USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1129 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 104 GLN : amide:sc= 0.0324 X(o=0.0068,f=-0.05) USER MOD Set 1.2: A 107 LYS NZ :NH3+ -123:sc= -0.0256 (180deg=0) USER MOD Set 2.1: A 28 MET CE :methyl -133:sc= -0.722 (180deg=-0.0618) USER MOD Set 2.2: A 110 MET CE :methyl 178:sc= -2.02 (180deg=-1.29) USER MOD Single : A 10 SER OG : rot -16:sc= 0.782 USER MOD Single : A 11 ASN : amide:sc= -0.422 K(o=-0.42,f=-2) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.987 K(o=-0.99,f=-2.6!) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -126:sc= 0.422 (180deg=0) USER MOD Single : A 29 SER OG : rot 108:sc= 1.06 USER MOD Single : A 30 SER OG : rot 180:sc= -0.0729 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl 155:sc= -0.173 (180deg=-1.41) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 91:sc= 1.21 USER MOD Single : A 57 THR OG1 : rot -30:sc= -0.771 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= -0.523 USER MOD Single : A 69 THR OG1 : rot -47:sc= 1.1 USER MOD Single : A 70 HIS : no HD1:sc= -0.185 X(o=-0.18,f=-0.035) USER MOD Single : A 75 MET CE :methyl -164:sc=-0.00529 (180deg=-0.11) USER MOD Single : A 77 GLN : amide:sc= -0.0781 K(o=-0.078,f=-2!) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= 0 X(o=0,f=-0.066) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -0.294 K(o=-0.29,f=-2.7!) USER MOD Single : A 90 LYS NZ :NH3+ -120:sc= 0.3 (180deg=0) USER MOD Single : A 91 MET CE :methyl -115:sc= -2.71! (180deg=-9.36!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.0703 K(o=-0.07,f=-3.6!) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.073) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl 171:sc= -1.19 (180deg=-1.3) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -2.86! C(o=-2.9!,f=-4.1!) USER MOD Single : A 106 TYR OH : rot 31:sc= -0.633 USER MOD Single : A 108 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0616) USER MOD Single : A 109 GLN : amide:sc= -0.162 K(o=-0.16,f=-1.1) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 HIS : no HE2:sc= -1.2 X(o=-1.2,f=-1.1) USER MOD Single : A 122 LYS NZ :NH3+ 162:sc= -0.0267 (180deg=-0.225) USER MOD Single : A 123 ASN : amide:sc= -0.0306 X(o=-0.031,f=-0.32) USER MOD Single : A 130 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 MET CE :methyl -152:sc= -0.21 (180deg=-0.743) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 97 N SER A 10 4.023 6.791 -8.694 1.00 72.41 N ATOM 98 CA SER A 10 4.772 7.998 -9.023 1.00 72.45 C ATOM 99 C SER A 10 5.491 7.843 -10.360 1.00 22.21 C ATOM 100 O SER A 10 5.538 8.773 -11.163 1.00 52.14 O ATOM 101 CB SER A 10 5.784 8.312 -7.920 1.00 52.31 C ATOM 102 OG SER A 10 5.987 7.190 -7.079 1.00 72.11 O ATOM 0 HA SER A 10 4.066 8.824 -9.104 1.00 72.45 H new ATOM 0 HB2 SER A 10 6.732 8.612 -8.367 1.00 52.31 H new ATOM 0 HB3 SER A 10 5.430 9.155 -7.327 1.00 52.31 H new ATOM 0 HG SER A 10 5.263 6.544 -7.215 1.00 72.11 H new ATOM 108 N ASN A 11 6.051 6.659 -10.590 1.00 1.52 N ATOM 109 CA ASN A 11 6.769 6.381 -11.828 1.00 43.42 C ATOM 110 C ASN A 11 5.864 6.583 -13.039 1.00 53.43 C ATOM 111 O ASN A 11 6.334 6.890 -14.135 1.00 22.11 O ATOM 112 CB ASN A 11 7.313 4.951 -11.817 1.00 1.32 C ATOM 113 CG ASN A 11 6.253 3.927 -12.172 1.00 71.20 C ATOM 114 OD1 ASN A 11 5.128 3.983 -11.674 1.00 63.41 O ATOM 115 ND2 ASN A 11 6.608 2.984 -13.037 1.00 72.12 N ATOM 0 H ASN A 11 6.021 5.878 -9.935 1.00 1.52 H new ATOM 0 HA ASN A 11 7.603 7.079 -11.899 1.00 43.42 H new ATOM 0 HB2 ASN A 11 8.140 4.874 -12.523 1.00 1.32 H new ATOM 0 HB3 ASN A 11 7.716 4.726 -10.829 1.00 1.32 H new ATOM 0 HD21 ASN A 11 5.937 2.267 -13.314 1.00 72.12 H new ATOM 0 HD22 ASN A 11 7.551 2.976 -13.425 1.00 72.12 H new ATOM 122 N ASP A 12 4.563 6.410 -12.834 1.00 32.03 N ATOM 123 CA ASP A 12 3.590 6.575 -13.908 1.00 23.22 C ATOM 124 C ASP A 12 3.076 8.010 -13.959 1.00 73.15 C ATOM 125 O ASP A 12 2.665 8.496 -15.013 1.00 54.13 O ATOM 126 CB ASP A 12 2.421 5.607 -13.719 1.00 0.12 C ATOM 127 CG ASP A 12 2.675 4.259 -14.365 1.00 53.31 C ATOM 128 OD1 ASP A 12 3.812 3.756 -14.259 1.00 63.22 O ATOM 129 OD2 ASP A 12 1.736 3.708 -14.978 1.00 13.55 O ATOM 0 H ASP A 12 4.157 6.155 -11.933 1.00 32.03 H new ATOM 0 HA ASP A 12 4.086 6.352 -14.853 1.00 23.22 H new ATOM 0 HB2 ASP A 12 2.237 5.467 -12.654 1.00 0.12 H new ATOM 0 HB3 ASP A 12 1.518 6.045 -14.143 1.00 0.12 H new ATOM 134 N LYS A 13 3.100 8.683 -12.814 1.00 43.44 N ATOM 135 CA LYS A 13 2.637 10.063 -12.728 1.00 11.24 C ATOM 136 C LYS A 13 3.472 10.975 -13.621 1.00 71.21 C ATOM 137 O LYS A 13 2.939 11.670 -14.487 1.00 23.24 O ATOM 138 CB LYS A 13 2.700 10.554 -11.279 1.00 71.14 C ATOM 139 CG LYS A 13 1.605 11.545 -10.925 1.00 11.11 C ATOM 140 CD LYS A 13 1.829 12.156 -9.552 1.00 2.21 C ATOM 141 CE LYS A 13 1.690 11.117 -8.450 1.00 14.21 C ATOM 142 NZ LYS A 13 1.148 11.709 -7.195 1.00 60.12 N ATOM 0 H LYS A 13 3.435 8.295 -11.932 1.00 43.44 H new ATOM 0 HA LYS A 13 1.603 10.095 -13.072 1.00 11.24 H new ATOM 0 HB2 LYS A 13 2.632 9.696 -10.610 1.00 71.14 H new ATOM 0 HB3 LYS A 13 3.670 11.019 -11.104 1.00 71.14 H new ATOM 0 HG2 LYS A 13 1.572 12.335 -11.675 1.00 11.11 H new ATOM 0 HG3 LYS A 13 0.638 11.043 -10.948 1.00 11.11 H new ATOM 0 HD2 LYS A 13 2.822 12.603 -9.509 1.00 2.21 H new ATOM 0 HD3 LYS A 13 1.111 12.960 -9.389 1.00 2.21 H new ATOM 0 HE2 LYS A 13 1.032 10.316 -8.787 1.00 14.21 H new ATOM 0 HE3 LYS A 13 2.663 10.668 -8.249 1.00 14.21 H new ATOM 0 HZ1 LYS A 13 1.068 10.969 -6.468 1.00 60.12 H new ATOM 0 HZ2 LYS A 13 1.788 12.457 -6.859 1.00 60.12 H new ATOM 0 HZ3 LYS A 13 0.209 12.115 -7.380 1.00 60.12 H new ATOM 156 N VAL A 14 4.784 10.966 -13.407 1.00 12.23 N ATOM 157 CA VAL A 14 5.693 11.790 -14.194 1.00 54.35 C ATOM 158 C VAL A 14 5.593 11.454 -15.678 1.00 65.21 C ATOM 159 O VAL A 14 5.614 12.343 -16.530 1.00 31.33 O ATOM 160 CB VAL A 14 7.152 11.612 -13.735 1.00 41.54 C ATOM 161 CG1 VAL A 14 7.550 10.145 -13.776 1.00 72.10 C ATOM 162 CG2 VAL A 14 8.086 12.451 -14.595 1.00 24.50 C ATOM 0 H VAL A 14 5.241 10.397 -12.695 1.00 12.23 H new ATOM 0 HA VAL A 14 5.396 12.827 -14.038 1.00 54.35 H new ATOM 0 HB VAL A 14 7.235 11.957 -12.704 1.00 41.54 H new ATOM 0 HG11 VAL A 14 8.584 10.039 -13.448 1.00 72.10 H new ATOM 0 HG12 VAL A 14 6.899 9.573 -13.115 1.00 72.10 H new ATOM 0 HG13 VAL A 14 7.452 9.770 -14.795 1.00 72.10 H new ATOM 0 HG21 VAL A 14 9.113 12.314 -14.257 1.00 24.50 H new ATOM 0 HG22 VAL A 14 8.001 12.138 -15.636 1.00 24.50 H new ATOM 0 HG23 VAL A 14 7.813 13.503 -14.509 1.00 24.50 H new ATOM 172 N TYR A 15 5.485 10.165 -15.981 1.00 25.14 N ATOM 173 CA TYR A 15 5.385 9.710 -17.362 1.00 71.12 C ATOM 174 C TYR A 15 4.005 10.016 -17.937 1.00 63.34 C ATOM 175 O TYR A 15 3.813 10.010 -19.153 1.00 31.43 O ATOM 176 CB TYR A 15 5.664 8.208 -17.448 1.00 43.54 C ATOM 177 CG TYR A 15 5.443 7.630 -18.827 1.00 72.55 C ATOM 178 CD1 TYR A 15 5.968 8.249 -19.955 1.00 13.41 C ATOM 179 CD2 TYR A 15 4.708 6.464 -19.003 1.00 71.34 C ATOM 180 CE1 TYR A 15 5.767 7.725 -21.217 1.00 63.41 C ATOM 181 CE2 TYR A 15 4.504 5.931 -20.261 1.00 72.14 C ATOM 182 CZ TYR A 15 5.035 6.565 -21.365 1.00 42.01 C ATOM 183 OH TYR A 15 4.833 6.038 -22.620 1.00 51.31 O ATOM 0 H TYR A 15 5.465 9.417 -15.288 1.00 25.14 H new ATOM 0 HA TYR A 15 6.131 10.245 -17.949 1.00 71.12 H new ATOM 0 HB2 TYR A 15 6.694 8.020 -17.145 1.00 43.54 H new ATOM 0 HB3 TYR A 15 5.023 7.686 -16.737 1.00 43.54 H new ATOM 0 HD1 TYR A 15 6.543 9.156 -19.843 1.00 13.41 H new ATOM 0 HD2 TYR A 15 4.289 5.966 -18.141 1.00 71.34 H new ATOM 0 HE1 TYR A 15 6.180 8.220 -22.083 1.00 63.41 H new ATOM 0 HE2 TYR A 15 3.932 5.023 -20.380 1.00 72.14 H new ATOM 0 HH TYR A 15 4.299 5.220 -22.549 1.00 51.31 H new ATOM 193 N GLU A 16 3.049 10.283 -17.054 1.00 11.34 N ATOM 194 CA GLU A 16 1.687 10.591 -17.473 1.00 12.40 C ATOM 195 C GLU A 16 1.511 12.092 -17.691 1.00 32.52 C ATOM 196 O GLU A 16 1.209 12.538 -18.797 1.00 25.51 O ATOM 197 CB GLU A 16 0.684 10.095 -16.430 1.00 14.35 C ATOM 198 CG GLU A 16 -0.708 10.682 -16.596 1.00 1.44 C ATOM 199 CD GLU A 16 -1.334 10.330 -17.931 1.00 34.43 C ATOM 200 OE1 GLU A 16 -1.097 9.204 -18.418 1.00 13.23 O ATOM 201 OE2 GLU A 16 -2.061 11.178 -18.489 1.00 0.25 O ATOM 0 H GLU A 16 3.192 10.292 -16.044 1.00 11.34 H new ATOM 0 HA GLU A 16 1.500 10.080 -18.417 1.00 12.40 H new ATOM 0 HB2 GLU A 16 0.620 9.008 -16.488 1.00 14.35 H new ATOM 0 HB3 GLU A 16 1.056 10.340 -15.435 1.00 14.35 H new ATOM 0 HG2 GLU A 16 -1.349 10.321 -15.792 1.00 1.44 H new ATOM 0 HG3 GLU A 16 -0.655 11.766 -16.498 1.00 1.44 H new ATOM 208 N ASN A 17 1.701 12.864 -16.626 1.00 53.32 N ATOM 209 CA ASN A 17 1.562 14.314 -16.700 1.00 10.22 C ATOM 210 C ASN A 17 2.395 14.883 -17.844 1.00 45.11 C ATOM 211 O ASN A 17 1.976 15.818 -18.527 1.00 23.21 O ATOM 212 CB ASN A 17 1.986 14.956 -15.377 1.00 61.21 C ATOM 213 CG ASN A 17 1.199 14.421 -14.196 1.00 53.05 C ATOM 214 OD1 ASN A 17 1.766 14.100 -13.152 1.00 11.20 O ATOM 215 ND2 ASN A 17 -0.116 14.322 -14.358 1.00 3.50 N ATOM 0 H ASN A 17 1.951 12.510 -15.703 1.00 53.32 H new ATOM 0 HA ASN A 17 0.513 14.544 -16.889 1.00 10.22 H new ATOM 0 HB2 ASN A 17 3.049 14.776 -15.213 1.00 61.21 H new ATOM 0 HB3 ASN A 17 1.851 16.036 -15.441 1.00 61.21 H new ATOM 0 HD21 ASN A 17 -0.698 13.968 -13.599 1.00 3.50 H new ATOM 0 HD22 ASN A 17 -0.543 14.600 -15.241 1.00 3.50 H new ATOM 222 N VAL A 18 3.578 14.312 -18.048 1.00 63.12 N ATOM 223 CA VAL A 18 4.471 14.760 -19.111 1.00 14.34 C ATOM 224 C VAL A 18 3.744 14.821 -20.449 1.00 70.15 C ATOM 225 O VAL A 18 4.088 15.621 -21.320 1.00 54.40 O ATOM 226 CB VAL A 18 5.694 13.834 -19.244 1.00 71.04 C ATOM 227 CG1 VAL A 18 5.267 12.449 -19.706 1.00 62.11 C ATOM 228 CG2 VAL A 18 6.713 14.433 -20.201 1.00 44.42 C ATOM 0 H VAL A 18 3.941 13.538 -17.491 1.00 63.12 H new ATOM 0 HA VAL A 18 4.810 15.760 -18.840 1.00 14.34 H new ATOM 0 HB VAL A 18 6.162 13.736 -18.265 1.00 71.04 H new ATOM 0 HG11 VAL A 18 6.144 11.808 -19.794 1.00 62.11 H new ATOM 0 HG12 VAL A 18 4.576 12.020 -18.980 1.00 62.11 H new ATOM 0 HG13 VAL A 18 4.774 12.525 -20.675 1.00 62.11 H new ATOM 0 HG21 VAL A 18 7.571 13.766 -20.283 1.00 44.42 H new ATOM 0 HG22 VAL A 18 6.258 14.562 -21.183 1.00 44.42 H new ATOM 0 HG23 VAL A 18 7.041 15.401 -19.823 1.00 44.42 H new ATOM 238 N THR A 19 2.736 13.969 -20.609 1.00 13.03 N ATOM 239 CA THR A 19 1.960 13.925 -21.842 1.00 20.43 C ATOM 240 C THR A 19 0.775 14.882 -21.781 1.00 21.34 C ATOM 241 O THR A 19 0.554 15.671 -22.698 1.00 71.43 O ATOM 242 CB THR A 19 1.442 12.503 -22.129 1.00 25.41 C ATOM 243 OG1 THR A 19 2.544 11.597 -22.260 1.00 2.42 O ATOM 244 CG2 THR A 19 0.605 12.478 -23.399 1.00 23.42 C ATOM 0 H THR A 19 2.438 13.300 -19.899 1.00 13.03 H new ATOM 0 HA THR A 19 2.629 14.230 -22.647 1.00 20.43 H new ATOM 0 HB THR A 19 0.815 12.193 -21.293 1.00 25.41 H new ATOM 0 HG1 THR A 19 2.206 10.695 -22.441 1.00 2.42 H new ATOM 0 HG21 THR A 19 0.250 11.464 -23.581 1.00 23.42 H new ATOM 0 HG22 THR A 19 -0.249 13.146 -23.285 1.00 23.42 H new ATOM 0 HG23 THR A 19 1.213 12.807 -24.242 1.00 23.42 H new ATOM 252 N GLY A 20 0.015 14.807 -20.692 1.00 4.22 N ATOM 253 CA GLY A 20 -1.138 15.673 -20.531 1.00 41.44 C ATOM 254 C GLY A 20 -0.799 17.136 -20.742 1.00 64.45 C ATOM 255 O GLY A 20 -1.439 17.820 -21.542 1.00 1.24 O ATOM 0 H GLY A 20 0.178 14.162 -19.919 1.00 4.22 H new ATOM 0 HA2 GLY A 20 -1.912 15.377 -21.239 1.00 41.44 H new ATOM 0 HA3 GLY A 20 -1.552 15.540 -19.531 1.00 41.44 H new ATOM 259 N LEU A 21 0.210 17.617 -20.024 1.00 33.10 N ATOM 260 CA LEU A 21 0.632 19.009 -20.135 1.00 64.30 C ATOM 261 C LEU A 21 0.876 19.389 -21.592 1.00 12.31 C ATOM 262 O LEU A 21 0.573 20.506 -22.012 1.00 14.12 O ATOM 263 CB LEU A 21 1.903 19.243 -19.316 1.00 15.54 C ATOM 264 CG LEU A 21 3.189 18.646 -19.886 1.00 3.00 C ATOM 265 CD1 LEU A 21 3.861 19.630 -20.831 1.00 62.44 C ATOM 266 CD2 LEU A 21 4.137 18.250 -18.763 1.00 41.41 C ATOM 0 H LEU A 21 0.751 17.064 -19.359 1.00 33.10 H new ATOM 0 HA LEU A 21 -0.167 19.638 -19.743 1.00 64.30 H new ATOM 0 HB2 LEU A 21 2.045 20.318 -19.202 1.00 15.54 H new ATOM 0 HB3 LEU A 21 1.748 18.834 -18.318 1.00 15.54 H new ATOM 0 HG LEU A 21 2.932 17.750 -20.450 1.00 3.00 H new ATOM 0 HD11 LEU A 21 4.775 19.188 -21.227 1.00 62.44 H new ATOM 0 HD12 LEU A 21 3.185 19.864 -21.653 1.00 62.44 H new ATOM 0 HD13 LEU A 21 4.105 20.545 -20.291 1.00 62.44 H new ATOM 0 HD21 LEU A 21 5.047 17.827 -19.188 1.00 41.41 H new ATOM 0 HD22 LEU A 21 4.388 19.130 -18.171 1.00 41.41 H new ATOM 0 HD23 LEU A 21 3.656 17.509 -18.125 1.00 41.41 H new ATOM 278 N VAL A 22 1.424 18.452 -22.359 1.00 55.34 N ATOM 279 CA VAL A 22 1.705 18.688 -23.771 1.00 33.15 C ATOM 280 C VAL A 22 0.417 18.884 -24.562 1.00 74.32 C ATOM 281 O VAL A 22 0.364 19.685 -25.495 1.00 53.23 O ATOM 282 CB VAL A 22 2.501 17.522 -24.386 1.00 53.15 C ATOM 283 CG1 VAL A 22 2.744 17.765 -25.868 1.00 51.32 C ATOM 284 CG2 VAL A 22 3.816 17.326 -23.647 1.00 53.01 C ATOM 0 H VAL A 22 1.682 17.523 -22.027 1.00 55.34 H new ATOM 0 HA VAL A 22 2.304 19.597 -23.828 1.00 33.15 H new ATOM 0 HB VAL A 22 1.914 16.610 -24.283 1.00 53.15 H new ATOM 0 HG11 VAL A 22 3.308 16.931 -26.286 1.00 51.32 H new ATOM 0 HG12 VAL A 22 1.788 17.851 -26.384 1.00 51.32 H new ATOM 0 HG13 VAL A 22 3.311 18.687 -25.997 1.00 51.32 H new ATOM 0 HG21 VAL A 22 4.365 16.498 -24.095 1.00 53.01 H new ATOM 0 HG22 VAL A 22 4.412 18.236 -23.716 1.00 53.01 H new ATOM 0 HG23 VAL A 22 3.615 17.103 -22.599 1.00 53.01 H new ATOM 294 N LYS A 23 -0.622 18.146 -24.184 1.00 2.43 N ATOM 295 CA LYS A 23 -1.912 18.239 -24.856 1.00 73.12 C ATOM 296 C LYS A 23 -2.473 19.654 -24.765 1.00 13.35 C ATOM 297 O LYS A 23 -3.004 20.186 -25.739 1.00 74.21 O ATOM 298 CB LYS A 23 -2.902 17.246 -24.243 1.00 73.24 C ATOM 299 CG LYS A 23 -2.442 15.800 -24.323 1.00 50.51 C ATOM 300 CD LYS A 23 -2.530 15.265 -25.742 1.00 65.14 C ATOM 301 CE LYS A 23 -2.087 13.812 -25.818 1.00 64.20 C ATOM 302 NZ LYS A 23 -3.232 12.895 -26.075 1.00 10.44 