40 N ATOM 591 CA GLY A 38 -7.531 0.857 15.925 1.00 64.32 C ATOM 592 C GLY A 38 -8.661 -0.141 15.827 1.00 14.11 C ATOM 593 O GLY A 38 -8.428 -1.346 15.746 1.00 14.12 O ATOM 0 H GLY A 38 -6.307 -0.775 16.388 1.00 73.40 H new ATOM 0 HA2 GLY A 38 -7.812 1.656 16.611 1.00 64.32 H new ATOM 0 HA3 GLY A 38 -7.368 1.317 14.950 1.00 64.32 H new ATOM 597 N THR A 39 -9.882 0.367 15.839 1.00 63.23 N ATOM 598 CA THR A 39 -11.071 -0.464 15.786 1.00 73.22 C ATOM 599 C THR A 39 -11.178 -1.223 14.471 1.00 12.34 C ATOM 600 O THR A 39 -11.252 -0.627 13.400 1.00 73.31 O ATOM 601 CB THR A 39 -12.332 0.387 15.973 1.00 73.33 C ATOM 602 OG1 THR A 39 -12.208 1.176 17.160 1.00 34.11 O ATOM 603 CG2 THR A 39 -13.567 -0.492 16.062 1.00 5.10 C ATOM 0 H THR A 39 -10.076 1.367 15.886 1.00 63.23 H new ATOM 0 HA THR A 39 -10.986 -1.187 16.597 1.00 73.22 H new ATOM 0 HB THR A 39 -12.440 1.043 15.110 1.00 73.33 H new ATOM 0 HG1 THR A 39 -13.014 1.720 17.277 1.00 34.11 H new ATOM 0 HG21 THR A 39 -14.450 0.133 16.195 1.00 5.10 H new ATOM 0 HG22 THR A 39 -13.668 -1.072 15.145 1.00 5.10 H new ATOM 0 HG23 THR A 39 -13.471 -1.169 16.911 1.00 5.10 H new ATOM 611 N LEU A 40 -11.162 -2.540 14.564 1.00 53.21 N ATOM 612 CA LEU A 40 -11.369 -3.382 13.401 1.00 11.34 C ATOM 613 C LEU A 40 -12.835 -3.736 13.248 1.00 42.45 C ATOM 614 O LEU A 40 -13.510 -4.105 14.209 1.00 5.34 O ATOM 615 CB LEU A 40 -10.526 -4.654 13.472 1.00 2.12 C ATOM 616 CG LEU A 40 -9.017 -4.445 13.360 1.00 1.11 C ATOM 617 CD1 LEU A 40 -8.309 -5.773 13.237 1.00 40.34 C ATOM 618 CD2 LEU A 40 -8.668 -3.572 12.175 1.00 32.52 C ATOM 0 H LEU A 40 -11.008 -3.050 15.434 1.00 53.21 H new ATOM 0 HA LEU A 40 -11.050 -2.814 12.527 1.00 11.34 H new ATOM 0 HB2 LEU A 40 -10.737 -5.158 14.415 1.00 2.12 H new ATOM 0 HB3 LEU A 40 -10.843 -5.325 12.674 1.00 2.12 H new ATOM 0 HG LEU A 40 -8.686 -3.941 14.268 1.00 1.11 H new ATOM 0 HD11 LEU A 40 -7.235 -5.607 13.158 1.00 40.34 H new ATOM 0 HD12 LEU A 40 -8.518 -6.380 14.118 1.00 40.34 H new ATOM 0 HD13 LEU A 40 -8.662 -6.292 12.346 1.00 40.34 H new ATOM 0 HD21 LEU A 40 -7.587 -3.443 12.124 1.00 32.52 H new ATOM 0 HD22 LEU A 40 -9.021 -4.045 11.258 1.00 32.52 H new ATOM 0 HD23 LEU A 40 -9.145 -2.598 12.288 1.00 32.52 H new ATOM 630 N THR A 41 -13.313 -3.611 12.028 1.00 24.51 N ATOM 631 CA THR A 41 -14.691 -3.923 11.704 1.00 61.52 C ATOM 632 C THR A 41 -14.764 -5.219 10.897 1.00 54.41 C ATOM 633 O THR A 41 -15.814 -5.859 10.819 1.00 55.50 O ATOM 634 CB THR A 41 -15.369 -2.753 10.941 1.00 65.31 C ATOM 635 OG1 THR A 41 -16.631 -3.161 10.400 1.00 1.04 O ATOM 636 CG2 THR A 41 -14.481 -2.211 9.831 1.00 53.23 C ATOM 0 H THR A 41 -12.759 -3.291 11.233 1.00 24.51 H new ATOM 0 HA THR A 41 -15.237 -4.065 12.637 1.00 61.52 H new ATOM 0 HB THR A 41 -15.532 -1.953 11.663 1.00 65.31 H new ATOM 0 HG1 THR A 41 -17.042 -2.409 9.925 1.00 1.04 H new ATOM 0 HG21 THR A 41 -14.992 -1.394 9.322 1.00 53.23 H new ATOM 0 HG22 THR A 41 -13.547 -1.845 10.258 1.00 53.23 H new ATOM 0 HG23 THR A 41 -14.266 -3.006 9.116 1.00 53.23 H new ATOM 644 N ASP A 42 -13.640 -5.598 10.303 1.00 23.25 N ATOM 645 CA ASP A 42 -13.547 -6.837 9.540 1.00 60.11 C ATOM 646 C ASP A 42 -12.127 -7.363 9.582 1.00 75.14 C ATOM 647 O ASP A 42 -11.187 -6.593 9.756 1.00 64.15 O ATOM 648 CB ASP A 42 -13.940 -6.594 8.084 1.00 73.34 C ATOM 649 CG ASP A 42 -13.995 -7.861 7.256 1.00 31.43 C ATOM 650 OD1 ASP A 42 -14.930 -8.664 7.446 1.00 12.21 O ATOM 651 OD2 ASP A 42 -13.106 -8.052 6.403 1.00 73.41 O ATOM 0 H ASP A 42 -12.774 -5.061 10.335 1.00 23.25 H new ATOM 0 HA ASP A 42 -14.226 -7.566 9.983 1.00 60.11 H new ATOM 0 HB2 ASP A 42 -14.915 -6.107 8.055 1.00 73.34 H new ATOM 0 HB3 ASP A 42 -13.226 -5.905 7.633 1.00 73.34 H new ATOM 656 N CYS A 43 -11.982 -8.667 9.455 1.00 64.51 N ATOM 657 CA CYS A 43 -10.681 -9.298 9.327 1.00 52.34 C ATOM 658 C CYS A 43 -10.852 -10.708 8.787 1.00 74.30 C ATOM 659 O CYS A 43 -11.630 -11.494 9.334 1.00 31.41 O ATOM 660 CB CYS A 43 -9.969 -9.335 10.685 1.00 15.11 C ATOM 661 SG CYS A 43 -8.548 -10.448 10.753 1.00 73.42 S ATOM 0 H CYS A 43 -12.764 -9.321 9.437 1.00 64.51 H new ATOM 0 HA CYS A 43 -10.071 -8.718 8.634 1.00 52.34 H new ATOM 0 HB2 CYS A 43 -9.638 -8.327 10.935 1.00 15.11 H new ATOM 0 HB3 CYS A 43 -10.686 -9.634 11.449 1.00 15.11 H new ATOM 0 HG CYS A 43 -8.669 -11.244 11.773 1.00 73.42 H new ATOM 667 N VAL A 44 -10.139 -11.031 7.719 1.00 61.31 N ATOM 668 CA VAL A 44 -10.208 -12.361 7.155 1.00 52.24 C ATOM 669 C VAL A 44 -8.836 -12.810 6.670 1.00 3.22 C ATOM 670 O VAL A 44 -8.174 -12.127 5.886 1.00 35.42 O ATOM 671 CB VAL A 44 -11.263 -12.465 6.016 1.00 13.31 C ATOM 672 CG1 VAL A 44 -11.037 -11.415 4.941 1.00 51.23 C ATOM 673 CG2 VAL A 44 -11.268 -13.862 5.404 1.00 42.31 C ATOM 0 H VAL A 44 -9.511 -10.392 7.231 1.00 61.31 H new ATOM 0 HA VAL A 44 -10.534 -13.032 7.950 1.00 52.24 H new ATOM 0 HB VAL A 44 -12.239 -12.277 6.463 1.00 13.31 H new ATOM 0 HG11 VAL A 44 -11.794 -11.521 4.164 1.00 51.23 H new ATOM 0 HG12 VAL A 44 -11.107 -10.421 5.383 1.00 51.23 H new ATOM 0 HG13 VAL A 44 -10.047 -11.549 4.504 1.00 51.23 H new ATOM 0 HG21 VAL A 44 -12.014 -13.909 4.610 1.00 42.31 H new ATOM 0 HG22 VAL A 44 -10.284 -14.082 4.990 1.00 42.31 H new ATOM 0 HG23 VAL A 44 -11.510 -14.595 6.173 1.00 42.31 H new ATOM 683 N VAL A 45 -8.395 -13.939 7.188 1.00 23.32 N ATOM 684 CA VAL A 45 -7.163 -14.551 6.741 1.00 75.04 C ATOM 685 C VAL A 45 -7.468 -15.426 5.542 1.00 11.13 C ATOM 686 O VAL A 45 -8.414 -16.208 5.569 1.00 42.04 O ATOM 687 CB VAL A 45 -6.503 -15.404 7.852 1.00 13.43 C ATOM 688 CG1 VAL A 45 -5.227 -16.075 7.353 1.00 75.31 C ATOM 689 CG2 VAL A 45 -6.203 -14.548 9.066 1.00 24.22 C ATOM 0 H VAL A 45 -8.877 -14.454 7.925 1.00 23.32 H new ATOM 0 HA VAL A 45 -6.460 -13.760 6.477 1.00 75.04 H new ATOM 0 HB VAL A 45 -7.207 -16.187 8.134 1.00 13.43 H new ATOM 0 HG11 VAL A 45 -4.788 -16.666 8.157 1.00 75.31 H new ATOM 0 HG12 VAL A 45 -5.463 -16.726 6.511 1.00 75.31 H new ATOM 0 HG13 VAL A 45 -4.516 -15.313 7.034 1.00 75.31 H new ATOM 0 HG21 VAL A 45 -5.739 -15.162 9.838 1.00 24.22 H new ATOM 0 HG22 VAL A 45 -5.523 -13.744 8.785 1.00 24.22 H new ATOM 0 HG23 VAL A 45 -7.130 -14.122 9.449 1.00 24.22 H new ATOM 699 N MET A 46 -6.698 -15.269 4.481 1.00 70.34 N ATOM 700 CA MET A 46 -6.869 -16.105 3.313 1.00 25.23 C ATOM 701 C MET A 46 -6.373 -17.501 3.630 1.00 5.31 C ATOM 702 O MET A 46 -5.310 -17.667 4.230 1.00 15.31 O ATOM 703 CB MET A 46 -6.130 -15.523 2.112 1.00 54.44 C ATOM 704 CG MET A 46 -6.656 -14.166 1.672 1.00 43.31 C ATOM 705 SD MET A 46 -8.019 -14.274 0.486 1.00 3.53 S ATOM 706 CE MET A 46 -9.417 -14.619 1.552 1.00 53.41 C ATOM 0 H MET A 46 -5.954 -14.575 4.406 1.00 70.34 H new ATOM 0 HA MET A 46 -7.926 -16.148 3.052 1.00 25.23 H new ATOM 0 HB2 MET A 46 -5.072 -15.431 2.357 1.00 54.44 H new ATOM 0 HB3 MET A 46 -6.205 -16.220 1.277 1.00 54.44 H new ATOM 0 HG2 MET A 46 -6.990 -13.612 2.549 1.00 43.31 H new ATOM 0 HG3 MET A 46 -5.841 -13.596 1.227 1.00 43.31 H new ATOM 0 HE1 MET A 46 -10.280 -14.043 1.218 1.00 53.41 H new ATOM 0 HE2 MET A 46 -9.652 -15.682 1.511 1.00 53.41 H new ATOM 0 HE3 MET A 46 -9.170 -14.342 2.577 1.00 53.41 H new ATOM 716 N ARG A 47 -7.144 -18.491 3.226 1.00 51.53 N ATOM 717 CA ARG A 47 -6.891 -19.859 3.631 1.00 2.20 C ATOM 718 C ARG A 47 -7.009 -20.817 2.459 1.00 74.44 C ATOM 719 O ARG A 47 -7.664 -20.524 1.457 1.00 22.31 O ATOM 720 CB ARG A 47 -7.874 -20.282 4.723 1.00 33.41 C ATOM 721 CG ARG A 47 -7.803 -19.427 5.973 1.00 53.13 C ATOM 722 CD ARG A 47 -9.144 -19.362 6.674 1.00 34.51 C ATOM 723 NE ARG A 47 -10.205 -18.847 5.804 1.00 25.12 N ATOM 724 CZ ARG A 47 -11.144 -17.983 6.191 1.00 52.44 C ATOM 725 NH1 ARG A 47 -11.163 -17.516 7.434 1.00 15.41 N ATOM 726 NH2 ARG A 47 -12.070 -17.587 5.327 1.00 3.03 N ATOM 0 H ARG A 47 -7.953 -18.373 2.616 1.00 51.53 H new ATOM 0 HA ARG A 47 -5.872 -19.901 4.015 1.00 2.20 H new ATOM 0 HB2 ARG A 47 -8.887 -20.241 4.323 1.00 33.41 H new ATOM 0 HB3 ARG A 47 -7.679 -21.320 4.992 1.00 33.41 H new ATOM 0 HG2 ARG A 47 -7.055 -19.835 6.653 1.00 53.13 H new ATOM 0 HG3 ARG A 47 -7.479 -18.420 5.709 1.00 53.13 H new ATOM 0 HD2 ARG A 47 -9.416 -20.358 7.024 1.00 34.51 H new ATOM 0 HD3 ARG A 47 -9.060 -18.726 7.555 1.00 34.51 H new ATOM 0 HE ARG A 47 -10.227 -19.171 4.837 1.00 25.12 H new ATOM 0 HH11 ARG A 47 -10.455 -17.818 8.103 1.00 15.41 H new ATOM 0 HH12 ARG A 47 -11.886 -16.855 7.720 1.00 15.41 H new ATOM 0 HH21 ARG A 47 -12.062 -17.943 4.371 1.00 3.03 H new ATOM 0 HH22 ARG A 47 -12.790 -16.926 5.619 1.00 3.03 H new ATOM 740 N ASP A 48 -6.349 -21.950 2.601 1.00 14.45 N ATOM 741 CA ASP A 48 -6.438 -23.037 1.645 1.00 71.41 C ATOM 742 C ASP A 48 -7.852 -23.614 1.666 1.00 0.32 C ATOM 743 O ASP A 48 -8.390 -23.874 2.732 1.00 21.53 O ATOM 744 CB ASP A 48 -5.429 -24.125 2.029 1.00 72.23 C ATOM 745 CG ASP A 48 -5.283 -25.191 0.967 1.00 13.21 C ATOM 746 OD1 ASP A 48 -6.142 -26.084 0.891 1.00 14.51 O ATOM 747 OD2 ASP A 48 -4.298 -25.148 0.205 1.00 45.14 O ATOM 0 H ASP A 48 -5.731 -22.144 3.389 1.00 14.45 H new ATOM 0 HA ASP A 48 -6.214 -22.670 0.643 1.00 71.41 H new ATOM 0 HB2 ASP A 48 -4.458 -23.665 2.211 1.00 72.23 H new ATOM 0 HB3 ASP A 48 -5.742 -24.590 2.964 1.00 72.23 H new ATOM 752 N PRO A 49 -8.484 -23.819 0.506 1.00 33.12 N ATOM 753 CA PRO A 49 -9.854 -24.348 0.451 1.00 10.41 C ATOM 754 C PRO A 49 -9.976 -25.808 0.916 1.00 65.41 C ATOM 755 O PRO A 49 -11.068 -26.266 1.251 1.00 70.35 O ATOM 756 CB PRO A 49 -10.224 -24.227 -1.029 1.00 34.23 C ATOM 757 CG PRO A 49 -8.928 -24.168 -1.762 1.00 74.32 C ATOM 758 CD PRO A 49 -7.943 -23.520 -0.831 1.00 44.13 C ATOM 0 HA PRO A 49 -10.511 -23.799 1.125 1.00 10.41 H new ATOM 0 HB2 PRO A 49 -10.820 -25.079 -1.355 1.00 34.23 H new ATOM 0 HB3 PRO A 49 -10.819 -23.333 -1.212 1.00 34.23 H new ATOM 0 HG2 PRO A 49 -8.596 -25.167 -2.045 1.00 74.32 H new ATOM 0 HG3 PRO A 49 -9.028 -23.593 -2.683 1.00 74.32 H new ATOM 0 HD2 PRO A 49 -6.941 -23.929 -0.959 1.00 44.13 H new ATOM 0 HD3 PRO A 49 -7.873 -22.446 -1.005 1.00 44.13 H new ATOM 766 N ASN A 50 -8.866 -26.536 0.938 1.00 54.04 N ATOM 767 CA ASN A 50 -8.890 -27.958 1.280 1.00 42.21 C ATOM 768 C ASN A 50 -8.822 -28.174 2.788 1.00 33.13 C ATOM 769 O ASN A 50 -9.720 -28.771 3.381 1.00 31.01 O ATOM 770 CB ASN A 50 -7.735 -28.698 0.605 1.00 43.43 C ATOM 771 CG ASN A 50 -7.790 -28.584 -0.900 1.00 34.12 C ATOM 772 OD1 ASN A 50 -8.304 -29.463 -1.591 1.00 4.24 O ATOM 773 ND2 ASN A 50 -7.266 -27.491 -1.417 1.00 35.30 N ATOM 0 H ASN A 50 -7.939 -26.169 0.724 1.00 54.04 H new ATOM 0 HA ASN A 50 -9.836 -28.359 0.917 1.00 42.21 H new ATOM 0 HB2 ASN A 50 -6.788 -28.296 0.964 1.00 43.43 H new ATOM 0 HB3 ASN A 50 -7.763 -29.750 0.890 1.00 43.43 H new ATOM 0 HD21 ASN A 50 -7.277 -27.349 -2.427 1.00 35.30 H new ATOM 0 HD22 ASN A 50 -6.850 -26.787 -0.807 1.00 35.30 H new ATOM 780 N THR A 51 -7.769 -27.647 3.407 1.00 51.50 N ATOM 781 CA THR A 51 -7.510 -27.884 4.827 1.00 25.13 C ATOM 782 C THR A 51 -7.844 -26.647 5.668 1.00 44.34 C ATOM 783 O THR A 51 -7.840 -26.695 6.900 1.00 12.24 O ATOM 784 CB THR A 51 -6.036 -28.296 5.035 1.00 2.24 C ATOM 785 OG1 THR A 51 -5.651 -29.212 4.001 1.00 34.21 O ATOM 786 CG2 THR A 51 -5.827 -28.964 6.386 1.00 41.34 C ATOM 0 H THR A 51 -7.079 -27.052 2.948 1.00 51.50 H new ATOM 0 HA THR A 51 -8.157 -28.696 5.159 1.00 25.13 H new ATOM 0 HB THR A 51 -5.426 -27.394 4.999 1.00 2.24 H new ATOM 0 HG1 THR A 51 -4.715 -29.475 4.128 1.00 34.21 H new ATOM 0 HG21 THR A 51 -4.778 -29.240 6.497 1.00 41.34 H new ATOM 0 HG22 THR A 51 -6.106 -28.272 7.181 1.00 41.34 H new ATOM 0 HG23 THR A 51 -6.446 -29.859 6.449 1.00 41.34 H new ATOM 794 N LYS A 52 -8.146 -25.546 4.977 1.00 13.41 N ATOM 795 CA LYS A 52 -8.545 -24.274 5.598 1.00 52.14 C ATOM 796 C LYS A 52 -7.420 -23.688 6.450 1.00 64.43 C ATOM 797 O LYS A 52 -7.667 -23.007 7.445 1.00 73.02 O ATOM 798 CB LYS A 52 -9.822 -24.427 6.441 1.00 33.44 C ATOM 799 CG LYS A 52 -10.943 -25.214 5.767 1.00 31.30 C ATOM 800 CD LYS A 52 -11.283 -24.689 4.381 1.00 21.11 C ATOM 801 CE LYS A 52 -12.573 -25.307 3.864 1.00 1.52 C ATOM 802 NZ LYS A 52 -12.453 -26.781 3.688 1.00 5.21 N ATOM 0 H LYS A 52 -8.121 -25.509 3.958 1.00 13.41 H new ATOM 0 HA LYS A 52 -8.756 -23.581 4.783 1.00 52.14 H new ATOM 0 HB2 LYS A 52 -9.565 -24.919 7.379 1.00 33.44 H new ATOM 0 HB3 LYS A 52 -10.195 -23.434 6.694 1.00 33.44 H new ATOM 0 HG2 LYS A 52 -10.651 -26.261 5.692 1.00 31.30 H new ATOM 0 HG3 LYS A 52 -11.834 -25.176 6.393 1.00 31.30 H new ATOM 0 HD2 LYS A 52 -11.383 -23.604 4.414 1.00 21.11 H new ATOM 0 HD3 LYS A 52 -10.467 -24.913 3.693 1.00 21.11 H new ATOM 0 HE2 LYS A 52 -13.384 -25.090 4.560 1.00 1.52 H new ATOM 0 HE3 LYS A 52 -12.839 -24.848 2.912 1.00 1.52 H new ATOM 0 HZ1 LYS A 52 -13.372 -27.172 3.399 1.00 5.21 H new ATOM 0 HZ2 LYS A 52 -11.744 -26.987 2.955 1.00 5.21 H new ATOM 0 HZ3 LYS A 52 -12.159 -27.215 4.586 1.00 5.21 H new ATOM 816 N ARG A 53 -6.180 -23.931 6.043 1.00 60.32 N ATOM 817 CA ARG A 53 -5.036 -23.374 6.752 1.00 52.22 C ATOM 818 C ARG A 53 -4.608 -22.098 6.061 1.00 11.52 C ATOM 819 O ARG A 53 -4.963 -21.881 4.909 1.00 13.11 O ATOM 820 CB ARG A 53 -3.871 -24.366 6.810 1.00 32.44 C ATOM 821 CG ARG A 53 -4.199 -25.688 7.495 1.00 62.10 C ATOM 822 CD ARG A 53 -5.016 -25.500 8.768 1.00 20.24 C ATOM 823 NE ARG A 53 -4.447 -24.493 9.666 1.00 74.34 N ATOM 824 CZ ARG A 53 -5.173 -23.768 10.520 1.00 61.54 C ATOM 825 NH1 ARG A 53 -6.489 -23.945 10.598 1.00 33.43 N ATOM 826 NH2 ARG A 53 -4.580 -22.868 11.294 1.00 71.51 N ATOM 0 H ARG A 53 -5.943 -24.504 5.234 1.00 60.32 H new ATOM 0 HA ARG A 53 -5.329 -23.162 7.780 1.00 52.22 H new ATOM 0 HB2 ARG A 53 -3.535 -24.572 5.794 1.00 32.44 H new ATOM 0 HB3 ARG A 53 -3.037 -23.898 7.333 1.00 32.44 H new ATOM 0 HG2 ARG A 53 -4.751 -26.324 6.804 1.00 62.10 H new ATOM 0 HG3 ARG A 53 -3.272 -26.208 7.736 1.00 62.10 H new ATOM 0 HD2 ARG A 53 -6.032 -25.210 8.502 1.00 20.24 H new ATOM 0 HD3 ARG A 53 -5.084 -26.452 9.294 1.00 20.24 H new ATOM 0 HE ARG A 53 -3.439 -24.337 9.637 1.00 74.34 H new ATOM 0 HH11 ARG A 53 -6.947 -24.637 10.004 1.00 33.43 H new ATOM 0 HH12 ARG A 53 -7.040 -23.389 11.252 1.00 33.43 H new ATOM 0 HH21 ARG A 53 -3.571 -22.731 11.236 1.00 71.51 H new ATOM 0 HH22 ARG A 53 -5.133 -22.313 11.947 1.00 71.51 H new ATOM 840 N SER A 54 -3.834 -21.268 6.740 1.00 51.43 N ATOM 841 CA SER A 54 -3.519 -19.939 6.241 1.00 2.41 C ATOM 842 C SER A 54 -2.680 -20.001 4.965 1.00 13.51 C ATOM 843 O SER A 54 -1.775 -20.825 4.845 1.00 73.04 O ATOM 844 CB SER A 54 -2.770 -19.174 7.328 1.00 21.40 C ATOM 845 OG SER A 54 -3.255 -19.538 8.612 1.00 64.21 O ATOM 0 H SER A 54 -3.411 -21.491 7.641 1.00 51.43 H new ATOM 0 HA SER A 54 -4.449 -19.427 5.992 1.00 2.41 H new ATOM 0 HB2 SER A 54 -1.703 -19.386 7.262 1.00 21.40 H new ATOM 0 HB3 SER A 54 -2.892 -18.101 7.177 1.00 21.40 H new ATOM 0 HG SER A 54 -3.666 -18.758 9.040 1.00 64.21 H new ATOM 851 N ARG A 55 -2.996 -19.117 4.021 1.00 3.31 N ATOM 852 CA ARG A 55 -2.259 -19.011 2.765 1.00 20.15 C ATOM 853 C ARG A 55 -1.058 -18.096 2.932 1.00 53.22 C ATOM 854 O ARG A 55 -0.324 -17.829 1.981 1.00 10.44 O ATOM 855 CB ARG A 55 -3.160 -18.460 1.662 1.00 3.54 C ATOM 856 CG ARG A 55 -4.071 -19.489 1.022 1.00 2.33 C ATOM 857 CD ARG A 55 -5.021 -18.827 0.041 1.00 41.13 C ATOM 858 NE ARG A 55 -5.644 -19.787 -0.866 1.00 44.52 N ATOM 859 CZ ARG A 55 -6.703 -19.520 -1.633 1.00 