N ATOM 0 H LYS A 23 -0.595 17.476 -23.415 1.00 2.43 H new ATOM 0 HA LYS A 23 -1.764 17.993 -25.908 1.00 73.12 H new ATOM 0 HB2 LYS A 23 -3.067 17.509 -23.198 1.00 73.24 H new ATOM 0 HB3 LYS A 23 -3.862 17.342 -24.751 1.00 73.24 H new ATOM 0 HG2 LYS A 23 -1.414 15.724 -23.968 1.00 50.51 H new ATOM 0 HG3 LYS A 23 -3.054 15.185 -23.663 1.00 50.51 H new ATOM 0 HD2 LYS A 23 -3.555 15.353 -26.102 1.00 65.14 H new ATOM 0 HD3 LYS A 23 -1.907 15.871 -26.400 1.00 65.14 H new ATOM 0 HE2 LYS A 23 -1.347 13.699 -26.610 1.00 64.20 H new ATOM 0 HE3 LYS A 23 -1.600 13.532 -24.884 1.00 64.20 H new ATOM 0 HZ1 LYS A 23 -3.255 12.155 -25.345 1.00 10.44 H new ATOM 0 HZ2 LYS A 23 -4.121 13.434 -26.049 1.00 10.44 H new ATOM 0 HZ3 LYS A 23 -3.121 12.455 -27.011 1.00 10.44 H new ATOM 316 N ALA A 24 -2.350 20.260 -23.588 1.00 34.42 N ATOM 317 CA ALA A 24 -2.842 21.615 -23.371 1.00 31.54 C ATOM 318 C ALA A 24 -2.040 22.626 -24.182 1.00 51.21 C ATOM 319 O ALA A 24 -2.607 23.488 -24.853 1.00 52.35 O ATOM 320 CB ALA A 24 -2.792 21.963 -21.890 1.00 42.35 C ATOM 0 H ALA A 24 -1.914 19.834 -22.770 1.00 34.42 H new ATOM 0 HA ALA A 24 -3.878 21.658 -23.708 1.00 31.54 H new ATOM 0 HB1 ALA A 24 -3.162 22.977 -21.742 1.00 42.35 H new ATOM 0 HB2 ALA A 24 -3.414 21.264 -21.331 1.00 42.35 H new ATOM 0 HB3 ALA A 24 -1.764 21.897 -21.535 1.00 42.35 H new ATOM 326 N VAL A 25 -0.717 22.516 -24.115 1.00 50.13 N ATOM 327 CA VAL A 25 0.163 23.421 -24.844 1.00 43.33 C ATOM 328 C VAL A 25 -0.222 23.494 -26.318 1.00 2.44 C ATOM 329 O VAL A 25 -0.111 24.547 -26.947 1.00 0.12 O ATOM 330 CB VAL A 25 1.636 22.984 -24.731 1.00 11.40 C ATOM 331 CG1 VAL A 25 2.537 23.938 -25.501 1.00 13.12 C ATOM 332 CG2 VAL A 25 2.056 22.902 -23.271 1.00 41.43 C ATOM 0 H VAL A 25 -0.231 21.809 -23.563 1.00 50.13 H new ATOM 0 HA VAL A 25 0.048 24.406 -24.392 1.00 43.33 H new ATOM 0 HB VAL A 25 1.738 21.992 -25.171 1.00 11.40 H new ATOM 0 HG11 VAL A 25 3.573 23.613 -25.410 1.00 13.12 H new ATOM 0 HG12 VAL A 25 2.249 23.942 -26.552 1.00 13.12 H new ATOM 0 HG13 VAL A 25 2.435 24.944 -25.094 1.00 13.12 H new ATOM 0 HG21 VAL A 25 3.099 22.592 -23.209 1.00 41.43 H new ATOM 0 HG22 VAL A 25 1.940 23.880 -22.804 1.00 41.43 H new ATOM 0 HG23 VAL A 25 1.430 22.175 -22.753 1.00 41.43 H new ATOM 342 N ILE A 26 -0.675 22.370 -26.861 1.00 41.05 N ATOM 343 CA ILE A 26 -1.078 22.307 -28.261 1.00 11.32 C ATOM 344 C ILE A 26 -2.502 22.822 -28.446 1.00 64.32 C ATOM 345 O ILE A 26 -2.757 23.678 -29.292 1.00 42.10 O ATOM 346 CB ILE A 26 -0.988 20.871 -28.809 1.00 21.22 C ATOM 347 CG1 ILE A 26 0.439 20.337 -28.670 1.00 3.25 C ATOM 348 CG2 ILE A 26 -1.435 20.829 -30.262 1.00 52.43 C ATOM 349 CD1 ILE A 26 0.532 18.830 -28.755 1.00 71.21 C ATOM 0 H ILE A 26 -0.772 21.490 -26.354 1.00 41.05 H new ATOM 0 HA ILE A 26 -0.389 22.942 -28.817 1.00 11.32 H new ATOM 0 HB ILE A 26 -1.653 20.234 -28.226 1.00 21.22 H new ATOM 0 HG12 ILE A 26 1.060 20.776 -29.451 1.00 3.25 H new ATOM 0 HG13 ILE A 26 0.849 20.665 -27.715 1.00 3.25 H new ATOM 0 HG21 ILE A 26 -1.365 19.807 -30.635 1.00 52.43 H new ATOM 0 HG22 ILE A 26 -2.467 21.173 -30.335 1.00 52.43 H new ATOM 0 HG23 ILE A 26 -0.793 21.477 -30.859 1.00 52.43 H new ATOM 0 HD11 ILE A 26 1.572 18.523 -28.648 1.00 71.21 H new ATOM 0 HD12 ILE A 26 -0.062 18.383 -27.957 1.00 71.21 H new ATOM 0 HD13 ILE A 26 0.152 18.496 -29.721 1.00 71.21 H new ATOM 361 N GLU A 27 -3.425 22.294 -27.648 1.00 65.11 N ATOM 362 CA GLU A 27 -4.823 22.701 -27.724 1.00 44.12 C ATOM 363 C GLU A 27 -4.952 24.220 -27.651 1.00 23.11 C ATOM 364 O GLU A 27 -5.593 24.840 -28.498 1.00 41.34 O ATOM 365 CB GLU A 27 -5.627 22.055 -26.595 1.00 34.24 C ATOM 366 CG GLU A 27 -6.544 20.937 -27.063 1.00 23.33 C ATOM 367 CD GLU A 27 -7.994 21.370 -27.151 1.00 72.31 C ATOM 368 OE1 GLU A 27 -8.525 21.876 -26.141 1.00 15.10 O ATOM 369 OE2 GLU A 27 -8.598 21.202 -28.232 1.00 21.05 O ATOM 0 H GLU A 27 -3.230 21.584 -26.942 1.00 65.11 H new ATOM 0 HA GLU A 27 -5.221 22.366 -28.682 1.00 44.12 H new ATOM 0 HB2 GLU A 27 -4.937 21.660 -25.849 1.00 34.24 H new ATOM 0 HB3 GLU A 27 -6.225 22.821 -26.102 1.00 34.24 H new ATOM 0 HG2 GLU A 27 -6.213 20.586 -28.041 1.00 23.33 H new ATOM 0 HG3 GLU A 27 -6.462 20.094 -26.377 1.00 23.33 H new ATOM 376 N MET A 28 -4.338 24.811 -26.631 1.00 50.42 N ATOM 377 CA MET A 28 -4.384 26.257 -26.447 1.00 44.31 C ATOM 378 C MET A 28 -3.846 26.979 -27.679 1.00 11.44 C ATOM 379 O MET A 28 -4.369 28.020 -28.077 1.00 74.34 O ATOM 380 CB MET A 28 -3.576 26.661 -25.212 1.00 14.31 C ATOM 381 CG MET A 28 -2.102 26.305 -25.306 1.00 63.13 C ATOM 382 SD MET A 28 -1.083 27.697 -25.832 1.00 30.31 S ATOM 383 CE MET A 28 -0.480 28.290 -24.253 1.00 62.03 C ATOM 0 H MET A 28 -3.803 24.312 -25.920 1.00 50.42 H new ATOM 0 HA MET A 28 -5.425 26.547 -26.303 1.00 44.31 H new ATOM 0 HB2 MET A 28 -3.673 27.736 -25.061 1.00 14.31 H new ATOM 0 HB3 MET A 28 -4.003 26.176 -24.334 1.00 14.31 H new ATOM 0 HG2 MET A 28 -1.755 25.952 -24.335 1.00 63.13 H new ATOM 0 HG3 MET A 28 -1.975 25.481 -26.008 1.00 63.13 H new ATOM 0 HE1 MET A 28 -0.594 29.373 -24.203 1.00 62.03 H new ATOM 0 HE2 MET A 28 -1.052 27.827 -23.448 1.00 62.03 H new ATOM 0 HE3 MET A 28 0.573 28.031 -24.145 1.00 62.03 H new ATOM 393 N SER A 29 -2.799 26.421 -28.277 1.00 24.24 N ATOM 394 CA SER A 29 -2.188 27.014 -29.460 1.00 50.14 C ATOM 395 C SER A 29 -3.158 26.997 -30.638 1.00 43.22 C ATOM 396 O SER A 29 -3.007 27.761 -31.591 1.00 52.34 O ATOM 397 CB SER A 29 -0.907 26.264 -29.829 1.00 44.34 C ATOM 398 OG SER A 29 0.058 26.364 -28.796 1.00 61.12 O ATOM 0 H SER A 29 -2.356 25.558 -27.961 1.00 24.24 H new ATOM 0 HA SER A 29 -1.940 28.050 -29.230 1.00 50.14 H new ATOM 0 HB2 SER A 29 -1.137 25.215 -30.016 1.00 44.34 H new ATOM 0 HB3 SER A 29 -0.498 26.670 -30.754 1.00 44.34 H new ATOM 0 HG SER A 29 0.135 25.502 -28.336 1.00 61.12 H new ATOM 404 N SER A 30 -4.153 26.120 -30.564 1.00 73.33 N ATOM 405 CA SER A 30 -5.146 25.999 -31.625 1.00 54.23 C ATOM 406 C SER A 30 -6.156 27.141 -31.557 1.00 3.32 C ATOM 407 O SER A 30 -6.411 27.821 -32.551 1.00 71.33 O ATOM 408 CB SER A 30 -5.871 24.656 -31.524 1.00 35.10 C ATOM 409 OG SER A 30 -7.267 24.841 -31.361 1.00 20.42 O ATOM 0 H SER A 30 -4.293 25.482 -29.780 1.00 73.33 H new ATOM 0 HA SER A 30 -4.627 26.052 -32.582 1.00 54.23 H new ATOM 0 HB2 SER A 30 -5.681 24.068 -32.422 1.00 35.10 H new ATOM 0 HB3 SER A 30 -5.475 24.088 -30.682 1.00 35.10 H new ATOM 0 HG SER A 30 -7.708 23.968 -31.301 1.00 20.42 H new ATOM 415 N LYS A 31 -6.727 27.347 -30.375 1.00 75.12 N ATOM 416 CA LYS A 31 -7.708 28.407 -30.173 1.00 74.34 C ATOM 417 C LYS A 31 -7.071 29.616 -29.497 1.00 52.43 C ATOM 418 O LYS A 31 -7.759 30.422 -28.870 1.00 53.42 O ATOM 419 CB LYS A 31 -8.877 27.894 -29.329 1.00 32.10 C ATOM 420 CG LYS A 31 -8.445 27.210 -28.043 1.00 41.43 C ATOM 421 CD LYS A 31 -9.441 27.451 -26.922 1.00 32.14 C ATOM 422 CE LYS A 31 -9.438 26.308 -25.919 1.00 21.55 C ATOM 423 NZ LYS A 31 -10.642 26.334 -25.043 1.00 52.30 N ATOM 0 H LYS A 31 -6.527 26.794 -29.542 1.00 75.12 H new ATOM 0 HA LYS A 31 -8.081 28.714 -31.150 1.00 74.34 H new ATOM 0 HB2 LYS A 31 -9.532 28.730 -29.084 1.00 32.10 H new ATOM 0 HB3 LYS A 31 -9.464 27.194 -29.924 1.00 32.10 H new ATOM 0 HG2 LYS A 31 -8.343 26.139 -28.216 1.00 41.43 H new ATOM 0 HG3 LYS A 31 -7.464 27.580 -27.745 1.00 41.43 H new ATOM 0 HD2 LYS A 31 -9.199 28.384 -26.413 1.00 32.14 H new ATOM 0 HD3 LYS A 31 -10.441 27.567 -27.341 1.00 32.14 H new ATOM 0 HE2 LYS A 31 -9.397 25.358 -26.452 1.00 21.55 H new ATOM 0 HE3 LYS A 31 -8.540 26.367 -25.304 1.00 21.55 H new ATOM 0 HZ1 LYS A 31 -10.602 25.539 -24.374 1.00 52.30 H new ATOM 0 HZ2 LYS A 31 -10.668 27.230 -24.515 1.00 52.30 H new ATOM 0 HZ3 LYS A 31 -11.498 26.252 -25.627 1.00 52.30 H new ATOM 437 N ILE A 32 -5.755 29.737 -29.630 1.00 43.41 N ATOM 438 CA ILE A 32 -5.026 30.850 -29.034 1.00 15.51 C ATOM 439 C ILE A 32 -5.519 32.186 -29.582 1.00 24.23 C ATOM 440 O ILE A 32 -5.674 33.153 -28.837 1.00 45.31 O ATOM 441 CB ILE A 32 -3.512 30.732 -29.286 1.00 62.23 C ATOM 442 CG1 ILE A 32 -2.777 31.932 -28.686 1.00 51.20 C ATOM 443 CG2 ILE A 32 -3.230 30.623 -30.777 1.00 72.04 C ATOM 444 CD1 ILE A 32 -1.691 31.548 -27.706 1.00 64.44 C ATOM 0 H ILE A 32 -5.171 29.078 -30.145 1.00 43.41 H new ATOM 0 HA ILE A 32 -5.211 30.809 -27.961 1.00 15.51 H new ATOM 0 HB ILE A 32 -3.148 29.827 -28.800 1.00 62.23 H new ATOM 0 HG12 ILE A 32 -2.336 32.518 -29.493 1.00 51.20 H new ATOM 0 HG13 ILE A 32 -3.499 32.575 -28.182 1.00 51.20 H new ATOM 0 HG21 ILE A 32 -2.155 30.540 -30.939 1.00 72.04 H new ATOM 0 HG22 ILE A 32 -3.726 29.739 -31.178 1.00 72.04 H new ATOM 0 HG23 ILE A 32 -3.606 31.511 -31.284 1.00 72.04 H new ATOM 0 HD11 ILE A 32 -1.213 32.449 -27.321 1.00 64.44 H new ATOM 0 HD12 ILE A 32 -2.128 30.988 -26.880 1.00 64.44 H new ATOM 0 HD13 ILE A 32 -0.948 30.930 -28.210 1.00 64.44 H new ATOM 456 N GLN A 33 -5.764 32.229 -30.887 1.00 51.32 N ATOM 457 CA GLN A 33 -6.240 33.446 -31.534 1.00 52.23 C ATOM 458 C GLN A 33 -7.569 33.896 -30.937 1.00 75.00 C ATOM 459 O GLN A 33 -7.688 34.984 -30.373 1.00 20.34 O ATOM 460 CB GLN A 33 -6.394 33.222 -33.040 1.00 23.04 C ATOM 461 CG GLN A 33 -5.249 33.794 -33.860 1.00 2.32 C ATOM 462 CD GLN A 33 -5.316 33.388 -35.319 1.00 23.54 C ATOM 463 OE1 GLN A 33 -5.365 32.201 -35.642 1.00 72.55 O ATOM 464 NE2 GLN A 33 -5.318 34.373 -36.209 1.00 23.13 N ATOM 0 H GLN A 33 -5.641 31.436 -31.517 1.00 51.32 H new ATOM 0 HA GLN A 33 -5.502 34.230 -31.364 1.00 52.23 H new ATOM 0 HB2 GLN A 33 -6.470 32.152 -33.234 1.00 23.04 H new ATOM 0 HB3 GLN A 33 -7.329 33.673 -33.372 1.00 23.04 H new ATOM 0 HG2 GLN A 33 -5.264 34.882 -33.788 1.00 2.32 H new ATOM 0 HG3 GLN A 33 -4.302 33.460 -33.437 1.00 2.32 H new ATOM 0 HE21 GLN A 33 -5.276 35.343 -35.896 1.00 23.13 H new ATOM 0 HE22 GLN A 33 -5.361 34.160 -37.206 1.00 23.13 H new ATOM 473 N PRO A 34 -8.595 33.041 -31.063 1.00 71.24 N ATOM 474 CA PRO A 34 -9.935 33.329 -30.542 1.00 64.32 C ATOM 475 C PRO A 34 -9.980 33.311 -29.018 1.00 62.21 C ATOM 476 O PRO A 34 -10.987 33.678 -28.413 1.00 63.23 O ATOM 477 CB PRO A 34 -10.789 32.196 -31.116 1.00 34.22 C ATOM 478 CG PRO A 34 -9.831 31.080 -31.351 1.00 60.11 C ATOM 479 CD PRO A 34 -8.526 31.727 -31.724 1.00 62.33 C ATOM 0 HA PRO A 34 -10.278 34.324 -30.824 1.00 64.32 H new ATOM 0 HB2 PRO A 34 -11.576 31.902 -30.421 1.00 34.22 H new ATOM 0 HB3 PRO A 34 -11.278 32.499 -32.042 1.00 34.22 H new ATOM 0 HG2 PRO A 34 -9.721 30.466 -30.457 1.00 60.11 H new ATOM 0 HG3 PRO A 34 -10.183 30.424 -32.147 1.00 60.11 H new ATOM 0 HD2 PRO A 34 -7.674 31.145 -31.373 1.00 62.33 H new ATOM 0 HD3 PRO A 34 -8.421 31.826 -32.804 1.00 62.33 H new ATOM 487 N ALA A 35 -8.882 32.882 -28.403 1.00 54.01 N ATOM 488 CA ALA A 35 -8.797 32.819 -26.949 1.00 44.04 C ATOM 489 C ALA A 35 -9.269 34.123 -26.315 1.00 22.44 C ATOM 490 O ALA A 35 -8.592 35.149 -26.371 1.00 2.42 O ATOM 491 CB ALA A 35 -7.372 32.505 -26.518 1.00 44.40 C ATOM 0 H ALA A 35 -8.040 32.573 -28.889 1.00 54.01 H new ATOM 0 HA ALA A 35 -9.454 32.020 -26.605 1.00 44.04 H new ATOM 0 HB1 ALA A 35 -7.322 32.461 -25.430 1.00 44.40 H new ATOM 0 HB2 ALA A 35 -7.069 31.544 -26.934 1.00 44.40 H new ATOM 0 HB3 ALA A 35 -6.702 33.285 -26.880 1.00 44.40 H new ATOM 497 N PRO A 36 -10.458 34.084 -25.696 1.00 73.31 N ATOM 498 CA PRO A 36 -11.047 35.254 -25.039 1.00 15.02 C ATOM 499 C PRO A 36 -10.293 35.650 -23.774 1.00 61.22 C ATOM 500 O PRO A 36 -9.432 34.920 -23.282 1.00 44.34 O ATOM 501 CB PRO A 36 -12.465 34.791 -24.693 1.00 23.42 C ATOM 502 CG PRO A 36 -12.364 33.308 -24.591 1.00 31.31 C ATOM 503 CD PRO A 36 -11.319 32.894 -25.590 1.00 75.13 C ATOM 0 HA PRO A 36 -11.016 36.137 -25.677 1.00 15.02 H new ATOM 0 HB2 PRO A 36 -12.807 35.230 -23.756 1.00 23.42 H new ATOM 0 HB3 PRO A 36 -13.177 35.087 -25.463 1.00 23.42 H new ATOM 0 HG2 PRO A 36 -12.082 33.005 -23.583 1.00 31.31 H new ATOM 0 HG3 PRO A 36 -13.322 32.836 -24.810 1.00 31.31 H new ATOM 0 HD2 PRO A 36 -10.760 32.023 -25.249 1.00 75.13 H new ATOM 0 HD3 PRO A 36 -11.763 32.632 -26.551 1.00 75.13 H new ATOM 511 N PRO A 37 -10.622 36.832 -23.233 1.00 40.34 N ATOM 512 CA PRO A 37 -9.987 37.351 -22.018 1.00 53.01 C ATOM 513 C PRO A 37 -10.383 36.562 -20.775 1.00 73.41 C ATOM 514 O PRO A 37 -9.713 36.630 -19.746 1.00 4.42 O ATOM 515 CB PRO A 37 -10.511 38.787 -21.929 1.00 72.53 C ATOM 516 CG PRO A 37 -11.807 38.763 -22.664 1.00 42.14 C ATOM 517 CD PRO A 37 -11.639 37.754 -23.766 1.00 74.24 C ATOM 0 HA PRO A 37 -8.900 37.281 -22.065 1.00 53.01 H new ATOM 0 HB2 PRO A 37 -10.649 39.095 -20.892 1.00 72.53 H new ATOM 0 HB3 PRO A 37 -9.813 39.492 -22.380 1.00 72.53 H new ATOM 0 HG2 PRO A 37 -12.626 38.484 -22.001 1.00 42.14 H new ATOM 0 HG3 PRO A 37 -12.045 39.747 -23.069 1.00 42.14 H new ATOM 0 HD2 PRO A 37 -12.574 37.238 -23.984 1.00 74.24 H new ATOM 0 HD3 PRO A 37 -11.310 38.223 -24.693 1.00 74.24 H new ATOM 525 N GLU A 38 -11.476 35.812 -20.879 1.00 15.21 N ATOM 526 CA GLU A 38 -11.961 35.010 -19.762 1.00 1.14 C ATOM 527 C GLU A 38 -11.272 33.649 -19.730 1.00 22.11 C ATOM 528 O GLU A 38 -11.205 33.000 -18.686 1.00 53.25 O ATOM 529 CB GLU A 38 -13.477 34.825 -19.857 1.00 63.44 C ATOM 530 CG GLU A 38 -13.907 33.901 -20.985 1.00 2.31 C ATOM 531 CD GLU A 38 -15.369 34.067 -21.349 1.00 53.53 C ATOM 532 OE1 GLU A 38 -15.790 35.214 -21.611 1.00 65.31 O ATOM 533 OE2 GLU A 38 -16.093 33.050 -21.373 1.00 14.12 O ATOM 0 H GLU A 38 -12.042 35.743 -21.725 1.00 15.21 H new ATOM 0 HA GLU A 38 -11.725 35.539 -18.839 1.00 1.14 H new ATOM 0 HB2 GLU A 38 -13.846 34.427 -18.912 1.00 63.44 H new ATOM 0 HB3 GLU A 38 -13.946 35.799 -19.998 1.00 63.44 H new ATOM 0 HG2 GLU A 38 -13.293 34.097 -21.864 1.00 2.31 H new ATOM 0 HG3 GLU A 38 -13.724 32.867 -20.692 1.00 2.31 H new ATOM 540 N GLU A 39 -10.762 33.224 -20.881 1.00 65.54 N ATOM 541 CA GLU A 39 -10.079 31.939 -20.986 1.00 11.14 C ATOM 542 C GLU A 39 -8.567 32.117 -20.884 1.00 21.34 C ATOM 543 O GLU A 39 -7.833 31.157 -20.646 1.00 42.04 O ATOM 544 CB GLU A 39 -10.435 31.253 -22.306 1.00 71.11 C ATOM 545 CG GLU A 39 -10.247 29.745 -22.279 1.00 13.44 C ATOM 546 CD GLU A 39 -11.536 29.002 -21.987 1.00 55.11 C ATOM 547 OE1 GLU A 39 -11.993 29.040 -20.825 1.00 42.41 O ATOM 548 OE2 GLU A 39 -12.089 28.382 -22.920 1.00 3.41 O ATOM 0 H GLU A 39 -10.808 33.750 -21.754 1.00 65.54 H new ATOM 0 HA GLU A 39 -10.410 31.312 -20.158 1.00 11.14 H new ATOM 0 HB2 GLU A 39 -11.473 31.477 -22.554 1.00 71.11 H new ATOM 0 HB3 GLU A 39 -9.820 31.673 -23.102 1.00 71.11 H new ATOM 0 HG2 GLU A 39 -9.851 29.415 -23.239 1.00 13.44 H new ATOM 0 HG3 GLU A 39 -9.505 29.489 -21.523 1.00 13.44 H new ATOM 555 N TYR A 40 -8.109 33.350 -21.065 1.00 4.20 N ATOM 556 CA TYR A 40 -6.684 33.654 -20.997 1.00 12.14 C ATOM 557 C TYR A 40 -6.188 33.618 -19.554 1.00 60.34 C ATOM 558 O TYR A 40 -5.107 33.102 -19.270 1.00 71.41 O ATOM 559 CB TYR A 40 -6.404 35.027 -21.609 1.00 54.35 C ATOM 560 CG TYR A 40 -5.189 35.053 -22.508 1.00 63.02 C ATOM 561 CD1 TYR A 40 -3.909 34.918 -21.984 1.00 13.44 C ATOM 562 CD2 TYR A 40 -5.320 35.211 -23.883 1.00 20.25 C ATOM 563 CE1 TYR A 40 -2.796 34.942 -22.801 1.00 50.11 C ATOM 564 CE2 TYR A 40 -4.212 35.234 -24.708 1.00 13.22 C ATOM 565 CZ TYR A 40 -2.953 35.100 -24.162 1.00 64.13 C ATOM 566 OH TYR A 40 -1.846 35.123 -24.980 1.00 71.41 O ATOM 0 H TYR A 40 -8.703 34.156 -21.260 1.00 4.20 H new ATOM 0 HA TYR A 40 -6.149 32.894 -21.566 1.00 12.14 H new ATOM 0 HB2 TYR A 40 -7.276 35.345 -22.181 1.00 54.35 H new ATOM 0 HB3 TYR A 40 -6.267 35.752 -20.807 1.00 54.35 H new ATOM 0 HD1 TYR A 40 -3.782 34.792 -20.919 1.00 13.44 H new ATOM 0 HD2 TYR A 40 -6.305 35.318 -24.314 1.00 20.25 H new ATOM 0 HE1 TYR A 40 -1.808 34.838 -22.377 1.00 50.11 H new ATOM 0 HE2 TYR A 40 -4.331 35.356 -25.774 1.00 13.22 H new ATOM 0 HH TYR A 40 -2.129 35.240 -25.911 1.00 71.41 H new ATOM 576 N VAL A 41 -6.987 34.170 -18.646 1.00 61.55 N ATOM 577 CA VAL A 41 -6.632 34.200 -17.233 1.00 24.42 C ATOM 578 C VAL A 41 -6.236 32.814 -16.736 1.00 31.41 C ATOM 579 O VAL A 41 -5.139 32.602 -16.218 1.00 52.04 O ATOM 580 CB VAL A 41 -7.795 34.729 -16.373 1.00 22.42 C ATOM 581 CG1 VAL A 41 -7.765 34.099 -14.989 1.00 32.34 C ATOM 582 CG2 VAL A 41 -7.740 36.246 -16.278 1.00 62.14 C ATOM 0 H VAL A 41 -7.885 34.602 -18.865 1.00 61.55 H new ATOM 0 HA VAL A 41 -5.781 34.875 -17.135 1.00 24.42 H new ATOM 0 HB VAL A 41 -8.734 34.452 -16.852 1.00 22.42 H new ATOM 0 HG11 VAL A 41 -8.594 34.485 -14.396 1.00 32.34 H new ATOM 0 HG12 VAL A 41 -7.856 33.017 -15.080 1.00 32.34 H new ATOM 0 HG13 VAL A 41 -6.823 34.344 -14.498 1.00 32.34 H new ATOM 0 HG21 VAL A 41 -8.569 36.603 -15.667 1.00 62.14 H new ATOM 0 HG22 VAL A 41 -6.797 36.548 -15.822 1.00 62.14 H new ATOM 0 HG23 VAL A 41 -7.814 36.676 -17.277 1.00 62.14 H new ATOM 592 N PRO A 42 -7.150 31.845 -16.896 1.00 64.33 N ATOM 593 CA PRO A 42 -6.919 30.461 -16.471 1.00 63.24 C ATOM 594 C PRO A 42 -5.877 29.756 -17.333 1.00 44.11 C ATOM 595 O PRO A 42 -5.180 28.855 -16.868 1.00 5.03 O ATOM 596 CB PRO A 42 -8.290 29.803 -16.645 1.00 61.12 C ATOM 597 CG PRO A 42 -8.971 30.617 -17.691 1.00 23.21 C ATOM 598 CD PRO A 42 -8.478 32.025 -17.505 1.00 51.33 C ATOM 0 HA PRO A 42 -6.531 30.407 -15.454 1.00 63.24 H new ATOM 0 HB2 PRO A 42 -8.193 28.762 -16.954 1.00 61.12 H new ATOM 0 HB3 PRO A 42 -8.853 29.807 -15.711 1.00 61.12 H new ATOM 0 HG2 PRO A 42 -8.733 30.249 -18.689 1.00 23.21 H new ATOM 0 HG3 PRO A 42 -10.054 30.565 -17.582 1.00 23.21 H new ATOM 0 HD2 PRO A 42 -8.416 32.557 -18.454 1.00 51.33 H new ATOM 0 HD3 PRO A 42 -9.141 32.601 -16.859 1.00 51.33 H new ATOM 606 N MET A 43 -5.776 30.173 -18.591 1.00 62.20 N ATOM 607 CA MET A 43 -4.817 29.582 -19.517 1.00 62.30 C ATOM 608 C MET A 43 -3.424 29.529 -18.897 1.00 71.10 C ATOM 609 O MET A 43 -2.745 28.504 -18.957 1.00 73.43 O ATOM 610 CB MET A 43 -4.777 30.379 -20.822 1.00 0.42 C ATOM 611 CG MET A 43 -4.972 29.524 -22.063 1.00 42.02 C ATOM 612 SD MET A 43 -6.591 28.733 -22.115 1.00 14.24 S ATOM 613 CE MET A 43 -7.164 29.240 -23.734 1.00 73.22 C ATOM 0 H MET A 43 -6.346 30.917 -18.992 1.00 62.20 H new ATOM 0 HA MET A 43 -5.139 28.563 -19.732 1.00 62.30 H new ATOM 0 HB2 MET A 43 -5.551 31.146 -20.794 1.00 0.42 H new ATOM 0 HB3 MET A 43 -3.820 30.895 -20.893 1.00 0.42 H new ATOM 0 HG2 MET A 43 -4.847 30.145 -22.950 1.00 42.02 H new ATOM 0 HG3 MET A 43 -4.197 28.758 -22.097 1.00 42.02 H new ATOM 0 HE1 MET A 43 -7.896 28.521 -24.103 1.00 73.22 H new ATOM 0 HE2 MET A 43 -7.626 30.225 -23.665 1.00 73.22 H new ATOM 0 HE3 MET A 43 -6.319 29.283 -24.422 1.00 73.22 H new ATOM 623 N VAL A 44 -3.004 30.640 -18.301 1.00 43.54 N ATOM 624 CA VAL A 44 -1.692 30.720 -17.670 1.00 10.23 C ATOM 625 C VAL A 44 -1.587 29.752 -16.497 1.00 32.02 C ATOM 626 O VAL A 44 -0.512 29.231 -16.201 1.00 45.02 O ATOM 627 CB VAL A 44 -1.395 32.147 -17.172 1.00 22.05 C ATOM 628 CG1 VAL A 44 -2.099 32.409 -15.849 1.00 31.40 C ATOM 629 CG2 VAL A 44 0.105 32.363 -17.038 1.00 61.40 C ATOM 0 H VAL A 44 -3.553 31.497 -18.242 1.00 43.54 H new ATOM 0 HA VAL A 44 -0.958 30.448 -18.429 1.00 10.23 H new ATOM 0 HB VAL A 44 -1.777 32.856 -17.906 1.00 22.05 H new ATOM 0 HG11 VAL A 44 -1.877 33.422 -15.513 1.00 31.40 H new ATOM 0 HG12 VAL A 44 -3.175 32.298 -15.981 1.00 31.40 H new ATOM 0 HG13 VAL A 44 -1.750 31.695 -15.103 1.00 31.40 H new ATOM 0 HG21 VAL A 44 0.297 33.376 -16.685 1.00 61.40 H new ATOM 0 HG22 VAL A 44 0.513 31.647 -16.325 1.00 61.40 H new ATOM 0 HG23 VAL A 44 0.581 32.220 -18.008 1.00 61.40 H new ATOM 639 N LYS A 45 -2.712 29.514 -15.831 1.00 11.23 N ATOM 640 CA LYS A 45 -2.749 28.607 -14.690 1.00 72.20 C ATOM 641 C LYS A 45 -2.312 27.203 -15.097 1.00 13.21 C ATOM 642 O LYS A 45 -1.464 26.595 -14.445 1.00 72.33 O ATOM 643 CB LYS A 45 -4.158 28.561 -14.094 1.00 51.21 C ATOM 644 CG LYS A 45 -4.188 28.754 -12.588 1.00 22.43 C ATOM 645 CD LYS A 45 -3.761 30.159 -12.196 1.00 73.54 C ATOM 646 CE LYS A 45 -4.866 31.170 -12.461 1.00 44.31 C ATOM 647 NZ LYS A 45 -4.318 32.505 -12.830 1.00 52.11 N ATOM 0 H LYS A 45 -3.611 29.937 -16.062 1.00 11.23 H new ATOM 0 HA LYS A 45 -2.055 28.981 -13.938 1.00 72.20 H new ATOM 0 HB2 LYS A 45 -4.767 29.334 -14.563 1.00 51.21 H new ATOM 0 HB3 LYS A 45 -4.616 27.602 -14.338 1.00 51.21 H new ATOM 0 HG2 LYS A 45 -5.194 28.562 -12.216 1.00 22.43 H new ATOM 0 HG3 LYS A 45 -3.528 28.027 -12.114 1.00 22.43 H new ATOM 0 HD2 LYS A 45 -3.494 30.178 -11.139 1.00 73.54 H new ATOM 0 HD3 LYS A 45 -2.868 30.439 -12.755 1.00 73.54 H new ATOM 0 HE2 LYS A 45 -5.507 30.806 -13.264 1.00 44.31 H new ATOM 0 HE3 LYS A 45 -5.491 31.266 -11.573 1.00 44.31 H new ATOM 0 HZ1 LYS A 45 -5.102 33.166 -13.003 1.00 52.11 H new ATOM 0 HZ2 LYS A 45 -3.727 32.864 -12.054 1.00 52.11 H new ATOM 0 HZ3 LYS A 45 -3.742 32.418 -13.692 1.00 52.11 H new ATOM 661 N GLU A 46 -2.896 26.697 -16.178 1.00 72.44 N ATOM 662 CA GLU A 46 -2.565 25.365 -16.671 1.00 74.32 C ATOM 663 C GLU A 46 -1.090 25.275 -17.049 1.00 4.41 C ATOM 664 O GLU A 46 -0.371 24.389 -16.586 1.00 12.31 O ATOM 665 CB GLU A 46 -3.435 25.014 -17.880 1.00 62.44 C ATOM 666 CG GLU A 46 -4.829 24.537 -17.510 1.00 13.52 C ATOM 667 CD GLU A 46 -4.949 23.026 -17.509 1.00 63.25 C ATOM 668 OE1 GLU A 46 -4.438 22.391 -16.563 1.00 2.32 O ATOM 669 OE2 GLU A 46 -5.552 22.478 -18.455 1.00 73.40 O ATOM 0 H GLU A 46 -3.600 27.188 -16.729 1.00 72.44 H new ATOM 0 HA GLU A 46 -2.761 24.651 -15.871 1.00 74.32 H new ATOM 0 HB2 GLU A 46 -3.519 25.890 -18.523 1.00 62.44 H new ATOM 0 HB3 GLU A 46 -2.937 24.238 -18.462 1.00 62.44 H new ATOM 0 HG2 GLU A 46 -5.089 24.919 -16.523 1.00 13.52 H new ATOM 0 HG3 GLU A 46 -5.550 24.954 -18.213 1.00 13.52 H new ATOM 676 N VAL A 47 -0.644 26.200 -17.894 1.00 71.41 N ATOM 677 CA VAL A 47 0.746 26.227 -18.334 1.00 75.45 C ATOM 678 C VAL A 47 1.696 26.339 -17.148 1.00 20.52 C ATOM 679 O VAL A 47 2.696 25.626 -17.071 1.00 10.14 O ATOM 680 CB VAL A 47 1.006 27.399 -19.299 1.00 71.11 C ATOM 681 CG1 VAL A 47 2.405 27.305 -19.888 1.00 41.13 C ATOM 682 CG2 VAL A 47 -0.044 27.426 -20.399 1.00 51.15 C ATOM 0 H VAL A 47 -1.225 26.940 -18.287 1.00 71.41 H new ATOM 0 HA VAL A 47 0.931 25.288 -18.856 1.00 75.45 H new ATOM 0 HB VAL A 47 0.936 28.331 -18.738 1.00 71.11 H new ATOM 0 HG11 VAL A 47 2.571 28.141 -20.567 1.00 41.13 H new ATOM 0 HG12 VAL A 47 3.141 27.339 -19.085 1.00 41.13 H new ATOM 0 HG13 VAL A 47 2.507 26.368 -20.435 1.00 41.13 H new ATOM 0 HG21 VAL A 47 0.155 28.260 -21.072 1.00 51.15 H new ATOM 0 HG22 VAL A 47 -0.008 26.492 -20.959 1.00 51.15 H new ATOM 0 HG23 VAL A 47 -1.033 27.545 -19.956 1.00 51.15 H new ATOM 692 N GLY A 48 1.376 27.239 -16.223 1.00 21.20 N ATOM 693 CA GLY A 48 2.211 27.428 -15.051 1.00 64.34 C ATOM 694 C GLY A 48 2.284 26.186 -14.185 1.00 3.10 C ATOM 695 O GLY A 48 3.351 25.835 -13.678 1.00 53.21 O ATOM 0 H GLY A 48 0.553 27.841 -16.264 1.00 21.20 H new ATOM 0 HA2 GLY A 48 3.216 27.707 -15.366 1.00 64.34 H new ATOM 0 HA3 GLY A 48 1.821 28.257 -14.460 1.00 64.34 H new ATOM 699 N LEU A 49 1.148 25.520 -14.012 1.00 62.34 N ATOM 700 CA LEU A 49 1.087 24.310 -13.199 1.00 54.12 C ATOM 701 C LEU A 49 1.949 23.205 -13.801 1.00 3.23 C ATOM 702 O LEU A 49 2.595 22.446 -13.079 1.00 3.21 O ATOM 703 CB LEU A 49 -0.360 23.831 -13.072 1.00 34.33 C ATOM 704 CG LEU A 49 -0.934 23.798 -11.655 1.00 32.13 C ATOM 705 CD1 LEU A 49 -0.976 25.198 -11.063 1.00 53.44 C ATOM 706 CD2 LEU A 49 -2.323 23.176 -11.656 1.00 22.50 C ATOM 0 H LEU A 49 0.257 25.797 -14.423 1.00 62.34 H new ATOM 0 HA LEU A 49 1.474 24.548 -12.208 1.00 54.12 H new ATOM 0 HB2 LEU A 49 -0.990 24.477 -13.683 1.00 34.33 H new ATOM 0 HB3 LEU A 49 -0.428 22.828 -13.494 1.00 34.33 H new ATOM 0 HG LEU A 49 -0.282 23.183 -11.035 1.00 32.13 H new ATOM 0 HD11 LEU A 49 -1.387 25.154 -10.055 1.00 53.44 H new ATOM 0 HD12 LEU A 49 0.033 25.608 -11.026 1.00 53.44 H new ATOM 0 HD13 LEU A 49 -1.604 25.837 -11.684 1.00 53.44 H new ATOM 0 HD21 LEU A 49 -2.716 23.161 -10.639 1.00 22.50 H new ATOM 0 HD22 LEU A 49 -2.985 23.764 -12.292 1.00 22.50 H new ATOM 0 HD23 LEU A 49 -2.265 22.157 -12.038 1.00 22.50 H new ATOM 718 N ALA A 50 1.956 23.123 -15.127 1.00 70.41 N ATOM 719 CA ALA A 50 2.743 22.114 -15.826 1.00 35.33 C ATOM 720 C ALA A 50 4.223 22.238 -15.483 1.00 63.13 C ATOM 721 O ALA A 50 4.885 21.246 -15.176 1.00 23.23 O ATOM 722 CB ALA A 50 2.535 22.230 -17.328 1.00 73.15 C ATOM 0 H ALA A 50 1.426 23.743 -15.739 1.00 70.41 H new ATOM 0 HA ALA A 50 2.403 21.132 -15.499 1.00 35.33 H new ATOM 0 HB1 ALA A 50 3.129 21.471 -17.837 1.00 73.15 H new ATOM 0 HB2 ALA A 50 1.480 22.083 -17.562 1.00 73.15 H new ATOM 0 HB3 ALA A 50 2.847 23.219 -17.663 1.00 73.15 H new ATOM 728 N LEU A 51 4.738 23.461 -15.539 1.00 51.32 N ATOM 729 CA LEU A 51 6.142 23.715 -15.235 1.00 50.34 C ATOM 730 C LEU A 51 6.452 23.388 -13.778 1.00 54.41 C ATOM 731 O LEU A 51 7.350 22.599 -13.486 1.00 41.10 O ATOM 732 CB LEU A 51 6.491 25.176 -15.528 1.00 23.42 C ATOM 733 CG LEU A 51 6.634 25.549 -17.004 1.00 12.24 C ATOM 734 CD1 LEU A 51 5.674 26.672 -17.365 1.00 3.40 C ATOM 735 CD2 LEU A 51 8.068 25.949 -17.316 1.00 42.35 C ATOM 0 H LEU A 51 4.204 24.293 -15.792 1.00 51.32 H new ATOM 0 HA LEU A 51 6.748 23.069 -15.869 1.00 50.34 H new ATOM 0 HB2 LEU A 51 5.720 25.808 -15.087 1.00 23.42 H new ATOM 0 HB3 LEU A 51 7.426 25.414 -15.022 1.00 23.42 H new ATOM 0 HG LEU A 51 6.383 24.676 -17.606 1.00 12.24 H new ATOM 0 HD11 LEU A 51 5.789 26.925 -18.419 1.00 3.40 H new ATOM 0 HD12 LEU A 51 4.650 26.349 -17.179 1.00 3.40 H new ATOM 0 HD13 LEU A 51 5.894 27.549 -16.756 1.00 3.40 H new ATOM 0 HD21 LEU A 51 8.151 26.211 -18.371 1.00 42.35 H new ATOM 0 HD22 LEU A 51 8.347 26.808 -16.705 1.00 42.35 H new ATOM 0 HD23 LEU A 51 8.734 25.115 -17.096 1.00 42.35 H new ATOM 747 N ARG A 52 5.700 23.999 -12.868 1.00 22.14 N ATOM 748 CA ARG A 52 5.894 23.772 -11.441 1.00 32.05 C ATOM 749 C ARG A 52 5.792 22.286 -11.108 1.00 3.34 C ATOM 750 O ARG A 52 6.552 21.769 -10.287 1.00 75.25 O ATOM 751 CB ARG A 52 4.860 24.558 -10.633 1.00 11.45 C ATOM 752 CG ARG A 52 5.472 25.594 -9.704 1.00 3.03 C ATOM 753 CD ARG A 52 4.403 26.431 -9.020 1.00 55.45 C ATOM 754 NE ARG A 52 4.375 27.802 -9.525 1.00 30.31 N ATOM 755 CZ ARG A 52 5.330 28.693 -9.283 1.00 52.14 C ATOM 756 NH1 ARG A 52 6.382 28.360 -8.549 1.00 21.31 N ATOM 757 NH2 ARG A 52 5.233 29.921 -9.777 1.00 63.24 N ATOM 0 H ARG A 52 4.952 24.654 -13.093 1.00 22.14 H new ATOM 0 HA ARG A 52 6.893 24.119 -11.176 1.00 32.05 H new ATOM 0 HB2 ARG A 52 4.177 25.057 -11.321 1.00 11.45 H new ATOM 0 HB3 ARG A 52 4.265 23.860 -10.044 1.00 11.45 H new ATOM 0 HG2 ARG A 52 6.081 25.094 -8.951 1.00 3.03 H new ATOM 0 HG3 ARG A 52 6.137 26.245 -10.271 1.00 3.03 H new ATOM 0 HD2 ARG A 52 3.428 25.969 -9.172 1.00 55.45 H new ATOM 0 HD3 ARG A 52 4.585 26.444 -7.945 1.00 55.45 H new ATOM 0 HE ARG A 52 3.579 28.090 -10.094 1.00 30.31 H new ATOM 0 HH11 ARG A 52 6.460 27.417 -8.168 1.00 21.31 H new ATOM 0 HH12 ARG A 52 7.114 29.047 -8.365 1.00 21.31 H new ATOM 0 HH21 ARG A 52 4.425 30.181 -10.343 1.00 63.24 H new ATOM 0 HH22 ARG A 52 5.966 30.605 -9.591 1.00 63.24 H new ATOM 771 N THR A 53 4.848 21.604 -11.749 1.00 45.32 N ATOM 772 CA THR A 53 4.646 20.179 -11.520 1.00 41.35 C ATOM 773 C THR A 53 5.776 19.358 -12.131 1.00 41.53 C ATOM 774 O THR A 53 6.207 18.355 -11.561 1.00 51.20 O ATOM 775 CB THR A 53 3.304 19.701 -12.107 1.00 44.21 C ATOM 776 OG1 THR A 53 2.222 20.416 -11.500 1.00 60.33 O ATOM 777 CG2 THR A 53 3.119 18.207 -11.887 1.00 43.40 C ATOM 0 H THR A 53 4.211 22.016 -12.431 1.00 45.32 H new ATOM 0 HA THR A 53 4.636 20.031 -10.440 1.00 41.35 H new ATOM 0 HB THR A 53 3.311 19.896 -13.179 1.00 44.21 H new ATOM 0 HG1 THR A 53 2.021 21.216 -12.029 1.00 60.33 H new ATOM 0 HG21 THR A 53 2.165 17.892 -12.310 1.00 43.40 H new ATOM 0 HG22 THR A 53 3.929 17.664 -12.375 1.00 43.40 H new ATOM 0 HG23 THR A 53 3.131 17.992 -10.818 1.00 43.40 H new ATOM 785 N LEU A 54 6.253 19.790 -13.293 1.00 42.24 N ATOM 786 CA LEU A 54 7.335 19.095 -13.982 1.00 42.10 C ATOM 787 C LEU A 54 8.540 18.919 -13.064 1.00 24.21 C ATOM 