21.23 C ATOM 860 NH1 ARG A 55 -7.275 -18.318 -1.607 1.00 42.22 N ATOM 861 NH2 ARG A 55 -7.173 -20.452 -2.448 1.00 22.33 N ATOM 0 H ARG A 55 -3.768 -18.456 4.105 1.00 3.31 H new ATOM 0 HA ARG A 55 -1.918 -20.008 2.487 1.00 20.15 H new ATOM 0 HB2 ARG A 55 -3.772 -17.659 2.077 1.00 3.54 H new ATOM 0 HB3 ARG A 55 -2.535 -18.015 0.888 1.00 3.54 H new ATOM 0 HG2 ARG A 55 -3.473 -20.241 0.506 1.00 2.33 H new ATOM 0 HG3 ARG A 55 -4.640 -20.008 1.793 1.00 2.33 H new ATOM 0 HD2 ARG A 55 -5.797 -18.297 0.593 1.00 41.13 H new ATOM 0 HD3 ARG A 55 -4.478 -18.082 -0.540 1.00 41.13 H new ATOM 0 HE ARG A 55 -5.243 -20.724 -0.917 1.00 44.52 H new ATOM 0 HH11 ARG A 55 -6.904 -17.590 -0.996 1.00 42.22 H new ATOM 0 HH12 ARG A 55 -8.084 -18.125 -2.198 1.00 42.22 H new ATOM 0 HH21 ARG A 55 -6.726 -21.368 -2.487 1.00 22.33 H new ATOM 0 HH22 ARG A 55 -7.982 -20.254 -3.037 1.00 22.33 H new ATOM 875 N GLY A 56 -0.871 -17.613 4.148 1.00 54.11 N ATOM 876 CA GLY A 56 0.252 -16.744 4.435 1.00 33.25 C ATOM 877 C GLY A 56 -0.041 -15.282 4.171 1.00 42.32 C ATOM 878 O GLY A 56 0.883 -14.476 4.075 1.00 60.13 O ATOM 0 H GLY A 56 -1.478 -17.807 4.945 1.00 54.11 H new ATOM 0 HA2 GLY A 56 0.541 -16.867 5.479 1.00 33.25 H new ATOM 0 HA3 GLY A 56 1.105 -17.052 3.830 1.00 33.25 H new ATOM 882 N PHE A 57 -1.317 -14.933 4.040 1.00 23.50 N ATOM 883 CA PHE A 57 -1.721 -13.543 3.878 1.00 52.23 C ATOM 884 C PHE A 57 -3.203 -13.373 4.213 1.00 10.24 C ATOM 885 O PHE A 57 -3.964 -14.340 4.174 1.00 62.43 O ATOM 886 CB PHE A 57 -1.408 -13.032 2.459 1.00 44.41 C ATOM 887 CG PHE A 57 -2.090 -13.770 1.331 1.00 55.32 C ATOM 888 CD1 PHE A 57 -1.560 -14.949 0.826 1.00 54.05 C ATOM 889 CD2 PHE A 57 -3.239 -13.260 0.749 1.00 54.03 C ATOM 890 CE1 PHE A 57 -2.169 -15.606 -0.224 1.00 43.12 C ATOM 891 CE2 PHE A 57 -3.846 -13.909 -0.308 1.00 54.10 C ATOM 892 CZ PHE A 57 -3.310 -15.082 -0.795 1.00 15.13 C ATOM 0 H PHE A 57 -2.091 -15.598 4.043 1.00 23.50 H new ATOM 0 HA PHE A 57 -1.143 -12.938 4.577 1.00 52.23 H new ATOM 0 HB2 PHE A 57 -1.688 -11.980 2.402 1.00 44.41 H new ATOM 0 HB3 PHE A 57 -0.330 -13.084 2.304 1.00 44.41 H new ATOM 0 HD1 PHE A 57 -0.659 -15.358 1.260 1.00 54.05 H new ATOM 0 HD2 PHE A 57 -3.666 -12.343 1.127 1.00 54.03 H new ATOM 0 HE1 PHE A 57 -1.753 -16.530 -0.598 1.00 43.12 H new ATOM 0 HE2 PHE A 57 -4.740 -13.498 -0.753 1.00 54.10 H new ATOM 0 HZ PHE A 57 -3.783 -15.590 -1.623 1.00 15.13 H new ATOM 902 N GLY A 58 -3.594 -12.151 4.564 1.00 3.42 N ATOM 903 CA GLY A 58 -4.969 -11.873 4.945 1.00 21.32 C ATOM 904 C GLY A 58 -5.275 -10.388 4.881 1.00 73.30 C ATOM 905 O GLY A 58 -4.530 -9.637 4.258 1.00 75.52 O ATOM 0 H GLY A 58 -2.976 -11.340 4.591 1.00 3.42 H new ATOM 0 HA2 GLY A 58 -5.647 -12.414 4.285 1.00 21.32 H new ATOM 0 HA3 GLY A 58 -5.149 -12.239 5.956 1.00 21.32 H new ATOM 909 N PHE A 59 -6.374 -9.963 5.502 1.00 42.45 N ATOM 910 CA PHE A 59 -6.759 -8.550 5.509 1.00 34.32 C ATOM 911 C PHE A 59 -7.353 -8.158 6.855 1.00 61.22 C ATOM 912 O PHE A 59 -7.959 -8.984 7.538 1.00 73.21 O ATOM 913 CB PHE A 59 -7.808 -8.236 4.429 1.00 25.53 C ATOM 914 CG PHE A 59 -7.598 -8.914 3.107 1.00 70.11 C ATOM 915 CD1 PHE A 59 -8.124 -10.171 2.884 1.00 14.12 C ATOM 916 CD2 PHE A 59 -6.889 -8.298 2.088 1.00 15.42 C ATOM 917 CE1 PHE A 59 -7.950 -10.810 1.679 1.00 41.00 C ATOM 918 CE2 PHE A 59 -6.709 -8.932 0.872 1.00 44.25 C ATOM 919 CZ PHE A 59 -7.241 -10.192 0.668 1.00 64.12 C ATOM 0 H PHE A 59 -7.014 -10.576 6.007 1.00 42.45 H new ATOM 0 HA PHE A 59 -5.849 -7.984 5.310 1.00 34.32 H new ATOM 0 HB2 PHE A 59 -8.790 -8.516 4.809 1.00 25.53 H new ATOM 0 HB3 PHE A 59 -7.825 -7.158 4.266 1.00 25.53 H new ATOM 0 HD1 PHE A 59 -8.681 -10.660 3.669 1.00 14.12 H new ATOM 0 HD2 PHE A 59 -6.473 -7.314 2.245 1.00 15.42 H new ATOM 0 HE1 PHE A 59 -8.367 -11.794 1.523 1.00 41.00 H new ATOM 0 HE2 PHE A 59 -6.154 -8.444 0.084 1.00 44.25 H new ATOM 0 HZ PHE A 59 -7.102 -10.691 -0.280 1.00 64.12 H new ATOM 929 N VAL A 60 -7.187 -6.891 7.212 1.00 52.33 N ATOM 930 CA VAL A 60 -7.838 -6.319 8.389 1.00 50.22 C ATOM 931 C VAL A 60 -8.477 -4.978 8.029 1.00 13.53 C ATOM 932 O VAL A 60 -7.812 -4.079 7.522 1.00 1.35 O ATOM 933 CB VAL A 60 -6.866 -6.131 9.585 1.00 2.13 C ATOM 934 CG1 VAL A 60 -6.542 -7.462 10.240 1.00 54.40 C ATOM 935 CG2 VAL A 60 -5.581 -5.442 9.154 1.00 4.22 C ATOM 0 H VAL A 60 -6.601 -6.232 6.699 1.00 52.33 H new ATOM 0 HA VAL A 60 -8.602 -7.029 8.705 1.00 50.22 H new ATOM 0 HB VAL A 60 -7.371 -5.495 10.312 1.00 2.13 H new ATOM 0 HG11 VAL A 60 -5.859 -7.300 11.074 1.00 54.40 H new ATOM 0 HG12 VAL A 60 -7.461 -7.920 10.606 1.00 54.40 H new ATOM 0 HG13 VAL A 60 -6.073 -8.122 9.510 1.00 54.40 H new ATOM 0 HG21 VAL A 60 -4.924 -5.326 10.016 1.00 4.22 H new ATOM 0 HG22 VAL A 60 -5.082 -6.045 8.395 1.00 4.22 H new ATOM 0 HG23 VAL A 60 -5.815 -4.460 8.742 1.00 4.22 H new ATOM 945 N THR A 61 -9.773 -4.854 8.262 1.00 13.31 N ATOM 946 CA THR A 61 -10.490 -3.630 7.937 1.00 2.13 C ATOM 947 C THR A 61 -10.662 -2.767 9.174 1.00 32.53 C ATOM 948 O THR A 61 -11.268 -3.197 10.157 1.00 51.00 O ATOM 949 CB THR A 61 -11.880 -3.919 7.345 1.00 25.11 C ATOM 950 OG1 THR A 61 -11.795 -4.983 6.393 1.00 32.22 O ATOM 951 CG2 THR A 61 -12.456 -2.679 6.671 1.00 72.13 C ATOM 0 H THR A 61 -10.351 -5.586 8.675 1.00 13.31 H new ATOM 0 HA THR A 61 -9.892 -3.105 7.192 1.00 2.13 H new ATOM 0 HB THR A 61 -12.541 -4.210 8.162 1.00 25.11 H new ATOM 0 HG1 THR A 61 -12.533 -4.908 5.752 1.00 32.22 H new ATOM 0 HG21 THR A 61 -13.439 -2.911 6.261 1.00 72.13 H new ATOM 0 HG22 THR A 61 -12.548 -1.877 7.403 1.00 72.13 H new ATOM 0 HG23 THR A 61 -11.793 -2.361 5.866 1.00 72.13 H new ATOM 959 N TYR A 62 -10.135 -1.557 9.118 1.00 74.35 N ATOM 960 CA TYR A 62 -10.267 -0.616 10.212 1.00 13.43 C ATOM 961 C TYR A 62 -11.544 0.181 10.068 1.00 35.44 C ATOM 962 O TYR A 62 -12.138 0.234 8.993 1.00 12.21 O ATOM 963 CB TYR A 62 -9.074 0.333 10.260 1.00 14.44 C ATOM 964 CG TYR A 62 -7.869 -0.254 10.947 1.00 64.32 C ATOM 965 CD1 TYR A 62 -6.939 -1.011 10.246 1.00 11.32 C ATOM 966 CD2 TYR A 62 -7.670 -0.058 12.303 1.00 73.30 C ATOM 967 CE1 TYR A 62 -5.841 -1.553 10.881 1.00 30.11 C ATOM 968 CE2 TYR A 62 -6.573 -0.599 12.945 1.00 22.51 C ATOM 969 CZ TYR A 62 -5.665 -1.345 12.230 1.00 51.41 C ATOM 970 OH TYR A 62 -4.577 -1.891 12.866 1.00 62.21 O ATOM 0 H TYR A 62 -9.608 -1.203 8.320 1.00 74.35 H new ATOM 0 HA TYR A 62 -10.300 -1.184 11.142 1.00 13.43 H new ATOM 0 HB2 TYR A 62 -8.802 0.614 9.243 1.00 14.44 H new ATOM 0 HB3 TYR A 62 -9.367 1.247 10.776 1.00 14.44 H new ATOM 0 HD1 TYR A 62 -7.078 -1.178 9.188 1.00 11.32 H new ATOM 0 HD2 TYR A 62 -8.382 0.526 12.867 1.00 73.30 H new ATOM 0 HE1 TYR A 62 -5.124 -2.137 10.323 1.00 30.11 H new ATOM 0 HE2 TYR A 62 -6.429 -0.437 14.003 1.00 22.51 H new ATOM 0 HH TYR A 62 -4.851 -2.245 13.738 1.00 62.21 H new ATOM 980 N ALA A 63 -11.965 0.787 11.158 1.00 62.23 N ATOM 981 CA ALA A 63 -13.155 1.607 11.171 1.00 44.20 C ATOM 982 C ALA A 63 -12.891 2.945 10.494 1.00 1.40 C ATOM 983 O ALA A 63 -13.753 3.481 9.806 1.00 24.12 O ATOM 984 CB ALA A 63 -13.617 1.808 12.599 1.00 50.04 C ATOM 0 H ALA A 63 -11.491 0.724 12.059 1.00 62.23 H new ATOM 0 HA ALA A 63 -13.943 1.101 10.613 1.00 44.20 H new ATOM 0 HB1 ALA A 63 -14.514 2.427 12.607 1.00 50.04 H new ATOM 0 HB2 ALA A 63 -13.839 0.840 13.049 1.00 50.04 H new ATOM 0 HB3 ALA A 63 -12.831 2.302 13.170 1.00 50.04 H new ATOM 990 N THR A 64 -11.681 3.463 10.671 1.00 11.10 N ATOM 991 CA THR A 64 -11.300 4.757 10.114 1.00 54.01 C ATOM 992 C THR A 64 -9.964 4.647 9.380 1.00 55.40 C ATOM 993 O THR A 64 -9.112 3.836 9.757 1.00 3.03 O ATOM 994 CB THR A 64 -11.162 5.815 11.230 1.00 64.44 C ATOM 995 OG1 THR A 64 -12.054 5.502 12.308 1.00 11.14 O ATOM 996 CG2 THR A 64 -11.459 7.213 10.704 1.00 72.33 C ATOM 0 H THR A 64 -10.941 3.002 11.201 1.00 11.10 H new ATOM 0 HA THR A 64 -12.082 5.061 9.419 1.00 54.01 H new ATOM 0 HB THR A 64 -10.133 5.799 11.589 1.00 64.44 H new ATOM 0 HG1 THR A 64 -11.690 4.755 12.828 1.00 11.14 H new ATOM 0 HG21 THR A 64 -11.354 7.936 11.513 1.00 72.33 H new ATOM 0 HG22 THR A 64 -10.759 7.458 9.905 1.00 72.33 H new ATOM 0 HG23 THR A 64 -12.477 7.247 10.317 1.00 72.33 H new ATOM 1004 N VAL A 65 -9.772 5.462 8.342 1.00 61.45 N ATOM 1005 CA VAL A 65 -8.519 5.459 7.593 1.00 23.00 C ATOM 1006 C VAL A 65 -7.357 5.961 8.459 1.00 41.34 C ATOM 1007 O VAL A 65 -6.228 5.498 8.325 1.00 61.44 O ATOM 1008 CB VAL A 65 -8.628 6.299 6.292 1.00 51.53 C ATOM 1009 CG1 VAL A 65 -8.812 7.779 6.588 1.00 31.32 C ATOM 1010 CG2 VAL A 65 -7.419 6.081 5.396 1.00 41.21 C ATOM 0 H VAL A 65 -10.466 6.129 8.004 1.00 61.45 H new ATOM 0 HA VAL A 65 -8.316 4.426 7.309 1.00 23.00 H new ATOM 0 HB VAL A 65 -9.516 5.954 5.763 1.00 51.53 H new ATOM 0 HG11 VAL A 65 -8.884 8.331 5.651 1.00 31.32 H new ATOM 0 HG12 VAL A 65 -9.725 7.924 7.166 1.00 31.32 H new ATOM 0 HG13 VAL A 65 -7.959 8.144 7.160 1.00 31.32 H new ATOM 0 HG21 VAL A 65 -7.523 6.682 4.492 1.00 41.21 H new ATOM 0 HG22 VAL A 65 -6.514 6.377 5.927 1.00 41.21 H new ATOM 0 HG23 VAL A 65 -7.352 5.027 5.125 1.00 41.21 H new ATOM 1020 N GLU A 66 -7.636 6.913 9.343 1.00 13.54 N ATOM 1021 CA GLU A 66 -6.635 7.418 10.275 1.00 3.32 C ATOM 1022 C GLU A 66 -6.124 6.331 11.218 1.00 63.15 C ATOM 1023 O GLU A 66 -4.938 6.294 11.539 1.00 53.43 O ATOM 1024 CB GLU A 66 -7.222 8.574 11.076 1.00 64.12 C ATOM 1025 CG GLU A 66 -7.952 9.590 10.215 1.00 10.51 C ATOM 1026 CD GLU A 66 -8.463 10.773 11.005 1.00 51.10 C ATOM 1027 OE1 GLU A 66 -9.209 10.567 11.980 1.00 75.43 O ATOM 1028 OE2 GLU A 66 -8.115 11.917 10.653 1.00 12.11 O ATOM 0 H GLU A 66 -8.552 7.352 9.433 1.00 13.54 H new ATOM 0 HA GLU A 66 -5.782 7.765 9.692 1.00 3.32 H new ATOM 0 HB2 GLU A 66 -7.911 8.178 11.822 1.00 64.12 H new ATOM 0 HB3 GLU A 66 -6.420 9.076 11.618 1.00 64.12 H new ATOM 0 HG2 GLU A 66 -7.281 9.945 9.433 1.00 10.51 H new ATOM 0 HG3 GLU A 66 -8.791 9.102 9.718 1.00 10.51 H new ATOM 1035 N GLU A 67 -7.012 5.439 11.649 1.00 33.24 N ATOM 1036 CA GLU A 67 -6.621 4.327 12.515 1.00 64.30 C ATOM 1037 C GLU A 67 -5.679 3.384 11.775 1.00 24.20 C ATOM 1038 O GLU A 67 -4.824 2.733 12.378 1.00 62.33 O ATOM 1039 CB GLU A 67 -7.850 3.558 12.984 1.00 42.43 C ATOM 1040 CG GLU A 67 -8.724 4.333 13.952 1.00 71.42 C ATOM 1041 CD GLU A 67 -9.942 3.546 14.375 1.00 54.53 C ATOM 1042 OE1 GLU A 67 -10.841 3.339 13.534 1.00 51.15 O ATOM 1043 OE2 GLU A 67 -10.013 3.128 15.549 1.00 65.12 O ATOM 0 H GLU A 67 -8.004 5.463 11.414 1.00 33.24 H new ATOM 0 HA GLU A 67 -6.106 4.737 13.384 1.00 64.30 H new ATOM 0 HB2 GLU A 67 -8.446 3.278 12.115 1.00 42.43 H new ATOM 0 HB3 GLU A 67 -7.528 2.632 13.461 1.00 42.43 H new ATOM 0 HG2 GLU A 67 -8.140 4.598 14.834 1.00 71.42 H new ATOM 0 HG3 GLU A 67 -9.040 5.266 13.486 1.00 71.42 H new ATOM 1050 N VAL A 68 -5.852 3.330 10.462 1.00 40.11 N ATOM 1051 CA VAL A 68 -4.956 2.587 9.590 1.00 10.10 C ATOM 1052 C VAL A 68 -3.541 3.150 9.654 1.00 64.13 C ATOM 1053 O VAL A 68 -2.574 2.400 9.749 1.00 51.31 O ATOM 1054 CB VAL A 68 -5.455 2.626 8.131 1.00 44.14 C ATOM 1055 CG1 VAL A 68 -4.321 2.442 7.141 1.00 61.41 C ATOM 1056 CG2 VAL A 68 -6.505 1.571 7.913 1.00 11.31 C ATOM 0 H VAL A 68 -6.615 3.799 9.973 1.00 40.11 H new ATOM 0 HA VAL A 68 -4.943 1.554 9.937 1.00 10.10 H new ATOM 0 HB VAL A 68 -5.889 3.611 7.959 1.00 44.14 H new ATOM 0 HG11 VAL A 68 -4.716 2.476 6.125 1.00 61.41 H new ATOM 0 HG12 VAL A 68 -3.590 3.239 7.273 1.00 61.41 H new ATOM 0 HG13 VAL A 68 -3.842 1.478 7.312 1.00 61.41 H new ATOM 0 HG21 VAL A 68 -6.849 1.609 6.880 1.00 11.31 H new ATOM 0 HG22 VAL A 68 -6.081 0.588 8.119 1.00 11.31 H new ATOM 0 HG23 VAL A 68 -7.346 1.751 8.582 1.00 11.31 H new ATOM 1066 N ASP A 69 -3.434 4.470 9.610 1.00 74.51 N ATOM 1067 CA ASP A 69 -2.135 5.133 9.584 1.00 12.12 C ATOM 1068 C ASP A 69 -1.333 4.823 10.847 1.00 3.33 C ATOM 1069 O ASP A 69 -0.127 4.598 10.779 1.00 24.24 O ATOM 1070 CB ASP A 69 -2.311 6.639 9.418 1.00 74.02 C ATOM 1071 CG ASP A 69 -1.194 7.259 8.606 1.00 4.30 C ATOM 1072 OD1 ASP A 69 -0.145 7.590 9.188 1.00 72.11 O ATOM 1073 OD2 ASP A 69 -1.358 7.414 7.375 1.00 53.11 O ATOM 0 H ASP A 69 -4.232 5.105 9.591 1.00 74.51 H new ATOM 0 HA ASP A 69 -1.577 4.750 8.730 1.00 12.12 H new ATOM 0 HB2 ASP A 69 -3.266 6.840 8.932 1.00 74.02 H new ATOM 0 HB3 ASP A 69 -2.348 7.109 10.401 1.00 74.02 H new ATOM 1078 N ALA A 70 -2.010 4.822 11.998 1.00 40.33 N ATOM 1079 CA ALA A 70 -1.408 4.382 13.261 1.00 54.25 C ATOM 1080 C ALA A 70 -0.888 2.945 13.179 1.00 4.21 C ATOM 1081 O ALA A 70 0.184 2.638 13.696 1.00 64.11 O ATOM 1082 CB ALA A 70 -2.409 4.515 14.400 1.00 65.53 C ATOM 0 H ALA A 70 -2.981 5.123 12.082 1.00 40.33 H new ATOM 0 HA ALA A 70 -0.553 5.029 13.456 1.00 54.25 H new ATOM 0 HB1 ALA A 70 -1.947 4.185 15.331 1.00 65.53 H new ATOM 0 HB2 ALA A 70 -2.714 5.557 14.496 1.00 65.53 H new ATOM 0 HB3 ALA A 70 -3.283 3.899 14.190 1.00 65.53 H new ATOM 1088 N ALA A 71 -1.638 2.074 12.515 1.00 32.32 N ATOM 1089 CA ALA A 71 -1.207 0.695 12.317 1.00 44.50 C ATOM 1090 C ALA A 71 0.011 0.642 11.405 1.00 63.41 C ATOM 1091 O ALA A 71 0.936 -0.140 11.617 1.00 2.40 O ATOM 1092 CB ALA A 71 -2.328 -0.134 11.727 1.00 43.54 C ATOM 0 H ALA A 71 -2.545 2.297 12.105 1.00 32.32 H new ATOM 0 HA ALA A 71 -0.938 0.281 13.289 1.00 44.50 H new ATOM 0 HB1 ALA A 71 -1.987 -1.160 11.587 1.00 43.54 H new ATOM 0 HB2 ALA A 71 -3.182 -0.125 12.404 1.00 43.54 H new ATOM 0 HB3 ALA A 71 -2.623 0.285 10.765 1.00 43.54 H new ATOM 1098 N MET A 72 0.007 1.490 10.391 1.00 14.44 N ATOM 1099 CA MET A 72 1.120 1.575 9.458 1.00 22.12 C ATOM 1100 C MET A 72 2.371 2.104 10.162 1.00 61.30 C ATOM 1101 O MET A 72 3.481 1.687 9.854 1.00 63.25 O ATOM 1102 CB MET A 72 0.760 2.466 8.262 1.00 2.24 C ATOM 1103 CG MET A 72 -0.484 2.017 7.498 1.00 21.12 C ATOM 1104 SD MET A 72 -0.123 1.156 5.950 1.00 35.11 S ATOM 1105 CE MET A 72 0.423 -0.443 6.529 1.00 54.40 C ATOM 0 H MET A 72 -0.759 2.133 10.191 1.00 14.44 H new ATOM 0 HA MET A 72 1.330 0.572 9.086 1.00 22.12 H new ATOM 0 HB2 MET A 72 0.607 3.485 8.616 1.00 2.24 H new ATOM 0 HB3 MET A 72 1.605 2.491 7.574 1.00 2.24 H new ATOM 0 HG2 MET A 72 -1.074 1.361 8.138 1.00 21.12 H new ATOM 0 HG3 MET A 72 -1.100 2.890 7.282 1.00 21.12 H new ATOM 0 HE1 MET A 72 0.036 -1.220 5.870 1.00 54.40 H new ATOM 0 HE2 MET A 72 1.512 -0.477 6.530 1.00 54.40 H new ATOM 0 HE3 MET A 72 0.054 -0.609 7.541 1.00 54.40 H new ATOM 1115 N ASN A 73 2.194 2.989 11.135 1.00 74.24 N ATOM 1116 CA ASN A 73 3.329 3.543 11.868 1.00 72.21 C ATOM 1117 C ASN A 73 3.784 2.593 12.979 1.00 74.01 C ATOM 1118 O ASN A 73 4.843 2.778 13.576 1.00 13.11 O ATOM 1119 CB ASN A 73 3.004 4.959 12.399 1.00 73.21 C ATOM 1120 CG ASN A 73 2.188 5.047 13.692 1.00 71.20 C ATOM 1121 OD1 ASN A 73 2.358 4.289 14.646 1.00 65.13 O ATOM 1122 ND2 ASN A 73 1.291 6.013 13.729 1.00 75.35 N ATOM 0 H ASN A 73 1.283 3.337 11.434 1.00 74.24 H new ATOM 0 HA ASN A 73 4.167 3.646 11.179 1.00 72.21 H new ATOM 0 HB2 ASN A 73 3.945 5.486 12.556 1.00 73.21 H new ATOM 0 HB3 ASN A 73 2.463 5.497 11.620 1.00 73.21 H new ATOM 0 HD21 ASN A 73 0.718 6.145 14.563 1.00 75.35 H new ATOM 0 HD22 ASN A 73 1.170 6.628 12.924 1.00 75.35 H new ATOM 1129 N ALA A 74 2.985 1.562 13.222 1.00 62.10 N ATOM 1130 CA ALA A 74 3.254 0.610 14.295 1.00 51.01 C ATOM 1131 C ALA A 74 4.201 -0.507 13.862 1.00 72.30 C ATOM 1132 O ALA A 74 4.700 -1.252 14.702 1.00 13.12 O ATOM 1133 CB ALA A 