788 O LEU A 54 9.216 17.889 -13.099 1.00 14.15 O ATOM 789 CB LEU A 54 7.745 19.866 -15.238 1.00 60.22 C ATOM 790 CG LEU A 54 8.596 19.097 -16.250 1.00 1.15 C ATOM 791 CD1 LEU A 54 7.817 17.922 -16.819 1.00 71.10 C ATOM 792 CD2 LEU A 54 9.063 20.021 -17.365 1.00 72.22 C ATOM 0 H LEU A 54 5.908 20.618 -13.778 1.00 42.24 H new ATOM 0 HA LEU A 54 6.974 18.108 -14.271 1.00 42.10 H new ATOM 0 HB2 LEU A 54 6.841 20.210 -15.740 1.00 60.22 H new ATOM 0 HB3 LEU A 54 8.296 20.755 -14.931 1.00 60.22 H new ATOM 0 HG LEU A 54 9.475 18.708 -15.736 1.00 1.15 H new ATOM 0 HD11 LEU A 54 8.438 17.387 -17.537 1.00 71.10 H new ATOM 0 HD12 LEU A 54 7.534 17.248 -16.011 1.00 71.10 H new ATOM 0 HD13 LEU A 54 6.919 18.288 -17.318 1.00 71.10 H new ATOM 0 HD21 LEU A 54 9.667 19.457 -18.076 1.00 72.22 H new ATOM 0 HD22 LEU A 54 8.197 20.440 -17.877 1.00 72.22 H new ATOM 0 HD23 LEU A 54 9.660 20.829 -16.942 1.00 72.22 H new ATOM 804 N LEU A 55 8.804 19.929 -12.242 1.00 20.40 N ATOM 805 CA LEU A 55 9.927 19.885 -11.312 1.00 31.13 C ATOM 806 C LEU A 55 9.764 18.742 -10.315 1.00 12.14 C ATOM 807 O LEU A 55 10.707 17.998 -10.048 1.00 43.50 O ATOM 808 CB LEU A 55 10.049 21.215 -10.565 1.00 74.45 C ATOM 809 CG LEU A 55 11.336 22.004 -10.806 1.00 30.22 C ATOM 810 CD1 LEU A 55 11.068 23.499 -10.727 1.00 23.23 C ATOM 811 CD2 LEU A 55 12.406 21.598 -9.802 1.00 74.24 C ATOM 0 H LEU A 55 8.256 20.788 -12.201 1.00 20.40 H new ATOM 0 HA LEU A 55 10.837 19.714 -11.888 1.00 31.13 H new ATOM 0 HB2 LEU A 55 9.203 21.844 -10.843 1.00 74.45 H new ATOM 0 HB3 LEU A 55 9.962 21.018 -9.496 1.00 74.45 H new ATOM 0 HG LEU A 55 11.699 21.773 -11.807 1.00 30.22 H new ATOM 0 HD11 LEU A 55 11.995 24.045 -10.901 1.00 23.23 H new ATOM 0 HD12 LEU A 55 10.335 23.778 -11.484 1.00 23.23 H new ATOM 0 HD13 LEU A 55 10.681 23.748 -9.739 1.00 23.23 H new ATOM 0 HD21 LEU A 55 13.315 22.169 -9.988 1.00 74.24 H new ATOM 0 HD22 LEU A 55 12.052 21.799 -8.791 1.00 74.24 H new ATOM 0 HD23 LEU A 55 12.618 20.534 -9.907 1.00 74.24 H new ATOM 823 N ALA A 56 8.560 18.608 -9.768 1.00 73.45 N ATOM 824 CA ALA A 56 8.272 17.553 -8.804 1.00 53.03 C ATOM 825 C ALA A 56 8.229 16.187 -9.481 1.00 42.21 C ATOM 826 O ALA A 56 8.798 15.216 -8.980 1.00 54.15 O ATOM 827 CB ALA A 56 6.956 17.833 -8.093 1.00 41.02 C ATOM 0 H ALA A 56 7.769 19.217 -9.976 1.00 73.45 H new ATOM 0 HA ALA A 56 9.075 17.539 -8.067 1.00 53.03 H new ATOM 0 HB1 ALA A 56 6.753 17.037 -7.376 1.00 41.02 H new ATOM 0 HB2 ALA A 56 7.022 18.786 -7.568 1.00 41.02 H new ATOM 0 HB3 ALA A 56 6.149 17.876 -8.825 1.00 41.02 H new ATOM 833 N THR A 57 7.551 16.118 -10.623 1.00 0.15 N ATOM 834 CA THR A 57 7.433 14.871 -11.367 1.00 34.20 C ATOM 835 C THR A 57 8.801 14.249 -11.619 1.00 24.10 C ATOM 836 O THR A 57 9.051 13.101 -11.249 1.00 53.43 O ATOM 837 CB THR A 57 6.723 15.088 -12.717 1.00 64.51 C ATOM 838 OG1 THR A 57 7.468 16.011 -13.519 1.00 62.21 O ATOM 839 CG2 THR A 57 5.311 15.614 -12.508 1.00 64.43 C ATOM 0 H THR A 57 7.075 16.912 -11.052 1.00 0.15 H new ATOM 0 HA THR A 57 6.837 14.193 -10.756 1.00 34.20 H new ATOM 0 HB THR A 57 6.663 14.128 -13.230 1.00 64.51 H new ATOM 0 HG1 THR A 57 7.947 16.637 -12.937 1.00 62.21 H new ATOM 0 HG21 THR A 57 4.830 15.759 -13.475 1.00 64.43 H new ATOM 0 HG22 THR A 57 4.738 14.895 -11.922 1.00 64.43 H new ATOM 0 HG23 THR A 57 5.352 16.565 -11.977 1.00 64.43 H new ATOM 847 N VAL A 58 9.687 15.014 -12.250 1.00 73.32 N ATOM 848 CA VAL A 58 11.032 14.538 -12.550 1.00 72.10 C ATOM 849 C VAL A 58 11.826 14.293 -11.272 1.00 34.52 C ATOM 850 O VAL A 58 12.690 13.417 -11.224 1.00 42.31 O ATOM 851 CB VAL A 58 11.798 15.541 -13.433 1.00 22.13 C ATOM 852 CG1 VAL A 58 13.214 15.049 -13.694 1.00 53.42 C ATOM 853 CG2 VAL A 58 11.056 15.775 -14.740 1.00 22.11 C ATOM 0 H VAL A 58 9.497 15.966 -12.563 1.00 73.32 H new ATOM 0 HA VAL A 58 10.922 13.598 -13.092 1.00 72.10 H new ATOM 0 HB VAL A 58 11.861 16.491 -12.903 1.00 22.13 H new ATOM 0 HG11 VAL A 58 13.740 15.770 -14.319 1.00 53.42 H new ATOM 0 HG12 VAL A 58 13.741 14.938 -12.746 1.00 53.42 H new ATOM 0 HG13 VAL A 58 13.177 14.086 -14.203 1.00 53.42 H new ATOM 0 HG21 VAL A 58 11.611 16.486 -15.351 1.00 22.11 H new ATOM 0 HG22 VAL A 58 10.960 14.832 -15.278 1.00 22.11 H new ATOM 0 HG23 VAL A 58 10.064 16.175 -14.529 1.00 22.11 H new ATOM 863 N ASP A 59 11.526 15.070 -10.238 1.00 11.45 N ATOM 864 CA ASP A 59 12.210 14.937 -8.957 1.00 24.12 C ATOM 865 C ASP A 59 12.202 13.486 -8.485 1.00 3.32 C ATOM 866 O ASP A 59 13.232 12.951 -8.077 1.00 4.24 O ATOM 867 CB ASP A 59 11.551 15.832 -7.906 1.00 71.32 C ATOM 868 CG ASP A 59 12.504 16.871 -7.350 1.00 25.44 C ATOM 869 OD1 ASP A 59 13.559 16.478 -6.809 1.00 63.00 O ATOM 870 OD2 ASP A 59 12.196 18.076 -7.454 1.00 14.42 O ATOM 0 H ASP A 59 10.813 15.799 -10.261 1.00 11.45 H new ATOM 0 HA ASP A 59 13.245 15.251 -9.092 1.00 24.12 H new ATOM 0 HB2 ASP A 59 10.690 16.333 -8.348 1.00 71.32 H new ATOM 0 HB3 ASP A 59 11.176 15.214 -7.090 1.00 71.32 H new ATOM 875 N GLU A 60 11.033 12.857 -8.543 1.00 72.21 N ATOM 876 CA GLU A 60 10.891 11.469 -8.120 1.00 24.45 C ATOM 877 C GLU A 60 11.394 10.516 -9.201 1.00 12.04 C ATOM 878 O GLU A 60 11.606 9.330 -8.948 1.00 51.12 O ATOM 879 CB GLU A 60 9.429 11.159 -7.791 1.00 24.12 C ATOM 880 CG GLU A 60 8.469 11.482 -8.923 1.00 43.03 C ATOM 881 CD GLU A 60 7.046 11.053 -8.622 1.00 65.21 C ATOM 882 OE1 GLU A 60 6.657 11.077 -7.436 1.00 2.20 O ATOM 883 OE2 GLU A 60 6.322 10.693 -9.574 1.00 22.42 O ATOM 0 H GLU A 60 10.171 13.286 -8.879 1.00 72.21 H new ATOM 0 HA GLU A 60 11.495 11.326 -7.224 1.00 24.45 H new ATOM 0 HB2 GLU A 60 9.338 10.102 -7.539 1.00 24.12 H new ATOM 0 HB3 GLU A 60 9.137 11.724 -6.906 1.00 24.12 H new ATOM 0 HG2 GLU A 60 8.488 12.555 -9.115 1.00 43.03 H new ATOM 0 HG3 GLU A 60 8.808 10.989 -9.834 1.00 43.03 H new ATOM 890 N SER A 61 11.581 11.044 -10.406 1.00 4.21 N ATOM 891 CA SER A 61 12.054 10.241 -11.527 1.00 45.02 C ATOM 892 C SER A 61 13.535 9.909 -11.371 1.00 22.42 C ATOM 893 O SER A 61 14.022 8.917 -11.916 1.00 30.13 O ATOM 894 CB SER A 61 11.823 10.981 -12.846 1.00 12.41 C ATOM 895 OG SER A 61 11.694 10.072 -13.925 1.00 44.44 O ATOM 0 H SER A 61 11.412 12.024 -10.631 1.00 4.21 H new ATOM 0 HA SER A 61 11.489 9.309 -11.537 1.00 45.02 H new ATOM 0 HB2 SER A 61 10.923 11.592 -12.771 1.00 12.41 H new ATOM 0 HB3 SER A 61 12.654 11.660 -13.036 1.00 12.41 H new ATOM 0 HG SER A 61 11.546 10.570 -14.756 1.00 44.44 H new ATOM 901 N LEU A 62 14.247 10.745 -10.623 1.00 32.41 N ATOM 902 CA LEU A 62 15.673 10.541 -10.393 1.00 40.24 C ATOM 903 C LEU A 62 15.952 9.116 -9.927 1.00 74.23 C ATOM 904 O LEU A 62 16.671 8.354 -10.575 1.00 14.25 O ATOM 905 CB LEU A 62 16.190 11.539 -9.356 1.00 42.41 C ATOM 906 CG LEU A 62 17.229 12.546 -9.853 1.00 32.34 C ATOM 907 CD1 LEU A 62 17.704 13.430 -8.710 1.00 54.33 C ATOM 908 CD2 LEU A 62 18.405 11.825 -10.496 1.00 13.21 C ATOM 0 H LEU A 62 13.860 11.570 -10.165 1.00 32.41 H new ATOM 0 HA LEU A 62 16.194 10.703 -11.336 1.00 40.24 H new ATOM 0 HB2 LEU A 62 15.339 12.092 -8.957 1.00 42.41 H new ATOM 0 HB3 LEU A 62 16.623 10.979 -8.527 1.00 42.41 H new ATOM 0 HG LEU A 62 16.762 13.180 -10.606 1.00 32.34 H new ATOM 0 HD11 LEU A 62 18.443 14.140 -9.082 1.00 54.33 H new ATOM 0 HD12 LEU A 62 16.856 13.973 -8.294 1.00 54.33 H new ATOM 0 HD13 LEU A 62 18.154 12.811 -7.934 1.00 54.33 H new ATOM 0 HD21 LEU A 62 19.134 12.557 -10.844 1.00 13.21 H new ATOM 0 HD22 LEU A 62 18.872 11.166 -9.764 1.00 13.21 H new ATOM 0 HD23 LEU A 62 18.052 11.235 -11.342 1.00 13.21 H new ATOM 920 N PRO A 63 15.368 8.744 -8.778 1.00 70.14 N ATOM 921 CA PRO A 63 15.536 7.407 -8.201 1.00 65.14 C ATOM 922 C PRO A 63 14.835 6.329 -9.021 1.00 15.33 C ATOM 923 O PRO A 63 15.350 5.223 -9.181 1.00 71.21 O ATOM 924 CB PRO A 63 14.891 7.533 -6.819 1.00 40.12 C ATOM 925 CG PRO A 63 13.903 8.639 -6.962 1.00 5.32 C ATOM 926 CD PRO A 63 14.498 9.600 -7.954 1.00 61.23 C ATOM 0 HA PRO A 63 16.583 7.105 -8.171 1.00 65.14 H new ATOM 0 HB2 PRO A 63 14.405 6.604 -6.523 1.00 40.12 H new ATOM 0 HB3 PRO A 63 15.634 7.762 -6.055 1.00 40.12 H new ATOM 0 HG2 PRO A 63 12.942 8.261 -7.312 1.00 5.32 H new ATOM 0 HG3 PRO A 63 13.723 9.128 -6.005 1.00 5.32 H new ATOM 0 HD2 PRO A 63 13.729 10.086 -8.554 1.00 61.23 H new ATOM 0 HD3 PRO A 63 15.063 10.390 -7.459 1.00 61.23 H new ATOM 934 N VAL A 64 13.655 6.660 -9.538 1.00 65.40 N ATOM 935 CA VAL A 64 12.883 5.720 -10.343 1.00 3.35 C ATOM 936 C VAL A 64 13.711 5.183 -11.505 1.00 33.43 C ATOM 937 O VAL A 64 13.460 4.085 -12.004 1.00 22.30 O ATOM 938 CB VAL A 64 11.604 6.375 -10.897 1.00 43.30 C ATOM 939 CG1 VAL A 64 10.912 5.446 -11.882 1.00 32.52 C ATOM 940 CG2 VAL A 64 10.667 6.757 -9.762 1.00 35.13 C ATOM 0 H VAL A 64 13.213 7.571 -9.414 1.00 65.40 H new ATOM 0 HA VAL A 64 12.605 4.895 -9.687 1.00 3.35 H new ATOM 0 HB VAL A 64 11.883 7.285 -11.428 1.00 43.30 H new ATOM 0 HG11 VAL A 64 10.010 5.926 -12.263 1.00 32.52 H new ATOM 0 HG12 VAL A 64 11.585 5.228 -12.711 1.00 32.52 H new ATOM 0 HG13 VAL A 64 10.644 4.517 -11.379 1.00 32.52 H new ATOM 0 HG21 VAL A 64 9.768 7.218 -10.172 1.00 35.13 H new ATOM 0 HG22 VAL A 64 10.393 5.864 -9.201 1.00 35.13 H new ATOM 0 HG23 VAL A 64 11.167 7.463 -9.099 1.00 35.13 H new ATOM 950 N LEU A 65 14.698 5.962 -11.931 1.00 51.33 N ATOM 951 CA LEU A 65 15.564 5.565 -13.036 1.00 23.45 C ATOM 952 C LEU A 65 16.985 5.301 -12.546 1.00 14.23 C ATOM 953 O LEU A 65 17.400 5.774 -11.487 1.00 62.44 O ATOM 954 CB LEU A 65 15.578 6.648 -14.115 1.00 13.40 C ATOM 955 CG LEU A 65 14.438 6.596 -15.133 1.00 63.53 C ATOM 956 CD1 LEU A 65 14.863 5.817 -16.369 1.00 55.21 C ATOM 957 CD2 LEU A 65 13.195 5.976 -14.511 1.00 44.12 C ATOM 0 H LEU A 65 14.919 6.873 -11.528 1.00 51.33 H new ATOM 0 HA LEU A 65 15.168 4.643 -13.462 1.00 23.45 H new ATOM 0 HB2 LEU A 65 15.557 7.621 -13.625 1.00 13.40 H new ATOM 0 HB3 LEU A 65 16.523 6.583 -14.654 1.00 13.40 H new ATOM 0 HG LEU A 65 14.198 7.616 -15.435 1.00 63.53 H new ATOM 0 HD11 LEU A 65 14.040 5.790 -17.083 1.00 55.21 H new ATOM 0 HD12 LEU A 65 15.725 6.303 -16.827 1.00 55.21 H new ATOM 0 HD13 LEU A 65 15.130 4.799 -16.084 1.00 55.21 H new ATOM 0 HD21 LEU A 65 12.394 5.947 -15.250 1.00 44.12 H new ATOM 0 HD22 LEU A 65 13.421 4.962 -14.181 1.00 44.12 H new ATOM 0 HD23 LEU A 65 12.879 6.574 -13.656 1.00 44.12 H new ATOM 969 N PRO A 66 17.749 4.531 -13.333 1.00 62.55 N ATOM 970 CA PRO A 66 19.136 4.189 -13.002 1.00 13.22 C ATOM 971 C PRO A 66 20.069 5.391 -13.105 1.00 61.41 C ATOM 972 O PRO A 66 20.031 6.136 -14.084 1.00 31.24 O ATOM 973 CB PRO A 66 19.502 3.136 -14.050 1.00 62.31 C ATOM 974 CG PRO A 66 18.601 3.419 -15.202 1.00 63.44 C ATOM 975 CD PRO A 66 17.319 3.934 -14.609 1.00 62.50 C ATOM 0 HA PRO A 66 19.236 3.839 -11.975 1.00 13.22 H new ATOM 0 HB2 PRO A 66 20.550 3.213 -14.339 1.00 62.31 H new ATOM 0 HB3 PRO A 66 19.350 2.127 -13.667 1.00 62.31 H new ATOM 0 HG2 PRO A 66 19.044 4.155 -15.872 1.00 63.44 H new ATOM 0 HG3 PRO A 66 18.425 2.518 -15.790 1.00 63.44 H new ATOM 0 HD2 PRO A 66 16.844 4.670 -15.257 1.00 62.50 H new ATOM 0 HD3 PRO A 66 16.597 3.132 -14.454 1.00 62.50 H new ATOM 983 N ALA A 67 20.907 5.572 -12.089 1.00 52.34 N ATOM 984 CA ALA A 67 21.852 6.682 -12.068 1.00 33.13 C ATOM 985 C ALA A 67 22.712 6.695 -13.326 1.00 64.34 C ATOM 986 O ALA A 67 23.501 5.779 -13.560 1.00 21.11 O ATOM 987 CB ALA A 67 22.729 6.604 -10.827 1.00 32.00 C ATOM 0 H ALA A 67 20.951 4.965 -11.271 1.00 52.34 H new ATOM 0 HA ALA A 67 21.283 7.611 -12.040 1.00 33.13 H new ATOM 0 HB1 ALA A 67 23.430 7.439 -10.824 1.00 32.00 H new ATOM 0 HB2 ALA A 67 22.103 6.652 -9.936 1.00 32.00 H new ATOM 0 HB3 ALA A 67 23.283 5.665 -10.831 1.00 32.00 H new ATOM 993 N SER A 68 22.555 7.738 -14.135 1.00 1.02 N ATOM 994 CA SER A 68 23.315 7.867 -15.373 1.00 0.44 C ATOM 995 C SER A 68 22.910 9.129 -16.129 1.00 61.24 C ATOM 996 O SER A 68 23.730 9.753 -16.804 1.00 12.32 O ATOM 997 CB SER A 68 23.102 6.638 -16.257 1.00 61.35 C ATOM 998 OG SER A 68 21.869 6.005 -15.963 1.00 54.24 O ATOM 0 H SER A 68 21.908 8.506 -13.955 1.00 1.02 H new ATOM 0 HA SER A 68 24.372 7.941 -15.116 1.00 0.44 H new ATOM 0 HB2 SER A 68 23.122 6.933 -17.306 1.00 61.35 H new ATOM 0 HB3 SER A 68 23.920 5.933 -16.109 1.00 61.35 H new ATOM 0 HG SER A 68 21.756 5.223 -16.543 1.00 54.24 H new ATOM 1004 N THR A 69 21.638 9.499 -16.013 1.00 25.13 N ATOM 1005 CA THR A 69 21.123 10.684 -16.686 1.00 14.24 C ATOM 1006 C THR A 69 20.763 11.773 -15.682 1.00 14.42 C ATOM 1007 O THR A 69 19.897 12.610 -15.942 1.00 33.43 O ATOM 1008 CB THR A 69 19.880 10.353 -17.534 1.00 24.31 C ATOM 1009 OG1 THR A 69 19.454 11.515 -18.254 1.00 23.12 O ATOM 1010 CG2 THR A 69 18.745 9.849 -16.656 1.00 74.13 C ATOM 0 H THR A 69 20.946 8.994 -15.459 1.00 25.13 H new ATOM 0 HA THR A 69 21.916 11.045 -17.342 1.00 14.24 H new ATOM 0 HB THR A 69 20.148 9.567 -18.240 1.00 24.31 H new ATOM 0 HG1 THR A 69 19.426 12.284 -17.647 1.00 23.12 H new ATOM 0 HG21 THR A 69 17.878 9.622 -17.277 1.00 74.13 H new ATOM 0 HG22 THR A 69 19.063 8.947 -16.132 1.00 74.13 H new ATOM 0 HG23 THR A 69 18.479 10.616 -15.929 1.00 74.13 H new ATOM 1018 N HIS A 70 21.433 11.759 -14.534 1.00 34.22 N ATOM 1019 CA HIS A 70 21.184 12.747 -13.491 1.00 15.34 C ATOM 1020 C HIS A 70 21.652 14.131 -13.930 1.00 42.02 C ATOM 1021 O HIS A 70 21.106 15.147 -13.501 1.00 53.33 O ATOM 1022 CB HIS A 70 21.891 12.344 -12.197 1.00 21.43 C ATOM 1023 CG HIS A 70 23.385 12.373 -12.297 1.00 2.12 C ATOM 1024 ND1 HIS A 70 24.157 13.376 -11.749 1.00 14.13 N ATOM 1025 CD2 HIS A 70 24.250 11.514 -12.885 1.00 23.13 C ATOM 1026 CE1 HIS A 70 25.431 13.134 -11.997 1.00 23.43 C ATOM 1027 NE2 HIS A 70 25.515 12.009 -12.684 1.00 44.03 N ATOM 0 H HIS A 70 22.153 11.074 -14.303 1.00 34.22 H new ATOM 0 HA HIS A 70 20.109 12.786 -13.312 1.00 15.34 H new ATOM 0 HB2 HIS A 70 21.576 13.013 -11.397 1.00 21.43 H new ATOM 0 HB3 HIS A 70 21.573 11.340 -11.917 1.00 21.43 H new ATOM 0 HD2 HIS A 70 23.993 10.608 -13.414 1.00 23.13 H new ATOM 0 HE1 HIS A 70 26.263 13.751 -11.690 