74 1.951 0.018 14.794 1.00 74.53 C ATOM 0 H ALA A 74 2.140 1.362 12.687 1.00 62.10 H new ATOM 0 HA ALA A 74 3.748 1.157 15.098 1.00 51.01 H new ATOM 0 HB1 ALA A 74 2.157 -0.692 15.595 1.00 74.53 H new ATOM 0 HB2 ALA A 74 1.310 0.815 15.172 1.00 74.53 H new ATOM 0 HB3 ALA A 74 1.447 -0.495 13.975 1.00 74.53 H new ATOM 1139 N ARG A 75 4.405 -0.640 12.548 1.00 5.15 N ATOM 1140 CA ARG A 75 5.327 -1.638 11.986 1.00 3.55 C ATOM 1141 C ARG A 75 6.700 -1.623 12.665 1.00 12.11 C ATOM 1142 O ARG A 75 7.191 -0.568 13.066 1.00 75.14 O ATOM 1143 CB ARG A 75 5.497 -1.407 10.486 1.00 43.42 C ATOM 1144 CG ARG A 75 4.445 -2.103 9.644 1.00 40.21 C ATOM 1145 CD ARG A 75 4.511 -1.659 8.196 1.00 24.51 C ATOM 1146 NE ARG A 75 4.129 -0.260 8.052 1.00 10.22 N ATOM 1147 CZ ARG A 75 4.495 0.524 7.046 1.00 3.42 C ATOM 1148 NH1 ARG A 75 5.268 0.062 6.078 1.00 64.31 N ATOM 1149 NH2 ARG A 75 4.105 1.789 7.024 1.00 61.00 N ATOM 0 H ARG A 75 3.940 -0.064 11.846 1.00 5.15 H new ATOM 0 HA ARG A 75 4.883 -2.617 12.169 1.00 3.55 H new ATOM 0 HB2 ARG A 75 5.462 -0.336 10.285 1.00 43.42 H new ATOM 0 HB3 ARG A 75 6.484 -1.756 10.182 1.00 43.42 H new ATOM 0 HG2 ARG A 75 4.586 -3.182 9.702 1.00 40.21 H new ATOM 0 HG3 ARG A 75 3.455 -1.889 10.047 1.00 40.21 H new ATOM 0 HD2 ARG A 75 5.522 -1.803 7.815 1.00 24.51 H new ATOM 0 HD3 ARG A 75 3.851 -2.282 7.592 1.00 24.51 H new ATOM 0 HE ARG A 75 3.537 0.146 8.777 1.00 10.22 H new ATOM 0 HH11 ARG A 75 5.589 -0.906 6.100 1.00 64.31 H new ATOM 0 HH12 ARG A 75 5.543 0.673 5.309 1.00 64.31 H new ATOM 0 HH21 ARG A 75 3.526 2.157 7.778 1.00 61.00 H new ATOM 0 HH22 ARG A 75 4.384 2.395 6.253 1.00 61.00 H new ATOM 1163 N PRO A 76 7.351 -2.798 12.787 1.00 70.10 N ATOM 1164 CA PRO A 76 6.840 -4.077 12.278 1.00 64.11 C ATOM 1165 C PRO A 76 5.802 -4.722 13.197 1.00 70.13 C ATOM 1166 O PRO A 76 5.789 -4.489 14.407 1.00 23.54 O ATOM 1167 CB PRO A 76 8.093 -4.965 12.202 1.00 0.22 C ATOM 1168 CG PRO A 76 9.242 -4.116 12.638 1.00 4.43 C ATOM 1169 CD PRO A 76 8.659 -2.978 13.422 1.00 23.44 C ATOM 0 HA PRO A 76 6.327 -3.941 11.326 1.00 64.11 H new ATOM 0 HB2 PRO A 76 7.989 -5.838 12.846 1.00 0.22 H new ATOM 0 HB3 PRO A 76 8.246 -5.334 11.188 1.00 0.22 H new ATOM 0 HG2 PRO A 76 9.939 -4.690 13.248 1.00 4.43 H new ATOM 0 HG3 PRO A 76 9.801 -3.748 11.777 1.00 4.43 H new ATOM 0 HD2 PRO A 76 8.567 -3.219 14.481 1.00 23.44 H new ATOM 0 HD3 PRO A 76 9.272 -2.080 13.352 1.00 23.44 H new ATOM 1177 N HIS A 77 4.942 -5.539 12.608 1.00 43.55 N ATOM 1178 CA HIS A 77 3.907 -6.244 13.358 1.00 63.44 C ATOM 1179 C HIS A 77 4.244 -7.718 13.468 1.00 71.34 C ATOM 1180 O HIS A 77 4.850 -8.294 12.562 1.00 44.10 O ATOM 1181 CB HIS A 77 2.539 -6.099 12.687 1.00 45.51 C ATOM 1182 CG HIS A 77 1.929 -4.745 12.821 1.00 70.32 C ATOM 1183 ND1 HIS A 77 0.907 -4.505 13.702 1.00 25.41 N ATOM 1184 CD2 HIS A 77 2.210 -3.609 12.151 1.00 22.10 C ATOM 1185 CE1 HIS A 77 0.589 -3.236 13.547 1.00 52.12 C ATOM 1186 NE2 HIS A 77 1.352 -2.653 12.615 1.00 21.31 N ATOM 0 H HIS A 77 4.939 -5.733 11.607 1.00 43.55 H new ATOM 0 HA HIS A 77 3.865 -5.798 14.352 1.00 63.44 H new ATOM 0 HB2 HIS A 77 2.640 -6.336 11.628 1.00 45.51 H new ATOM 0 HB3 HIS A 77 1.858 -6.835 13.114 1.00 45.51 H new ATOM 0 HD2 HIS A 77 2.968 -3.480 11.393 1.00 22.10 H new ATOM 0 HE1 HIS A 77 -0.188 -2.731 14.101 1.00 52.12 H new ATOM 0 HE2 HIS A 77 1.302 -1.681 12.310 1.00 21.31 H new ATOM 1194 N LYS A 78 3.857 -8.323 14.574 1.00 64.31 N ATOM 1195 CA LYS A 78 4.071 -9.743 14.773 1.00 12.31 C ATOM 1196 C LYS A 78 2.854 -10.400 15.412 1.00 61.44 C ATOM 1197 O LYS A 78 2.615 -10.265 16.610 1.00 3.51 O ATOM 1198 CB LYS A 78 5.318 -9.987 15.627 1.00 35.13 C ATOM 1199 CG LYS A 78 5.471 -11.430 16.074 1.00 71.15 C ATOM 1200 CD LYS A 78 6.923 -11.787 16.333 1.00 73.54 C ATOM 1201 CE LYS A 78 7.693 -11.988 15.038 1.00 30.03 C ATOM 1202 NZ LYS A 78 9.154 -12.112 15.282 1.00 64.04 N ATOM 0 H LYS A 78 3.392 -7.852 15.350 1.00 64.31 H new ATOM 0 HA LYS A 78 4.225 -10.196 13.794 1.00 12.31 H new ATOM 0 HB2 LYS A 78 6.201 -9.695 15.059 1.00 35.13 H new ATOM 0 HB3 LYS A 78 5.278 -9.344 16.507 1.00 35.13 H new ATOM 0 HG2 LYS A 78 4.889 -11.594 16.981 1.00 71.15 H new ATOM 0 HG3 LYS A 78 5.064 -12.093 15.310 1.00 71.15 H new ATOM 0 HD2 LYS A 78 7.393 -10.996 16.917 1.00 73.54 H new ATOM 0 HD3 LYS A 78 6.973 -12.697 16.931 1.00 73.54 H new ATOM 0 HE2 LYS A 78 7.331 -12.884 14.534 1.00 30.03 H new ATOM 0 HE3 LYS A 78 7.506 -11.148 14.369 1.00 30.03 H new ATOM 0 HZ1 LYS A 78 9.647 -12.248 14.376 1.00 64.04 H new ATOM 0 HZ2 LYS A 78 9.504 -11.247 15.740 1.00 64.04 H new ATOM 0 HZ3 LYS A 78 9.335 -12.928 15.900 1.00 64.04 H new ATOM 1216 N VAL A 79 2.097 -11.121 14.605 1.00 4.30 N ATOM 1217 CA VAL A 79 0.953 -11.865 15.097 1.00 61.13 C ATOM 1218 C VAL A 79 1.169 -13.354 14.838 1.00 51.35 C ATOM 1219 O VAL A 79 1.734 -13.729 13.804 1.00 61.11 O ATOM 1220 CB VAL A 79 -0.375 -11.381 14.454 1.00 25.33 C ATOM 1221 CG1 VAL A 79 -0.320 -11.471 12.937 1.00 21.04 C ATOM 1222 CG2 VAL A 79 -1.564 -12.164 14.996 1.00 4.02 C ATOM 0 H VAL A 79 2.255 -11.207 13.601 1.00 4.30 H new ATOM 0 HA VAL A 79 0.866 -11.690 16.169 1.00 61.13 H new ATOM 0 HB VAL A 79 -0.506 -10.333 14.724 1.00 25.33 H new ATOM 0 HG11 VAL A 79 -1.265 -11.125 12.518 1.00 21.04 H new ATOM 0 HG12 VAL A 79 0.493 -10.847 12.565 1.00 21.04 H new ATOM 0 HG13 VAL A 79 -0.148 -12.506 12.640 1.00 21.04 H new ATOM 0 HG21 VAL A 79 -2.480 -11.804 14.528 1.00 4.02 H new ATOM 0 HG22 VAL A 79 -1.435 -13.223 14.773 1.00 4.02 H new ATOM 0 HG23 VAL A 79 -1.629 -12.026 16.075 1.00 4.02 H new ATOM 1232 N ASP A 80 0.782 -14.184 15.811 1.00 22.54 N ATOM 1233 CA ASP A 80 0.927 -15.640 15.719 1.00 62.01 C ATOM 1234 C ASP A 80 2.396 -16.045 15.618 1.00 21.11 C ATOM 1235 O ASP A 80 2.738 -17.051 14.991 1.00 41.42 O ATOM 1236 CB ASP A 80 0.124 -16.204 14.539 1.00 45.33 C ATOM 1237 CG ASP A 80 -1.249 -16.675 14.964 1.00 73.14 C ATOM 1238 OD1 ASP A 80 -1.319 -17.607 15.790 1.00 62.52 O ATOM 1239 OD2 ASP A 80 -2.259 -16.124 14.486 1.00 70.40 O ATOM 0 H ASP A 80 0.360 -13.866 16.684 1.00 22.54 H new ATOM 0 HA ASP A 80 0.523 -16.068 16.636 1.00 62.01 H new ATOM 0 HB2 ASP A 80 0.023 -15.438 13.770 1.00 45.33 H new ATOM 0 HB3 ASP A 80 0.670 -17.035 14.092 1.00 45.33 H new ATOM 1244 N GLY A 81 3.255 -15.247 16.256 1.00 45.12 N ATOM 1245 CA GLY A 81 4.682 -15.523 16.280 1.00 1.40 C ATOM 1246 C GLY A 81 5.340 -15.302 14.935 1.00 31.42 C ATOM 1247 O GLY A 81 6.392 -15.869 14.649 1.00 44.14 O ATOM 0 H GLY A 81 2.981 -14.405 16.762 1.00 45.12 H new ATOM 0 HA2 GLY A 81 5.159 -14.884 17.023 1.00 1.40 H new ATOM 0 HA3 GLY A 81 4.844 -16.554 16.594 1.00 1.40 H new ATOM 1251 N ARG A 82 4.722 -14.476 14.107 1.00 55.25 N ATOM 1252 CA ARG A 82 5.206 -14.235 12.761 1.00 43.21 C ATOM 1253 C ARG A 82 5.318 -12.740 12.486 1.00 65.40 C ATOM 1254 O ARG A 82 4.429 -11.975 12.848 1.00 52.14 O ATOM 1255 CB ARG A 82 4.244 -14.877 11.760 1.00 71.33 C ATOM 1256 CG ARG A 82 4.513 -14.495 10.319 1.00 54.42 C ATOM 1257 CD ARG A 82 5.601 -15.347 9.701 1.00 2.43 C ATOM 1258 NE ARG A 82 6.062 -14.793 8.431 1.00 61.11 N ATOM 1259 CZ ARG A 82 7.064 -15.300 7.708 1.00 50.51 C ATOM 1260 NH1 ARG A 82 7.715 -16.382 8.130 1.00 70.01 N ATOM 1261 NH2 ARG A 82 7.422 -14.719 6.567 1.00 11.35 N ATOM 0 H ARG A 82 3.877 -13.958 14.348 1.00 55.25 H new ATOM 0 HA ARG A 82 6.198 -14.675 12.657 1.00 43.21 H new ATOM 0 HB2 ARG A 82 4.305 -15.961 11.856 1.00 71.33 H new ATOM 0 HB3 ARG A 82 3.224 -14.592 12.017 1.00 71.33 H new ATOM 0 HG2 ARG A 82 3.596 -14.600 9.739 1.00 54.42 H new ATOM 0 HG3 ARG A 82 4.803 -13.445 10.270 1.00 54.42 H new ATOM 0 HD2 ARG A 82 6.441 -15.423 10.392 1.00 2.43 H new ATOM 0 HD3 ARG A 82 5.226 -16.358 9.543 1.00 2.43 H new ATOM 0 HE ARG A 82 5.588 -13.964 8.072 1.00 61.11 H new ATOM 0 HH11 ARG A 82 7.449 -16.827 9.008 1.00 70.01 H new ATOM 0 HH12 ARG A 82 8.480 -16.766 7.575 1.00 70.01 H new ATOM 0 HH21 ARG A 82 6.931 -13.885 6.243 1.00 11.35 H new ATOM 0 HH22 ARG A 82 8.187 -15.107 6.015 1.00 11.35 H new ATOM 1275 N VAL A 83 6.409 -12.338 11.842 1.00 34.35 N ATOM 1276 CA VAL A 83 6.583 -10.951 11.443 1.00 4.13 C ATOM 1277 C VAL A 83 5.834 -10.713 10.128 1.00 42.33 C ATOM 1278 O VAL A 83 6.122 -11.338 9.104 1.00 53.32 O ATOM 1279 CB VAL A 83 8.083 -10.550 11.328 1.00 54.25 C ATOM 1280 CG1 VAL A 83 8.869 -11.519 10.453 1.00 63.45 C ATOM 1281 CG2 VAL A 83 8.223 -9.123 10.814 1.00 71.52 C ATOM 0 H VAL A 83 7.182 -12.953 11.587 1.00 34.35 H new ATOM 0 HA VAL A 83 6.164 -10.312 12.220 1.00 4.13 H new ATOM 0 HB VAL A 83 8.509 -10.602 12.330 1.00 54.25 H new ATOM 0 HG11 VAL A 83 9.910 -11.200 10.401 1.00 63.45 H new ATOM 0 HG12 VAL A 83 8.817 -12.520 10.881 1.00 63.45 H new ATOM 0 HG13 VAL A 83 8.443 -11.531 9.450 1.00 63.45 H new ATOM 0 HG21 VAL A 83 9.279 -8.864 10.742 1.00 71.52 H new ATOM 0 HG22 VAL A 83 7.762 -9.044 9.830 1.00 71.52 H new ATOM 0 HG23 VAL A 83 7.728 -8.438 11.503 1.00 71.52 H new ATOM 1291 N VAL A 84 4.827 -9.855 10.180 1.00 54.22 N ATOM 1292 CA VAL A 84 3.940 -9.659 9.044 1.00 52.43 C ATOM 1293 C VAL A 84 4.147 -8.294 8.404 1.00 14.11 C ATOM 1294 O VAL A 84 4.611 -7.347 9.048 1.00 22.11 O ATOM 1295 CB VAL A 84 2.461 -9.824 9.460 1.00 70.04 C ATOM 1296 CG1 VAL A 84 2.284 -11.091 10.277 1.00 61.44 C ATOM 1297 CG2 VAL A 84 1.957 -8.617 10.236 1.00 21.23 C ATOM 0 H VAL A 84 4.604 -9.284 10.995 1.00 54.22 H new ATOM 0 HA VAL A 84 4.187 -10.425 8.309 1.00 52.43 H new ATOM 0 HB VAL A 84 1.866 -9.901 8.550 1.00 70.04 H new ATOM 0 HG11 VAL A 84 1.238 -11.196 10.564 1.00 61.44 H new ATOM 0 HG12 VAL A 84 2.585 -11.953 9.682 1.00 61.44 H new ATOM 0 HG13 VAL A 84 2.902 -11.035 11.173 1.00 61.44 H new ATOM 0 HG21 VAL A 84 0.913 -8.771 10.511 1.00 21.23 H new ATOM 0 HG22 VAL A 84 2.555 -8.489 11.138 1.00 21.23 H new ATOM 0 HG23 VAL A 84 2.041 -7.725 9.616 1.00 21.23 H new ATOM 1307 N GLU A 85 3.821 -8.218 7.128 1.00 12.45 N ATOM 1308 CA GLU A 85 3.957 -6.993 6.368 1.00 74.14 C ATOM 1309 C GLU A 85 2.587 -6.450 5.967 1.00 74.12 C ATOM 1310 O GLU A 85 2.010 -6.884 4.971 1.00 62.31 O ATOM 1311 CB GLU A 85 4.806 -7.252 5.120 1.00 62.00 C ATOM 1312 CG GLU A 85 5.779 -6.131 4.801 1.00 64.15 C ATOM 1313 CD GLU A 85 6.717 -6.477 3.661 1.00 3.40 C ATOM 1314 OE1 GLU A 85 7.400 -7.516 3.741 1.00 61.14 O ATOM 1315 OE2 GLU A 85 6.775 -5.706 2.680 1.00 13.21 O ATOM 0 H GLU A 85 3.455 -9.004 6.590 1.00 12.45 H new ATOM 0 HA GLU A 85 4.450 -6.248 6.992 1.00 74.14 H new ATOM 0 HB2 GLU A 85 5.364 -8.178 5.257 1.00 62.00 H new ATOM 0 HB3 GLU A 85 4.145 -7.402 4.266 1.00 62.00 H new ATOM 0 HG2 GLU A 85 5.219 -5.231 4.545 1.00 64.15 H new ATOM 0 HG3 GLU A 85 6.365 -5.900 5.691 1.00 64.15 H new ATOM 1322 N PRO A 86 2.035 -5.509 6.746 1.00 23.11 N ATOM 1323 CA PRO A 86 0.755 -4.890 6.424 1.00 23.12 C ATOM 1324 C PRO A 86 0.876 -3.873 5.293 1.00 62.44 C ATOM 1325 O PRO A 86 1.794 -3.052 5.269 1.00 32.13 O ATOM 1326 CB PRO A 86 0.342 -4.207 7.725 1.00 22.23 C ATOM 1327 CG PRO A 86 1.599 -3.979 8.487 1.00 21.14 C ATOM 1328 CD PRO A 86 2.610 -4.986 7.999 1.00 61.35 C ATOM 0 HA PRO A 86 0.027 -5.621 6.072 1.00 23.12 H new ATOM 0 HB2 PRO A 86 -0.169 -3.265 7.526 1.00 22.23 H new ATOM 0 HB3 PRO A 86 -0.349 -4.832 8.291 1.00 22.23 H new ATOM 0 HG2 PRO A 86 1.963 -2.963 8.332 1.00 21.14 H new ATOM 0 HG3 PRO A 86 1.426 -4.096 9.557 1.00 21.14 H new ATOM 0 HD2 PRO A 86 3.581 -4.522 7.827 1.00 61.35 H new ATOM 0 HD3 PRO A 86 2.762 -5.782 8.728 1.00 61.35 H new ATOM 1336 N LYS A 87 -0.050 -3.963 4.357 1.00 62.12 N ATOM 1337 CA LYS A 87 -0.127 -3.077 3.204 1.00 34.03 C ATOM 1338 C LYS A 87 -1.522 -2.479 3.169 1.00 15.33 C ATOM 1339 O LYS A 87 -2.314 -2.747 4.061 1.00 63.13 O ATOM 1340 CB LYS A 87 0.126 -3.872 1.914 1.00 0.41 C ATOM 1341 CG LYS A 87 1.357 -4.754 1.969 1.00 54.32 C ATOM 1342 CD LYS A 87 2.575 -4.044 1.466 1.00 32.12 C ATOM 1343 CE LYS A 87 3.797 -4.837 1.817 1.00 52.23 C ATOM 1344 NZ LYS A 87 5.010 -4.043 1.593 1.00 32.41 N ATOM 0 H LYS A 87 -0.787 -4.668 4.375 1.00 62.12 H new ATOM 0 HA LYS A 87 0.625 -2.292 3.280 1.00 34.03 H new ATOM 0 HB2 LYS A 87 -0.745 -4.493 1.705 1.00 0.41 H new ATOM 0 HB3 LYS A 87 0.227 -3.174 1.083 1.00 0.41 H new ATOM 0 HG2 LYS A 87 1.525 -5.080 2.996 1.00 54.32 H new ATOM 0 HG3 LYS A 87 1.188 -5.651 1.373 1.00 54.32 H new ATOM 0 HD2 LYS A 87 2.512 -3.912 0.386 1.00 32.12 H new ATOM 0 HD3 LYS A 87 2.636 -3.048 1.906 1.00 32.12 H new ATOM 0 HE2 LYS A 87 3.747 -5.149 2.860 1.00 52.23 H new ATOM 0 HE3 LYS A 87 3.834 -5.745 1.214 1.00 52.23 H new ATOM 0 HZ1 LYS A 87 5.834 -4.675 1.542 1.00 32.41 H new ATOM 0 HZ2 LYS A 87 4.921 -3.518 0.700 1.00 32.41 H new ATOM 0 HZ3 LYS A 87 5.136 -3.372 2.378 1.00 32.41 H new ATOM 1358 N ARG A 88 -1.831 -1.672 2.173 1.00 31.13 N ATOM 1359 CA ARG A 88 -3.205 -1.229 1.971 1.00 2.22 C ATOM 1360 C ARG A 88 -3.989 -2.305 1.253 1.00 60.35 C ATOM 1361 O ARG A 88 -3.417 -3.214 0.656 1.00 2.15 O ATOM 1362 CB ARG A 88 -3.280 0.046 1.131 1.00 14.11 C ATOM 1363 CG ARG A 88 -3.139 1.329 1.921 1.00 23.30 C ATOM 1364 CD ARG A 88 -4.164 1.393 3.042 1.00 73.03 C ATOM 1365 NE ARG A 88 -4.404 2.761 3.519 1.00 33.23 N ATOM 1366 CZ ARG A 88 -3.500 3.522 4.153 1.00 40.32 C ATOM 1367 NH1 ARG A 88 -2.269 3.064 4.389 1.00 14.05 N ATOM 1368 NH2 ARG A 88 -3.846 4.734 4.581 1.00 43.40 N ATOM 0 H ARG A 88 -1.160 -1.310 1.495 1.00 31.13 H new ATOM 0 HA ARG A 88 -3.623 -1.027 2.957 1.00 2.22 H new ATOM 0 HB2 ARG A 88 -2.497 0.013 0.373 1.00 14.11 H new ATOM 0 HB3 ARG A 88 -4.234 0.062 0.603 1.00 14.11 H new ATOM 0 HG2 ARG A 88 -2.134 1.395 2.338 1.00 23.30 H new ATOM 0 HG3 ARG A 88 -3.266 2.185 1.258 1.00 23.30 H new ATOM 0 HD2 ARG A 88 -5.104 0.965 2.693 1.00 73.03 H new ATOM 0 HD3 ARG A 88 -3.823 0.778 3.875 1.00 73.03 H new ATOM 0 HE ARG A 88 -5.327 3.162 3.356 1.00 33.23 H new ATOM 0 HH11 ARG A 88 -2.007 2.126 4.086 1.00 14.05 H new ATOM 0 HH12 ARG A 88 -1.590 3.652 4.872 1.00 14.05 H new ATOM 0 HH21 ARG A 88 -4.794 5.078 4.426 1.00 43.40 H new ATOM 0 HH22 ARG A 88 -3.164 5.318 5.064 1.00 43.40 H new ATOM 1382 N ALA A 89 -5.296 -2.204 1.303 1.00 15.41 N ATOM 1383 CA ALA A 89 -6.119 -3.051 0.475 1.00 64.14 C ATOM 1384 C ALA A 89 -6.547 -2.271 -0.747 1.00 34.54 C ATOM 1385 O ALA A 89 -7.578 -1.597 -0.759 1.00 50.30 O ATOM 1386 CB ALA A 89 -7.323 -3.564 1.235 1.00 75.14 C ATOM 0 H ALA A 89 -5.806 -1.553 1.900 1.00 15.41 H new ATOM 0 HA ALA A 89 -5.540 -3.922 0.170 1.00 64.14 H new ATOM 0 HB1 ALA A 89 -7.922 -4.199 0.582 1.00 75.14 H new ATOM 0 HB2 ALA A 89 -6.990 -4.142 2.097 1.00 75.14 H new ATOM 0 HB3 ALA A 89 -7.926 -2.721 1.574 1.00 75.14 H new ATOM 1392 N VAL A 90 -5.736 -2.374 -1.771 1.00 55.43 N ATOM 1393 CA VAL A 90 -5.966 -1.669 -3.012 1.00 15.13 C ATOM 1394 C VAL A 90 -6.952 -2.457 -3.859 1.00 52.15 C ATOM 1395 O VAL A 90 -7.102 -3.667 -3.671 1.00 71.21 O ATOM 1396 CB VAL A 90 -4.637 -1.474 -3.778 1.00 55.44 C ATOM 1397 CG1 VAL A 90 -4.798 -0.535 -4.956 1.00 60.32 C ATOM 1398 CG2 VAL A 90 -3.559 -0.950 -2.843 1.00 75.34 C ATOM 0 H VAL A 90 -4.895 -2.951 -1.769 1.00 55.43 H new ATOM 0 HA VAL A 90 -6.380 -0.684 -2.795 1.00 15.13 H new ATOM 0 HB VAL A 90 -4.339 -2.448 -4.165 1.00 55.44 H new ATOM 0 HG11 VAL A 90 -3.842 -0.425 -5.467 1.00 60.32 H new ATOM 0 HG12 VAL A 90 -5.535 -0.943 -5.648 1.00 60.32 H new ATOM 0 HG13 VAL A 90 -5.134 0.439 -4.601 1.00 60.32 H new ATOM 0 HG21 VAL A 90 -2.630 -0.818 -3.397 1.00 75.34 H new ATOM 0 HG22 VAL A 90 -3.872 0.007 -2.427 1.00 75.34 H new ATOM 0 HG23 VAL A 90 -3.401 -1.663 -2.034 1.00 75.34 H new ATOM 1408 N SER A 91 -7.634 -1.767 -4.765 1.00 43.33 N ATOM 1409 CA SER A 91 -8.551 -2.407 -5.694 1.00 51.44 C ATOM 1410 C SER A 91 -7.827 -3.515 -6.460 1.00 45.02 C ATOM 1411 O SER A 91 -6.623 -3.412 -6.724 1.00 4.33 O ATOM 1412 CB SER A 91 -9.108 -1.360 -6.661 1.00 70.12 C ATOM 1413 OG SER A 91 -10.021 -1.929 -7.580 1.00 41.33 O ATOM 0 H SER A 91 -7.567 -0.755 -4.875 1.00 43.33 H new ATOM 0 HA SER A 91 -9.378 -2.854 -5.142 1.00 51.44 H new ATOM 0 HB2 SER A 91 -9.604 -0.571 -6.096 1.00 70.12 H new ATOM 0 HB3 SER A 91 -8.287 -0.894 -7.205 1.00 70.12 H new ATOM 0 HG SER A 91 -10.031 -1.397 -8.403 1.00 41.33 H new ATOM 1419 N ARG A 92 -8.565 -4.567 -6.821 1.00 43.02 N ATOM 1420 CA ARG A 92 -7.977 -5.773 -7.410 1.00 64.15 C ATOM 1421 C ARG A 92 -7.378 -5.502 -8.793 1.00 14.53 C ATOM 1422 O ARG A 92 -6.741 -6.367 -9.389 1.00 21.42 O ATOM 1423 CB ARG A 92 -9.025 -6.889 -7.476 1.00 63.31 C ATOM 1424 CG ARG A 92 -8.444 -8.281 -7.685 1.00 40.02 C ATOM 1425 CD ARG A 92 -7.561 -8.712 -6.521 1.00 25.23 C ATOM 1426 NE ARG A 92 -8.285 -8.710 -5.249 1.00 31.45 N ATOM 1427 CZ ARG A 92 -8.018 -9.520 -4.224 1.00 60.43 C ATOM 1428 NH1 ARG A 92 -7.038 -10.413 -4.316 1.00 40.44 N ATOM 1429 NH2 ARG A 92 -8.734 -9.435 -3.107 1.00 32.12 N ATOM 0 H ARG A 92 -9.579 -4.608 -6.715 1.00 43.02 H new ATOM 0 HA ARG A 92 -7.157 -6.094 -6.767 1.00 64.15 H new ATOM 0 HB2 ARG A 92 -9.603 -6.884 -6.552 1.00 63.31 H new ATOM 0 HB3 ARG A 92 -9.720 -6.672 -8.288 1.00 63.31 H new ATOM 0 HG2 ARG A 92 -9.256 -8.998 -7.809 1.00 40.02 H new ATOM 0 HG3 ARG A 92 -7.862 -8.296 -8.606 1.00 40.02 H new ATOM 0 HD2 ARG A 92 -7.171 -9.711 -6.714 1.00 25.23 H new ATOM 0 HD3 ARG A 92 -6.703 -8.043 -6.450 1.00 25.23 H new ATOM 0 HE ARG A 92 -9.048 -8.042 -5.139 1.00 31.45 H new ATOM 0 HH11 ARG A 92 -6.488 -10.480 -5.172 1.00 40.44 H new ATOM 0 HH12 ARG A 92 -6.836 -11.031 -3.530 1.00 40.44 H new ATOM 0 HH21 ARG A 92 -9.487 -8.751 -3.035 1.00 32.12 H new ATOM 0 HH22 ARG A 92 -8.530 -10.054 -2.322 1.00 32.12 H new ATOM 1443 N GLU A 93 -7.583 -4.296 -9.291 1.00 33.42 N ATOM 1444 CA GLU A 93 -6.947 -3.844 -10.517 1.00 42.13 C ATOM 1445 C GLU A 93 -5.430 -3.787 -10.337 1.00 75.43 C ATOM 1446 O GLU A 93 -4.676 -4.241 -11.196 1.00 30.22 O ATOM 1447 CB GLU A 93 -7.471 -2.458 -10.889 1.00 13.45 C ATOM 1448 CG GLU A 93 -8.985 -2.358 -10.888 1.00 63.34 C ATOM 1449 CD GLU A 93 -9.463 -0.925 -10.874 1.00 21.42 C ATOM 1450 OE1 GLU A 93 -9.593 -0.348 -9.772 1.00 45.54 O ATOM 1451 OE2 GLU A 93 -9.713 -0.364 -11.960 1.00 62.23 O ATOM 0 H GLU A 93 -8.194 -3.603 -8.859 1.00 33.42 H new ATOM 0 HA GLU A 93 -7.182 -4.548 -11.315 1.00 42.13 H new ATOM 0 HB2 GLU A 93 -7.067 -1.727 -10.189 1.00 13.45 H new ATOM 0 HB3 GLU A 93 -7.099 -2.192 -11.878 1.00 13.45 H new ATOM 0 HG2 GLU A 93 -9.381 -2.863 -11.769 1.00 63.34 H new ATOM 0 HG3 GLU A 93 -9.381 -2.880 -10.017 1.00 63.34 H new ATOM 1458 N ASP A 94 -5.001 -3.252 -9.197 1.00 50.44 N ATOM 1459 CA ASP A 94 -3.581 -3.060 -8.912 1.00 10.31 C ATOM 1460 C ASP A 94 -2.957 -4.333 -8.352 1.00 14.34 C ATOM 1461 O ASP A 94 -1.876 -4.741 -8.777 1.00 43.41 O ATOM 1462 CB ASP A 94 -3.391 -1.913 -7.919 1.00 3.20 C ATOM 1463 CG ASP A 94 -1.929 -1.584 -7.685 1.00 41.34 C ATOM 1464 OD1 ASP A 94 -1.356 -0.822 -8.496 1.00 74.12 O ATOM 1465 OD2 ASP A 94 -1.347 -2.087 -6.700 1.00 23.21 O ATOM 0 H ASP A 94 -5.622 -2.941 -8.450 1.00 50.44 H new ATOM 0 HA ASP A 94 -3.081 -2.813 -9.849 1.00 10.31 H new ATOM 0 HB2 ASP A 94 -3.905 -1.026 -8.290 1.00 3.20 H new ATOM 0 HB3 ASP A 94 -3.857 -2.177 -6.970 1.00 3.20 H new ATOM 1470 N SER A 95 -3.664 -4.977 -7.426 1.00 13.13 N ATOM 1471 CA SER A 95 -3.167 -6.184 -6.767 1.00 71.02 C ATOM 1472 C SER A 95 -3.111 -7.374 -7.725 1.00 71.20 C ATOM 1473 O SER A 95 -2.513 -8.404 -7.409 1.00 25.42 O ATOM 1474 CB SER A 95 -4.046 -6.516 -5.559 1.00 13.54 C ATOM 1475 OG SER A 95 -5.396 -6.158 -5.798 1.00 61.24 O ATOM 0 H SER A 95 -4.589 -4.681 -7.113 1.00 13.13 H new ATOM 0 HA SER A 95 -2.148 -5.987 -6.433 1.00 71.02 H new ATOM 0 HB2 SER A 95 -3.982 -7.582 -5.341 1.00 13.54 H new ATOM 0 HB3 SER A 95 -3.676 -5.988 -4.680 1.00 13.54 H new ATOM 0 HG SER A 95 -5.551 -5.241 -5.489 1.00 61.24 H new ATOM 1481 N GLN A 96 -3.738 -7.222 -8.890 1.00 13.31 N ATOM 1482 CA GLN A 96 -3.703 -8.236 -9.936 1.00 53.35 C ATOM 1483 C GLN A 96 -2.273 -8.475 -10.418 1.00 4.03 C ATOM 1484 O GLN A 96 -1.898 -9.603 -10.736 1.00 64.15 O ATOM 1485 CB GLN A 96 -4.569 -7.778 -11.111 1.00 64.44 C ATOM 1486 CG GLN A 96 -4.703 -8.798 -12.225 1.00 70.03 C ATOM 1487 CD GLN A 96 -5.517 -8.265 -13.385 1.00 23.22 C ATOM 1488 OE1 GLN A 96 -4.975 -7.717 -14.343 1.00 24.02 O ATOM 1489 NE2 GLN A 96 -6.822 -8.389 -13.289 1.00 61.53 N ATOM 0 H GLN A 96 -4.282 -6.394 -9.133 1.00 13.31 H new ATOM 0 HA GLN A 96 -4.088 -9.171 -9.528 1.00 53.35 H new ATOM 0 HB2 GLN A 96 -5.563 -7.531 -10.739 1.00 64.44 H new ATOM 0 HB3 GLN A 96 -4.146 -6.862 -11.523 1.00 64.44 H new ATOM 0 HG2 GLN A 96 -3.712 -9.082 -12.578 1.00 70.03 H new ATOM 0 HG3 GLN A 96 -5.174 -9.701 -11.836 1.00 70.03 H new ATOM 0 HE21 GLN A 96 -7.232 -8.851 -12.477 1.00 61.53 H new ATOM 0 HE22 GLN A 96 -7.425 -8.024 -14.026 1.00 61.53 H new ATOM 1498 N ARG A 97 -1.477 -7.410 -10.443 1.00 41.43 N ATOM 1499 CA ARG A 97 -0.127 -7.470 -10.991 1.00 23.13 C ATOM 1500 C ARG A 97 0.801 -8.280 -10.088 1.00 54.44 C ATOM 1501 O ARG A 97 0.662 -8.269 -8.862 1.00 62.24 O ATOM 1502 CB ARG A 97 0.454 -6.065 -11.217 1.00 31.05 C ATOM 1503 CG ARG A 97 -0.124 -5.328 -12.421 1.00 12.33 C ATOM 1504 CD ARG A 97 -1.562 -4.896 -12.191 1.00 12.25 C ATOM 1505 NE ARG A 97 -2.124 -4.176 -13.338 1.00 61.11 N ATOM 1506 CZ ARG A 97 -2.408 -2.871 -13.342 1.00 62.44 C ATOM 1507 NH1 ARG A 97 -2.174 -2.123 -12.268 1.00 74.44 N ATOM 1508 NH2 ARG A 97 -2.941 -2.315 -14.423 1.00 54.33 N ATOM 0 H ARG A 97 -1.746 -6.492 -10.089 1.00 41.43 H new ATOM 0 HA ARG A 97 -0.197 -7.970 -11.957 1.00 23.13 H new ATOM 0 HB2 ARG A 97 0.281 -5.466 -10.323 1.00 31.05 H new ATOM 0 HB3 ARG A 97 1.534 -6.148 -11.342 1.00 31.05 H new ATOM 0 HG2 ARG A 97 0.487 -4.452 -12.636 1.00 12.33 H new ATOM 0 HG3 ARG A 97 -0.076 -5.974 -13.298 1.00 12.33 H new ATOM 0 HD2 ARG A 97 -2.173 -5.775 -11.983 1.00 12.25 H new ATOM 0 HD3 ARG A 97 -1.609 -4.259 -11.308 1.00 12.25 H new ATOM 0 HE ARG A 97 -2.310 -4.707 -14.189 1.00 61.11 H new ATOM 0 HH11 ARG A 97 -1.774 -2.545 -11.430 1.00 74.44 H new ATOM 0 HH12 ARG A 97 -2.395 -1.127 -12.282 1.00 74.44 H new ATOM 0 HH21 ARG A 97 -3.133 -2.884 -15.247 1.00 54.33 H new ATOM 0 HH22 ARG A 97 -3.159 -1.319 -14.429 1.00 54.33 H new ATOM 1522 N PRO A 98 1.752 -8.996 -10.700 1.00 52.21 N ATOM 1523 CA PRO A 98 2.685 -9.875 -9.986 1.00 71.42 C ATOM 1524 C PRO A 98 3.657 -9.104 -9.095 1.00 23.55 C ATOM 1525 O PRO A 98 4.412 -8.254 -9.573 1.00 21.11 O ATOM 1526 CB PRO A 98 3.444 -10.586 -11.113 1.00 4.12 C ATOM 1527 CG PRO A 98 3.307 -9.706 -12.305 1.00 21.34 C ATOM 1528 CD PRO A 98 1.989 -8.994 -12.154 1.00 2.44 C ATOM 0 HA PRO A 98 2.161 -10.552 -9.311 1.00 71.42 H new ATOM 0 HB2 PRO A 98 4.492 -10.729 -10.850 1.00 4.12 H new ATOM 0 HB3 PRO A 98 3.025 -11.574 -11.305 1.00 4.12 H new ATOM 0 HG2 PRO A 98 4.130 -8.993 -12.359 1.00 21.34 H new ATOM 0 HG3 PRO A 98 3.330 -10.290 -13.225 1.00 21.34 H new ATOM 0 HD2 PRO A 98 2.035 -7.980 -12.550 1.00 2.44 H new ATOM 0 HD3 PRO A 98 1.192 -9.510 -12.690 1.00 2.44 H new ATOM 1536 N GLY A 99 3.615 -9.393 -7.799 1.00 12.45 N ATOM 1537 CA GLY A 99 4.549 -8.790 -6.863 1.00 40.43 C ATOM 1538 C GLY A 99 4.282 -7.318 -6.625 1.00 40.33 C ATOM 1539 O GLY A 99 5.202 -6.554 -6.328 1.00 63.24 O ATOM 0 H GLY A 99 2.947 -10.038 -7.377 1.00 12.45 H new ATOM 0 HA2 GLY A 99 4.496 -9.321 -5.913 1.00 40.43 H new ATOM 0 HA3 GLY A 99 5.564 -8.913 -7.241 1.00 40.43 H new ATOM 1543 N ALA A 100 3.020 -6.923 -6.752 1.00 41.44 N ATOM 1544 CA ALA A 100 2.635 -5.534 -6.559 1.00 4.42 C ATOM 1545 C ALA A 100 2.541 -5.205 -5.076 1.00 13.43 C ATOM 1546 O ALA A 100 3.133 -4.239 -4.610 1.00 11.41 O ATOM 1547 CB ALA A 100 1.315 -5.236 -7.260 1.00 75.02 C ATOM 0 H ALA A 100 2.248 -7.547 -6.988 1.00 41.44 H new ATOM 0 HA ALA A 100 3.405 -4.903 -7.002 1.00 4.42 H new ATOM 0 HB1 ALA A 100 1.047 -4.191 -7.102 1.00 75.02 H new ATOM 0 HB2 ALA A 100 1.419 -5.426 -8.328 1.00 75.02 H new ATOM 0 HB3 ALA A 100 0.533 -5.877 -6.852 1.00 75.02 H new ATOM 1553 N HIS A 101 1.832 -6.042 -4.327 1.00 61.33 N ATOM 1554 CA HIS A 101 1.589 -5.794 -2.904 1.00 15.44 C ATOM 1555 C HIS A 101 2.769 -6.209 -2.024 1.00 32.22 C ATOM 1556 O HIS A 101 2.603 -6.511 -0.842 1.00 24.33 O ATOM 1557 CB HIS A 101 0.306 -6.490 -2.451 1.00 1.13 C ATOM 1558 CG HIS A 101 -0.881 -5.581 -2.489 1.00 14.52 C ATOM 1559 ND1 HIS A 101 -1.395 -5.131 -3.676 1.00 44.23 N ATOM 1560 CD2 HIS A 101 -1.582 -5.034 -1.468 1.00 43.15 C ATOM 1561 CE1 HIS A 101 -2.384 -4.322 -3.351 1.00 24.24 C ATOM 1562 NE2 HIS A 101 -2.534 -4.228 -2.024 1.00 61.43 N ATOM 0 H HIS A 101 1.413 -6.902 -4.680 1.00 61.33 H new ATOM 0 HA HIS A 101 1.471 -4.717 -2.784 1.00 15.44 H new ATOM 0 HB2 HIS A 101 0.119 -7.353 -3.090 1.00 1.13 H new ATOM 0 HB3 HIS A 101 0.439 -6.867 -1.437 1.00 1.13 H new ATOM 0 HD1 HIS A 101 -1.079 -5.372 -4.615 1.00 44.23 H new ATOM 0 HD2 HIS A 101 -1.419 -5.203 -0.414 1.00 43.15 H new ATOM 0 HE1 HIS A 101 -2.999 -3.799 -4.068 1.00 24.24 H new ATOM 1570 N LEU A 102 3.960 -6.219 -2.605 1.00 45.50 N ATOM 1571 CA LEU A 102 5.185 -6.388 -1.844 1.00 71.42 C ATOM 1572 C LEU A 102 5.658 -5.019 -1.368 1.00 73.12 C ATOM 1573 O LEU A 102 4.883 -4.060 -1.364 1.00 30.21 O ATOM 1574 CB LEU A 102 6.250 -7.074 -2.705 1.00 4.12 C ATOM 1575 CG LEU A 102 5.882 -8.475 -3.204 1.00 40.40 C ATOM 1576 CD1 LEU A 102 6.966 -9.012 -4.123 1.00 52.42 C ATOM 1577 CD2 LEU A 102 5.662 -9.424 -2.033 1.00 2.04 C ATOM 0 H LEU A 102 4.102 -6.111 -3.609 1.00 45.50 H new ATOM 0 HA LEU A 102 5.004 -7.023 -0.977 1.00 71.42 H new ATOM 0 HB2 LEU A 102 6.459 -6.442 -3.568 1.00 4.12 H new ATOM 0 HB3 LEU A 102 7.172 -7.142 -2.128 1.00 4.12 H new ATOM 0 HG LEU A 102 4.951 -8.404 -3.767 1.00 40.40 H new ATOM 0 HD11 LEU A 102 6.689 -10.008 -4.469 1.00 52.42 H new ATOM 0 HD12 LEU A 102 7.078 -8.348 -4.980 1.00 52.42 H new ATOM 0 HD13 LEU A 102 7.910 -9.066 -3.580 1.00 52.42 H new ATOM 0 HD21 LEU A 102 5.402 -10.413 -2.410 1.00 2.04 H new ATOM 0 HD22 LEU A 102 6.575 -9.490 -1.442 1.00 2.04 H new ATOM 0 HD23 LEU A 102 4.851 -9.049 -1.408 1.00 2.04 H new ATOM 1589 N THR A 103 6.902 -4.905 -0.940 1.00 41.54 N ATOM 1590 CA THR A 103 7.393 -3.624 -0.469 1.00 62.12 C ATOM 1591 C THR A 103 7.801 -2.732 -1.632 1.00 34.34 C ATOM 1592 O THR A 103 8.943 -2.747 -2.081 1.00 0.33 O ATOM 1593 CB THR A 103 8.553 -3.774 0.525 1.00 11.55 C ATOM 1594 OG1 THR A 103 8.727 -5.151 0.883 1.00 3.01 O ATOM 1595 CG2 THR A 103 8.265 -2.958 1.773 1.00 12.30 C ATOM 0 H THR A 103 7.579 -5.667 -0.909 1.00 41.54 H new ATOM 0 HA THR A 103 6.568 -3.149 0.062 1.00 62.12 H new ATOM 0 HB THR A 103 9.467 -3.413 0.054 1.00 11.55 H new ATOM 0 HG1 THR A 103 8.006 -5.425 1.487 1.00 3.01 H new ATOM 0 HG21 THR A 103 9.090 -3.066 2.477 1.00 12.30 H new ATOM 0 HG22 THR A 103 8.154 -1.908 1.503 1.00 12.30 H new ATOM 0 HG23 THR A 103 7.344 -3.313 2.236 1.00 12.30 H new ATOM 1603 N VAL A 104 6.831 -1.982 -2.121 1.00 71.21 N ATOM 1604 CA VAL A 104 7.023 -1.075 -3.235 1.00 44.30 C ATOM 1605 C VAL A 104 6.828 0.354 -2.766 1.00 42.32 C ATOM 1606 O VAL A 104 5.713 0.737 -2.418 1.00 32.01 O ATOM 1607 CB VAL A 104 6.003 -1.362 -4.356 1.00 3.34 C ATOM 1608 CG1 VAL A 104 6.143 -0.360 -5.489 1.00 3.12 C ATOM 1609 CG2 VAL A 104 6.154 -2.782 -4.866 1.00 44.42 C ATOM 0 H VAL A 104 5.880 -1.986 -1.752 1.00 71.21 H new ATOM 0 HA VAL A 104 8.033 -1.218 -3.620 1.00 44.30 H new ATOM 0 HB VAL A 104 5.002 -1.255 -3.939 1.00 3.34 H new ATOM 0 HG11 VAL A 104 5.412 -0.585 -6.266 1.00 3.12 H new ATOM 0 HG12 VAL A 104 5.969 0.646 -5.108 1.00 3.12 H new ATOM 0 HG13 VAL A 104 7.148 -0.421 -5.907 1.00 3.12 H new ATOM 0 HG21 VAL A 104 5.426 -2.964 -5.656 1.00 44.42 H new ATOM 0 HG22 VAL A 104 7.160 -2.922 -5.261 1.00 44.42 H new ATOM 0 HG23 VAL A 104 5.985 -3.482 -4.048 1.00 44.42 H new ATOM 1619 N LYS A 105 7.894 1.138 -2.709 1.00 15.33 N ATOM 1620 CA LYS A 105 7.764 2.538 -2.346 1.00 13.11 C ATOM 1621 C LYS A 105 7.995 3.430 -3.559 1.00 0.44 C ATOM 1622 O LYS A 105 8.290 4.611 -3.429 1.00 22.32 O ATOM 1623 CB LYS A 105 8.764 2.873 -1.244 1.00 11.31 C ATOM 1624 CG LYS A 105 8.763 1.858 -0.119 1.00 30.24 C ATOM 1625 CD LYS A 105 9.793 2.193 0.932 1.00 31.12 C ATOM 1626 CE LYS A 105 9.897 1.101 1.977 1.00 53.52 C ATOM 1627 NZ LYS A 105 10.789 1.499 3.094 1.00 24.51 N ATOM 0 H LYS A 105 8.847 0.832 -2.907 1.00 15.33 H new ATOM 0 HA LYS A 105 6.753 2.717 -1.981 1.00 13.11 H new ATOM 0 HB2 LYS A 105 9.764 2.931 -1.673 1.00 11.31 H new ATOM 0 HB3 LYS A 105 8.533 3.858 -0.838 1.00 11.31 H new ATOM 0 HG2 LYS A 105 7.774 1.822 0.338 1.00 30.24 H new ATOM 0 HG3 LYS A 105 8.964 0.866 -0.523 1.00 30.24 H new ATOM 0 HD2 LYS A 105 10.764 2.338 0.458 1.00 31.12 H new ATOM 0 HD3 LYS A 105 9.530 3.135 1.414 1.00 31.12 H new ATOM 0 HE2 LYS A 105 8.905 0.873 2.366 1.00 53.52 H new ATOM 0 HE3 LYS A 105 10.276 0.189 1.515 1.00 53.52 H new ATOM 0 HZ1 LYS A 105 10.528 0.971 3.951 1.00 24.51 H new ATOM 0 HZ2 LYS A 105 11.776 1.286 2.843 1.00 24.51 H new ATOM 0 HZ3 LYS A 105 10.689 2.519 3.272 1.00 24.51 H new ATOM 1641 N LYS A 106 7.856 2.857 -4.737 1.00 41.51 N ATOM 1642 CA LYS A 106 8.012 3.607 -5.972 1.00 10.14 C ATOM 1643 C LYS A 106 6.736 3.551 -6.798 1.00 53.22 C ATOM 1644 O LYS A 106 6.081 2.511 -6.866 1.00 42.14 O ATOM 1645 CB LYS A 106 9.194 3.056 -6.770 1.00 45.42 C ATOM 1646 CG LYS A 106 10.490 3.805 -6.521 1.00 0.03 C ATOM 1647 CD LYS A 106 10.618 4.995 -7.454 1.00 11.24 C ATOM 1648 CE LYS A 106 11.060 4.565 -8.842 1.00 2.34 C ATOM 1649 NZ LYS A 106 12.518 4.298 -8.899 1.00 45.21 N ATOM 0 H LYS A 106 7.634 1.870 -4.868 1.00 41.51 H new ATOM 0 HA LYS A 106 8.210 4.650 -5.726 1.00 10.14 H new ATOM 0 HB2 LYS A 106 9.336 2.005 -6.517 1.00 45.42 H new ATOM 0 HB3 LYS A 106 8.957 3.099 -7.833 1.00 45.42 H new ATOM 0 HG2 LYS A 106 10.525 4.145 -5.486 1.00 0.03 H new ATOM 0 HG3 LYS A 106 11.336 3.133 -6.665 1.00 0.03 H new ATOM 0 HD2 LYS A 106 9.661 5.513 -7.519 1.00 11.24 H new ATOM 0 HD3 LYS A 106 11.337 5.705 -7.045 1.00 11.24 H new ATOM 0 HE2 LYS A 106 10.515 3.668 -9.135 1.00 2.34 H new ATOM 0 HE3 LYS A 106 10.805 5.343 -9.562 1.00 2.34 H new ATOM 0 HZ1 LYS A 106 12.798 4.107 -9.882 1.00 45.21 H new ATOM 0 HZ2 LYS A 106 13.037 5.128 -8.547 1.00 45.21 H new ATOM 0 HZ3 LYS A 106 12.743 3.472 -8.308 1.00 45.21 H new ATOM 1663 N ILE A 107 6.364 4.671 -7.411 1.00 4.03 N ATOM 1664 CA ILE A 107 5.194 4.705 -8.281 1.00 54.32 C ATOM 1665 C ILE A 107 5.512 5.342 -9.625 1.00 24.44 C ATOM 1666 O ILE A 107 6.410 6.184 -9.742 1.00 74.01 O ATOM 1667 CB ILE A 107 4.002 5.449 -7.645 1.00 23.40 C ATOM 1668 CG1 ILE A 107 4.482 6.687 -6.898 1.00 13.04 C ATOM 1669 CG2 ILE A 107 3.228 4.523 -6.724 1.00 3.55 C ATOM 1670 CD1 ILE A 107 3.361 7.528 -6.342 1.00 25.21 C ATOM 0 H ILE A 107 6.853 5.562 -7.322 1.00 4.03 H new ATOM 0 HA ILE A 107 4.911 3.663 -8.430 1.00 54.32 H new ATOM 0 HB ILE A 107 3.331 5.774 -8.440 1.00 23.40 H new ATOM 