1.00 23.43 H new ATOM 0 HE2 HIS A 70 26.379 11.578 -13.012 1.00 44.03 H new ATOM 1035 N ARG A 71 22.668 14.162 -14.787 1.00 74.02 N ATOM 1036 CA ARG A 71 23.211 15.421 -15.283 1.00 32.20 C ATOM 1037 C ARG A 71 22.102 16.312 -15.835 1.00 34.24 C ATOM 1038 O ARG A 71 21.881 17.419 -15.344 1.00 73.44 O ATOM 1039 CB ARG A 71 24.256 15.157 -16.369 1.00 14.51 C ATOM 1040 CG ARG A 71 24.778 16.422 -17.031 1.00 53.02 C ATOM 1041 CD ARG A 71 26.222 16.261 -17.478 1.00 43.11 C ATOM 1042 NE ARG A 71 26.645 17.343 -18.363 1.00 41.03 N ATOM 1043 CZ ARG A 71 26.923 18.572 -17.941 1.00 61.45 C ATOM 1044 NH1 ARG A 71 26.824 18.872 -16.654 1.00 51.30 N ATOM 1045 NH2 ARG A 71 27.302 19.502 -18.808 1.00 52.13 N ATOM 0 H ARG A 71 23.131 13.330 -15.152 1.00 74.02 H new ATOM 0 HA ARG A 71 23.686 15.937 -14.448 1.00 32.20 H new ATOM 0 HB2 ARG A 71 25.094 14.614 -15.931 1.00 14.51 H new ATOM 0 HB3 ARG A 71 23.821 14.511 -17.131 1.00 14.51 H new ATOM 0 HG2 ARG A 71 24.155 16.668 -17.891 1.00 53.02 H new ATOM 0 HG3 ARG A 71 24.703 17.257 -16.334 1.00 53.02 H new ATOM 0 HD2 ARG A 71 26.871 16.234 -16.603 1.00 43.11 H new ATOM 0 HD3 ARG A 71 26.338 15.306 -17.991 1.00 43.11 H new ATOM 0 HE ARG A 71 26.732 17.144 -19.360 1.00 41.03 H new ATOM 0 HH11 ARG A 71 26.534 18.159 -15.985 1.00 51.30 H new ATOM 0 HH12 ARG A 71 27.038 19.816 -16.332 1.00 51.30 H new ATOM 0 HH21 ARG A 71 27.380 19.274 -19.799 1.00 52.13 H new ATOM 0 HH22 ARG A 71 27.515 20.445 -18.483 1.00 52.13 H new ATOM 1059 N GLU A 72 21.408 15.821 -16.857 1.00 64.40 N ATOM 1060 CA GLU A 72 20.324 16.574 -17.475 1.00 75.45 C ATOM 1061 C GLU A 72 19.175 16.780 -16.492 1.00 41.31 C ATOM 1062 O GLU A 72 18.555 17.844 -16.460 1.00 61.34 O ATOM 1063 CB GLU A 72 19.816 15.848 -18.724 1.00 4.24 C ATOM 1064 CG GLU A 72 20.927 15.376 -19.647 1.00 21.04 C ATOM 1065 CD GLU A 72 20.403 14.848 -20.968 1.00 52.30 C ATOM 1066 OE1 GLU A 72 19.305 15.273 -21.383 1.00 55.14 O ATOM 1067 OE2 GLU A 72 21.092 14.010 -21.587 1.00 12.32 O ATOM 0 H GLU A 72 21.577 14.906 -17.274 1.00 64.40 H new ATOM 0 HA GLU A 72 20.713 17.551 -17.763 1.00 75.45 H new ATOM 0 HB2 GLU A 72 19.220 14.988 -18.417 1.00 4.24 H new ATOM 0 HB3 GLU A 72 19.154 16.514 -19.277 1.00 4.24 H new ATOM 0 HG2 GLU A 72 21.612 16.202 -19.836 1.00 21.04 H new ATOM 0 HG3 GLU A 72 21.500 14.594 -19.149 1.00 21.04 H new ATOM 1074 N ILE A 73 18.898 15.756 -15.692 1.00 55.32 N ATOM 1075 CA ILE A 73 17.825 15.825 -14.708 1.00 13.51 C ATOM 1076 C ILE A 73 18.018 17.010 -13.767 1.00 35.22 C ATOM 1077 O ILE A 73 17.103 17.806 -13.561 1.00 54.41 O ATOM 1078 CB ILE A 73 17.739 14.532 -13.876 1.00 64.03 C ATOM 1079 CG1 ILE A 73 17.271 13.367 -14.751 1.00 50.41 C ATOM 1080 CG2 ILE A 73 16.802 14.724 -12.693 1.00 71.45 C ATOM 1081 CD1 ILE A 73 17.562 12.008 -14.154 1.00 54.21 C ATOM 0 H ILE A 73 19.402 14.869 -15.706 1.00 55.32 H new ATOM 0 HA ILE A 73 16.896 15.952 -15.263 1.00 13.51 H new ATOM 0 HB ILE A 73 18.732 14.297 -13.492 1.00 64.03 H new ATOM 0 HG12 ILE A 73 16.198 13.458 -14.920 1.00 50.41 H new ATOM 0 HG13 ILE A 73 17.754 13.438 -15.725 1.00 50.41 H new ATOM 0 HG21 ILE A 73 16.752 13.801 -12.115 1.00 71.45 H new ATOM 0 HG22 ILE A 73 17.175 15.529 -12.060 1.00 71.45 H new ATOM 0 HG23 ILE A 73 15.806 14.980 -13.055 1.00 71.45 H new ATOM 0 HD11 ILE A 73 17.203 11.230 -14.828 1.00 54.21 H new ATOM 0 HD12 ILE A 73 18.637 11.896 -14.010 1.00 54.21 H new ATOM 0 HD13 ILE A 73 17.056 11.917 -13.193 1.00 54.21 H new ATOM 1093 N GLU A 74 19.215 17.119 -13.200 1.00 11.23 N ATOM 1094 CA GLU A 74 19.528 18.208 -12.281 1.00 33.40 C ATOM 1095 C GLU A 74 19.378 19.561 -12.970 1.00 35.03 C ATOM 1096 O GLU A 74 18.691 20.451 -12.469 1.00 74.12 O ATOM 1097 CB GLU A 74 20.950 18.054 -11.739 1.00 22.03 C ATOM 1098 CG GLU A 74 21.070 18.347 -10.253 1.00 1.53 C ATOM 1099 CD GLU A 74 21.450 19.788 -9.971 1.00 54.44 C ATOM 1100 OE1 GLU A 74 22.540 20.211 -10.408 1.00 40.54 O ATOM 1101 OE2 GLU A 74 20.655 20.493 -9.314 1.00 21.11 O ATOM 0 H GLU A 74 19.983 16.468 -13.360 1.00 11.23 H new ATOM 0 HA GLU A 74 18.824 18.163 -11.450 1.00 33.40 H new ATOM 0 HB2 GLU A 74 21.294 17.037 -11.929 1.00 22.03 H new ATOM 0 HB3 GLU A 74 21.613 18.723 -12.287 1.00 22.03 H new ATOM 0 HG2 GLU A 74 20.122 18.123 -9.765 1.00 1.53 H new ATOM 0 HG3 GLU A 74 21.818 17.686 -9.815 1.00 1.53 H new ATOM 1108 N MET A 75 20.026 19.708 -14.121 1.00 31.25 N ATOM 1109 CA MET A 75 19.964 20.952 -14.879 1.00 3.14 C ATOM 1110 C MET A 75 18.530 21.264 -15.295 1.00 45.41 C ATOM 1111 O MET A 75 18.179 22.421 -15.523 1.00 14.52 O ATOM 1112 CB MET A 75 20.860 20.865 -16.116 1.00 12.20 C ATOM 1113 CG MET A 75 21.892 21.978 -16.198 1.00 61.13 C ATOM 1114 SD MET A 75 21.521 23.176 -17.494 1.00 73.50 S ATOM 1115 CE MET A 75 21.848 22.201 -18.960 1.00 63.53 C ATOM 0 H MET A 75 20.600 18.981 -14.549 1.00 31.25 H new ATOM 0 HA MET A 75 20.320 21.758 -14.238 1.00 3.14 H new ATOM 0 HB2 MET A 75 21.374 19.904 -16.116 1.00 12.20 H new ATOM 0 HB3 MET A 75 20.236 20.893 -17.009 1.00 12.20 H new ATOM 0 HG2 MET A 75 21.944 22.492 -15.238 1.00 61.13 H new ATOM 0 HG3 MET A 75 22.875 21.544 -16.381 1.00 61.13 H new ATOM 0 HE1 MET A 75 21.943 22.861 -19.822 1.00 63.53 H new ATOM 0 HE2 MET A 75 22.775 21.643 -18.827 1.00 63.53 H new ATOM 0 HE3 MET A 75 21.026 21.505 -19.125 1.00 63.53 H new ATOM 1125 N ALA A 76 17.708 20.225 -15.393 1.00 13.40 N ATOM 1126 CA ALA A 76 16.312 20.390 -15.780 1.00 62.24 C ATOM 1127 C ALA A 76 15.505 21.042 -14.663 1.00 23.34 C ATOM 1128 O ALA A 76 14.562 21.788 -14.921 1.00 14.11 O ATOM 1129 CB ALA A 76 15.707 19.045 -16.156 1.00 52.51 C ATOM 0 H ALA A 76 17.984 19.260 -15.210 1.00 13.40 H new ATOM 0 HA ALA A 76 16.277 21.048 -16.648 1.00 62.24 H new ATOM 0 HB1 ALA A 76 14.664 19.182 -16.443 1.00 52.51 H new ATOM 0 HB2 ALA A 76 16.260 18.618 -16.993 1.00 52.51 H new ATOM 0 HB3 ALA A 76 15.762 18.370 -15.302 1.00 52.51 H new ATOM 1135 N GLN A 77 15.883 20.754 -13.421 1.00 72.22 N ATOM 1136 CA GLN A 77 15.192 21.312 -12.264 1.00 63.35 C ATOM 1137 C GLN A 77 15.311 22.832 -12.241 1.00 55.10 C ATOM 1138 O GLN A 77 14.316 23.545 -12.379 1.00 45.24 O ATOM 1139 CB GLN A 77 15.761 20.724 -10.972 1.00 3.01 C ATOM 1140 CG GLN A 77 15.264 19.319 -10.672 1.00 3.10 C ATOM 1141 CD GLN A 77 15.389 18.957 -9.205 1.00 73.22 C ATOM 1142 OE1 GLN A 77 15.569 19.826 -8.352 1.00 43.32 O ATOM 1143 NE2 GLN A 77 15.292 17.667 -8.903 1.00 43.24 N ATOM 0 H GLN A 77 16.663 20.138 -13.191 1.00 72.22 H new ATOM 0 HA GLN A 77 14.137 21.050 -12.340 1.00 63.35 H new ATOM 0 HB2 GLN A 77 16.849 20.709 -11.038 1.00 3.01 H new ATOM 0 HB3 GLN A 77 15.501 21.378 -10.140 1.00 3.01 H new ATOM 0 HG2 GLN A 77 14.221 19.234 -10.976 1.00 3.10 H new ATOM 0 HG3 GLN A 77 15.829 18.603 -11.269 1.00 3.10 H new ATOM 0 HE21 GLN A 77 15.143 16.980 -9.642 1.00 43.24 H new ATOM 0 HE22 GLN A 77 15.367 17.363 -7.932 1.00 43.24 H new ATOM 1152 N LYS A 78 16.533 23.323 -12.065 1.00 34.25 N ATOM 1153 CA LYS A 78 16.783 24.759 -12.024 1.00 35.35 C ATOM 1154 C LYS A 78 16.279 25.435 -13.295 1.00 1.14 C ATOM 1155 O LYS A 78 15.648 26.491 -13.240 1.00 11.42 O ATOM 1156 CB LYS A 78 18.278 25.032 -11.845 1.00 53.15 C ATOM 1157 CG LYS A 78 18.591 25.979 -10.700 1.00 33.12 C ATOM 1158 CD LYS A 78 20.085 26.218 -10.567 1.00 3.23 C ATOM 1159 CE LYS A 78 20.412 27.704 -10.538 1.00 74.52 C ATOM 1160 NZ LYS A 78 21.477 28.019 -9.546 1.00 72.54 N ATOM 0 H LYS A 78 17.367 22.747 -11.948 1.00 34.25 H new ATOM 0 HA LYS A 78 16.241 25.174 -11.174 1.00 35.35 H new ATOM 0 HB2 LYS A 78 18.793 24.087 -11.675 1.00 53.15 H new ATOM 0 HB3 LYS A 78 18.676 25.450 -12.770 1.00 53.15 H new ATOM 0 HG2 LYS A 78 18.083 26.929 -10.863 1.00 33.12 H new ATOM 0 HG3 LYS A 78 18.203 25.566 -9.769 1.00 33.12 H new ATOM 0 HD2 LYS A 78 20.450 25.746 -9.655 1.00 3.23 H new ATOM 0 HD3 LYS A 78 20.606 25.746 -11.400 1.00 3.23 H new ATOM 0 HE2 LYS A 78 20.733 28.025 -11.529 1.00 74.52 H new ATOM 0 HE3 LYS A 78 19.512 28.269 -10.296 1.00 74.52 H new ATOM 0 HZ1 LYS A 78 21.671 29.041 -9.557 1.00 72.54 H new ATOM 0 HZ2 LYS A 78 21.161 27.737 -8.596 1.00 72.54 H new ATOM 0 HZ3 LYS A 78 22.344 27.500 -9.791 1.00 72.54 H new ATOM 1174 N LEU A 79 16.561 24.820 -14.438 1.00 33.12 N ATOM 1175 CA LEU A 79 16.135 25.362 -15.724 1.00 32.05 C ATOM 1176 C LEU A 79 14.617 25.508 -15.777 1.00 45.02 C ATOM 1177 O LEU A 79 14.097 26.515 -16.259 1.00 35.10 O ATOM 1178 CB LEU A 79 16.612 24.460 -16.863 1.00 4.00 C ATOM 1179 CG LEU A 79 15.983 24.719 -18.232 1.00 64.25 C ATOM 1180 CD1 LEU A 79 17.060 24.996 -19.271 1.00 32.35 C ATOM 1181 CD2 LEU A 79 15.123 23.537 -18.656 1.00 11.31 C ATOM 0 H LEU A 79 17.083 23.946 -14.501 1.00 33.12 H new ATOM 0 HA LEU A 79 16.581 26.350 -15.840 1.00 32.05 H new ATOM 0 HB2 LEU A 79 17.693 24.567 -16.956 1.00 4.00 H new ATOM 0 HB3 LEU A 79 16.417 23.424 -16.586 1.00 4.00 H new ATOM 0 HG LEU A 79 15.345 25.599 -18.156 1.00 64.25 H new ATOM 0 HD11 LEU A 79 16.593 25.178 -20.239 1.00 32.35 H new ATOM 0 HD12 LEU A 79 17.635 25.873 -18.974 1.00 32.35 H new ATOM 0 HD13 LEU A 79 17.725 24.135 -19.345 1.00 32.35 H new ATOM 0 HD21 LEU A 79 14.683 23.739 -19.633 1.00 11.31 H new ATOM 0 HD22 LEU A 79 15.740 22.640 -18.714 1.00 11.31 H new ATOM 0 HD23 LEU A 79 14.329 23.384 -17.925 1.00 11.31 H new ATOM 1193 N LEU A 80 13.913 24.498 -15.278 1.00 2.31 N ATOM 1194 CA LEU A 80 12.455 24.515 -15.267 1.00 35.25 C ATOM 1195 C LEU A 80 11.929 25.798 -14.630 1.00 24.40 C ATOM 1196 O LEU A 80 11.093 26.491 -15.207 1.00 32.11 O ATOM 1197 CB LEU A 80 11.917 23.299 -14.509 1.00 41.14 C ATOM 1198 CG LEU A 80 11.246 22.221 -15.361 1.00 23.30 C ATOM 1199 CD1 LEU A 80 10.868 21.022 -14.504 1.00 42.52 C ATOM 1200 CD2 LEU A 80 10.020 22.783 -16.065 1.00 43.23 C ATOM 0 H LEU A 80 14.328 23.658 -14.876 1.00 2.31 H new ATOM 0 HA LEU A 80 12.108 24.475 -16.300 1.00 35.25 H new ATOM 0 HB2 LEU A 80 12.742 22.841 -13.964 1.00 41.14 H new ATOM 0 HB3 LEU A 80 11.199 23.647 -13.767 1.00 41.14 H new ATOM 0 HG LEU A 80 11.956 21.891 -16.119 1.00 23.30 H new ATOM 0 HD11 LEU A 80 10.392 20.265 -15.127 1.00 42.52 H new ATOM 0 HD12 LEU A 80 11.765 20.604 -14.047 1.00 42.52 H new ATOM 0 HD13 LEU A 80 10.176 21.337 -13.723 1.00 42.52 H new ATOM 0 HD21 LEU A 80 9.556 22.002 -16.667 1.00 43.23 H new ATOM 0 HD22 LEU A 80 9.307 23.142 -15.323 1.00 43.23 H new ATOM 0 HD23 LEU A 80 10.318 23.609 -16.711 1.00 43.23 H new ATOM 1212 N ASN A 81 12.428 26.108 -13.438 1.00 24.22 N ATOM 1213 CA ASN A 81 12.011 27.309 -12.723 1.00 74.34 C ATOM 1214 C ASN A 81 12.136 28.542 -13.613 1.00 33.03 C ATOM 1215 O ASN A 81 11.186 29.311 -13.762 1.00 43.11 O ATOM 1216 CB ASN A 81 12.850 27.492 -11.457 1.00 73.22 C ATOM 1217 CG ASN A 81 12.685 28.871 -10.849 1.00 10.21 C ATOM 1218 OD1 ASN A 81 13.483 29.773 -11.104 1.00 12.53 O ATOM 1219 ND2 ASN A 81 11.646 29.040 -10.040 1.00 11.45 N ATOM 0 H ASN A 81 13.122 25.544 -12.947 1.00 24.22 H new ATOM 0 HA ASN A 81 10.965 27.190 -12.442 1.00 74.34 H new ATOM 0 HB2 ASN A 81 12.565 26.738 -10.723 1.00 73.22 H new ATOM 0 HB3 ASN A 81 13.901 27.325 -11.694 1.00 73.22 H new ATOM 0 HD21 ASN A 81 11.483 29.946 -9.601 1.00 11.45 H new ATOM 0 HD22 ASN A 81 11.010 28.264 -9.857 1.00 11.45 H new ATOM 1226 N SER A 82 13.314 28.723 -14.201 1.00 54.34 N ATOM 1227 CA SER A 82 13.565 29.865 -15.074 1.00 35.43 C ATOM 1228 C SER A 82 12.498 29.963 -16.160 1.00 14.22 C ATOM 1229 O SER A 82 11.820 30.983 -16.289 1.00 45.14 O ATOM 1230 CB SER A 82 14.950 29.750 -15.713 1.00 11.13 C ATOM 1231 OG SER A 82 15.961 30.186 -14.820 1.00 73.03 O ATOM 0 H SER A 82 14.109 28.094 -14.089 1.00 54.34 H new ATOM 0 HA SER A 82 13.526 30.770 -14.468 1.00 35.43 H new ATOM 0 HB2 SER A 82 15.136 28.715 -16.001 1.00 11.13 H new ATOM 0 HB3 SER A 82 14.984 30.346 -16.625 1.00 11.13 H new ATOM 0 HG SER A 82 16.837 30.101 -15.251 1.00 73.03 H new ATOM 1237 N ASP A 83 12.354 28.896 -16.938 1.00 22.03 N ATOM 1238 CA ASP A 83 11.369 28.860 -18.013 1.00 4.23 C ATOM 1239 C ASP A 83 9.987 29.247 -17.497 1.00 1.55 C ATOM 1240 O ASP A 83 9.288 30.057 -18.108 1.00 64.44 O ATOM 1241 CB ASP A 83 11.320 27.467 -18.642 1.00 45.12 C ATOM 1242 CG ASP A 83 12.702 26.901 -18.902 1.00 64.54 C ATOM 1243 OD1 ASP A 83 13.612 27.687 -19.240 1.00 75.24 O ATOM 1244 OD2 ASP A 83 12.875 25.671 -18.769 1.00 34.41 O ATOM 0 H ASP A 83 12.907 28.044 -16.844 1.00 22.03 H new ATOM 0 HA ASP A 83 11.669 29.583 -18.772 1.00 4.23 H new ATOM 0 HB2 ASP A 83 10.772 26.793 -17.983 1.00 45.12 H new ATOM 0 HB3 ASP A 83 10.767 27.514 -19.580 1.00 45.12 H new ATOM 1249 N LEU A 84 9.598 28.664 -16.368 1.00 50.32 N ATOM 1250 CA LEU A 84 8.298 28.947 -15.769 1.00 41.44 C ATOM 1251 C LEU A 84 8.091 30.449 -15.602 1.00 41.32 C ATOM 1252 O LEU A 84 7.236 31.045 -16.257 1.00 34.44 O ATOM 1253 CB LEU A 84 8.177 28.250 -14.413 1.00 55.23 C ATOM 1254 CG LEU A 84 6.771 28.189 -13.814 1.00 3.03 C ATOM 1255 CD1 LEU A 84 6.673 27.061 -12.799 1.00 33.33 C ATOM 1256 CD2 LEU A 84 6.407 29.520 -13.172 1.00 30.34 C ATOM 0 H LEU A 84 10.164 27.993 -15.849 1.00 50.32 H new ATOM 0 HA LEU A 84 7.526 28.565 -16.437 1.00 41.44 H new ATOM 0 HB2 LEU A 84 8.551 27.231 -14.516 1.00 55.23 H new ATOM 0 HB3 LEU A 84 8.830 28.760 -13.705 1.00 55.23 H new ATOM 0 HG LEU A 84 6.062 27.990 -14.618 1.00 3.03 H new ATOM 0 HD11 LEU A 84 5.666 27.032 -12.383 1.00 33.33 H new ATOM 0 HD12 LEU A 84 6.891 26.112 -13.288 1.00 33.33 H new ATOM 0 HD13 LEU A 84 7.392 27.229 -11.997 1.00 33.33 H new ATOM 0 HD21 LEU A 84 5.403 29.459 -12.751 1.00 30.34 H new ATOM 0 HD22 LEU A 84 7.120 29.749 -12.380 1.00 30.34 H new ATOM 0 HD23 LEU A 84 6.437 30.307 -13.925 1.00 30.34 H new ATOM 1268 N ALA A 85 8.882 31.056 -14.723 1.00 54.20 N ATOM 1269 CA ALA A 85 8.788 32.489 -14.473 1.00 51.11 C ATOM 1270 C ALA A 85 8.854 33.279 -15.776 1.00 10.12 C ATOM 1271 O ALA A 85 8.025 34.154 -16.024 1.00 72.30 O ATOM 1272 CB ALA A 85 9.894 32.933 -13.528 1.00 1.44 C ATOM 0 H ALA A 85 9.595 30.578 -14.172 1.00 54.20 H new ATOM 0 HA ALA A 85 7.824 32.689 -14.006 1.00 51.11 H new ATOM 0 HB1 ALA A 85 9.812 34.005 -13.350 1.00 1.44 H new ATOM 0 HB2 ALA A 85 9.800 32.400 -12.582 1.00 1.44 H new ATOM 0 HB3 ALA A 85 10.864 32.713 -13.974 1.00 1.44 H new ATOM 1278 N GLU A 86 9.846 32.965 -16.603 1.00 73.15 N ATOM 1279 CA GLU A 86 10.020 33.648 -17.880 1.00 74.32 C ATOM 1280 C GLU A 86 8.744 33.575 -18.714 1.00 71.44 C ATOM 1281 O GLU A 86 8.427 34.497 -19.467 1.00 70.31 O ATOM 1282 CB GLU A 86 11.186 33.034 -18.657 1.00 41.03 C ATOM 1283 CG GLU A 86 11.971 34.045 -19.477 1.00 14.15 C ATOM 1284 CD GLU A 86 13.072 34.714 -18.678 1.00 2.22 C ATOM 1285 OE1 GLU A 86 13.904 33.991 -18.091 1.00 71.33 O ATOM 1286 OE2 GLU A 86 13.102 35.962 -18.640 1.00 3.22 O ATOM 0 H GLU A 86 10.541 32.243 -16.412 1.00 73.15 H new ATOM 0 HA GLU A 86 10.241 34.696 -17.676 1.00 74.32 H new ATOM 0 HB2 GLU A 86 11.862 32.545 -17.955 1.00 41.03 H new ATOM 0 HB3 GLU A 86 10.801 32.260 -19.321 1.00 41.03 H new ATOM 0 HG2 GLU A 86 12.407 33.546 -20.342 1.00 14.15 H new ATOM 0 HG3 GLU A 86 11.290 34.806 -19.858 1.00 14.15 H new ATOM 1293 N LEU A 87 8.016 32.472 -18.576 1.00 10.12 N ATOM 1294 CA LEU A 87 6.774 32.277 -19.316 1.00 64.25 C ATOM 1295 C LEU A 87 5.652 33.127 -18.731 1.00 14.11 C ATOM 1296 O LEU A 87 5.015 33.906 -19.441 1.00 74.20 O ATOM 1297 CB LEU A 87 6.374 30.801 -19.299 1.00 71.40 C ATOM 1298 CG LEU A 87 5.609 30.298 -20.524 1.00 12.21 C ATOM 1299 CD1 LEU A 87 5.168 28.857 -20.324 1.00 33.35 C ATOM 1300 CD2 LEU A 87 4.409 31.191 -20.806 1.00 61.34 C ATOM 0 H LEU A 87 8.264 31.699 -17.958 1.00 10.12 H new ATOM 0 HA LEU A 87 6.941 32.590 -20.347 1.00 64.25 H new ATOM 0 HB2 LEU A 87 7.278 30.202 -19.189 1.00 71.40 H new ATOM 0 HB3 LEU A 87 5.763 30.621 -18.415 1.00 71.40 H new ATOM 0 HG LEU A 87 6.276 30.335 -21.386 1.00 12.21 H new ATOM 0 HD11 LEU A 87 4.625 28.517 -21.206 1.00 33.35 H new ATOM 0 HD12 LEU A 87 6.044 28.226 -20.171 1.00 33.35 H new ATOM 0 HD13 LEU A 87 4.518 28.793 -19.451 1.00 33.35 H new ATOM 0 HD21 LEU A 87 3.876 30.819 -21.681 1.00 61.34 H new ATOM 0 HD22 LEU A 87 3.741 31.186 -19.945 1.00 61.34 H new ATOM 0 HD23 LEU A 87 4.749 32.209 -20.995 1.00 61.34 H new ATOM 1312 N ILE A 88 5.416 32.974 -17.432 1.00 61.12 N ATOM 1313 CA ILE A 88 4.373 33.730 -16.751 1.00 53.11 C ATOM 1314 C ILE A 88 4.606 35.231 -16.883 1.00 43.24 C ATOM 1315 O ILE A 88 3.659 36.011 -16.972 1.00 44.44 O ATOM 1316 CB ILE A 88 4.296 33.364 -15.257 1.00 73.43 C ATOM 1317 CG1 ILE A 88 4.180 31.847 -15.087 1.00 43.40 C ATOM 1318 CG2 ILE A 88 3.118 34.067 -14.599 1.00 42.23 C ATOM 1319 CD1 ILE A 88 2.989 31.248 -15.801 1.00 12.33 C ATOM 0 H ILE A 88 5.933 32.333 -16.830 1.00 61.12 H new ATOM 0 HA ILE A 88 3.430 33.467 -17.230 1.00 53.11 H new ATOM 0 HB ILE A 88 5.212 33.697 -14.769 1.00 73.43 H new ATOM 0 HG12 ILE A 88 5.090 31.377 -15.459 1.00 43.40 H new ATOM 0 HG13 ILE A 88 4.112 31.613 -14.025 1.00 43.40 H new ATOM 0 HG21 ILE A 88 3.077 33.798 -13.543 1.00 42.23 H new ATOM 0 HG22 ILE A 88 3.239 35.146 -14.694 1.00 42.23 H new ATOM 0 HG23 ILE A 88 2.193 33.761 -15.087 1.00 42.23 H new ATOM 0 HD11 ILE A 88 2.970 30.171 -15.637 1.00 12.33 H new ATOM 0 HD12 ILE A 88 2.072 31.690 -15.412 1.00 12.33 H new ATOM 0 HD13 ILE A 88 3.065 31.451 -16.869 1.00 12.33 H new ATOM 1331 N ASN A 89 5.875 35.628 -16.897 1.00 53.23 N ATOM 1332 CA ASN A 89 6.234 37.036 -17.020 1.00 54.42 C ATOM 1333 C ASN A 89 5.757 37.605 -18.353 1.00 72.24 C ATOM 1334 O ASN A 89 4.860 38.447 -18.397 1.00 73.10 O ATOM 1335 CB ASN A 89 7.748 37.211 -16.891 1.00 0.43 C ATOM 1336 CG ASN A 89 8.198 38.619 -17.229 1.00 43.35 C ATOM 1337 OD1 ASN A 89 8.281 38.992 -18.400 1.00 30.21 O ATOM 1338 ND2 ASN A 89 8.492 39.409 -16.203 1.00 44.23 N ATOM 0 H ASN A 89 6.671 34.994 -16.825 1.00 53.23 H new ATOM 0 HA ASN A 89 5.742 37.582 -16.215 1.00 54.42 H new ATOM 0 HB2 ASN A 89 8.053 36.969 -15.873 1.00 0.43 H new ATOM 0 HB3 ASN A 89 8.250 36.504 -17.551 1.00 0.43 H new ATOM 0 HD21 ASN A 89 8.801 40.367 -16.369 1.00 44.23 H new ATOM 0 HD22 ASN A 89 8.409 39.058 -15.249 1.00 44.23 H new ATOM 1345 N LYS A 90 6.363 37.138 -19.440 1.00 11.12 N ATOM 1346 CA LYS A 90 6.001 37.597 -20.775 1.00 55.25 C ATOM 1347 C LYS A 90 4.496 37.484 -21.000 1.00 61.43 C ATOM 1348 O LYS A 90 3.889 38.339 -21.644 1.00 1.02 O ATOM 1349 CB LYS A 90 6.748 36.786 -21.836 1.00 41.12 C ATOM 1350 CG LYS A 90 6.660 37.381 -23.231 1.00 13.01 C ATOM 1351 CD LYS A 90 8.035 37.718 -23.782 1.00 23.41 C ATOM 1352 CE LYS A 90 7.959 38.801 -24.847 1.00 24.21 C ATOM 1353 NZ LYS A 90 8.085 40.164 -24.261 1.00 42.23 N ATOM 0 H LYS A 90 7.108 36.441 -19.422 1.00 11.12 H new ATOM 0 HA LYS A 90 6.286 38.646 -20.861 1.00 55.25 H new ATOM 0 HB2 LYS A 90 7.797 36.707 -21.549 1.00 41.12 H new ATOM 0 HB3 LYS A 90 6.346 35.773 -21.856 1.00 41.12 H new ATOM 0 HG2 LYS A 90 6.163 36.676 -23.897 1.00 13.01 H new ATOM 0 HG3 LYS A 90 6.047 38.282 -23.205 1.00 13.01 H new ATOM 0 HD2 LYS A 90 8.682 38.050 -22.970 1.00 23.41 H new ATOM 0 HD3 LYS A 90 8.488 36.822 -24.205 1.00 23.41 H new ATOM 0 HE2 LYS A 90 8.751 38.646 -25.580 1.00 24.21 H new ATOM 0 HE3 LYS A 90 7.011 38.721 -25.380 1.00 24.21 H new ATOM 0 HZ1 LYS A 90 7.229 40.714 -24.474 1.00 42.23 H new ATOM 0 HZ2 LYS A 90 8.201 40.089 -23.230 1.00 42.23 H new ATOM 0 HZ3 LYS A 90 8.914 40.642 -24.669 1.00 42.23 H new ATOM 1367 N MET A 91 3.901 36.423 -20.465 1.00 32.13 N ATOM 1368 CA MET A 91 2.466 36.200 -20.605 1.00 65.13 C ATOM 1369 C MET A 91 1.675 37.358 -20.006 1.00 30.25 C ATOM 1370 O MET A 91 0.834 37.961 -20.673 1.00 62.52 O ATOM 1371 CB MET A 91 2.064 34.888 -19.930 1.00 21.34 C ATOM 1372 CG MET A 91 0.618 34.492 -20.183 1.00 65.11 C ATOM 1373 SD MET A 91 -0.506 35.128 -18.925 1.00 74.35 S ATOM 1374 CE MET A 91 -1.432 36.331 -19.876 1.00 61.02 C ATOM 0 H MET A 91 4.390 35.704 -19.931 1.00 32.13 H new ATOM 0 HA MET A 91 2.235 36.138 -21.668 1.00 65.13 H new ATOM 0 HB2 MET A 91 2.718 34.091 -20.285 1.00 21.34 H new ATOM 0 HB3 MET A 91 2.225 34.978 -18.856 1.00 21.34 H new ATOM 0 HG2 MET A 91 0.310 34.862 -21.161 1.00 65.11 H new ATOM 0 HG3 MET A 91 0.543 33.405 -20.215 1.00 65.11 H new ATOM 0 HE1 MET A 91 -1.231 37.331 -19.492 1.00 61.02 H new ATOM 0 HE2 MET A 91 -1.132 36.277 -20.922 1.00 61.02 H new ATOM 0 HE3 MET A 91 -2.498 36.118 -19.793 1.00 61.02 H new ATOM 1384 N LYS A 92 1.949 37.664 -18.742 1.00 33.11 N ATOM 1385 CA LYS A 92 1.263 38.750 -18.052 1.00 3.14 C ATOM 1386 C LYS A 92 1.330 40.039 -18.864 1.00 44.32 C ATOM 1387 O LYS A 92 0.425 40.872 -18.802 1.00 3.43 O ATOM 1388 CB LYS A 92 1.881 38.973 -16.669 1.00 52.43 C ATOM 1389 CG LYS A 92 1.136 38.267 -15.549 1.00 43.53 C ATOM 1390 CD LYS A 92 2.006 38.112 -14.313 1.00 31.00 C ATOM 1391 CE LYS A 92 1.501 38.973 -13.165 1.00 24.52 C ATOM 1392 NZ LYS A 92 0.288 38.391 -12.527 1.00 73.14 N ATOM 0 H LYS A 92 2.641 37.175 -18.175 1.00 33.11 H new ATOM 0 HA LYS A 92 0.216 38.469 -17.935 1.00 3.14 H new ATOM 0 HB2 LYS A 92 2.914 38.626 -16.682 1.00 52.43 H new ATOM 0 HB3 LYS A 92 1.906 40.042 -16.460 1.00 52.43 H new ATOM 0 HG2 LYS A 92 0.239 38.831 -15.295 1.00 43.53 H new ATOM 0 HG3 LYS A 92 0.809 37.285 -15.891 1.00 43.53 H new ATOM 0 HD2 LYS A 92 2.021 37.066 -14.006 1.00 31.00 H new ATOM 0 HD3 LYS A 92 3.033 38.388 -14.552 1.00 31.00 H new ATOM 0 HE2 LYS A 92 2.288 39.081 -12.418 1.00 24.52 H new ATOM 0 HE3 LYS A 92 1.273 39.973 -13.534 1.00 24.52 H new ATOM 0 HZ1 LYS A 92 -0.025 39.007 -11.750 1.00 73.14 H new ATOM 0 HZ2 LYS A 92 -0.471 38.312 -13.233 1.00 73.14 H new ATOM 0 HZ3 LYS A 92 0.512 37.447 -12.152 1.00 73.14 H new ATOM 1406 N LEU A 93 2.406 40.197 -19.627 1.00 65.10 N ATOM 1407 CA LEU A 93 2.591 41.385 -20.454 1.00 32.50 C ATOM 1408 C LEU A 93 1.554 41.436 -21.572 1.00 24.20 C ATOM 1409 O LEU A 93 0.912 42.463 -21.790 1.00 21.43 O ATOM 1410 CB LEU A 93 4.000 41.403 -21.048 1.00 61.53 C ATOM 1411 CG LEU A 93 4.891 42.573 -20.629 1.00 34.43 C ATOM 1412 CD1 LEU A 93 6.357 42.234 -20.851 1.00 55.32 C ATOM 1413 CD2 LEU A 93 4.510 43.833 -21.392 1.00 63.22 C ATOM 0 H LEU A 93 3.164 39.517 -19.690 1.00 65.10 H new ATOM 0 HA LEU A 93 2.460 42.263 -19.821 1.00 32.50 H new ATOM 0 HB2 LEU A 93 4.500 40.475 -20.773 1.00 61.53 H new ATOM 0 HB3 LEU A 93 3.914 41.409 -22.135 1.00 61.53 H new ATOM 0 HG LEU A 93 4.740 42.758 -19.565 1.00 34.43 H new ATOM 0 HD11 LEU A 93 6.976 43.078 -20.547 1.00 55.32 H new ATOM 0 HD12 LEU A 93 6.622 41.358 -20.258 1.00 55.32 H new ATOM 0 HD13 LEU A 93 6.526 42.022 -21.907 1.00 55.32 H new ATOM 0 HD21 LEU A 93 5.154 44.655 -21.081 1.00 63.22 H new ATOM 0 HD22 LEU A 93 4.631 43.661 -22.462 1.00 63.22 H new ATOM 0 HD23 LEU A 93 3.471 44.086 -21.181 1.00 63.22 H new ATOM 1425 N ALA A 94 1.396 40.320 -22.276 1.00 53.03 N ATOM 1426 CA ALA A 94 0.434 40.236 -23.369 1.00 4.52 C ATOM 1427 C ALA A 94 -0.967 40.610 -22.897 1.00 21.53 C ATOM 1428 O ALA A 94 -1.693 41.326 -23.585 1.00 63.14 O ATOM 1429 CB ALA A 94 0.437 38.838 -23.968 1.00 74.00 C ATOM 0 H ALA A 94 1.921 39.462 -22.109 1.00 53.03 H new ATOM 0 HA ALA A 94 0.731 40.949 -24.138 1.00 4.52 H new ATOM 0 HB1 ALA A 94 -0.286 38.790 -24.783 1.00 74.00 H new ATOM 0 HB2 ALA A 94 1.431 38.608 -24.351 1.00 74.00 H new ATOM 0 HB3 ALA A 94 0.167 38.113 -23.200 1.00 74.00 H new ATOM 1435 N GLN A 95 -1.340 40.118 -21.719 1.00 40.44 N ATOM 1436 CA GLN A 95 -2.656 40.400 -21.157 1.00 65.11 C ATOM 1437 C GLN A 95 -2.882 41.903 -21.027 1.00 61.54 C ATOM 1438 O GLN A 95 -4.019 42.372 -21.052 1.00 12.11 O ATOM 1439 CB GLN A 95 -2.803 39.730 -19.790 1.00 0.02 C ATOM 1440 CG GLN A 95 -4.206 39.827 -19.213 1.00 72.32 C ATOM 1441 CD GLN A 95 -5.087 38.663 -19.623 1.00 21.34 C ATOM 1442 OE1 GLN A 95 -4.714 37.857 -20.476 1.00 23.13 O ATOM 1443 NE2 GLN A 95 -6.264 38.568 -19.015 1.00 23.02 N ATOM 0 H GLN A 95 -0.750 39.523 -21.137 1.00 40.44 H new ATOM 0 HA GLN A 95 -3.408 39.996 -21.835 1.00 65.11 H new ATOM 0 HB2 GLN A 95 -2.527 38.679 -19.878 1.00 0.02 H new ATOM 0 HB3 GLN A 95 -2.100 40.187 -19.093 1.00 0.02 H new ATOM 0 HG2 GLN A 95 -4.146 39.867 -18.125 1.00 72.32 H new ATOM 0 HG3 GLN A 95 -4.666 40.759 -19.541 1.00 72.32 H new ATOM 0 HE21 GLN A 95 -6.533 39.258 -18.314 1.00 23.02 H new ATOM 0 HE22 GLN A 95 -6.899 37.805 -19.249 1.00 23.02 H new ATOM 1452 N GLN A 96 -1.792 42.650 -20.889 1.00 41.40 N ATOM 1453 CA GLN A 96 -1.873 44.100 -20.754 1.00 42.13 C ATOM 1454 C GLN A 96 -1.733 44.782 -22.112 1.00 21.55 C ATOM 1455 O GLN A 96 -2.232 45.888 -22.316 1.00 10.30 O ATOM 1456 CB GLN A 96 -0.788 44.606 -19.802 1.00 11.21 C ATOM 1457 CG GLN A 96 -1.339 45.255 -18.542 1.00 62.03 C ATOM 1458 CD GLN A 96 -0.717 46.609 -18.264 1.00 1.15 C ATOM 1459 OE1 GLN A 96 0.502 46.770 -18.326 1.00 23.10 O ATOM 1460 NE2 GLN A 96 -1.554 47.593 -17.954 1.00 24.42 N ATOM 0 H GLN A 96 -0.843 42.276 -20.868 1.00 41.40 H new ATOM 0 HA GLN A 96 -2.852 44.347 -20.343 1.00 42.13 H new ATOM 0 HB2 GLN A 96 -0.146 43.772 -19.520 1.00 11.21 H new ATOM 0 HB3 GLN A 96 -0.162 45.327 -20.328 1.00 11.21 H new ATOM 0 HG2 GLN A 96 -2.419 45.368 -18.638 1.00 62.03 H new ATOM 0 HG3 GLN A 96 -1.162 44.597 -17.692 1.00 62.03 H new ATOM 0 HE21 GLN A 96 -2.558 47.415 -17.914 1.00 24.42 H new ATOM 0 HE22 GLN A 96 -1.193 48.526 -17.756 1.00 24.42 H new ATOM 1469 N TYR A 97 -1.051 44.114 -23.035 1.00 61.04 N ATOM 1470 CA TYR A 97 -0.843 44.657 -24.373 1.00 22.43 C ATOM 1471 C TYR A 97 -1.825 44.046 -25.367 1.00 55.23 C ATOM 1472 O TYR A 97 -1.554 43.982 -26.566 1.00 60.34 O ATOM 1473 CB TYR A 97 0.593 44.398 -24.833 1.00 52.01 C ATOM 1474 CG TYR A 97 1.592 45.394 -24.289 1.00 52.44 C ATOM 1475 CD1 TYR A 97 1.727 45.597 -22.922 1.00 32.04 C ATOM 1476 CD2 TYR A 97 2.401 46.133 -25.144 1.00 65.50 C ATOM 1477 CE1 TYR A 97 2.638 46.507 -22.421 1.00 33.23 C ATOM 1478 CE2 TYR A 97 3.316 47.043 -24.652 1.00 2.50 C ATOM 1479 CZ TYR A 97 3.430 47.227 -23.290 1.00 1.42 C ATOM 1480 OH TYR A 97 4.340 48.134 -22.795 1.00 33.43 O ATOM 0 H TYR A 97 -0.633 43.196 -22.882 1.00 61.04 H new ATOM 0 HA TYR A 97 -1.017 45.732 -24.333 1.00 22.43 H new ATOM 0 HB2 TYR A 97 0.889 43.395 -24.526 1.00 52.01 H new ATOM 0 HB3 TYR A 97 0.626 44.421 -25.922 1.00 52.01 H new ATOM 0 HD1 TYR A 97 1.109 45.034 -22.238 1.00 32.04 H new ATOM 0 HD2 TYR A 97 2.313 45.993 -26.211 1.00 65.50 H new ATOM 0 HE1 TYR A 97 2.729 46.653 -21.355 1.00 33.23 H new ATOM 0 HE2 TYR A 97 3.939 47.607 -25.330 1.00 2.50 H new ATOM 0 HH TYR A 97 4.819 48.556 -23.539 1.00 33.43 H new ATOM 1490 N VAL A 98 -2.970 43.599 -24.860 1.00 11.50 N ATOM 1491 CA VAL A 98 -3.996 42.996 -25.702 1.00 64.43 C ATOM 1492 C VAL A 98 -5.162 43.953 -25.920 1.00 20.23 C ATOM 1493 O VAL A 98 -5.796 43.945 -26.974 1.00 72.23 O ATOM 1494 CB VAL A 98 -4.527 41.687 -25.088 1.00 73.01 C ATOM 1495 CG1 VAL A 98 -5.152 41.951 -23.727 1.00 14.21 C ATOM 1496 CG2 VAL A 98 -5.528 41.028 -26.025 1.00 33.42 C ATOM 0 H VAL A 98 -3.210 43.643 -23.870 1.00 11.50 H new ATOM 0 HA VAL A 98 -3.528 42.775 -26.662 1.00 64.43 H new ATOM 0 HB VAL A 98 -3.689 41.004 -24.950 1.00 73.01 H new ATOM 0 HG11 VAL A 98 -5.522 41.015 -23.309 1.00 14.21 H new ATOM 0 HG12 VAL A 98 -4.403 42.376 -23.059 1.00 14.21 H new ATOM 0 HG13 VAL A 98 -5.980 42.651 -23.837 1.00 14.21 H new ATOM 0 HG21 VAL A 98 -5.893 40.104 -25.576 1.00 33.42 H new ATOM 0 HG22 VAL A 98 -6.366 41.704 -26.196 1.00 33.42 H new ATOM 0 HG23 VAL A 98 -5.043 40.803 -26.975 1.00 33.42 H new ATOM 1506 N MET A 99 -5.439 44.777 -24.915 1.00 0.22 N ATOM 1507 CA MET A 99 -6.529 45.743 -24.997 1.00 61.41 C ATOM 1508 C MET A 99 -6.163 46.898 -25.924 1.00 30.14 C ATOM 1509 O MET A 99 -7.038 47.584 -26.454 1.00 22.33 O ATOM 1510 CB MET A 99 -6.870 46.278 -23.605 1.00 55.23 C ATOM 1511 CG MET A 99 -8.101 47.170 -23.583 1.00 12.14 C ATOM 1512 SD MET A 99 -7.765 48.800 -22.888 1.00 33.44 S ATOM 1513 CE MET A 99 -6.868 49.564 -24.236 1.00 52.51 C ATOM 0 H MET A 99 -4.924 44.795 -24.035 1.00 0.22 H new ATOM 0 HA MET A 99 -7.402 45.235 -25.407 1.00 61.41 H new ATOM 0 HB2 MET A 99 -7.028 45.437 -22.930 1.00 55.23 H new ATOM 0 HB3 