0 HG12 ILE A 107 5.133 6.378 -6.080 1.00 13.04 H new ATOM 0 HG13 ILE A 107 5.083 7.297 -7.572 1.00 13.04 H new ATOM 0 HG21 ILE A 107 2.391 5.064 -6.284 1.00 3.55 H new ATOM 0 HG22 ILE A 107 2.852 3.674 -7.294 1.00 3.55 H new ATOM 0 HG23 ILE A 107 3.885 4.165 -5.932 1.00 3.55 H new ATOM 0 HD11 ILE A 107 3.777 8.392 -5.823 1.00 25.21 H new ATOM 0 HD12 ILE A 107 2.722 7.867 -7.157 1.00 25.21 H new ATOM 0 HD13 ILE A 107 2.773 6.934 -5.643 1.00 25.21 H new ATOM 1682 N PHE A 108 4.772 4.906 -10.630 1.00 22.22 N ATOM 1683 CA PHE A 108 4.932 5.369 -11.995 1.00 61.15 C ATOM 1684 C PHE A 108 3.843 6.380 -12.328 1.00 12.33 C ATOM 1685 O PHE A 108 2.672 6.158 -12.022 1.00 2.01 O ATOM 1686 CB PHE A 108 4.877 4.155 -12.941 1.00 0.34 C ATOM 1687 CG PHE A 108 4.446 4.449 -14.355 1.00 42.22 C ATOM 1688 CD1 PHE A 108 5.373 4.779 -15.329 1.00 74.32 C ATOM 1689 CD2 PHE A 108 3.107 4.377 -14.708 1.00 2.51 C ATOM 1690 CE1 PHE A 108 4.971 5.035 -16.627 1.00 30.30 C ATOM 1691 CE2 PHE A 108 2.699 4.630 -15.999 1.00 53.11 C ATOM 1692 CZ PHE A 108 3.633 4.960 -16.962 1.00 0.33 C ATOM 0 H PHE A 108 4.034 4.211 -10.518 1.00 22.22 H new ATOM 0 HA PHE A 108 5.895 5.865 -12.116 1.00 61.15 H new ATOM 0 HB2 PHE A 108 5.865 3.695 -12.970 1.00 0.34 H new ATOM 0 HB3 PHE A 108 4.194 3.418 -12.518 1.00 0.34 H new ATOM 0 HD1 PHE A 108 6.420 4.837 -15.072 1.00 74.32 H new ATOM 0 HD2 PHE A 108 2.373 4.119 -13.959 1.00 2.51 H new ATOM 0 HE1 PHE A 108 5.703 5.293 -17.378 1.00 30.30 H new ATOM 0 HE2 PHE A 108 1.652 4.571 -16.258 1.00 53.11 H new ATOM 0 HZ PHE A 108 3.317 5.159 -17.975 1.00 0.33 H new ATOM 1702 N VAL A 109 4.237 7.491 -12.928 1.00 62.22 N ATOM 1703 CA VAL A 109 3.291 8.506 -13.369 1.00 0.20 C ATOM 1704 C VAL A 109 3.442 8.718 -14.867 1.00 31.12 C ATOM 1705 O VAL A 109 4.443 9.262 -15.315 1.00 41.15 O ATOM 1706 CB VAL A 109 3.517 9.854 -12.648 1.00 22.21 C ATOM 1707 CG1 VAL A 109 2.389 10.831 -12.949 1.00 70.31 C ATOM 1708 CG2 VAL A 109 3.663 9.649 -11.151 1.00 15.41 C ATOM 0 H VAL A 109 5.213 7.715 -13.123 1.00 62.22 H new ATOM 0 HA VAL A 109 2.288 8.154 -13.127 1.00 0.20 H new ATOM 0 HB VAL A 109 4.445 10.283 -13.026 1.00 22.21 H new ATOM 0 HG11 VAL A 109 2.573 11.771 -12.429 1.00 70.31 H new ATOM 0 HG12 VAL A 109 2.342 11.013 -14.023 1.00 70.31 H new ATOM 0 HG13 VAL A 109 1.442 10.409 -12.611 1.00 70.31 H new ATOM 0 HG21 VAL A 109 3.821 10.612 -10.666 1.00 15.41 H new ATOM 0 HG22 VAL A 109 2.757 9.188 -10.757 1.00 15.41 H new ATOM 0 HG23 VAL A 109 4.516 8.999 -10.954 1.00 15.41 H new ATOM 1718 N GLY A 110 2.459 8.297 -15.639 1.00 72.41 N ATOM 1719 CA GLY A 110 2.574 8.382 -17.079 1.00 54.51 C ATOM 1720 C GLY A 110 1.428 9.128 -17.718 1.00 11.42 C ATOM 1721 O GLY A 110 0.346 9.240 -17.140 1.00 2.12 O ATOM 0 H GLY A 110 1.584 7.898 -15.298 1.00 72.41 H new ATOM 0 HA2 GLY A 110 3.511 8.877 -17.335 1.00 54.51 H new ATOM 0 HA3 GLY A 110 2.622 7.375 -17.494 1.00 54.51 H new ATOM 1725 N GLY A 111 1.670 9.649 -18.910 1.00 4.22 N ATOM 1726 CA GLY A 111 0.641 10.369 -19.625 1.00 23.43 C ATOM 1727 C GLY A 111 0.731 11.858 -19.390 1.00 63.40 C ATOM 1728 O GLY A 111 -0.236 12.589 -19.607 1.00 64.34 O ATOM 0 H GLY A 111 2.565 9.585 -19.396 1.00 4.22 H new ATOM 0 HA2 GLY A 111 0.728 10.164 -20.692 1.00 23.43 H new ATOM 0 HA3 GLY A 111 -0.339 10.010 -19.310 1.00 23.43 H new ATOM 1732 N ILE A 112 1.899 12.308 -18.947 1.00 33.03 N ATOM 1733 CA ILE A 112 2.114 13.716 -18.652 1.00 62.22 C ATOM 1734 C ILE A 112 2.345 14.513 -19.937 1.00 51.24 C ATOM 1735 O ILE A 112 3.283 14.251 -20.695 1.00 45.05 O ATOM 1736 CB ILE A 112 3.292 13.922 -17.662 1.00 25.53 C ATOM 1737 CG1 ILE A 112 4.583 13.274 -18.181 1.00 33.45 C ATOM 1738 CG2 ILE A 112 2.926 13.350 -16.298 1.00 31.12 C ATOM 1739 CD1 ILE A 112 5.789 13.495 -17.290 1.00 51.22 C ATOM 0 H ILE A 112 2.713 11.715 -18.784 1.00 33.03 H new ATOM 0 HA ILE A 112 1.210 14.089 -18.171 1.00 62.22 H new ATOM 0 HB ILE A 112 3.474 14.993 -17.569 1.00 25.53 H new ATOM 0 HG12 ILE A 112 4.419 12.202 -18.293 1.00 33.45 H new ATOM 0 HG13 ILE A 112 4.801 13.668 -19.173 1.00 33.45 H new ATOM 0 HG21 ILE A 112 3.756 13.497 -15.607 1.00 31.12 H new ATOM 0 HG22 ILE A 112 2.041 13.859 -15.916 1.00 31.12 H new ATOM 0 HG23 ILE A 112 2.719 12.284 -16.394 1.00 31.12 H new ATOM 0 HD11 ILE A 112 6.659 13.006 -17.727 1.00 51.22 H new ATOM 0 HD12 ILE A 112 5.982 14.564 -17.198 1.00 51.22 H new ATOM 0 HD13 ILE A 112 5.594 13.075 -16.303 1.00 51.22 H new ATOM 1751 N LYS A 113 1.458 15.465 -20.199 1.00 13.54 N ATOM 1752 CA LYS A 113 1.546 16.288 -21.398 1.00 11.22 C ATOM 1753 C LYS A 113 2.607 17.367 -21.235 1.00 34.40 C ATOM 1754 O LYS A 113 3.657 17.314 -21.874 1.00 22.20 O ATOM 1755 CB LYS A 113 0.188 16.917 -21.713 1.00 52.24 C ATOM 1756 CG LYS A 113 -0.872 15.903 -22.124 1.00 63.12 C ATOM 1757 CD LYS A 113 -2.222 16.560 -22.367 1.00 44.25 C ATOM 1758 CE LYS A 113 -2.831 17.090 -21.079 1.00 24.30 C ATOM 1759 NZ LYS A 113 -4.121 17.789 -21.322 1.00 12.22 N ATOM 0 H LYS A 113 0.667 15.686 -19.595 1.00 13.54 H new ATOM 0 HA LYS A 113 1.835 15.648 -22.232 1.00 11.22 H new ATOM 0 HB2 LYS A 113 -0.163 17.462 -20.837 1.00 52.24 H new ATOM 0 HB3 LYS A 113 0.311 17.646 -22.514 1.00 52.24 H new ATOM 0 HG2 LYS A 113 -0.550 15.389 -23.030 1.00 63.12 H new ATOM 0 HG3 LYS A 113 -0.971 15.146 -21.346 1.00 63.12 H new ATOM 0 HD2 LYS A 113 -2.106 17.378 -23.078 1.00 44.25 H new ATOM 0 HD3 LYS A 113 -2.901 15.838 -22.820 1.00 44.25 H new ATOM 0 HE2 LYS A 113 -2.991 16.264 -20.386 1.00 24.30 H new ATOM 0 HE3 LYS A 113 -2.131 17.776 -20.602 1.00 24.30 H new ATOM 0 HZ1 LYS A 113 -4.504 18.135 -20.419 1.00 12.22 H new ATOM 0 HZ2 LYS A 113 -3.965 18.593 -21.963 1.00 12.22 H new ATOM 0 HZ3 LYS A 113 -4.798 17.128 -21.754 1.00 12.22 H new ATOM 1773 N GLU A 114 2.340 18.334 -20.370 1.00 31.52 N ATOM 1774 CA GLU A 114 3.301 19.388 -20.095 1.00 22.15 C ATOM 1775 C GLU A 114 4.464 18.827 -19.278 1.00 53.40 C ATOM 1776 O GLU A 114 4.316 17.813 -18.588 1.00 0.03 O ATOM 1777 CB GLU A 114 2.616 20.540 -19.347 1.00 1.10 C ATOM 1778 CG GLU A 114 3.483 21.775 -19.155 1.00 2.53 C ATOM 1779 CD GLU A 114 4.050 22.298 -20.460 1.00 61.51 C ATOM 1780 OE1 GLU A 114 3.371 23.095 -21.133 1.00 74.33 O ATOM 1781 OE2 GLU A 114 5.178 21.911 -20.823 1.00 13.10 O ATOM 0 H GLU A 114 1.467 18.409 -19.848 1.00 31.52 H new ATOM 0 HA GLU A 114 3.693 19.775 -21.036 1.00 22.15 H new ATOM 0 HB2 GLU A 114 1.716 20.825 -19.892 1.00 1.10 H new ATOM 0 HB3 GLU A 114 2.296 20.181 -18.369 1.00 1.10 H new ATOM 0 HG2 GLU A 114 2.893 22.558 -18.680 1.00 2.53 H new ATOM 0 HG3 GLU A 114 4.302 21.537 -18.477 1.00 2.53 H new ATOM 1788 N ASP A 115 5.616 19.481 -19.391 1.00 51.50 N ATOM 1789 CA ASP A 115 6.814 19.107 -18.655 1.00 73.31 C ATOM 1790 C ASP A 115 6.555 19.157 -17.153 1.00 73.14 C ATOM 1791 O ASP A 115 6.443 20.234 -16.564 1.00 13.31 O ATOM 1792 CB ASP A 115 7.958 20.048 -19.031 1.00 1.42 C ATOM 1793 CG ASP A 115 9.222 19.765 -18.255 1.00 30.54 C ATOM 1794 OD1 ASP A 115 9.890 18.759 -18.560 1.00 71.34 O ATOM 1795 OD2 ASP A 115 9.569 20.562 -17.355 1.00 14.11 O ATOM 0 H ASP A 115 5.743 20.290 -20.000 1.00 51.50 H new ATOM 0 HA ASP A 115 7.090 18.086 -18.918 1.00 73.31 H new ATOM 0 HB2 ASP A 115 8.163 19.957 -20.098 1.00 1.42 H new ATOM 0 HB3 ASP A 115 7.650 21.078 -18.853 1.00 1.42 H new ATOM 1800 N THR A 116 6.413 17.986 -16.553 1.00 35.10 N ATOM 1801 CA THR A 116 6.145 17.894 -15.134 1.00 3.14 C ATOM 1802 C THR A 116 7.429 18.076 -14.340 1.00 14.13 C ATOM 1803 O THR A 116 8.459 17.472 -14.645 1.00 10.12 O ATOM 1804 CB THR A 116 5.491 16.547 -14.777 1.00 15.01 C ATOM 1805 OG1 THR A 116 4.451 16.269 -15.720 1.00 41.10 O ATOM 1806 CG2 THR A 116 4.907 16.575 -13.366 1.00 10.12 C ATOM 0 H THR A 116 6.480 17.087 -17.031 1.00 35.10 H new ATOM 0 HA THR A 116 5.448 18.691 -14.873 1.00 3.14 H new ATOM 0 HB THR A 116 6.253 15.768 -14.814 1.00 15.01 H new ATOM 0 HG1 THR A 116 3.751 15.736 -15.288 1.00 41.10 H new ATOM 0 HG21 THR A 116 4.452 15.610 -13.141 1.00 10.12 H new ATOM 0 HG22 THR A 116 5.701 16.777 -12.647 1.00 10.12 H new ATOM 0 HG23 THR A 116 4.151 17.357 -13.301 1.00 10.12 H new ATOM 1814 N GLU A 117 7.349 18.912 -13.327 1.00 73.12 N ATOM 1815 CA GLU A 117 8.503 19.229 -12.514 1.00 40.20 C ATOM 1816 C GLU A 117 8.457 18.464 -11.208 1.00 3.43 C ATOM 1817 O GLU A 117 7.428 17.876 -10.851 1.00 22.34 O ATOM 1818 CB GLU A 117 8.595 20.730 -12.256 1.00 63.41 C ATOM 1819 CG GLU A 117 8.837 21.540 -13.515 1.00 23.10 C ATOM 1820 CD GLU A 117 9.277 22.953 -13.217 1.00 73.20 C ATOM 1821 OE1 GLU A 117 8.417 23.800 -12.905 1.00 44.21 O ATOM 1822 OE2 GLU A 117 10.490 23.229 -13.296 1.00 53.03 O ATOM 0 H GLU A 117 6.491 19.387 -13.046 1.00 73.12 H new ATOM 0 HA GLU A 117 9.396 18.927 -13.061 1.00 40.20 H new ATOM 0 HB2 GLU A 117 7.671 21.068 -11.786 1.00 63.41 H new ATOM 0 HB3 GLU A 117 9.401 20.921 -11.548 1.00 63.41 H new ATOM 0 HG2 GLU A 117 9.597 21.046 -14.120 1.00 23.10 H new ATOM 0 HG3 GLU A 117 7.923 21.565 -14.109 1.00 23.10 H new ATOM 1829 N GLU A 118 9.576 18.470 -10.506 1.00 51.05 N ATOM 1830 CA GLU A 118 9.702 17.765 -9.246 1.00 45.42 C ATOM 1831 C GLU A 118 8.714 18.320 -8.225 1.00 22.25 C ATOM 1832 O GLU A 118 7.971 17.566 -7.606 1.00 34.23 O ATOM 1833 CB GLU A 118 11.155 17.861 -8.756 1.00 3.43 C ATOM 1834 CG GLU A 118 11.375 17.459 -7.304 1.00 70.32 C ATOM 1835 CD GLU A 118 11.263 18.635 -6.350 1.00 35.45 C ATOM 1836 OE1 GLU A 118 11.563 19.773 -6.765 1.00 42.32 O ATOM 1837 OE2 GLU A 118 10.860 18.427 -5.192 1.00 71.13 O ATOM 0 H GLU A 118 10.421 18.963 -10.794 1.00 51.05 H new ATOM 0 HA GLU A 118 9.458 16.711 -9.383 1.00 45.42 H new ATOM 0 HB2 GLU A 118 11.778 17.230 -9.390 1.00 3.43 H new ATOM 0 HB3 GLU A 118 11.500 18.886 -8.889 1.00 3.43 H new ATOM 0 HG2 GLU A 118 10.644 16.700 -7.026 1.00 70.32 H new ATOM 0 HG3 GLU A 118 12.361 17.005 -7.202 1.00 70.32 H new ATOM 1844 N HIS A 119 8.678 19.644 -8.104 1.00 14.14 N ATOM 1845 CA HIS A 119 7.817 20.319 -7.137 1.00 12.14 C ATOM 1846 C HIS A 119 6.340 20.044 -7.427 1.00 15.43 C ATOM 1847 O HIS A 119 5.514 20.063 -6.516 1.00 73.43 O ATOM 1848 CB HIS A 119 8.095 21.829 -7.156 1.00 12.42 C ATOM 1849 CG HIS A 119 7.357 22.607 -6.102 1.00 75.53 C ATOM 1850 ND1 HIS A 119 6.438 23.572 -6.434 1.00 23.45 N ATOM 1851 CD2 HIS A 119 7.438 22.523 -4.753 1.00 42.01 C ATOM 1852 CE1 HIS A 119 5.982 24.050 -5.287 1.00 63.22 C ATOM 1853 NE2 HIS A 119 6.561 23.444 -4.244 1.00 53.33 N ATOM 0 H HIS A 119 9.242 20.277 -8.671 1.00 14.14 H new ATOM 0 HA HIS A 119 8.040 19.927 -6.145 1.00 12.14 H new ATOM 0 HB2 HIS A 119 9.165 21.991 -7.028 1.00 12.42 H new ATOM 0 HB3 HIS A 119 7.828 22.224 -8.136 1.00 12.42 H new ATOM 0 HD2 HIS A 119 8.073 21.857 -4.187 1.00 42.01 H new ATOM 0 HE1 HIS A 119 5.238 24.829 -5.204 1.00 63.22 H new ATOM 0 HE2 HIS A 119 6.383 23.632 -3.257 1.00 53.33 H new ATOM 1861 N HIS A 120 6.023 19.768 -8.689 1.00 73.00 N ATOM 1862 CA HIS A 120 4.647 19.496 -9.096 1.00 72.03 C ATOM 1863 C HIS A 120 4.134 18.229 -8.425 1.00 1.52 C ATOM 1864 O HIS A 120 3.203 18.268 -7.606 1.00 23.13 O ATOM 1865 CB HIS A 120 4.547 19.347 -10.622 1.00 54.11 C ATOM 1866 CG HIS A 120 4.839 20.603 -11.392 1.00 1.32 C ATOM 1867 ND1 HIS A 120 4.868 20.606 -12.765 1.00 54.41 N ATOM 1868 CD2 HIS A 120 5.112 21.854 -10.945 1.00 55.25 C ATOM 1869 CE1 HIS A 120 5.155 21.847 -13.119 1.00 2.13 C ATOM 1870 NE2 HIS A 120 5.310 22.639 -12.050 1.00 40.41 N ATOM 0 H HIS A 120 6.702 19.727 -9.449 1.00 73.00 H new ATOM 0 HA HIS A 120 4.033 20.341 -8.785 1.00 72.03 H new ATOM 0 HB2 HIS A 120 5.239 18.569 -10.944 1.00 54.11 H new ATOM 0 HB3 HIS A 120 3.543 19.006 -10.876 1.00 54.11 H new ATOM 0 HD2 HIS A 120 5.164 22.171 -9.914 1.00 55.25 H new ATOM 0 HE1 HIS A 120 5.252 22.180 -14.142 1.00 2.13 H new ATOM 0 HE2 HIS A 120 5.532 23.634 -12.057 1.00 40.41 H new ATOM 1878 N LEU A 121 4.789 17.111 -8.709 1.00 1.52 N ATOM 1879 CA LEU A 121 4.297 15.836 -8.231 1.00 52.30 C ATOM 1880 C LEU A 121 4.722 15.575 -6.793 1.00 3.33 C ATOM 1881 O LEU A 121 4.030 14.872 -6.069 1.00 3.43 O ATOM 1882 CB LEU A 121 4.716 14.692 -9.165 1.00 71.33 C ATOM 1883 CG LEU A 121 6.218 14.504 -9.400 1.00 61.53 C ATOM 1884 CD1 LEU A 121 6.838 13.628 -8.322 1.00 13.31 C ATOM 1885 CD2 LEU A 121 6.447 13.891 -10.765 1.00 42.22 C ATOM 0 H LEU A 121 5.647 17.065 -9.259 1.00 1.52 H new ATOM 0 HA LEU A 121 3.208 15.880 -8.239 1.00 52.30 H new ATOM 0 HB2 LEU A 121 4.317 13.761 -8.762 1.00 71.33 H new ATOM 0 HB3 LEU A 121 4.239 14.851 -10.132 1.00 71.33 H new ATOM 0 HG LEU A 121 6.698 15.481 -9.355 1.00 61.53 H new ATOM 0 HD11 LEU A 121 7.904 13.513 -8.516 1.00 13.31 H new ATOM 0 HD12 LEU A 121 6.695 14.094 -7.347 1.00 13.31 H new ATOM 0 HD13 LEU A 121 6.360 12.648 -8.330 1.00 13.31 H new ATOM 0 HD21 LEU A 121 7.516 13.758 -10.930 1.00 42.22 H new ATOM 0 HD22 LEU A 121 5.949 12.923 -10.817 1.00 42.22 H new ATOM 0 HD23 LEU A 121 6.041 14.550 -11.533 1.00 42.22 H new ATOM 1897 N ARG A 122 5.839 16.157 -6.366 1.00 33.14 N ATOM 1898 CA ARG A 122 6.301 15.979 -4.993 1.00 2.10 C ATOM 1899 C ARG A 122 5.318 16.605 -4.021 1.00 24.31 C ATOM 1900 O ARG A 122 4.884 15.955 -3.084 1.00 42.40 O ATOM 1901 CB ARG A 122 7.696 16.576 -4.793 1.00 64.01 C ATOM 1902 CG ARG A 122 8.197 16.501 -3.356 1.00 4.10 C ATOM 1903 CD ARG A 122 8.090 17.844 -2.668 1.00 55.54 C ATOM 1904 NE ARG A 122 9.041 18.804 -3.222 1.00 50.14 N ATOM 1905 CZ ARG A 122 9.106 20.084 -2.878 1.00 72.14 C ATOM 1906 NH1 ARG A 122 8.271 20.582 -1.970 1.00 63.52 N ATOM 1907 NH2 ARG A 122 10.008 20.865 -3.458 1.00 45.20 N ATOM 0 H ARG A 122 6.435 16.750 -6.944 1.00 33.14 H new ATOM 0 HA ARG A 122 6.362 14.909 -4.797 1.00 2.10 H new ATOM 0 HB2 ARG A 122 8.400 16.055 -5.441 1.00 64.01 H new ATOM 0 HB3 ARG A 122 7.683 17.619 -5.110 1.00 64.01 H new ATOM 0 HG2 ARG A 122 7.618 15.760 -2.805 1.00 4.10 H new ATOM 0 HG3 ARG A 122 9.234 16.166 -3.347 1.00 4.10 H new ATOM 0 HD2 ARG A 122 7.076 18.230 -2.776 1.00 55.54 H new ATOM 0 HD3 ARG A 122 8.273 17.723 -1.600 1.00 55.54 H new ATOM 0 HE ARG A 122 9.702 18.467 -3.922 1.00 50.14 H new ATOM 0 HH11 ARG A 122 7.574 19.979 -1.533 1.00 63.52 H new ATOM 0 HH12 ARG A 122 8.327 21.567 -1.711 1.00 63.52 H new ATOM 0 HH21 ARG A 122 10.641 20.480 -4.159 1.00 45.20 H new ATOM 0 HH22 ARG A 122 10.069 21.851 -3.203 1.00 45.20 H new ATOM 1921 N ASP A 123 4.951 17.859 -4.266 1.00 61.14 N ATOM 1922 CA ASP A 123 4.009 18.563 -3.398 1.00 22.22 C ATOM 1923 C ASP A 123 2.665 17.837 -3.353 1.00 32.50 C ATOM 1924 O ASP A 123 1.979 17.840 -2.330 1.00 14.33 O ATOM 1925 CB ASP A 123 3.824 20.006 -3.877 1.00 11.35 C ATOM 1926 CG ASP A 123 2.807 20.777 -3.061 1.00 72.23 C ATOM 1927 OD1 ASP A 123 3.075 21.059 -1.874 1.00 74.40 O ATOM 1928 OD2 ASP A 123 1.733 21.110 -3.605 1.00 40.30 O ATOM 0 H ASP A 123 5.290 18.409 -5.056 1.00 61.14 H new ATOM 0 HA ASP A 123 4.419 18.580 -2.388 1.00 22.22 H new ATOM 0 HB2 ASP A 123 4.783 20.523 -3.834 1.00 11.35 H new ATOM 0 HB3 ASP A 123 3.513 19.999 -4.922 1.00 11.35 H new ATOM 1933 N TYR A 124 2.313 17.186 -4.456 1.00 31.25 N ATOM 1934 CA TYR A 124 1.076 16.436 -4.524 1.00 45.01 C ATOM 1935 C TYR A 124 1.175 15.089 -3.792 1.00 4.23 C ATOM 1936 O TYR A 124 0.373 14.800 -2.908 1.00 3.13 O ATOM 1937 CB TYR A 124 0.692 16.221 -5.979 1.00 51.31 C ATOM 1938 CG TYR A 124 -0.513 15.345 -6.127 1.00 32.41 C ATOM 1939 CD1 TYR A 124 -1.765 15.819 -5.783 1.00 71.04 C ATOM 1940 CD2 TYR A 124 -0.394 14.039 -6.571 1.00 0.20 C ATOM 1941 CE1 TYR A 124 -2.875 15.021 -5.884 1.00 42.14 C ATOM 1942 CE2 TYR A 124 -1.505 13.227 -6.670 1.00 73.01 C ATOM 1943 CZ TYR A 124 -2.744 13.731 -6.325 1.00 2.22 C ATOM 1944 OH TYR A 124 -3.858 12.943 -6.409 1.00 63.23 O ATOM 0 H TYR A 124 2.869 17.166 -5.311 1.00 31.25 H new ATOM 0 HA TYR A 124 0.303 17.017 -4.021 1.00 45.01 H new ATOM 0 HB2 TYR A 124 0.496 17.186 -6.447 1.00 51.31 H new ATOM 0 HB3 TYR A 124 1.531 15.773 -6.511 1.00 51.31 H new ATOM 0 HD1 TYR A 124 -1.870 16.834 -5.429 1.00 71.04 H new ATOM 0 HD2 TYR A 124 0.577 13.652 -6.842 1.00 0.20 H new ATOM 0 HE1 TYR A 124 -3.848 15.407 -5.617 1.00 42.14 H new ATOM 0 HE2 TYR A 124 -1.407 12.208 -7.014 1.00 73.01 H new ATOM 0 HH TYR A 124 -3.590 12.012 -6.557 1.00 63.23 H new ATOM 1954 N PHE A 125 2.146 14.267 -4.179 1.00 31.24 N ATOM 1955 CA PHE A 125 2.309 12.925 -3.616 1.00 52.24 C ATOM 1956 C PHE A 125 2.714 12.963 -2.134 1.00 54.41 C ATOM 1957 O PHE A 125 2.475 12.006 -1.402 1.00 20.13 O ATOM 1958 CB PHE A 125 3.342 12.131 -4.428 1.00 13.31 C ATOM 1959 CG PHE A 125 2.854 11.634 -5.769 1.00 23.34 C ATOM 1960 CD1 PHE A 125 1.756 10.788 -5.868 1.00 73.55 C ATOM 1961 CD2 PHE A 125 3.511 12.003 -6.930 1.00 53.14 C ATOM 1962 CE1 PHE A 125 1.327 10.326 -7.105 1.00 11.44 C ATOM 1963 CE2 PHE A 125 3.084 11.545 -8.162 1.00 34.52 C ATOM 1964 CZ PHE A 125 1.993 10.706 -8.247 1.00 70.44 C ATOM 0 H PHE A 125 2.840 14.508 -4.887 1.00 31.24 H new ATOM 0 HA PHE A 125 1.341 12.428 -3.676 1.00 52.24 H new ATOM 0 HB2 PHE A 125 4.218 12.760 -4.587 1.00 13.31 H new ATOM 0 HB3 PHE A 125 3.667 11.275 -3.836 1.00 13.31 H new ATOM 0 HD1 PHE A 125 1.231 10.487 -4.974 1.00 73.55 H new ATOM 0 HD2 PHE A 125 4.368 12.657 -6.872 1.00 53.14 H new ATOM 0 HE1 PHE A 125 0.472 9.669 -7.170 1.00 11.44 H new ATOM 0 HE2 PHE A 125 3.605 11.845 -9.059 1.00 34.52 H new ATOM 0 HZ PHE A 125 1.661 10.347 -9.210 1.00 70.44 H new ATOM 1974 N GLU A 126 3.291 14.085 -1.698 1.00 20.04 N ATOM 1975 CA GLU A 126 3.747 14.245 -0.309 1.00 22.43 C ATOM 1976 C GLU A 126 2.564 14.210 0.657 1.00 14.23 C ATOM 1977 O GLU A 126 2.703 13.824 1.813 1.00 71.31 O ATOM 1978 CB GLU A 126 4.517 15.561 -0.141 1.00 11.11 C ATOM 1979 CG GLU A 126 6.019 15.395 0.048 1.00 41.44 C ATOM 1980 CD GLU A 126 6.402 14.970 1.454 1.00 61.24 C ATOM 1981 OE1 GLU A 126 5.739 15.408 2.415 1.00 41.52 O ATOM 1982 OE2 GLU A 126 7.398 14.229 1.607 1.00 15.11 O ATOM 0 H GLU A 126 3.455 14.901 -2.287 1.00 20.04 H new ATOM 0 HA GLU A 126 4.413 13.414 -0.077 1.00 22.43 H new ATOM 0 HB2 GLU A 126 4.341 16.185 -1.017 1.00 11.11 H new ATOM 0 HB3 GLU A 126 4.113 16.097 0.718 1.00 11.11 H new ATOM 0 HG2 GLU A 126 6.388 14.655 -0.662 1.00 41.44 H new ATOM 0 HG3 GLU A 126 6.514 16.337 -0.187 1.00 41.44 H new ATOM 1989 N GLN A 127 1.397 14.622 0.170 1.00 0.30 N ATOM 1990 CA GLN A 127 0.158 14.562 0.951 1.00 42.21 C ATOM 1991 C GLN A 127 -0.141 13.139 1.435 1.00 31.02 C ATOM 1992 O GLN A 127 -0.800 12.945 2.457 1.00 3.35 O ATOM 1993 CB GLN A 127 -1.023 15.067 0.117 1.00 62.34 C ATOM 1994 CG GLN A 127 -0.804 16.435 -0.513 1.00 45.35 C ATOM 1995 CD GLN A 127 -2.022 16.924 -1.266 1.00 3.51 C ATOM 1996 OE1 GLN A 127 -2.876 17.613 -0.711 1.00 1.13 O ATOM 1997 NE2 GLN A 127 -2.116 16.554 -2.528 1.00 5.43 N ATOM 0 H GLN A 127 1.280 15.004 -0.768 1.00 0.30 H new ATOM 0 HA GLN A 127 0.297 15.201 1.823 1.00 42.21 H new ATOM 0 HB2 GLN A 127 -1.230 14.345 -0.673 1.00 62.34 H new ATOM 0 HB3 GLN A 127 -1.909 15.109 0.751 1.00 62.34 H new ATOM 0 HG2 GLN A 127 -0.548 17.154 0.265 1.00 45.35 H new ATOM 0 HG3 GLN A 127 0.046 16.387 -1.194 1.00 45.35 H new ATOM 0 HE21 GLN A 127 -1.383 15.982 -2.948 1.00 5.43 H new ATOM 0 HE22 GLN A 127 -2.921 16.840 -3.085 1.00 5.43 H new ATOM 2006 N TYR A 128 0.326 12.151 0.683 1.00 13.14 N ATOM 2007 CA TYR A 128 0.105 10.751 1.025 1.00 1.33 C ATOM 2008 C TYR A 128 1.177 10.226 1.983 1.00 14.31 C ATOM 2009 O TYR A 128 0.925 9.290 2.746 1.00 41.21 O ATOM 2010 CB TYR A 128 0.070 9.905 -0.245 1.00 1.42 C ATOM 2011 CG TYR A 128 -1.107 10.214 -1.148 1.00 42.01 C ATOM 2012 CD1 TYR A 128 -1.040 11.226 -2.102 1.00 25.54 C ATOM 2013 CD2 TYR A 128 -2.285 9.487 -1.049 1.00 73.55 C ATOM 2014 CE1 TYR A 128 -2.116 11.500 -2.927 1.00 73.04 C ATOM 2015 CE2 TYR A 128 -3.363 9.755 -1.870 1.00 50.33 C ATOM 2016 CZ TYR A 128 -3.273 10.763 -2.806 1.00 61.44 C ATOM 2017 OH TYR A 128 -4.348 11.034 -3.622 1.00 3.11 O ATOM 0 H TYR A 128 0.863 12.294 -0.172 1.00 13.14 H new ATOM 0 HA TYR A 128 -0.855 10.678 1.535 1.00 1.33 H new ATOM 0 HB2 TYR A 128 0.994 10.061 -0.801 1.00 1.42 H new ATOM 0 HB3 TYR A 128 0.038 8.851 0.031 1.00 1.42 H new ATOM 0 HD1 TYR A 128 -0.134 11.806 -2.199 1.00 25.54 H new ATOM 0 HD2 TYR A 128 -2.360 8.697 -0.316 1.00 73.55 H new ATOM 0 HE1 TYR A 128 -2.049 12.288 -3.662 1.00 73.04 H new ATOM 0 HE2 TYR A 128 -4.271 9.178 -1.779 1.00 50.33 H new ATOM 0 HH TYR A 128 -5.083 10.423 -3.408 1.00 3.11 H new ATOM 2027 N GLY A 129 2.359 10.830 1.938 1.00 32.10 N ATOM 2028 CA GLY A 129 3.445 10.412 2.811 1.00 2.44 C ATOM 2029 C GLY A 129 4.770 11.060 2.465 1.00 74.22 C ATOM 2030 O GLY A 129 4.844 11.891 1.560 1.00 14.43 O ATOM 0 H GLY A 129 2.587 11.603 1.312 1.00 32.10 H new ATOM 0 HA2 GLY A 129 3.188 10.654 3.842 1.00 2.44 H new ATOM 0 HA3 GLY A 129 3.552 9.329 2.755 1.00 2.44 H new ATOM 2034 N LYS A 130 5.824 10.663 3.176 1.00 73.51 N ATOM 2035 CA LYS A 130 7.147 11.252 2.999 1.00 71.31 C ATOM 2036 C LYS A 130 7.820 10.739 1.732 1.00 53.04 C ATOM 2037 O LYS A 130 7.838 9.534 1.464 1.00 53.02 O ATOM 2038 CB LYS A 130 8.032 10.943 4.216 1.00 2.23 C ATOM 2039 CG LYS A 130 9.493 11.332 4.024 1.00 30.14 C ATOM 2040 CD LYS A 130 10.376 10.771 5.125 1.00 71.24 C ATOM 2041 CE LYS A 130 11.847 10.858 4.753 1.00 11.51 C ATOM 2042 NZ LYS A 130 12.673 9.914 5.550 1.00 40.51 N ATOM 0 H LYS A 130 5.785 9.930 3.885 1.00 73.51 H new ATOM 0 HA LYS A 130 7.020 12.330 2.905 1.00 71.31 H new ATOM 0 HB2 LYS A 130 7.636 11.469 5.085 1.00 2.23 H new ATOM 0 HB3 LYS A 130 7.975 9.877 4.435 1.00 2.23 H new ATOM 0 HG2 LYS A 130 9.842 10.968 3.058 1.00 30.14 H new ATOM 0 HG3 LYS A 130 9.580 12.418 4.006 1.00 30.14 H new ATOM 0 HD2 LYS A 130 10.200 11.320 6.050 1.00 71.24 H new ATOM 0 HD3 LYS A 130 10.108 9.732 5.315 1.00 71.24 H new ATOM 0 HE2 LYS A 130 11.967 10.640 3.692 1.00 11.51 H new ATOM 0 HE3 LYS A 130 12.203 11.876 4.912 1.00 11.51 H new ATOM 0 HZ1 LYS A 130 13.644 9.903 5.178 1.00 40.51 H new ATOM 0 HZ2 LYS A 130 12.687 10.219 6.544 1.00 40.51 H new ATOM 0 HZ3 LYS A 130 12.267 8.959 5.486 1.00 40.51 H new ATOM 2056 N ILE A 131 8.392 11.659 0.972 1.00 31.20 N ATOM 2057 CA ILE A 131 9.099 11.320 -0.246 1.00 23.31 C ATOM 2058 C ILE A 131 10.612 11.436 -0.045 1.00 12.24 C ATOM 2059 O ILE A 131 11.092 12.329 0.652 1.00 72.52 O ATOM 2060 CB ILE A 131 8.649 12.219 -1.420 1.00 23.13 C ATOM 2061 CG1 ILE A 131 7.149 12.035 -1.677 1.00 43.53 C ATOM 2062 CG2 ILE A 131 9.449 11.905 -2.675 1.00 51.23 C ATOM 2063 CD1 ILE A 131 6.604 12.903 -2.790 1.00 32.33 C ATOM 0 H ILE A 131 8.378 12.657 1.183 1.00 31.20 H new ATOM 0 HA ILE A 131 8.856 10.286 -0.493 1.00 23.31 H new ATOM 0 HB ILE A 131 8.834 13.259 -1.153 1.00 23.13 H new ATOM 0 HG12 ILE A 131 6.958 10.989 -1.919 1.00 43.53 H new ATOM 0 HG13 ILE A 131 6.604 12.255 -0.759 1.00 43.53 H new ATOM 0 HG21 ILE A 131 9.116 12.549 -3.489 1.00 51.23 H new ATOM 0 HG22 ILE A 131 10.508 12.079 -2.484 1.00 51.23 H new ATOM 0 HG23 ILE A 131 9.297 10.862 -2.952 1.00 51.23 H new ATOM 0 HD11 ILE A 131 5.537 12.714 -2.910 1.00 32.33 H new ATOM 0 HD12 ILE A 131 6.761 13.953 -2.543 1.00 32.33 H new ATOM 0 HD13 ILE A 131 7.121 12.668 -3.721 1.00 32.33 H new ATOM 2075 N GLU A 132 11.343 10.512 -0.653 1.00 32.35 N ATOM 2076 CA GLU A 132 12.796 10.475 -0.559 1.00 14.45 C ATOM 2077 C GLU A 132 13.435 11.261 -1.689 1.00 61.34 C ATOM 2078 O GLU A 132 14.276 12.129 -1.458 1.00 13.54 O ATOM 2079 CB GLU A 132 13.277 9.038 -0.623 1.00 63.01 C ATOM 2080 CG GLU A 132 12.693 8.170 0.464 1.00 22.00 C ATOM 2081 CD GLU A 132 13.641 8.000 1.628 1.00 33.41 C ATOM 2082 OE1 GLU A 132 13.631 8.848 2.543 1.00 21.24 O ATOM 2083 OE2 GLU A 132 14.413 7.019 1.627 1.00 64.33 O ATOM 0 H GLU A 132 10.946 9.767 -1.225 1.00 32.35 H new ATOM 0 HA GLU A 132 13.085 10.926 0.390 1.00 14.45 H new ATOM 0 HB2 GLU A 132 13.018 8.617 -1.594 1.00 63.01 H new ATOM 0 HB3 GLU A 132 14.364 9.021 -0.548 1.00 63.01 H new ATOM 0 HG2 GLU A 132 11.761 8.611 0.818 1.00 22.00 H new ATOM 0 HG3 GLU A 132 12.446 7.191 0.052 1.00 22.00 H new ATOM 2090 N VAL A 133 13.035 10.948 -2.913 1.00 62.50 N ATOM 2091 CA VAL A 133 13.589 11.602 -4.088 1.00 40.50 C ATOM 2092 C VAL A 133 12.598 11.526 -5.251 1.00 31.22 C ATOM 2093 O VAL A 133 11.745 10.638 -5.295 1.00 43.12 O ATOM 2094 CB VAL A 133 14.960 10.991 -4.497 1.00 34.40 C ATOM 2095 CG1 VAL A 133 14.799 9.665 -5.228 1.00 33.53 C ATOM 2096 CG2 VAL A 133 15.765 11.973 -5.338 1.00 33.22 C ATOM 0 H VAL A 133 12.327 10.243 -3.118 1.00 62.50 H new ATOM 0 HA VAL A 133 13.762 12.648 -3.836 1.00 40.50 H new ATOM 0 HB VAL A 133 15.509 10.792 -3.576 1.00 34.40 H new ATOM 0 HG11 VAL A 133 15.781 9.275 -5.495 1.00 33.53 H new ATOM 0 HG12 VAL A 133 14.289 8.952 -4.580 1.00 33.53 H new ATOM 0 HG13 VAL A 133 14.211 9.818 -6.133 1.00 33.53 H new ATOM 0 HG21 VAL A 133 16.719 11.522 -5.611 1.00 33.22 H new ATOM 0 HG22 VAL A 133 15.208 12.219 -6.242 1.00 33.22 H new ATOM 0 HG23 VAL A 133 15.945 12.882 -4.764 1.00 33.22 H new ATOM 2106 N ILE A 134 12.703 12.468 -6.170 1.00 42.22 N ATOM 2107 CA ILE A 134 11.824 12.514 -7.324 1.00 33.32 C ATOM 2108 C ILE A 134 12.624 12.277 -8.589 1.00 0.51 C ATOM 2109 O ILE A 134 13.653 12.914 -8.821 1.00 60.23 O ATOM 2110 CB ILE A 134 11.058 13.860 -7.431 1.00 53.41 C ATOM 2111 CG1 ILE A 134 9.972 13.957 -6.358 1.00 42.13 C ATOM 2112 CG2 ILE A 134 10.434 14.030 -8.811 1.00 75.04 C ATOM 2113 CD1 ILE A 134 10.474 14.390 -5.000 1.00 72.25 C ATOM 0 H ILE A 134 13.394 13.217 -6.139 1.00 42.22 H new ATOM 0 HA ILE A 134 11.081 11.726 -7.198 1.00 33.32 H new ATOM 0 HB ILE A 134 11.782 14.660 -7.275 1.00 53.41 H new ATOM 0 HG12 ILE A 134 9.210 14.661 -6.692 1.00 42.13 H new ATOM 0 HG13 ILE A 134 9.487 12.986 -6.260 1.00 42.13 H new ATOM 0 HG21 ILE A 134 9.904 14.982 -8.856 1.00 75.04 H new ATOM 0 HG22 ILE A 134 11.217 14.014 -9.569 1.00 75.04 H new ATOM 0 HG23 ILE A 134 9.734 13.216 -8.996 1.00 75.04 H new ATOM 0 HD11 ILE A 134 9.639 14.432 -4.300 1.00 72.25 H new ATOM 0 HD12 ILE A 134 11.213 13.674 -4.640 1.00 72.25 H new ATOM 0 HD13 ILE A 134 10.932 15.376 -5.079 1.00 72.25 H new ATOM 2125 N GLU A 135 12.159 11.334 -9.381 1.00 70.03 N ATOM 2126 CA GLU A 135 12.798 11.001 -10.631 1.00 34.14 C ATOM 2127 C GLU A 135 12.001 11.551 -11.810 1.00 41.42 C ATOM 2128 O GLU A 135 10.972 11.002 -12.192 1.00 24.12 O ATOM 2129 CB GLU A 135 12.905 9.481 -10.726 1.00 13.41 C ATOM 2130 CG GLU A 135 14.004 8.902 -9.861 1.00 53.22 C ATOM 2131 CD GLU A 135 14.051 7.394 -9.923 1.00 10.33 C ATOM 2132 OE1 GLU A 135 14.434 6.851 -10.981 1.00 42.21 O ATOM 2133 OE2 GLU A 135 13.697 6.741 -8.920 1.00 72.42 O ATOM 0 H GLU A 135 11.329 10.779 -9.174 1.00 70.03 H new ATOM 0 HA GLU A 135 13.791 11.449 -10.666 1.00 34.14 H new ATOM 0 HB2 GLU A 135 11.952 9.038 -10.436 1.00 13.41 H new ATOM 0 HB3 GLU A 135 13.084 9.201 -11.764 1.00 13.41 H new ATOM 0 HG2 GLU A 135 14.965 9.306 -10.180 1.00 53.22 H new ATOM 0 HG3 GLU A 135 13.853 9.216 -8.828 1.00 53.22 H new ATOM 2140 N ILE A 136 12.485 12.629 -12.398 1.00 73.42 N ATOM 2141 CA ILE A 136 11.857 13.180 -13.585 1.00 2.31 C ATOM 2142 C ILE A 136 12.516 12.582 -14.811 1.00 54.21 C ATOM 2143 O ILE A 136 13.737 12.640 -14.956 1.00 55.31 O ATOM 2144 CB ILE A 136 11.971 14.722 -13.644 1.00 51.43 C ATOM 2145 CG1 ILE A 136 11.383 15.365 -12.377 1.00 21.24 C ATOM 2146 CG2 ILE A 136 11.282 15.268 -14.893 1.00 34.52 C ATOM 2147 CD1 ILE A 136 9.893 15.154 -12.203 1.00 54.34 C ATOM 0 H ILE A 136 13.307 13.139 -12.075 1.00 73.42 H new ATOM 0 HA ILE A 136 10.797 12.930 -13.552 1.00 2.31 H new ATOM 0 HB ILE A 136 13.029 14.980 -13.696 1.00 51.43 H new ATOM 0 HG12 ILE A 136 11.899 14.961 -11.506 1.00 21.24 H new ATOM 0 HG13 ILE A 136 11.586 16.436 -12.400 1.00 21.24 H new ATOM 0 HG21 ILE A 136 11.374 16.354 -14.914 1.00 34.52 H new ATOM 0 HG22 ILE A 136 11.752 14.846 -15.782 1.00 34.52 H new ATOM 0 HG23 ILE A 136 10.227 14.994 -14.876 1.00 34.52 H new ATOM 0 HD11 ILE A 136 9.561 15.640 -11.285 1.00 54.34 H new ATOM 0 HD12 ILE A 136 9.363 15.584 -13.053 1.00 54.34 H new ATOM 0 HD13 ILE A 136 9.681 14.086 -12.145 1.00 54.34 H new ATOM 2159 N MET A 137 11.727 11.986 -15.685 1.00 24.33 N ATOM 2160 CA MET A 137 12.279 11.357 -16.861 1.00 72.13 C ATOM 2161 C MET A 137 12.238 12.326 -18.032 1.00 10.32 C ATOM 2162 O MET A 137 11.166 12.705 -18.515 1.00 12.02 O ATOM 2163 CB MET A 137 11.533 10.062 -17.193 1.00 52.40 C ATOM 2164 CG MET A 137 11.343 9.139 -15.994 1.00 4.33 C ATOM 2165 SD MET A 137 12.866 8.835 -15.075 1.00 51.22 S ATOM 2166 CE MET A 137 13.855 7.994 -16.306 1.00 2.52 C ATOM 0 H MET A 137 10.712 11.926 -15.601 1.00 24.33 H new ATOM 0 HA MET A 137 13.318 11.094 -16.661 1.00 72.13 H new ATOM 0 HB2 MET A 137 10.556 10.312 -17.606 1.00 52.40 H new ATOM 0 HB3 MET A 137 12.080 9.527 -17.969 1.00 52.40 H new ATOM 0 HG2 MET A 137 10.603 9.575 -15.323 1.00 4.33 H new ATOM 0 HG3 MET A 137 10.939 8.187 -16.338 1.00 4.33 H new ATOM 0 HE1 MET A 137 14.784 7.649 -15.852 1.00 2.52 H new ATOM 0 HE2 MET A 137 13.302 7.139 -16.696 1.00 2.52 H new ATOM 0 HE3 MET A 137 14.083 8.681 -17.121 1.00 2.52 H new ATOM 2176 N THR A 138 13.414 12.718 -18.477 1.00 4.52 N ATOM 2177 CA THR A 138 13.542 13.681 -19.546 1.00 43.33 C ATOM 2178 C THR A 138 14.413 13.126 -20.656 1.00 1.30 C ATOM 2179 O THR A 138 15.202 12.207 -20.437 1.00 21.04 O ATOM 2180 CB THR A 138 14.126 15.013 -19.045 1.00 24.33 C ATOM 2181 OG1 THR A 138 14.962 14.792 -17.899 1.00 71.42 O ATOM 2182 CG2 THR A 138 13.021 15.989 -18.688 1.00 21.03 C ATOM 0 H THR A 138 14.303 12.379 -18.109 1.00 4.52 H new ATOM 0 HA THR A 138 12.541 13.874 -19.932 1.00 43.33 H new ATOM 0 HB THR A 138 14.724 15.441 -19.850 1.00 24.33 H new ATOM 0 HG1 THR A 138 15.328 15.647 -17.592 1.00 71.42 H new ATOM 0 HG21 THR A 138 13.460 16.923 -18.337 1.00 21.03 H new ATOM 0 HG22 THR A 138 12.409 16.184 -19.569 1.00 21.03 H new ATOM 0 HG23 THR A 138 12.399 15.562 -17.902 1.00 21.03 H new ATOM 2319 N GLY A 147 7.364 11.543 -21.155 1.00 22.14 N ATOM 2320 CA GLY A 147 5.981 11.116 -21.110 1.00 63.04 C ATOM 2321 C GLY A 147 5.615 10.448 -19.807 1.00 53.34 C ATOM 2322 O GLY A 147 4.445 10.154 -19.565 1.00 54.05 O ATOM 0 HA2 GLY A 147 5.334 11.980 -21.264 1.00 63.04 H new ATOM 0 HA3 GLY A 147 5.792 10.426 -21.932 1.00 63.04 H new ATOM 2326 N PHE A 148 6.603 10.224 -18.954 1.00 0.43 N ATOM 2327 CA PHE A 148 6.373 9.576 -17.681 1.00 3.32 C ATOM 2328 C PHE A 148 7.383 10.080 -16.656 1.00 22.21 C ATOM 2329 O PHE A 148 8.443 10.594 -17.017 1.00 22.05 O ATOM 2330 CB PHE A 148 6.450 8.044 -17.816 1.00 10.14 C ATOM 2331 CG PHE A 148 7.717 7.527 -18.451 1.00 51.35 C ATOM 2332 CD1 PHE A 148 7.821 7.408 -19.828 1.00 43.45 C ATOM 2333 CD2 PHE A 148 8.798 7.152 -17.668 1.00 54.45 C ATOM 2334 CE1 PHE A 148 8.979 6.930 -20.411 1.00 41.40 C ATOM 2335 CE2 PHE A 148 9.957 