MET A 99 -6.018 46.839 -23.221 1.00 55.23 H new ATOM 0 HG2 MET A 99 -8.481 47.283 -24.598 1.00 12.14 H new ATOM 0 HG3 MET A 99 -8.885 46.686 -23.001 1.00 12.14 H new ATOM 0 HE1 MET A 99 -6.729 50.625 -24.026 1.00 52.51 H new ATOM 0 HE2 MET A 99 -5.895 49.085 -24.343 1.00 52.51 H new ATOM 0 HE3 MET A 99 -7.433 49.448 -25.161 1.00 52.51 H new ATOM 1523 N THR A 100 -4.864 47.109 -26.115 1.00 14.02 N ATOM 1524 CA THR A 100 -4.383 48.182 -26.976 1.00 32.12 C ATOM 1525 C THR A 100 -4.506 47.803 -28.447 1.00 51.13 C ATOM 1526 O THR A 100 -5.380 48.303 -29.156 1.00 30.42 O ATOM 1527 CB THR A 100 -2.915 48.533 -26.669 1.00 12.03 C ATOM 1528 OG1 THR A 100 -2.790 48.974 -25.312 1.00 33.51 O ATOM 1529 CG2 THR A 100 -2.410 49.618 -27.608 1.00 14.01 C ATOM 0 H THR A 100 -4.127 46.551 -25.685 1.00 14.02 H new ATOM 0 HA THR A 100 -5.007 49.053 -26.775 1.00 32.12 H new ATOM 0 HB THR A 100 -2.312 47.637 -26.817 1.00 12.03 H new ATOM 0 HG1 THR A 100 -1.854 49.194 -25.124 1.00 33.51 H new ATOM 0 HG21 THR A 100 -1.371 49.849 -27.372 1.00 14.01 H new ATOM 0 HG22 THR A 100 -2.479 49.269 -28.638 1.00 14.01 H new ATOM 0 HG23 THR A 100 -3.017 50.515 -27.488 1.00 14.01 H new ATOM 1537 N SER A 101 -3.626 46.917 -28.901 1.00 25.21 N ATOM 1538 CA SER A 101 -3.634 46.473 -30.290 1.00 2.20 C ATOM 1539 C SER A 101 -2.529 45.451 -30.541 1.00 10.35 C ATOM 1540 O SER A 101 -2.696 44.519 -31.328 1.00 34.22 O ATOM 1541 CB SER A 101 -3.462 47.668 -31.230 1.00 61.21 C ATOM 1542 OG SER A 101 -2.146 47.719 -31.754 1.00 12.41 O ATOM 0 H SER A 101 -2.898 46.492 -28.327 1.00 25.21 H new ATOM 0 HA SER A 101 -4.595 45.999 -30.488 1.00 2.20 H new ATOM 0 HB2 SER A 101 -4.180 47.598 -32.047 1.00 61.21 H new ATOM 0 HB3 SER A 101 -3.679 48.591 -30.693 1.00 61.21 H new ATOM 0 HG SER A 101 -2.062 48.490 -32.353 1.00 12.41 H new ATOM 1548 N LEU A 102 -1.399 45.633 -29.866 1.00 14.54 N ATOM 1549 CA LEU A 102 -0.265 44.728 -30.014 1.00 12.13 C ATOM 1550 C LEU A 102 -0.504 43.428 -29.253 1.00 64.41 C ATOM 1551 O LEU A 102 0.196 43.126 -28.287 1.00 1.34 O ATOM 1552 CB LEU A 102 1.016 45.398 -29.513 1.00 32.30 C ATOM 1553 CG LEU A 102 1.183 46.876 -29.867 1.00 62.31 C ATOM 1554 CD1 LEU A 102 2.460 47.430 -29.255 1.00 63.01 C ATOM 1555 CD2 LEU A 102 1.187 47.065 -31.377 1.00 43.20 C ATOM 0 H LEU A 102 -1.244 46.399 -29.211 1.00 14.54 H new ATOM 0 HA LEU A 102 -0.154 44.493 -31.073 1.00 12.13 H new ATOM 0 HB2 LEU A 102 1.054 45.298 -28.428 1.00 32.30 H new ATOM 0 HB3 LEU A 102 1.869 44.850 -29.913 1.00 32.30 H new ATOM 0 HG LEU A 102 0.338 47.427 -29.454 1.00 62.31 H new ATOM 0 HD11 LEU A 102 2.562 48.483 -29.517 1.00 63.01 H new ATOM 0 HD12 LEU A 102 2.417 47.329 -28.171 1.00 63.01 H new ATOM 0 HD13 LEU A 102 3.317 46.876 -29.638 1.00 63.01 H new ATOM 0 HD21 LEU A 102 1.307 48.123 -31.611 1.00 43.20 H new ATOM 0 HD22 LEU A 102 2.012 46.501 -31.812 1.00 43.20 H new ATOM 0 HD23 LEU A 102 0.245 46.706 -31.791 1.00 43.20 H new ATOM 1567 N GLN A 103 -1.494 42.661 -29.698 1.00 10.02 N ATOM 1568 CA GLN A 103 -1.823 41.392 -29.059 1.00 40.14 C ATOM 1569 C GLN A 103 -1.133 40.231 -29.768 1.00 53.13 C ATOM 1570 O GLN A 103 -0.426 39.443 -29.142 1.00 64.43 O ATOM 1571 CB GLN A 103 -3.337 41.176 -29.056 1.00 53.02 C ATOM 1572 CG GLN A 103 -3.762 39.851 -28.443 1.00 45.14 C ATOM 1573 CD GLN A 103 -5.216 39.521 -28.716 1.00 1.22 C ATOM 1574 OE1 GLN A 103 -5.910 40.257 -29.418 1.00 33.22 O ATOM 1575 NE2 GLN A 103 -5.685 38.410 -28.160 1.00 52.05 N ATOM 0 H GLN A 103 -2.082 42.896 -30.498 1.00 10.02 H new ATOM 0 HA GLN A 103 -1.467 41.429 -28.030 1.00 40.14 H new ATOM 0 HB2 GLN A 103 -3.810 41.989 -28.506 1.00 53.02 H new ATOM 0 HB3 GLN A 103 -3.705 41.227 -30.081 1.00 53.02 H new ATOM 0 HG2 GLN A 103 -3.132 39.054 -28.838 1.00 45.14 H new ATOM 0 HG3 GLN A 103 -3.597 39.884 -27.366 1.00 45.14 H new ATOM 0 HE21 GLN A 103 -5.074 37.830 -27.585 1.00 52.05 H new ATOM 0 HE22 GLN A 103 -6.657 38.137 -28.308 1.00 52.05 H new ATOM 1584 N GLN A 104 -1.345 40.133 -31.077 1.00 13.23 N ATOM 1585 CA GLN A 104 -0.744 39.067 -31.870 1.00 14.42 C ATOM 1586 C GLN A 104 0.762 39.002 -31.641 1.00 41.02 C ATOM 1587 O GLN A 104 1.351 37.922 -31.634 1.00 24.20 O ATOM 1588 CB GLN A 104 -1.038 39.281 -33.356 1.00 1.13 C ATOM 1589 CG GLN A 104 -2.517 39.211 -33.700 1.00 20.11 C ATOM 1590 CD GLN A 104 -2.889 37.929 -34.419 1.00 45.22 C ATOM 1591 OE1 GLN A 104 -2.573 36.832 -33.959 1.00 32.51 O ATOM 1592 NE2 GLN A 104 -3.563 38.062 -35.555 1.00 62.25 N ATOM 0 H GLN A 104 -1.928 40.778 -31.610 1.00 13.23 H new ATOM 0 HA GLN A 104 -1.182 38.121 -31.553 1.00 14.42 H new ATOM 0 HB2 GLN A 104 -0.649 40.253 -33.658 1.00 1.13 H new ATOM 0 HB3 GLN A 104 -0.503 38.529 -33.936 1.00 1.13 H new ATOM 0 HG2 GLN A 104 -3.103 39.293 -32.785 1.00 20.11 H new ATOM 0 HG3 GLN A 104 -2.781 40.064 -34.325 1.00 20.11 H new ATOM 0 HE21 GLN A 104 -3.804 38.991 -35.899 1.00 62.25 H new ATOM 0 HE22 GLN A 104 -3.840 37.235 -36.084 1.00 62.25 H new ATOM 1601 N GLU A 105 1.379 40.165 -31.455 1.00 54.04 N ATOM 1602 CA GLU A 105 2.817 40.239 -31.228 1.00 21.41 C ATOM 1603 C GLU A 105 3.234 39.321 -30.082 1.00 3.31 C ATOM 1604 O GLU A 105 3.880 38.295 -30.297 1.00 53.12 O ATOM 1605 CB GLU A 105 3.234 41.678 -30.921 1.00 44.31 C ATOM 1606 CG GLU A 105 4.722 41.837 -30.654 1.00 13.11 C ATOM 1607 CD GLU A 105 5.292 43.104 -31.261 1.00 54.15 C ATOM 1608 OE1 GLU A 105 4.515 44.054 -31.492 1.00 14.04 O ATOM 1609 OE2 GLU A 105 6.516 43.145 -31.507 1.00 14.35 O ATOM 0 H GLU A 105 0.905 41.068 -31.457 1.00 54.04 H new ATOM 0 HA GLU A 105 3.320 39.909 -32.137 1.00 21.41 H new ATOM 0 HB2 GLU A 105 2.954 42.315 -31.760 1.00 44.31 H new ATOM 0 HB3 GLU A 105 2.678 42.031 -30.053 1.00 44.31 H new ATOM 0 HG2 GLU A 105 4.895 41.844 -29.578 1.00 13.11 H new ATOM 0 HG3 GLU A 105 5.254 40.975 -31.057 1.00 13.11 H new ATOM 1616 N TYR A 106 2.862 39.699 -28.864 1.00 54.12 N ATOM 1617 CA TYR A 106 3.199 38.913 -27.683 1.00 40.14 C ATOM 1618 C TYR A 106 2.719 37.473 -27.832 1.00 60.43 C ATOM 1619 O TYR A 106 3.298 36.550 -27.259 1.00 64.32 O ATOM 1620 CB TYR A 106 2.581 39.542 -26.433 1.00 64.51 C ATOM 1621 CG TYR A 106 3.334 40.752 -25.929 1.00 50.20 C ATOM 1622 CD1 TYR A 106 3.080 42.017 -26.446 1.00 22.12 C ATOM 1623 CD2 TYR A 106 4.299 40.632 -24.937 1.00 62.41 C ATOM 1624 CE1 TYR A 106 3.766 43.126 -25.989 1.00 32.11 C ATOM 1625 CE2 TYR A 106 4.989 41.735 -24.473 1.00 54.12 C ATOM 1626 CZ TYR A 106 4.718 42.980 -25.002 1.00 65.03 C ATOM 1627 OH TYR A 106 5.404 44.082 -24.544 1.00 20.41 O ATOM 0 H TYR A 106 2.327 40.545 -28.669 1.00 54.12 H new ATOM 0 HA TYR A 106 4.284 38.906 -27.580 1.00 40.14 H new ATOM 0 HB2 TYR A 106 1.553 39.830 -26.652 1.00 64.51 H new ATOM 0 HB3 TYR A 106 2.541 38.794 -25.642 1.00 64.51 H new ATOM 0 HD1 TYR A 106 2.334 42.135 -27.218 1.00 22.12 H new ATOM 0 HD2 TYR A 106 4.514 39.659 -24.521 1.00 62.41 H new ATOM 0 HE1 TYR A 106 3.558 44.102 -26.402 1.00 32.11 H new ATOM 0 HE2 TYR A 106 5.736 41.623 -23.701 1.00 54.12 H new ATOM 0 HH TYR A 106 4.832 44.875 -24.612 1.00 20.41 H new ATOM 1637 N LYS A 107 1.656 37.287 -28.607 1.00 52.53 N ATOM 1638 CA LYS A 107 1.096 35.960 -28.835 1.00 44.45 C ATOM 1639 C LYS A 107 2.087 35.074 -29.583 1.00 21.51 C ATOM 1640 O LYS A 107 2.339 33.935 -29.187 1.00 53.10 O ATOM 1641 CB LYS A 107 -0.209 36.064 -29.627 1.00 34.12 C ATOM 1642 CG LYS A 107 -1.022 34.781 -29.630 1.00 62.43 C ATOM 1643 CD LYS A 107 -1.606 34.494 -31.003 1.00 40.25 C ATOM 1644 CE LYS A 107 -0.628 33.721 -31.875 1.00 51.20 C ATOM 1645 NZ LYS A 107 -0.582 34.255 -33.264 1.00 44.14 N ATOM 0 H LYS A 107 1.164 38.040 -29.089 1.00 52.53 H new ATOM 0 HA LYS A 107 0.890 35.508 -27.865 1.00 44.45 H new ATOM 0 HB2 LYS A 107 -0.815 36.867 -29.209 1.00 34.12 H new ATOM 0 HB3 LYS A 107 0.021 36.341 -30.656 1.00 34.12 H new ATOM 0 HG2 LYS A 107 -0.390 33.948 -29.321 1.00 62.43 H new ATOM 0 HG3 LYS A 107 -1.828 34.858 -28.900 1.00 62.43 H new ATOM 0 HD2 LYS A 107 -2.528 33.923 -30.895 1.00 40.25 H new ATOM 0 HD3 LYS A 107 -1.867 35.433 -31.492 1.00 40.25 H new ATOM 0 HE2 LYS A 107 0.368 33.769 -31.434 1.00 51.20 H new ATOM 0 HE3 LYS A 107 -0.916 32.670 -31.899 1.00 51.20 H new ATOM 0 HZ1 LYS A 107 -0.810 33.495 -33.936 1.00 44.14 H new ATOM 0 HZ2 LYS A 107 -1.275 35.024 -33.363 1.00 44.14 H new ATOM 0 HZ3 LYS A 107 0.371 34.620 -33.464 1.00 44.14 H new ATOM 1659 N LYS A 108 2.648 35.602 -30.665 1.00 2.50 N ATOM 1660 CA LYS A 108 3.614 34.861 -31.467 1.00 31.31 C ATOM 1661 C LYS A 108 4.745 34.322 -30.596 1.00 75.12 C ATOM 1662 O LYS A 108 5.036 33.126 -30.613 1.00 11.45 O ATOM 1663 CB LYS A 108 4.186 35.755 -32.569 1.00 64.20 C ATOM 1664 CG LYS A 108 3.921 35.236 -33.972 1.00 4.41 C ATOM 1665 CD LYS A 108 3.643 36.372 -34.943 1.00 22.23 C ATOM 1666 CE LYS A 108 3.497 35.863 -36.368 1.00 73.24 C ATOM 1667 NZ LYS A 108 4.802 35.429 -36.939 1.00 72.24 N ATOM 0 H LYS A 108 2.450 36.542 -31.007 1.00 2.50 H new ATOM 0 HA LYS A 108 3.098 34.017 -31.924 1.00 31.31 H new ATOM 0 HB2 LYS A 108 3.759 36.753 -32.473 1.00 64.20 H new ATOM 0 HB3 LYS A 108 5.262 35.853 -32.424 1.00 64.20 H new ATOM 0 HG2 LYS A 108 4.781 34.663 -34.318 1.00 4.41 H new ATOM 0 HG3 LYS A 108 3.070 34.555 -33.954 1.00 4.41 H new ATOM 0 HD2 LYS A 108 2.732 36.891 -34.646 1.00 22.23 H new ATOM 0 HD3 LYS A 108 4.454 37.099 -34.896 1.00 22.23 H new ATOM 0 HE2 LYS A 108 2.797 35.027 -36.385 1.00 73.24 H new ATOM 0 HE3 LYS A 108 3.071 36.648 -36.992 1.00 73.24 H new ATOM 0 HZ1 LYS A 108 4.685 35.218 -37.951 1.00 72.24 H new ATOM 0 HZ2 LYS A 108 5.502 36.189 -36.823 1.00 72.24 H new ATOM 0 HZ3 LYS A 108 5.132 34.576 -36.443 1.00 72.24 H new ATOM 1681 N GLN A 109 5.376 35.211 -29.837 1.00 10.41 N ATOM 1682 CA GLN A 109 6.474 34.823 -28.959 1.00 51.53 C ATOM 1683 C GLN A 109 6.063 33.669 -28.051 1.00 41.03 C ATOM 1684 O GLN A 109 6.865 32.783 -27.757 1.00 75.44 O ATOM 1685 CB GLN A 109 6.926 36.016 -28.115 1.00 15.32 C ATOM 1686 CG GLN A 109 7.501 37.159 -28.935 1.00 51.53 C ATOM 1687 CD GLN A 109 8.707 36.742 -29.753 1.00 72.52 C ATOM 1688 OE1 GLN A 109 9.426 35.810 -29.390 1.00 15.14 O ATOM 1689 NE2 GLN A 109 8.935 37.430 -30.866 1.00 23.33 N ATOM 0 H GLN A 109 5.146 36.204 -29.812 1.00 10.41 H new ATOM 0 HA GLN A 109 7.305 34.492 -29.582 1.00 51.53 H new ATOM 0 HB2 GLN A 109 6.078 36.385 -27.538 1.00 15.32 H new ATOM 0 HB3 GLN A 109 7.676 35.680 -27.399 1.00 15.32 H new ATOM 0 HG2 GLN A 109 6.731 37.546 -29.602 1.00 51.53 H new ATOM 0 HG3 GLN A 109 7.783 37.973 -28.268 1.00 51.53 H new ATOM 0 HE21 GLN A 109 8.314 38.195 -31.129 1.00 23.33 H new ATOM 0 HE22 GLN A 109 9.731 37.193 -31.458 1.00 23.33 H new ATOM 1698 N MET A 110 4.810 33.687 -27.610 1.00 33.01 N ATOM 1699 CA MET A 110 4.293 32.641 -26.736 1.00 32.54 C ATOM 1700 C MET A 110 4.464 31.265 -27.373 1.00 44.41 C ATOM 1701 O MET A 110 4.995 30.344 -26.752 1.00 34.54 O ATOM 1702 CB MET A 110 2.816 32.890 -26.424 1.00 10.23 C ATOM 1703 CG MET A 110 2.413 32.475 -25.018 1.00 21.00 C ATOM 1704 SD MET A 110 2.536 30.695 -24.758 1.00 14.05 S ATOM 1705 CE MET A 110 1.462 30.088 -26.056 1.00 55.11 C ATOM 0 H MET A 110 4.134 34.414 -27.843 1.00 33.01 H new ATOM 0 HA MET A 110 4.863 32.666 -25.807 1.00 32.54 H new ATOM 0 HB2 MET A 110 2.599 33.950 -26.557 1.00 10.23 H new ATOM 0 HB3 MET A 110 2.204 32.346 -27.144 1.00 10.23 H new ATOM 0 HG2 MET A 110 3.048 32.989 -24.296 1.00 21.00 H new ATOM 0 HG3 MET A 110 1.389 32.796 -24.828 1.00 21.00 H new ATOM 0 HE1 MET A 110 1.462 28.998 -26.048 1.00 55.11 H new ATOM 0 HE2 MET A 110 0.448 30.452 -25.890 1.00 55.11 H new ATOM 0 HE3 MET A 110 1.821 30.444 -27.022 1.00 55.11 H new ATOM 1715 N LEU A 111 4.013 31.134 -28.616 1.00 30.15 N ATOM 1716 CA LEU A 111 4.117 29.870 -29.337 1.00 54.55 C ATOM 1717 C LEU A 111 5.561 29.382 -29.375 1.00 71.40 C ATOM 1718 O LEU A 111 5.833 28.196 -29.180 1.00 55.31 O ATOM 1719 CB LEU A 111 3.583 30.029 -30.762 1.00 54.21 C ATOM 1720 CG LEU A 111 3.433 28.740 -31.570 1.00 70.14 C ATOM 1721 CD1 LEU A 111 1.976 28.508 -31.940 1.00 63.23 C ATOM 1722 CD2 LEU A 111 4.301 28.790 -32.819 1.00 71.43 C ATOM 0 H LEU A 111 3.572 31.887 -29.145 1.00 30.15 H new ATOM 0 HA LEU A 111 3.516 29.129 -28.810 1.00 54.55 H new ATOM 0 HB2 LEU A 111 2.610 30.518 -30.712 1.00 54.21 H new ATOM 0 HB3 LEU A 111 4.249 30.699 -31.305 1.00 54.21 H new ATOM 0 HG LEU A 111 3.767 27.906 -30.953 1.00 70.14 H new ATOM 0 HD11 LEU A 111 1.889 27.586 -32.515 1.00 63.23 H new ATOM 0 HD12 LEU A 111 1.378 28.427 -31.032 1.00 63.23 H new ATOM 0 HD13 LEU A 111 1.615 29.344 -32.539 1.00 63.23 H new ATOM 0 HD21 LEU A 111 4.182 27.864 -33.382 1.00 71.43 H new ATOM 0 HD22 LEU A 111 3.998 29.634 -33.439 1.00 71.43 H new ATOM 0 HD23 LEU A 111 5.346 28.908 -32.532 1.00 71.43 H new ATOM 1734 N THR A 112 6.486 30.303 -29.625 1.00 40.11 N ATOM 1735 CA THR A 112 7.903 29.967 -29.687 1.00 73.21 C ATOM 1736 C THR A 112 8.373 29.325 -28.387 1.00 11.43 C ATOM 1737 O THR A 112 8.769 28.160 -28.366 1.00 1.50 O ATOM 1738 CB THR A 112 8.764 31.212 -29.973 1.00 33.31 C ATOM 1739 OG1 THR A 112 8.326 31.843 -31.181 1.00 40.23 O ATOM 1740 CG2 THR A 112 10.233 30.837 -30.094 1.00 1.32 C ATOM 0 H THR A 112 6.279 31.288 -29.788 1.00 40.11 H new ATOM 0 HA THR A 112 8.024 29.256 -30.504 1.00 73.21 H new ATOM 0 HB THR A 112 8.650 31.905 -29.140 1.00 33.31 H new ATOM 0 HG1 THR A 112 8.877 32.634 -31.355 1.00 40.23 H new ATOM 0 HG21 THR A 112 10.822 31.732 -30.296 1.00 1.32 H new ATOM 0 HG22 THR A 112 10.571 30.383 -29.162 1.00 1.32 H new ATOM 0 HG23 THR A 112 10.361 30.127 -30.911 1.00 1.32 H new ATOM 1748 N ALA A 113 8.326 30.093 -27.303 1.00 32.02 N ATOM 1749 CA ALA A 113 8.745 29.598 -25.997 1.00 74.03 C ATOM 1750 C ALA A 113 7.975 28.338 -25.615 1.00 65.14 C ATOM 1751 O ALA A 113 8.559 27.361 -25.148 1.00 64.42 O ATOM 1752 CB ALA A 113 8.556 30.675 -24.939 1.00 70.12 C ATOM 0 H ALA A 113 8.002 31.060 -27.303 1.00 32.02 H new ATOM 0 HA ALA A 113 9.803 29.343 -26.055 1.00 74.03 H new ATOM 0 HB1 ALA A 113 8.873 30.292 -23.969 1.00 