6.672 -18.247 1.00 3.42 C ATOM 2336 CZ PHE A 148 10.048 6.561 -19.620 1.00 73.10 C ATOM 0 H PHE A 148 7.574 10.484 -19.126 1.00 0.43 H new ATOM 0 HA PHE A 148 5.368 9.826 -17.340 1.00 3.32 H new ATOM 0 HB2 PHE A 148 6.350 7.601 -16.825 1.00 10.14 H new ATOM 0 HB3 PHE A 148 5.599 7.702 -18.406 1.00 10.14 H new ATOM 0 HD1 PHE A 148 6.987 7.692 -20.453 1.00 43.45 H new ATOM 0 HD2 PHE A 148 8.733 7.236 -16.593 1.00 54.45 H new ATOM 0 HE1 PHE A 148 9.048 6.845 -21.485 1.00 41.40 H new ATOM 0 HE2 PHE A 148 10.792 6.384 -17.625 1.00 3.42 H new ATOM 0 HZ PHE A 148 10.953 6.186 -20.074 1.00 73.10 H new ATOM 2346 N ALA A 149 7.031 9.950 -15.393 1.00 61.22 N ATOM 2347 CA ALA A 149 7.890 10.349 -14.297 1.00 0.33 C ATOM 2348 C ALA A 149 7.833 9.304 -13.193 1.00 71.00 C ATOM 2349 O ALA A 149 6.958 8.432 -13.195 1.00 3.41 O ATOM 2350 CB ALA A 149 7.477 11.716 -13.769 1.00 33.34 C ATOM 0 H ALA A 149 6.135 9.562 -15.096 1.00 61.22 H new ATOM 0 HA ALA A 149 8.916 10.422 -14.657 1.00 0.33 H new ATOM 0 HB1 ALA A 149 8.132 12.001 -12.946 1.00 33.34 H new ATOM 0 HB2 ALA A 149 7.556 12.454 -14.568 1.00 33.34 H new ATOM 0 HB3 ALA A 149 6.447 11.673 -13.415 1.00 33.34 H new ATOM 2356 N PHE A 150 8.765 9.392 -12.266 1.00 22.54 N ATOM 2357 CA PHE A 150 8.834 8.468 -11.149 1.00 31.13 C ATOM 2358 C PHE A 150 9.049 9.231 -9.851 1.00 4.22 C ATOM 2359 O PHE A 150 9.578 10.339 -9.846 1.00 62.23 O ATOM 2360 CB PHE A 150 9.972 7.462 -11.346 1.00 21.24 C ATOM 2361 CG PHE A 150 9.704 6.408 -12.381 1.00 11.43 C ATOM 2362 CD1 PHE A 150 8.927 5.302 -12.077 1.00 24.30 C ATOM 2363 CD2 PHE A 150 10.241 6.516 -13.653 1.00 14.23 C ATOM 2364 CE1 PHE A 150 8.690 4.326 -13.025 1.00 73.25 C ATOM 2365 CE2 PHE A 150 10.010 5.543 -14.602 1.00 4.30 C ATOM 2366 CZ PHE A 150 9.233 4.447 -14.289 1.00 4.31 C ATOM 0 H PHE A 150 9.495 10.104 -12.264 1.00 22.54 H new ATOM 0 HA PHE A 150 7.890 7.925 -11.098 1.00 31.13 H new ATOM 0 HB2 PHE A 150 10.875 8.005 -11.625 1.00 21.24 H new ATOM 0 HB3 PHE A 150 10.176 6.973 -10.393 1.00 21.24 H new ATOM 0 HD1 PHE A 150 8.502 5.202 -11.089 1.00 24.30 H new ATOM 0 HD2 PHE A 150 10.848 7.373 -13.905 1.00 14.23 H new ATOM 0 HE1 PHE A 150 8.081 3.469 -12.778 1.00 73.25 H new ATOM 0 HE2 PHE A 150 10.437 5.639 -15.589 1.00 4.30 H new ATOM 0 HZ PHE A 150 9.050 3.684 -15.032 1.00 4.31 H new ATOM 2376 N VAL A 151 8.608 8.651 -8.759 1.00 50.21 N ATOM 2377 CA VAL A 151 8.832 9.239 -7.450 1.00 1.04 C ATOM 2378 C VAL A 151 9.073 8.158 -6.396 1.00 41.02 C ATOM 2379 O VAL A 151 8.356 7.155 -6.330 1.00 32.20 O ATOM 2380 CB VAL A 151 7.666 10.183 -7.043 1.00 75.34 C ATOM 2381 CG1 VAL A 151 6.319 9.511 -7.212 1.00 64.44 C ATOM 2382 CG2 VAL A 151 7.827 10.685 -5.618 1.00 11.10 C ATOM 0 H VAL A 151 8.091 7.772 -8.747 1.00 50.21 H new ATOM 0 HA VAL A 151 9.734 9.848 -7.510 1.00 1.04 H new ATOM 0 HB VAL A 151 7.705 11.040 -7.715 1.00 75.34 H new ATOM 0 HG11 VAL A 151 5.528 10.201 -6.918 1.00 64.44 H new ATOM 0 HG12 VAL A 151 6.183 9.227 -8.255 1.00 64.44 H new ATOM 0 HG13 VAL A 151 6.275 8.621 -6.585 1.00 64.44 H new ATOM 0 HG21 VAL A 151 6.994 11.342 -5.367 1.00 11.10 H new ATOM 0 HG22 VAL A 151 7.839 9.837 -4.933 1.00 11.10 H new ATOM 0 HG23 VAL A 151 8.763 11.236 -5.530 1.00 11.10 H new ATOM 2392 N THR A 152 10.118 8.366 -5.605 1.00 55.13 N ATOM 2393 CA THR A 152 10.530 7.423 -4.581 1.00 4.14 C ATOM 2394 C THR A 152 10.003 7.854 -3.214 1.00 20.10 C ATOM 2395 O THR A 152 10.266 8.968 -2.766 1.00 24.41 O ATOM 2396 CB THR A 152 12.071 7.342 -4.519 1.00 31.25 C ATOM 2397 OG1 THR A 152 12.594 6.816 -5.747 1.00 4.34 O ATOM 2398 CG2 THR A 152 12.535 6.487 -3.353 1.00 51.42 C ATOM 0 H THR A 152 10.704 9.199 -5.659 1.00 55.13 H new ATOM 0 HA THR A 152 10.120 6.446 -4.836 1.00 4.14 H new ATOM 0 HB THR A 152 12.449 8.354 -4.371 1.00 31.25 H new ATOM 0 HG1 THR A 152 13.572 6.772 -5.694 1.00 4.34 H new ATOM 0 HG21 THR A 152 13.624 6.451 -3.339 1.00 51.42 H new ATOM 0 HG22 THR A 152 12.174 6.918 -2.419 1.00 51.42 H new ATOM 0 HG23 THR A 152 12.140 5.477 -3.463 1.00 51.42 H new ATOM 2406 N PHE A 153 9.278 6.970 -2.553 1.00 75.23 N ATOM 2407 CA PHE A 153 8.718 7.257 -1.242 1.00 54.21 C ATOM 2408 C PHE A 153 9.562 6.643 -0.138 1.00 22.43 C ATOM 2409 O PHE A 153 10.360 5.738 -0.381 1.00 24.05 O ATOM 2410 CB PHE A 153 7.297 6.721 -1.149 1.00 75.51 C ATOM 2411 CG PHE A 153 6.254 7.738 -1.480 1.00 74.25 C ATOM 2412 CD1 PHE A 153 5.818 7.914 -2.781 1.00 54.44 C ATOM 2413 CD2 PHE A 153 5.702 8.513 -0.480 1.00 1.40 C ATOM 2414 CE1 PHE A 153 4.844 8.847 -3.071 1.00 43.21 C ATOM 2415 CE2 PHE A 153 4.734 9.447 -0.764 1.00 22.20 C ATOM 2416 CZ PHE A 153 4.303 9.613 -2.058 1.00 42.35 C ATOM 0 H PHE A 153 9.061 6.038 -2.906 1.00 75.23 H new ATOM 0 HA PHE A 153 8.710 8.339 -1.113 1.00 54.21 H new ATOM 0 HB2 PHE A 153 7.192 5.872 -1.824 1.00 75.51 H new ATOM 0 HB3 PHE A 153 7.123 6.349 -0.139 1.00 75.51 H new ATOM 0 HD1 PHE A 153 6.243 7.317 -3.575 1.00 54.44 H new ATOM 0 HD2 PHE A 153 6.035 8.384 0.539 1.00 1.40 H new ATOM 0 HE1 PHE A 153 4.506 8.978 -4.088 1.00 43.21 H new ATOM 0 HE2 PHE A 153 4.313 10.049 0.028 1.00 22.20 H new ATOM 0 HZ PHE A 153 3.540 10.344 -2.283 1.00 42.35 H new ATOM 2426 N ASP A 154 9.378 7.147 1.073 1.00 71.31 N ATOM 2427 CA ASP A 154 10.067 6.630 2.249 1.00 5.45 C ATOM 2428 C ASP A 154 9.421 5.332 2.708 1.00 11.21 C ATOM 2429 O ASP A 154 10.090 4.414 3.194 1.00 32.21 O ATOM 2430 CB ASP A 154 10.013 7.676 3.367 1.00 22.40 C ATOM 2431 CG ASP A 154 10.480 7.160 4.715 1.00 71.22 C ATOM 2432 OD1 ASP A 154 9.654 6.599 5.456 1.00 74.33 O ATOM 2433 OD2 ASP A 154 11.663 7.354 5.055 1.00 34.14 O ATOM 0 H ASP A 154 8.748 7.925 1.270 1.00 71.31 H new ATOM 0 HA ASP A 154 11.108 6.425 1.998 1.00 5.45 H new ATOM 0 HB2 ASP A 154 10.629 8.529 3.083 1.00 22.40 H new ATOM 0 HB3 ASP A 154 8.990 8.039 3.463 1.00 22.40 H new ATOM 2438 N ASP A 155 8.116 5.255 2.520 1.00 15.14 N ATOM 2439 CA ASP A 155 7.358 4.105 2.964 1.00 0.51 C ATOM 2440 C ASP A 155 6.417 3.629 1.869 1.00 61.14 C ATOM 2441 O ASP A 155 6.021 4.405 0.999 1.00 24.13 O ATOM 2442 CB ASP A 155 6.569 4.447 4.224 1.00 64.42 C ATOM 2443 CG ASP A 155 6.256 3.213 5.040 1.00 75.44 C ATOM 2444 OD1 ASP A 155 5.377 2.432 4.627 1.00 54.41 O ATOM 2445 OD2 ASP A 155 6.905 2.998 6.084 1.00 34.12 O ATOM 0 H ASP A 155 7.561 5.978 2.062 1.00 15.14 H new ATOM 0 HA ASP A 155 8.056 3.300 3.193 1.00 0.51 H new ATOM 0 HB2 ASP A 155 7.140 5.150 4.831 1.00 64.42 H new ATOM 0 HB3 ASP A 155 5.640 4.946 3.948 1.00 64.42 H new ATOM 2450 N HIS A 156 6.062 2.350 1.916 1.00 60.42 N ATOM 2451 CA HIS A 156 5.189 1.763 0.908 1.00 22.14 C ATOM 2452 C HIS A 156 3.730 2.109 1.203 1.00 4.34 C ATOM 2453 O HIS A 156 2.887 2.066 0.311 1.00 73.31 O ATOM 2454 CB HIS A 156 5.390 0.234 0.823 1.00 1.11 C ATOM 2455 CG HIS A 156 4.878 -0.540 2.006 1.00 31.15 C ATOM 2456 ND1 HIS A 156 3.534 -0.705 2.233 1.00 43.11 N ATOM 2457 CD2 HIS A 156 5.564 -1.161 2.990 1.00 20.02 C ATOM 2458 CE1 HIS A 156 3.433 -1.408 3.338 1.00 31.12 C ATOM 2459 NE2 HIS A 156 4.637 -1.710 3.830 1.00 71.13 N ATOM 0 H HIS A 156 6.366 1.700 2.641 1.00 60.42 H new ATOM 0 HA HIS A 156 5.452 2.185 -0.062 1.00 22.14 H new ATOM 0 HB2 HIS A 156 4.894 -0.133 -0.075 1.00 1.11 H new ATOM 0 HB3 HIS A 156 6.454 0.028 0.706 1.00 1.11 H new ATOM 0 HD2 HIS A 156 6.638 -1.213 3.093 1.00 20.02 H new ATOM 0 HE1 HIS A 156 2.498 -1.703 3.790 1.00 31.12 H new ATOM 0 HE2 HIS A 156 4.829 -2.249 4.674 1.00 71.13 H new ATOM 2467 N ASP A 157 3.462 2.455 2.467 1.00 75.33 N ATOM 2468 CA ASP A 157 2.124 2.838 2.925 1.00 43.41 C ATOM 2469 C ASP A 157 1.555 3.954 2.067 1.00 41.22 C ATOM 2470 O ASP A 157 0.396 3.911 1.651 1.00 33.30 O ATOM 2471 CB ASP A 157 2.187 3.270 4.405 1.00 25.43 C ATOM 2472 CG ASP A 157 1.314 4.476 4.739 1.00 72.33 C ATOM 2473 OD1 ASP A 157 0.131 4.292 5.093 1.00 74.31 O ATOM 2474 OD2 ASP A 157 1.823 5.620 4.657 1.00 51.22 O ATOM 0 H ASP A 157 4.169 2.477 3.202 1.00 75.33 H new ATOM 0 HA ASP A 157 1.462 1.977 2.832 1.00 43.41 H new ATOM 0 HB2 ASP A 157 1.883 2.431 5.031 1.00 25.43 H new ATOM 0 HB3 ASP A 157 3.221 3.501 4.661 1.00 25.43 H new ATOM 2479 N SER A 158 2.393 4.935 1.781 1.00 12.25 N ATOM 2480 CA SER A 158 1.992 6.094 1.021 1.00 35.33 C ATOM 2481 C SER A 158 1.779 5.740 -0.449 1.00 22.21 C ATOM 2482 O SER A 158 0.873 6.269 -1.092 1.00 32.23 O ATOM 2483 CB SER A 158 3.059 7.161 1.172 1.00 60.35 C ATOM 2484 OG SER A 158 3.567 7.172 2.500 1.00 53.41 O ATOM 0 H SER A 158 3.371 4.945 2.072 1.00 12.25 H new ATOM 0 HA SER A 158 1.041 6.468 1.401 1.00 35.33 H new ATOM 0 HB2 SER A 158 3.870 6.975 0.468 1.00 60.35 H new ATOM 0 HB3 SER A 158 2.642 8.138 0.928 1.00 60.35 H new ATOM 0 HG SER A 158 4.492 7.496 2.494 1.00 53.41 H new ATOM 2490 N VAL A 159 2.569 4.796 -0.955 1.00 2.44 N ATOM 2491 CA VAL A 159 2.479 4.389 -2.346 1.00 24.04 C ATOM 2492 C VAL A 159 1.210 3.581 -2.563 1.00 3.42 C ATOM 2493 O VAL A 159 0.525 3.726 -3.581 1.00 41.11 O ATOM 2494 CB VAL A 159 3.730 3.573 -2.750 1.00 15.42 C ATOM 2495 CG1 VAL A 159 3.438 2.560 -3.851 1.00 52.43 C ATOM 2496 CG2 VAL A 159 4.831 4.518 -3.181 1.00 30.34 C ATOM 0 H VAL A 159 3.279 4.300 -0.417 1.00 2.44 H new ATOM 0 HA VAL A 159 2.438 5.277 -2.977 1.00 24.04 H new ATOM 0 HB VAL A 159 4.049 3.003 -1.877 1.00 15.42 H new ATOM 0 HG11 VAL A 159 4.350 2.015 -4.096 1.00 52.43 H new ATOM 0 HG12 VAL A 159 2.678 1.859 -3.508 1.00 52.43 H new ATOM 0 HG13 VAL A 159 3.077 3.081 -4.738 1.00 52.43 H new ATOM 0 HG21 VAL A 159 5.713 3.944 -3.466 1.00 30.34 H new ATOM 0 HG22 VAL A 159 4.492 5.108 -4.032 1.00 30.34 H new ATOM 0 HG23 VAL A 159 5.083 5.184 -2.356 1.00 30.34 H new ATOM 2506 N ASP A 160 0.882 2.770 -1.573 1.00 43.33 N ATOM 2507 CA ASP A 160 -0.280 1.911 -1.637 1.00 41.03 C ATOM 2508 C ASP A 160 -1.571 2.722 -1.523 1.00 12.02 C ATOM 2509 O ASP A 160 -2.623 2.289 -1.986 1.00 74.34 O ATOM 2510 CB ASP A 160 -0.193 0.855 -0.542 1.00 12.13 C ATOM 2511 CG ASP A 160 -0.388 -0.547 -1.085 1.00 74.11 C ATOM 2512 OD1 ASP A 160 -0.271 -0.734 -2.315 1.00 54.20 O ATOM 2513 OD2 ASP A 160 -0.646 -1.464 -0.285 1.00 63.34 O ATOM 0 H ASP A 160 1.414 2.691 -0.706 1.00 43.33 H new ATOM 0 HA ASP A 160 -0.299 1.412 -2.606 1.00 41.03 H new ATOM 0 HB2 ASP A 160 0.778 0.921 -0.051 1.00 12.13 H new ATOM 0 HB3 ASP A 160 -0.948 1.058 0.217 1.00 12.13 H new ATOM 2518 N LYS A 161 -1.484 3.910 -0.914 1.00 60.13 N ATOM 2519 CA LYS A 161 -2.613 4.848 -0.894 1.00 54.42 C ATOM 2520 C LYS A 161 -2.872 5.386 -2.294 1.00 53.34 C ATOM 2521 O LYS A 161 -4.014 5.562 -2.717 1.00 34.22 O ATOM 2522 CB LYS A 161 -2.328 6.052 0.010 1.00 52.13 C ATOM 2523 CG LYS A 161 -2.083 5.729 1.471 1.00 32.03 C ATOM 2524 CD LYS A 161 -1.723 6.989 2.244 1.00 40.40 C ATOM 2525 CE LYS A 161 -1.244 6.666 3.643 1.00 51.40 C ATOM 2526 NZ LYS A 161 -0.966 7.888 4.439 1.00 41.01 N ATOM 0 H LYS A 161 -0.650 4.244 -0.431 1.00 60.13 H new ATOM 0 HA LYS A 161 -3.475 4.298 -0.517 1.00 54.42 H new ATOM 0 HB2 LYS A 161 -1.456 6.578 -0.379 1.00 52.13 H new ATOM 0 HB3 LYS A 161 -3.170 6.741 -0.055 1.00 52.13 H new ATOM 0 HG2 LYS A 161 -2.974 5.273 1.903 1.00 32.03 H new ATOM 0 HG3 LYS A 161 -1.278 5.000 1.558 1.00 32.03 H new ATOM 0 HD2 LYS A 161 -0.946 7.535 1.710 1.00 40.40 H new ATOM 0 HD3 LYS A 161 -2.592 7.644 2.299 1.00 40.40 H new ATOM 0 HE2 LYS A 161 -1.998 6.066 4.153 1.00 51.40 H new ATOM 0 HE3 LYS A 161 -0.340 6.060 3.584 1.00 51.40 H new ATOM 0 HZ1 LYS A 161 -0.756 7.622 5.422 1.00 41.01 H new ATOM 0 HZ2 LYS A 161 -0.149 8.388 4.034 1.00 41.01 H new ATOM 0 HZ3 LYS A 161 -1.798 8.512 4.420 1.00 41.01 H new ATOM 2540 N ILE A 162 -1.784 5.645 -3.000 1.00 62.15 N ATOM 2541 CA ILE A 162 -1.828 6.317 -4.285 1.00 22.24 C ATOM 2542 C ILE A 162 -2.302 5.399 -5.409 1.00 14.24 C ATOM 2543 O ILE A 162 -3.135 5.791 -6.222 1.00 12.54 O ATOM 2544 CB ILE A 162 -0.440 6.894 -4.613 1.00 72.31 C ATOM 2545 CG1 ILE A 162 -0.146 8.067 -3.689 1.00 75.34 C ATOM 2546 CG2 ILE A 162 -0.354 7.326 -6.062 1.00 34.30 C ATOM 2547 CD1 ILE A 162 1.321 8.269 -3.426 1.00 11.32 C ATOM 0 H ILE A 162 -0.843 5.394 -2.696 1.00 62.15 H new ATOM 0 HA ILE A 162 -2.556 7.124 -4.210 1.00 22.24 H new ATOM 0 HB ILE A 162 0.306 6.115 -4.457 1.00 72.31 H new ATOM 0 HG12 ILE A 162 -0.557 8.976 -4.127 1.00 75.34 H new ATOM 0 HG13 ILE A 162 -0.659 7.910 -2.740 1.00 75.34 H new ATOM 0 HG21 ILE A 162 0.638 7.729 -6.263 1.00 34.30 H new ATOM 0 HG22 ILE A 162 -0.535 6.468 -6.709 1.00 34.30 H new ATOM 0 HG23 ILE A 162 -1.104 8.092 -6.258 1.00 34.30 H new ATOM 0 HD11 ILE A 162 1.457 9.121 -2.760 1.00 11.32 H new ATOM 0 HD12 ILE A 162 1.734 7.374 -2.959 1.00 11.32 H new ATOM 0 HD13 ILE A 162 1.837 8.458 -4.367 1.00 11.32 H new ATOM 2559 N VAL A 163 -1.832 4.161 -5.416 1.00 44.12 N ATOM 2560 CA VAL A 163 -2.129 3.240 -6.519 1.00 34.13 C ATOM 2561 C VAL A 163 -3.578 2.750 -6.462 1.00 3.43 C ATOM 2562 O VAL A 163 -4.045 2.039 -7.356 1.00 23.45 O ATOM 2563 CB VAL A 163 -1.170 2.037 -6.524 1.00 43.20 C ATOM 2564 CG1 VAL A 163 0.253 2.515 -6.731 1.00 72.02 C ATOM 2565 CG2 VAL A 163 -1.287 1.241 -5.233 1.00 32.02 C ATOM 0 H VAL A 163 -1.247 3.767 -4.679 1.00 44.12 H new ATOM 0 HA VAL A 163 -1.987 3.799 -7.444 1.00 34.13 H new ATOM 0 HB VAL A 163 -1.445 1.377 -7.347 1.00 43.20 H new ATOM 0 HG11 VAL A 163 0.928 1.659 -6.734 1.00 72.02 H new ATOM 0 HG12 VAL A 163 0.326 3.038 -7.685 1.00 72.02 H new ATOM 0 HG13 VAL A 163 0.530 3.193 -5.924 1.00 72.02 H new ATOM 0 HG21 VAL A 163 -0.599 0.396 -5.263 1.00 32.02 H new ATOM 0 HG22 VAL A 163 -1.039 1.882 -4.387 1.00 32.02 H new ATOM 0 HG23 VAL A 163 -2.307 0.874 -5.123 1.00 32.02 H new ATOM 2575 N ILE A 164 -4.269 3.135 -5.392 1.00 63.12 N ATOM 2576 CA ILE A 164 -5.702 2.917 -5.252 1.00 32.14 C ATOM 2577 C ILE A 164 -6.460 3.656 -6.352 1.00 41.21 C ATOM 2578 O ILE A 164 -7.475 3.178 -6.861 1.00 51.11 O ATOM 2579 CB ILE A 164 -6.180 3.376 -3.848 1.00 25.14 C ATOM 2580 CG1 ILE A 164 -5.755 2.347 -2.795 1.00 23.32 C ATOM 2581 CG2 ILE A 164 -7.687 3.594 -3.815 1.00 61.32 C ATOM 2582 CD1 ILE A 164 -5.921 2.817 -1.366 1.00 15.53 C ATOM 0 H ILE A 164 -3.846 3.610 -4.594 1.00 63.12 H new ATOM 0 HA ILE A 164 -5.908 1.851 -5.353 1.00 32.14 H new ATOM 0 HB ILE A 164 -5.710 4.333 -3.621 1.00 25.14 H new ATOM 0 HG12 ILE A 164 -6.338 1.437 -2.936 1.00 23.32 H new ATOM 0 HG13 ILE A 164 -4.710 2.085 -2.960 1.00 23.32 H new ATOM 0 HG21 ILE A 164 -7.986 3.915 -2.817 1.00 61.32 H new ATOM 0 HG22 ILE A 164 -7.960 4.361 -4.540 1.00 61.32 H new ATOM 0 HG23 ILE A 164 -8.195 2.662 -4.064 1.00 61.32 H new ATOM 0 HD11 ILE A 164 -5.598 2.030 -0.684 1.00 15.53 H new ATOM 0 HD12 ILE A 164 -5.316 3.709 -1.204 1.00 15.53 H new ATOM 0 HD13 ILE A 164 -6.969 3.051 -1.179 1.00 15.53 H new ATOM 2594 N GLN A 165 -5.930 4.801 -6.746 1.00 12.25 N ATOM 2595 CA GLN A 165 -6.531 5.600 -7.796 1.00 74.43 C ATOM 2596 C GLN A 165 -5.639 5.557 -9.030 1.00 74.12 C ATOM 2597 O GLN A 165 -4.541 6.109 -9.026 1.00 64.13 O ATOM 2598 CB GLN A 165 -6.726 7.042 -7.321 1.00 1.25 C ATOM 2599 CG GLN A 165 -7.382 7.147 -5.951 1.00 31.22 C ATOM 2600 CD GLN A 165 -7.522 8.578 -5.478 1.00 63.44 C ATOM 2601 OE1 GLN A 165 -7.689 9.498 -6.276 1.00 74.22 O ATOM 2602 NE2 GLN A 165 -7.442 8.779 -4.173 1.00 35.11 N ATOM 0 H GLN A 165 -5.078 5.199 -6.350 1.00 12.25 H new ATOM 0 HA GLN A 165 -7.510 5.193 -8.048 1.00 74.43 H new ATOM 0 HB2 GLN A 165 -5.757 7.540 -7.290 1.00 1.25 H new ATOM 0 HB3 GLN A 165 -7.336 7.577 -8.049 1.00 1.25 H new ATOM 0 HG2 GLN A 165 -8.368 6.683 -5.988 1.00 31.22 H new ATOM 0 HG3 GLN A 165 -6.792 6.585 -5.226 1.00 31.22 H new ATOM 0 HE21 GLN A 165 -7.303 7.989 -3.543 1.00 35.11 H new ATOM 0 HE22 GLN A 165 -7.519 9.724 -3.797 1.00 35.11 H new ATOM 2611 N LYS A 166 -6.106 4.856 -10.059 1.00 41.20 N ATOM 2612 CA LYS A 166 -5.345 4.668 -11.298 1.00 41.23 C ATOM 2613 C LYS A 166 -4.928 5.994 -11.942 1.00 25.22 C ATOM 2614 O LYS A 166 -3.879 6.081 -12.574 1.00 31.14 O ATOM 2615 CB LYS A 166 -6.165 3.842 -12.288 1.00 21.05 C ATOM 2616 CG LYS A 166 -5.403 3.480 -13.549 1.00 64.14 C ATOM 2617 CD LYS A 166 -6.231 2.608 -14.474 1.00 23.24 C ATOM 2618 CE LYS A 166 -6.528 1.250 -13.856 1.00 75.44 C ATOM 2619 NZ LYS A 166 -7.134 0.321 -14.842 1.00 14.13 N ATOM 0 H LYS A 166 -7.019 4.402 -10.061 1.00 41.20 H new ATOM 0 HA LYS A 166 -4.429 4.138 -11.037 1.00 41.23 H new ATOM 0 HB2 LYS A 166 -6.497 2.927 -11.798 1.00 21.05 H new ATOM 0 HB3 LYS A 166 -7.060 4.400 -12.561 1.00 21.05 H new ATOM 0 HG2 LYS A 166 -5.111 4.391 -14.072 1.00 64.14 H new ATOM 0 HG3 LYS A 166 -4.484 2.958 -13.282 1.00 64.14 H new ATOM 0 HD2 LYS A 166 -7.168 3.114 -14.708 1.00 23.24 H new ATOM 0 HD3 LYS A 166 -5.700 2.470 -15.416 1.00 23.24 H new ATOM 0 HE2 LYS A 166 -5.606 0.818 -13.467 1.00 75.44 H new ATOM 0 HE3 LYS A 166 -7.204 1.375 -13.010 1.00 75.44 H new ATOM 0 HZ1 LYS A 166 -7.323 -0.594 -14.386 1.00 14.13 H new ATOM 0 HZ2 LYS A 166 -8.026 0.723 -15.195 1.00 14.13 H new ATOM 0 HZ3 LYS A 166 -6.478 0.183 -15.637 1.00 14.13 H new ATOM 2633 N TYR A 167 -5.754 7.014 -11.805 1.00 34.41 N ATOM 2634 CA TYR A 167 -5.413 8.332 -12.323 1.00 24.44 C ATOM 2635 C TYR A 167 -5.461 9.375 -11.214 1.00 11.44 C ATOM 2636 O TYR A 167 -6.350 9.341 -10.362 1.00 32.14 O ATOM 2637 CB TYR A 167 -6.367 8.741 -13.448 1.00 21.53 C ATOM 2638 CG TYR A 167 -6.241 7.908 -14.704 1.00 42.14 C ATOM 2639 CD1 TYR A 167 -6.879 6.681 -14.813 1.00 73.15 C ATOM 2640 CD2 TYR A 167 -5.497 8.356 -15.788 1.00 23.50 C ATOM 2641 CE1 TYR A 167 -6.781 5.925 -15.960 1.00 21.11 C ATOM 2642 CE2 TYR A 167 -5.391 7.601 -16.939 1.00 43.44 C ATOM 2643 CZ TYR A 167 -6.039 6.388 -17.020 1.00 34.13 C ATOM 2644 OH TYR A 167 -5.950 5.635 -18.170 1.00 23.34 O ATOM 0 H TYR A 167 -6.662 6.960 -11.343 1.00 34.41 H new ATOM 0 HA TYR A 167 -4.400 8.278 -12.721 1.00 24.44 H new ATOM 0 HB2 TYR A 167 -7.392 8.673 -13.082 1.00 21.53 H new ATOM 0 HB3 TYR A 167 -6.187 9.786 -13.700 1.00 21.53 H new ATOM 0 HD1 TYR A 167 -7.463 6.312 -13.983 1.00 73.15 H new ATOM 0 HD2 TYR A 167 -4.994 9.310 -15.730 1.00 23.50 H new ATOM 0 HE1 TYR A 167 -7.285 4.972 -16.026 1.00 21.11 H new ATOM 0 HE2 TYR A 167 -4.803 7.959 -17.771 1.00 43.44 H new ATOM 0 HH TYR A 167 -5.390 6.102 -18.824 1.00 23.34 H new ATOM 2654 N HIS A 168 -4.501 10.289 -11.228 1.00 32.35 N ATOM 2655 CA HIS A 168 -4.477 11.403 -10.287 1.00 5.24 C ATOM 2656 C HIS A 168 -4.323 12.713 -11.039 1.00 74.42 C ATOM 2657 O HIS A 168 -3.750 12.750 -12.129 1.00 11.22 O ATOM 2658 CB HIS A 168 -3.327 11.265 -9.286 1.00 65.22 C ATOM 2659 CG HIS A 168 -3.495 10.159 -8.294 1.00 24.44 C ATOM 2660 ND1 HIS A 168 -4.170 10.336 -7.112 1.00 61.34 N ATOM 2661 CD2 HIS A 168 -3.042 8.897 -8.350 1.00 71.03 C ATOM 2662 CE1 HIS A 168 -4.109 9.179 -6.484 1.00 32.10 C ATOM 2663 NE2 HIS A 168 -3.432 8.280 -7.199 1.00 35.41 N ATOM 0 H HIS A 168 -3.722 10.281 -11.886 1.00 32.35 H new ATOM 0 HA HIS A 168 -5.419 11.393 -9.739 1.00 5.24 H new ATOM 0 HB2 HIS A 168 -2.400 11.104 -9.837 1.00 65.22 H new ATOM 0 HB3 HIS A 168 -3.217 12.206 -8.747 1.00 65.22 H new ATOM 0 HD2 HIS A 168 -2.475 8.454 -9.155 1.00 71.03 H new ATOM 0 HE1 HIS A 168 -4.549 8.985 -5.517 1.00 32.10 H new ATOM 0 HE2 HIS A 168 -3.242 7.313 -6.935 1.00 35.41 H new ATOM 2671 N THR A 169 -4.828 13.786 -10.458 1.00 14.40 N ATOM 2672 CA THR A 169 -4.706 15.096 -11.066 1.00 1.32 C ATOM 2673 C THR A 169 -3.573 15.876 -10.408 1.00 71.24 C ATOM 2674 O THR A 169 -3.658 16.252 -9.242 1.00 24.10 O ATOM 2675 CB THR A 169 -6.022 15.887 -10.961 1.00 54.45 C ATOM 2676 OG1 THR A 169 -7.128 15.024 -11.254 1.00 34.45 O ATOM 2677 CG2 THR A 169 -6.035 17.058 -11.930 1.00 64.14 C ATOM 0 H THR A 169 -5.325 13.775 -9.568 1.00 14.40 H new ATOM 0 HA THR A 169 -4.480 14.956 -12.123 1.00 1.32 H new ATOM 0 HB THR A 169 -6.105 16.273 -9.945 1.00 54.45 H new ATOM 0 HG1 THR A 169 -7.965 15.530 -11.185 1.00 34.45 H new ATOM 0 HG21 THR A 169 -6.976 17.599 -11.834 1.00 64.14 H new ATOM 0 HG22 THR A 169 -5.206 17.728 -11.702 1.00 64.14 H new ATOM 0 HG23 THR A 169 -5.932 16.687 -12.950 1.00 64.14 H new ATOM 2685 N VAL A 170 -2.498 16.073 -11.158 1.00 42.30 N ATOM 2686 CA VAL A 170 -1.334 16.805 -10.678 1.00 74.50 C ATOM 2687 C VAL A 170 -1.044 17.950 -11.629 1.00 2.42 C ATOM 2688 O VAL A 170 -1.016 17.739 -12.839 1.00 44.50 O ATOM 2689 CB VAL A 170 -0.077 15.901 -10.608 1.00 74.54 C ATOM 2690 CG1 VAL A 170 1.043 16.587 -9.847 1.00 51.33 C ATOM 2691 CG2 VAL A 170 -0.394 14.546 -9.987 1.00 3.23 C ATOM 0 H VAL A 170 -2.408 15.731 -12.115 1.00 42.30 H new ATOM 0 HA VAL A 170 -1.557 17.169 -9.675 1.00 74.50 H new ATOM 0 HB VAL A 170 0.256 15.728 -11.631 1.00 74.54 H new ATOM 0 HG11 VAL A 170 1.914 15.932 -9.812 1.00 51.33 H new ATOM 0 HG12 VAL A 170 1.308 17.517 -10.350 1.00 51.33 H new ATOM 0 HG13 VAL A 170 0.712 16.805 -8.832 1.00 51.33 H new ATOM 0 HG21 VAL A 170 0.511 13.940 -9.955 1.00 3.23 H new ATOM 0 HG22 VAL A 170 -0.771 14.689 -8.974 1.00 3.23 H new ATOM 0 HG23 VAL A 170 -1.149 14.038 -10.587 1.00 3.23 H new ATOM 2701 N ASN A 171 -0.810 19.152 -11.089 1.00 22.10 N ATOM 2702 CA ASN A 171 -0.564 20.350 -11.906 1.00 35.30 C ATOM 2703 C ASN A 171 -1.730 20.619 -12.880 1.00 13.13 C ATOM 2704 O ASN A 171 -1.561 21.231 -13.937 1.00 13.03 O ATOM 2705 CB ASN A 171 0.781 20.195 -12.649 1.00 51.32 C ATOM 2706 CG ASN A 171 1.303 21.489 -13.250 1.00 23.12 C ATOM 2707 OD1 ASN A 171 1.832 22.347 -12.541 1.00 65.52 O ATOM 2708 ND2 ASN A 171 1.186 21.628 -14.564 1.00 71.34 N ATOM 0 H ASN A 171 -0.785 19.323 -10.084 1.00 22.10 H new ATOM 0 HA ASN A 171 -0.503 21.220 -11.252 1.00 35.30 H new ATOM 0 HB2 ASN A 171 1.525 19.801 -11.956 1.00 51.32 H new ATOM 0 HB3 ASN A 171 0.664 19.458 -13.443 1.00 51.32 H new ATOM 0 HD21 ASN A 171 1.540 22.468 -15.022 1.00 71.34 H new ATOM 0 HD22 ASN A 171 0.742 20.895 -15.117 1.00 71.34 H new ATOM 2715 N GLY A 172 -2.925 20.189 -12.494 1.00 13.40 N ATOM 2716 CA GLY A 172 -4.089 20.341 -13.352 1.00 74.30 C ATOM 2717 C GLY A 172 -4.140 19.314 -14.473 1.00 12.15 C ATOM 2718 O GLY A 172 -4.993 19.392 -15.357 1.00 50.33 O ATOM 0 H GLY A 172 -3.111 19.736 -11.599 1.00 13.40 H new ATOM 0 HA2 GLY A 172 -4.992 20.256 -12.748 1.00 74.30 H new ATOM 0 HA3 GLY A 172 -4.087 21.342 -13.784 1.00 74.30 H new ATOM 2722 N HIS A 173 -3.234 18.348 -14.429 1.00 53.04 N ATOM 2723 CA HIS A 173 -3.139 17.316 -15.454 1.00 25.21 C ATOM 2724 C HIS A 173 -3.533 15.957 -14.890 1.00 73.25 C ATOM 2725 O HIS A 173 -2.973 15.510 -13.886 1.00 3.34 O ATOM 2726 CB HIS A 173 -1.706 17.235 -15.994 1.00 35.22 C ATOM 2727 CG HIS A 173 -1.277 18.421 -16.803 1.00 31.32 C ATOM 2728 ND1 HIS A 173 -0.317 19.294 -16.348 1.00 72.33 N ATOM 2729 CD2 HIS A 173 -1.686 18.816 -18.030 1.00 51.40 C ATOM 2730 CE1 HIS A 173 -0.165 20.189 -17.305 1.00 62.01 C ATOM 2731 NE2 HIS A 173 -0.973 19.944 -18.344 1.00 43.20 N ATOM 0 H HIS A 173 -2.544 18.257 -13.683 1.00 53.04 H new ATOM 0 HA HIS A 173 -3.822 17.581 -16.261 1.00 25.21 H new ATOM 0 HB2 HIS A 173 -1.021 17.118 -15.154 1.00 35.22 H new ATOM 0 HB3 HIS A 173 -1.613 16.340 -16.609 1.00 35.22 H new ATOM 0 HD2 HIS A 173 -2.432 18.335 -18.645 1.00 51.40 H new ATOM 0 HE1 HIS A 173 0.526 21.017 -17.256 1.00 62.01 H new ATOM 0 HE2 HIS A 173 -1.044 20.490 -19.202 1.00 43.20 H new ATOM 2739 N ASN A 174 -4.492 15.300 -15.527 1.00 60.11 N ATOM 2740 CA ASN A 174 -4.872 13.953 -15.120 1.00 15.22 C ATOM 2741 C ASN A 174 -3.909 12.935 -15.738 1.00 45.42 C ATOM 2742 O ASN A 174 -3.855 12.758 -16.954 1.00 2.30 O ATOM 2743 CB ASN A 174 -6.347 13.648 -15.471 1.00 1.25 C ATOM 2744 CG ASN A 174 -6.670 13.721 -16.957 1.00 2.13 C ATOM 2745 OD1 ASN A 174 -6.639 12.715 -17.663 1.00 1.13 O ATOM 2746 ND2 ASN A 174 -7.002 14.906 -17.440 1.00 21.13 N ATOM 0 H ASN A 174 -5.017 15.672 -16.319 1.00 60.11 H new ATOM 0 HA ASN A 174 -4.795 13.879 -14.035 1.00 15.22 H new ATOM 0 HB2 ASN A 174 -6.595 12.651 -15.107 1.00 1.25 H new ATOM 0 HB3 ASN A 174 -6.987 14.351 -14.938 1.00 1.25 H new ATOM 0 HD21 ASN A 174 -7.242 15.006 -18.426 1.00 21.13 H new ATOM 0 HD22 ASN A 174 -7.018 15.721 -16.826 1.00 21.13 H new ATOM 2753 N CYS A 175 -3.096 12.322 -14.889 1.00 43.14 N ATOM 2754 CA CYS A 175 -2.083 11.372 -15.334 1.00 42.04 C ATOM 2755 C CYS A 175 -2.281 10.017 -14.665 1.00 64.30 C ATOM 2756 O CYS A 175 -2.901 9.928 -13.604 1.00 41.34 O ATOM 2757 CB CYS A 175 -0.693 11.927 -15.018 1.00 63.34 C ATOM 2758 SG CYS A 175 -0.475 13.656 -15.501 1.00 61.54 S ATOM 0 H CYS A 175 -3.118 12.467 -13.880 1.00 43.14 H new ATOM 0 HA CYS A 175 -2.178 11.230 -16.411 1.00 42.04 H new ATOM 0 HB2 CYS A 175 -0.508 11.832 -13.948 1.00 63.34 H new ATOM 0 HB3 CYS A 175 0.056 11.320 -15.527 1.00 63.34 H new ATOM 0 HG CYS A 175 -1.358 14.391 -14.893 1.00 61.54 H new ATOM 2764 N GLU A 176 -1.756 8.971 -15.288 1.00 15.02 N ATOM 2765 CA GLU A 176 -1.909 7.618 -14.778 1.00 2.42 C ATOM 2766 C GLU A 176 -0.826 7.315 -13.751 1.00 14.30 C ATOM 2767 O GLU A 176 0.352 7.588 -13.976 1.00 42.32 O ATOM 2768 CB GLU A 176 -1.834 6.599 -15.922 1.00 73.24 C ATOM 2769 CG GLU A 176 -2.191 5.183 -15.500 1.00 14.45 C ATOM 2770 CD GLU A 176 -1.736 4.137 -16.501 1.00 52.21 C ATOM 2771 OE1 GLU A 176 -2.410 3.970 -17.539 1.00 63.14 O ATOM 2772 OE2 GLU A 176 -0.703 3.482 -16.258 1.00 53.52 O ATOM 0 H GLU A 176 -1.218 9.036 -16.152 1.00 15.02 H new ATOM 0 HA GLU A 176 -2.886 7.542 -14.301 1.00 2.42 H new ATOM 0 HB2 GLU A 176 -2.507 6.912 -16.721 1.00 73.24 H new ATOM 0 HB3 GLU A 176 -0.825 6.603 -16.335 1.00 73.24 H new ATOM 0 HG2 GLU A 176 -1.738 4.973 -14.531 1.00 14.45 H new ATOM 0 HG3 GLU A 176 -3.271 5.109 -15.370 1.00 14.45 H new ATOM 2779 N VAL A 177 -1.241 6.757 -12.630 1.00 75.02 N ATOM 2780 CA VAL A 177 -0.330 6.415 -11.553 1.00 72.00 C ATOM 2781 C VAL A 177 -0.544 4.971 -11.124 1.00 70.02 C ATOM 2782 O VAL A 177 -1.679 4.517 -10.971 1.00 20.24 O ATOM 2783 CB VAL A 177 -0.499 7.335 -10.327 1.00 53.13 C ATOM 2784 CG1 VAL A 177 0.591 7.069 -9.303 1.00 63.44 C ATOM 2785 CG2 VAL A 177 -0.500 8.806 -10.736 1.00 25.15 C ATOM 0 H VAL A 177 -2.217 6.528 -12.440 1.00 75.02 H new ATOM 0 HA VAL A 177 0.681 6.550 -11.939 1.00 72.00 H new ATOM 0 HB VAL A 177 -1.464 7.111 -9.873 1.00 53.13 H new ATOM 0 HG11 VAL A 177 0.454 7.728 -8.446 1.00 63.44 H new ATOM 0 HG12 VAL A 177 0.536 6.031 -8.975 1.00 63.44 H new ATOM 0 HG13 VAL A 177 1.566 7.257 -9.753 1.00 63.44 H new ATOM 0 HG21 VAL A 177 -0.621 9.430 -9.850 1.00 25.15 H new ATOM 0 HG22 VAL A 177 0.444 9.048 -11.225 1.00 25.15 H new ATOM 0 HG23 VAL A 177 -1.324 8.991 -11.425 1.00 25.15 H new ATOM 2795 N ARG A 178 0.553 4.258 -10.941 1.00 72.13 N ATOM 2796 CA ARG A 178 0.492 2.842 -10.591 1.00 71.01 C ATOM 2797 C ARG A 178 1.786 2.392 -9.922 1.00 13.20 C ATOM 2798 O ARG A 178 2.740 3.164 -9.843 1.00 15.31 O ATOM 2799 CB ARG A 178 0.205 2.005 -11.851 1.00 13.03 C ATOM 2800 CG ARG A 178 1.422 1.727 -12.720 1.00 24.45 C ATOM 2801 CD ARG A 178 1.012 1.398 -14.147 1.00 21.22 C ATOM 2802 NE ARG A 178 2.128 0.895 -14.946 1.00 21.11 N ATOM 2803 CZ ARG A 178 2.201 0.991 -16.275 1.00 10.34 C ATOM 2804 NH1 ARG A 178 1.225 1.581 -16.959 1.00 22.40 N ATOM 2805 NH2 ARG A 178 3.260 0.505 -16.919 1.00 71.44 N ATOM 0 H ARG A 178 1.498 4.632 -11.028 1.00 72.13 H new ATOM 0 HA ARG A 178 -0.319 2.691 -9.878 1.00 71.01 H new ATOM 0 HB2 ARG A 178 -0.232 1.054 -11.547 1.00 13.03 H new ATOM 0 HB3 ARG A 178 -0.543 2.522 -12.452 1.00 13.03 H new ATOM 0 HG2 ARG A 178 2.080 2.596 -12.719 1.00 24.45 H new ATOM 0 HG3 ARG A 178 1.990 0.896 -12.301 1.00 24.45 H new ATOM 0 HD2 ARG A 178 0.216 0.654 -14.131 1.00 21.22 H new ATOM 0 HD3 ARG A 178 0.604 2.291 -14.620 1.00 21.22 H new ATOM 0 HE ARG A 178 2.900 0.442 -14.457 1.00 21.11 H new ATOM 0 HH11 ARG A 178 0.416 1.962 -16.468 1.00 22.40 H new ATOM 0 HH12 ARG A 178 1.285 1.652 -17.975 1.00 22.40 H new ATOM 0 HH21 ARG A 178 4.015 0.060 -16.397 1.00 71.44 H new ATOM 0 HH22 ARG A 178 3.317 0.578 -17.935 1.00 71.44 H new ATOM 2819 N LYS A 179 1.803 1.153 -9.430 1.00 1.41 N ATOM 2820 CA LYS A 179 2.986 0.586 -8.779 1.00 32.23 C ATOM 2821 C LYS A 179 4.179 0.581 -9.725 1.00 10.45 C ATOM 2822 O LYS A 179 4.065 0.169 -10.878 1.00 12.14 O ATOM 2823 CB LYS A 179 2.717 -0.849 -8.320 1.00 75.13 C ATOM 2824 CG LYS A 179 1.660 -0.979 -7.237 1.00 71.15 C ATOM 2825 CD LYS A 179 2.161 -0.490 -5.888 1.00 74.44 C ATOM 2826 CE LYS A 179 1.943 -1.537 -4.811 1.00 20.55 C ATOM 2827 NZ LYS A 179 0.502 -1.865 -4.613 1.00 73.23 N ATOM 0 H LYS A 179 1.005 0.518 -9.470 1.00 1.41 H new ATOM 0 HA LYS A 179 3.212 1.211 -7.915 1.00 32.23 H new ATOM 0 HB2 LYS A 179 2.410 -1.441 -9.182 1.00 75.13 H new ATOM 0 HB3 LYS A 179 3.649 -1.280 -7.954 1.00 75.13 H new ATOM 0 HG2 LYS A 179 0.776 -0.409 -7.523 1.00 71.15 H new ATOM 0 HG3 LYS A 179 1.354 -2.022 -7.153 1.00 71.15 H new ATOM 0 HD2 LYS A 179 3.222 -0.250 -5.956 1.00 74.44 H new ATOM 0 HD3 LYS A 179 1.643 0.429 -5.616 1.00 74.44 H new ATOM 0 HE2 LYS A 179 2.485 -2.445 -5.077 1.00 20.55 H new ATOM 0 HE3 LYS A 179 2.363 -1.179 -3.871 1.00 20.55 H new ATOM 0 HZ1 LYS A 179 0.415 -2.823 -4.218 1.00 73.23 H new ATOM 0 HZ2 LYS A 179 0.077 -1.180 -3.956 1.00 73.23 H new ATOM 0 HZ3 LYS A 179 0.007 -1.821 -5.527 1.00 73.23 H new ATOM 2841 N ALA A 180 5.313 1.046 -9.240 1.00 75.31 N ATOM 2842 CA ALA A 180 6.538 1.013 -10.011 1.00 20.24 C ATOM 2843 C ALA A 180 7.568 0.178 -9.291 1.00 52.41 C ATOM 2844 O ALA A 180 8.010 0.528 -8.198 1.00 21.20 O ATOM 2845 CB ALA A 180 7.083 2.411 -10.248 1.00 1.42 C ATOM 0 H ALA A 180 5.411 1.453 -8.310 1.00 75.31 H new ATOM 0 HA ALA A 180 6.316 0.570 -10.982 1.00 20.24 H new ATOM 0 HB1 ALA A 180 8.003 2.349 -10.830 1.00 1.42 H new ATOM 0 HB2 ALA A 180 6.347 3.001 -10.795 1.00 1.42 H new ATOM 0 HB3 ALA A 180 7.291 2.888 -9.290 1.00 1.42 H new ATOM 2851 N LEU A 181 7.937 -0.930 -9.886 1.00 35.42 N ATOM 2852 CA LEU A 181 8.943 -1.771 -9.294 1.00 60.13 C ATOM 2853 C LEU A 181 10.313 -1.259 -9.697 1.00 40.01 C ATOM 2854 O LEU A 181 10.700 -1.336 -10.864 1.00 63.25 O ATOM 2855 CB LEU A 181 8.760 -3.228 -9.728 1.00 75.21 C ATOM 2856 CG LEU A 181 7.348 -3.800 -9.551 1.00 21.25 C ATOM 2857 CD1 LEU A 181 7.304 -5.244 -10.012 1.00 60.44 C ATOM 2858 CD2 LEU A 181 6.888 -3.693 -8.104 1.00 64.54 C ATOM 0 H LEU A 181 7.559 -1.267 -10.772 1.00 35.42 H new ATOM 0 HA LEU A 181 8.848 -1.738 -8.209 1.00 60.13 H new ATOM 0 HB2 LEU A 181 9.038 -3.313 -10.779 1.00 75.21 H new ATOM 0 HB3 LEU A 181 9.457 -3.847 -9.163 1.00 75.21 H new ATOM 0 HG LEU A 181 6.666 -3.211 -10.165 1.00 21.25 H new ATOM 0 HD11 LEU A 181 6.296 -5.637 -9.881 1.00 60.44 H new ATOM 0 HD12 LEU A 181 7.580 -5.298 -11.065 1.00 60.44 H new ATOM 0 HD13 LEU A 181 8.004 -5.836 -9.422 1.00 60.44 H new ATOM 0 HD21 LEU A 181 5.884 -4.106 -8.010 1.00 64.54 H new ATOM 0 HD22 LEU A 181 7.571 -4.250 -7.463 1.00 64.54 H new ATOM 0 HD23 LEU A 181 6.879 -2.646 -7.802 1.00 64.54 H new