70.12 H new ATOM 0 HB2 ALA A 113 9.155 31.548 -25.197 1.00 70.12 H new ATOM 0 HB3 ALA A 113 7.504 30.958 -24.892 1.00 70.12 H new ATOM 1758 N ALA A 114 6.662 28.368 -25.817 1.00 1.13 N ATOM 1759 CA ALA A 114 5.814 27.228 -25.494 1.00 75.45 C ATOM 1760 C ALA A 114 6.234 25.991 -26.281 1.00 22.31 C ATOM 1761 O ALA A 114 6.126 24.865 -25.792 1.00 41.53 O ATOM 1762 CB ALA A 114 4.355 27.560 -25.771 1.00 52.41 C ATOM 0 H ALA A 114 6.163 29.169 -26.203 1.00 1.13 H new ATOM 0 HA ALA A 114 5.931 27.009 -24.433 1.00 75.45 H new ATOM 0 HB1 ALA A 114 3.733 26.699 -25.525 1.00 52.41 H new ATOM 0 HB2 ALA A 114 4.054 28.412 -25.161 1.00 52.41 H new ATOM 0 HB3 ALA A 114 4.232 27.807 -26.825 1.00 52.41 H new ATOM 1768 N HIS A 115 6.714 26.206 -27.502 1.00 12.12 N ATOM 1769 CA HIS A 115 7.151 25.108 -28.356 1.00 71.32 C ATOM 1770 C HIS A 115 8.286 24.328 -27.700 1.00 62.32 C ATOM 1771 O HIS A 115 8.206 23.110 -27.545 1.00 24.42 O ATOM 1772 CB HIS A 115 7.602 25.640 -29.717 1.00 11.34 C ATOM 1773 CG HIS A 115 7.792 24.569 -30.746 1.00 4.20 C ATOM 1774 ND1 HIS A 115 8.201 24.830 -32.037 1.00 4.03 N ATOM 1775 CD2 HIS A 115 7.629 23.228 -30.668 1.00 61.35 C ATOM 1776 CE1 HIS A 115 8.280 23.696 -32.709 1.00 72.42 C ATOM 1777 NE2 HIS A 115 7.938 22.708 -31.901 1.00 70.04 N ATOM 0 H HIS A 115 6.810 27.131 -27.922 1.00 12.12 H new ATOM 0 HA HIS A 115 6.306 24.434 -28.500 1.00 71.32 H new ATOM 0 HB2 HIS A 115 6.864 26.355 -30.081 1.00 11.34 H new ATOM 0 HB3 HIS A 115 8.539 26.184 -29.593 1.00 11.34 H new ATOM 0 HD1 HIS A 115 8.410 25.755 -32.414 1.00 4.03 H new ATOM 0 HD2 HIS A 115 7.314 22.670 -29.798 1.00 61.35 H new ATOM 0 HE1 HIS A 115 8.574 23.594 -33.743 1.00 72.42 H new ATOM 1785 N ALA A 116 9.342 25.038 -27.318 1.00 44.22 N ATOM 1786 CA ALA A 116 10.493 24.413 -26.678 1.00 70.33 C ATOM 1787 C ALA A 116 10.121 23.847 -25.312 1.00 10.43 C ATOM 1788 O ALA A 116 10.702 22.861 -24.857 1.00 61.14 O ATOM 1789 CB ALA A 116 11.632 25.413 -26.545 1.00 54.25 C ATOM 0 H ALA A 116 9.424 26.047 -27.441 1.00 44.22 H new ATOM 0 HA ALA A 116 10.823 23.586 -27.307 1.00 70.33 H new ATOM 0 HB1 ALA A 116 12.484 24.932 -26.065 1.00 54.25 H new ATOM 0 HB2 ALA A 116 11.924 25.766 -27.534 1.00 54.25 H new ATOM 0 HB3 ALA A 116 11.305 26.259 -25.940 1.00 54.25 H new ATOM 1795 N LEU A 117 9.150 24.478 -24.660 1.00 62.02 N ATOM 1796 CA LEU A 117 8.701 24.038 -23.344 1.00 73.10 C ATOM 1797 C LEU A 117 8.033 22.669 -23.426 1.00 51.02 C ATOM 1798 O LEU A 117 8.457 21.720 -22.768 1.00 31.04 O ATOM 1799 CB LEU A 117 7.728 25.057 -22.748 1.00 44.41 C ATOM 1800 CG LEU A 117 8.341 26.381 -22.289 1.00 64.04 C ATOM 1801 CD1 LEU A 117 7.291 27.481 -22.281 1.00 23.03 C ATOM 1802 CD2 LEU A 117 8.969 26.229 -20.911 1.00 74.12 C ATOM 0 H LEU A 117 8.659 25.296 -25.021 1.00 62.02 H new ATOM 0 HA LEU A 117 9.575 23.958 -22.698 1.00 73.10 H new ATOM 0 HB2 LEU A 117 6.960 25.273 -23.490 1.00 44.41 H new ATOM 0 HB3 LEU A 117 7.228 24.597 -21.896 1.00 44.41 H new ATOM 0 HG LEU A 117 9.124 26.660 -22.994 1.00 64.04 H new ATOM 0 HD11 LEU A 117 7.745 28.415 -21.952 1.00 23.03 H new ATOM 0 HD12 LEU A 117 6.889 27.607 -23.286 1.00 23.03 H new ATOM 0 HD13 LEU A 117 6.485 27.210 -21.599 1.00 23.03 H new ATOM 0 HD21 LEU A 117 9.400 27.181 -20.601 1.00 74.12 H new ATOM 0 HD22 LEU A 117 8.205 25.926 -20.195 1.00 74.12 H new ATOM 0 HD23 LEU A 117 9.752 25.471 -20.949 1.00 74.12 H new ATOM 1814 N ALA A 118 6.987 22.574 -24.241 1.00 42.50 N ATOM 1815 CA ALA A 118 6.264 21.321 -24.413 1.00 35.11 C ATOM 1816 C ALA A 118 7.216 20.180 -24.754 1.00 74.33 C ATOM 1817 O ALA A 118 7.222 19.143 -24.090 1.00 11.30 O ATOM 1818 CB ALA A 118 5.203 21.468 -25.494 1.00 62.42 C ATOM 0 H ALA A 118 6.622 23.351 -24.792 1.00 42.50 H new ATOM 0 HA ALA A 118 5.774 21.080 -23.469 1.00 35.11 H new ATOM 0 HB1 ALA A 118 4.671 20.524 -25.612 1.00 62.42 H new ATOM 0 HB2 ALA A 118 4.498 22.249 -25.208 1.00 62.42 H new ATOM 0 HB3 ALA A 118 5.679 21.736 -26.437 1.00 62.42 H new ATOM 1824 N VAL A 119 8.019 20.377 -25.795 1.00 20.41 N ATOM 1825 CA VAL A 119 8.976 19.364 -26.224 1.00 71.23 C ATOM 1826 C VAL A 119 9.980 19.053 -25.120 1.00 50.10 C ATOM 1827 O VAL A 119 10.410 17.910 -24.962 1.00 1.55 O ATOM 1828 CB VAL A 119 9.738 19.811 -27.486 1.00 5.15 C ATOM 1829 CG1 VAL A 119 10.698 18.723 -27.944 1.00 11.24 C ATOM 1830 CG2 VAL A 119 8.764 20.176 -28.595 1.00 42.03 C ATOM 0 H VAL A 119 8.026 21.228 -26.357 1.00 20.41 H new ATOM 0 HA VAL A 119 8.404 18.465 -26.453 1.00 71.23 H new ATOM 0 HB VAL A 119 10.323 20.698 -27.241 1.00 5.15 H new ATOM 0 HG11 VAL A 119 11.227 19.057 -28.837 1.00 11.24 H new ATOM 0 HG12 VAL A 119 11.417 18.516 -27.152 1.00 11.24 H new ATOM 0 HG13 VAL A 119 10.138 17.816 -28.172 1.00 11.24 H new ATOM 0 HG21 VAL A 119 9.320 20.489 -29.479 1.00 42.03 H new ATOM 0 HG22 VAL A 119 8.151 19.309 -28.841 1.00 42.03 H new ATOM 0 HG23 VAL A 119 8.122 20.992 -28.262 1.00 42.03 H new ATOM 1840 N ASP A 120 10.349 20.077 -24.359 1.00 2.14 N ATOM 1841 CA ASP A 120 11.302 19.914 -23.267 1.00 21.31 C ATOM 1842 C ASP A 120 10.775 18.929 -22.228 1.00 73.11 C ATOM 1843 O ASP A 120 11.441 17.951 -21.891 1.00 70.55 O ATOM 1844 CB ASP A 120 11.591 21.263 -22.608 1.00 5.22 C ATOM 1845 CG ASP A 120 12.826 21.933 -23.178 1.00 24.12 C ATOM 1846 OD1 ASP A 120 13.246 21.554 -24.291 1.00 21.41 O ATOM 1847 OD2 ASP A 120 13.374 22.836 -22.510 1.00 74.24 O ATOM 0 H ASP A 120 10.003 21.029 -24.478 1.00 2.14 H new ATOM 0 HA ASP A 120 12.228 19.516 -23.682 1.00 21.31 H new ATOM 0 HB2 ASP A 120 10.731 21.920 -22.740 1.00 5.22 H new ATOM 0 HB3 ASP A 120 11.721 21.120 -21.535 1.00 5.22 H new ATOM 1852 N ALA A 121 9.575 19.195 -21.723 1.00 54.52 N ATOM 1853 CA ALA A 121 8.958 18.333 -20.724 1.00 34.45 C ATOM 1854 C ALA A 121 8.955 16.878 -21.180 1.00 63.33 C ATOM 1855 O ALA A 121 9.162 15.965 -20.381 1.00 23.51 O ATOM 1856 CB ALA A 121 7.539 18.797 -20.428 1.00 42.33 C ATOM 0 H ALA A 121 9.011 20.002 -21.990 1.00 54.52 H new ATOM 0 HA ALA A 121 9.548 18.400 -19.810 1.00 34.45 H new ATOM 0 HB1 ALA A 121 7.091 18.143 -19.680 1.00 42.33 H new ATOM 0 HB2 ALA A 121 7.562 19.819 -20.050 1.00 42.33 H new ATOM 0 HB3 ALA A 121 6.946 18.762 -21.342 1.00 42.33 H new ATOM 1862 N LYS A 122 8.719 16.668 -22.471 1.00 1.10 N ATOM 1863 CA LYS A 122 8.690 15.324 -23.036 1.00 1.04 C ATOM 1864 C LYS A 122 10.100 14.757 -23.163 1.00 44.15 C ATOM 1865 O LYS A 122 10.342 13.593 -22.848 1.00 21.10 O ATOM 1866 CB LYS A 122 8.009 15.339 -24.406 1.00 33.22 C ATOM 1867 CG LYS A 122 7.883 13.963 -25.037 1.00 54.22 C ATOM 1868 CD LYS A 122 9.105 13.619 -25.872 1.00 33.41 C ATOM 1869 CE LYS A 122 8.823 12.465 -26.823 1.00 2.15 C ATOM 1870 NZ LYS A 122 7.908 12.867 -27.926 1.00 74.21 N ATOM 0 H LYS A 122 8.545 17.412 -23.146 1.00 1.10 H new ATOM 0 HA LYS A 122 8.120 14.685 -22.361 1.00 1.04 H new ATOM 0 HB2 LYS A 122 7.015 15.775 -24.304 1.00 33.22 H new ATOM 0 HB3 LYS A 122 8.574 15.987 -25.076 1.00 33.22 H new ATOM 0 HG2 LYS A 122 7.752 13.214 -24.256 1.00 54.22 H new ATOM 0 HG3 LYS A 122 6.992 13.929 -25.664 1.00 54.22 H new ATOM 0 HD2 LYS A 122 9.416 14.494 -26.442 1.00 33.41 H new ATOM 0 HD3 LYS A 122 9.934 13.356 -25.215 1.00 33.41 H new ATOM 0 HE2 LYS A 122 9.761 12.103 -27.243 1.00 2.15 H new ATOM 0 HE3 LYS A 122 8.382 11.637 -26.268 1.00 2.15 H new ATOM 0 HZ1 LYS A 122 7.977 12.179 -28.702 1.00 74.21 H new ATOM 0 HZ2 LYS A 122 6.930 12.894 -27.573 1.00 74.21 H new ATOM 0 HZ3 LYS A 122 8.177 13.809 -28.274 1.00 74.21 H new ATOM 1884 N ASN A 123 11.028 15.589 -23.627 1.00 32.31 N ATOM 1885 CA ASN A 123 12.415 15.170 -23.795 1.00 74.33 C ATOM 1886 C ASN A 123 12.998 14.677 -22.474 1.00 43.35 C ATOM 1887 O ASN A 123 13.859 13.797 -22.453 1.00 63.34 O ATOM 1888 CB ASN A 123 13.256 16.326 -24.338 1.00 43.40 C ATOM 1889 CG ASN A 123 14.699 15.928 -24.579 1.00 64.24 C ATOM 1890 OD1 ASN A 123 14.978 14.967 -25.296 1.00 71.45 O ATOM 1891 ND2 ASN A 123 15.625 16.667 -23.980 1.00 24.13 N ATOM 0 H ASN A 123 10.844 16.556 -23.893 1.00 32.31 H new ATOM 0 HA ASN A 123 12.437 14.347 -24.510 1.00 74.33 H new ATOM 0 HB2 ASN A 123 12.820 16.682 -25.271 1.00 43.40 H new ATOM 0 HB3 ASN A 123 13.224 17.157 -23.634 1.00 43.40 H new ATOM 0 HD21 ASN A 123 16.613 16.447 -24.106 1.00 24.13 H new ATOM 0 HD22 ASN A 123 15.348 17.455 -23.394 1.00 24.13 H new ATOM 1898 N LEU A 124 12.524 15.251 -21.374 1.00 72.32 N ATOM 1899 CA LEU A 124 12.998 14.870 -20.048 1.00 14.21 C ATOM 1900 C LEU A 124 12.917 13.359 -19.853 1.00 53.55 C ATOM 1901 O LEU A 124 13.924 12.702 -19.586 1.00 54.31 O ATOM 1902 CB LEU A 124 12.177 15.579 -18.969 1.00 4.41 C ATOM 1903 CG LEU A 124 12.852 16.771 -18.288 1.00 33.32 C ATOM 1904 CD1 LEU A 124 13.369 17.756 -19.325 1.00 34.05 C ATOM 1905 CD2 LEU A 124 11.885 17.456 -17.333 1.00 3.40 C ATOM 0 H LEU A 124 11.812 15.982 -21.374 1.00 72.32 H new ATOM 0 HA LEU A 124 14.041 15.173 -19.961 1.00 14.21 H new ATOM 0 HB2 LEU A 124 11.244 15.922 -19.417 1.00 4.41 H new ATOM 0 HB3 LEU A 124 11.913 14.850 -18.203 1.00 4.41 H new ATOM 0 HG LEU A 124 13.701 16.404 -17.712 1.00 33.32 H new ATOM 0 HD11 LEU A 124 13.846 18.597 -18.822 1.00 34.05 H new ATOM 0 HD12 LEU A 124 14.095 17.259 -19.969 1.00 34.05 H new ATOM 0 HD13 LEU A 124 12.537 18.119 -19.929 1.00 34.05 H new ATOM 0 HD21 LEU A 124 12.381 18.302 -16.857 1.00 3.40 H new ATOM 0 HD22 LEU A 124 11.016 17.810 -17.887 1.00 3.40 H new ATOM 0 HD23 LEU A 124 11.564 16.747 -16.570 1.00 3.40 H new ATOM 1917 N LEU A 125 11.713 12.814 -19.991 1.00 43.25 N ATOM 1918 CA LEU A 125 11.501 11.380 -19.833 1.00 73.44 C ATOM 1919 C LEU A 125 12.083 10.609 -21.014 1.00 53.44 C ATOM 1920 O LEU A 125 12.592 9.500 -20.854 1.00 40.05 O ATOM 1921 CB LEU A 125 10.007 11.077 -19.699 1.00 2.21 C ATOM 1922 CG LEU A 125 9.611 10.148 -18.551 1.00 63.52 C ATOM 1923 CD1 LEU A 125 8.634 10.841 -17.615 1.00 51.32 C ATOM 1924 CD2 LEU A 125 9.011 8.858 -19.092 1.00 52.22 C ATOM 0 H LEU A 125 10.870 13.343 -20.212 1.00 43.25 H new ATOM 0 HA LEU A 125 12.014 11.060 -18.926 1.00 73.44 H new ATOM 0 HB2 LEU A 125 9.475 12.020 -19.576 1.00 2.21 H new ATOM 0 HB3 LEU A 125 9.661 10.635 -20.633 1.00 2.21 H new ATOM 0 HG LEU A 125 10.509 9.899 -17.985 1.00 63.52 H new ATOM 0 HD11 LEU A 125 8.364 10.164 -16.805 1.00 51.32 H new ATOM 0 HD12 LEU A 125 9.099 11.735 -17.201 1.00 51.32 H new ATOM 0 HD13 LEU A 125 7.737 11.121 -18.168 1.00 51.32 H new ATOM 0 HD21 LEU A 125 8.735 8.209 -18.261 1.00 52.22 H new ATOM 0 HD22 LEU A 125 8.124 9.089 -19.682 1.00 52.22 H new ATOM 0 HD23 LEU A 125 9.744 8.351 -19.720 1.00 52.22 H new ATOM 1936 N ASP A 126 12.006 11.206 -22.199 1.00 15.03 N ATOM 1937 CA ASP A 126 12.528 10.578 -23.407 1.00 33.22 C ATOM 1938 C ASP A 126 14.013 10.264 -23.258 1.00 1.24 C ATOM 1939 O ASP A 126 14.470 9.181 -23.625 1.00 13.45 O ATOM 1940 CB ASP A 126 12.305 11.486 -24.617 1.00 15.11 C ATOM 1941 CG ASP A 126 11.314 10.902 -25.604 1.00 75.04 C ATOM 1942 OD1 ASP A 126 10.212 10.501 -25.173 1.00 51.02 O ATOM 1943 OD2 ASP A 126 11.639 10.846 -26.808 1.00 41.55 O ATOM 0 H ASP A 126 11.587 12.124 -22.348 1.00 15.03 H new ATOM 0 HA ASP A 126 11.991 9.642 -23.561 1.00 33.22 H new ATOM 0 HB2 ASP A 126 11.946 12.457 -24.277 1.00 15.11 H new ATOM 0 HB3 ASP A 126 13.257 11.656 -25.120 1.00 15.11 H new ATOM 1948 N VAL A 127 14.763 11.220 -22.717 1.00 62.45 N ATOM 1949 CA VAL A 127 16.197 11.046 -22.520 1.00 22.43 C ATOM 1950 C VAL A 127 16.483 9.940 -21.510 1.00 35.31 C ATOM 1951 O VAL A 127 17.129 8.942 -21.833 1.00 12.55 O ATOM 1952 CB VAL A 127 16.859 12.350 -22.037 1.00 65.21 C ATOM 1953 CG1 VAL A 127 18.338 12.126 -21.756 1.00 54.12 C ATOM 1954 CG2 VAL A 127 16.665 13.457 -23.062 1.00 72.32 C ATOM 0 H VAL A 127 14.401 12.122 -22.408 1.00 62.45 H new ATOM 0 HA VAL A 127 16.618 10.769 -23.487 1.00 22.43 H new ATOM 0 HB VAL A 127 16.379 12.658 -21.108 1.00 65.21 H new ATOM 0 HG11 VAL A 127 18.789 13.058 -21.416 1.00 54.12 H new ATOM 0 HG12 VAL A 127 18.450 11.365 -20.983 1.00 54.12 H new ATOM 0 HG13 VAL A 127 18.835 11.794 -22.667 1.00 54.12 H new ATOM 0 HG21 VAL A 127 17.139 14.371 -22.704 1.00 72.32 H new ATOM 0 HG22 VAL A 127 17.117 13.160 -24.008 1.00 72.32 H new ATOM 0 HG23 VAL A 127 15.600 13.634 -23.209 1.00 72.32 H new ATOM 1964 N ILE A 128 15.996 10.123 -20.287 1.00 23.00 N ATOM 1965 CA ILE A 128 16.198 9.140 -19.230 1.00 72.31 C ATOM 1966 C ILE A 128 15.691 7.765 -19.654 1.00 43.21 C ATOM 1967 O ILE A 128 16.138 6.741 -19.137 1.00 12.12 O ATOM 1968 CB ILE A 128 15.487 9.558 -17.929 1.00 72.54 C ATOM 1969 CG1 ILE A 128 13.969 9.458 -18.097 1.00 62.43 C ATOM 1970 CG2 ILE A 128 15.890 10.971 -17.536 1.00 73.10 C ATOM 1971 CD1 ILE A 128 13.195 9.913 -16.880 1.00 23.11 C ATOM 0 H ILE A 128 15.459 10.943 -20.004 1.00 23.00 H new ATOM 0 HA ILE A 128 17.271 9.089 -19.047 1.00 72.31 H new ATOM 0 HB ILE A 128 15.791 8.880 -17.132 1.00 72.54 H new ATOM 0 HG12 ILE A 128 13.666 10.058 -18.955 1.00 62.43 H new ATOM 0 HG13 ILE A 128 13.704 8.425 -18.321 1.00 62.43 H new ATOM 0 HG21 ILE A 128 15.379 11.252 -16.615 1.00 73.10 H new ATOM 0 HG22 ILE A 128 16.968 11.012 -17.380 1.00 73.10 H new ATOM 0 HG23 ILE A 128 15.612 11.663 -18.331 1.00 73.10 H new ATOM 0 HD11 ILE A 128 12.126 9.815 -17.071 1.00 23.11 H new ATOM 0 HD12 ILE A 128 13.469 9.297 -16.023 1.00 23.11 H new ATOM 0 HD13 ILE A 128 13.431 10.956 -16.668 1.00 23.11 H new ATOM 1983 N ASP A 129 14.758 7.751 -20.599 1.00 62.44 N ATOM 1984 CA ASP A 129 14.192 6.502 -21.096 1.00 65.41 C ATOM 1985 C ASP A 129 15.291 5.569 -21.597 1.00 32.34 C ATOM 1986 O ASP A 129 15.253 4.363 -21.351 1.00 3.41 O ATOM 1987 CB ASP A 129 13.192 6.781 -22.219 1.00 63.10 C ATOM 1988 CG ASP A 129 11.816 6.220 -21.921 1.00 13.11 C ATOM 1989 OD1 ASP A 129 11.605 5.010 -22.148 1.00 45.13 O ATOM 1990 OD2 ASP A 129 10.949 6.991 -21.459 1.00 53.13 O ATOM 0 H ASP A 129 14.377 8.590 -21.036 1.00 62.44 H new ATOM 0 HA ASP A 129 13.673 6.014 -20.271 1.00 65.41 H new ATOM 0 HB2 ASP A 129 13.116 7.857 -22.375 1.00 63.10 H new ATOM 0 HB3 ASP A 129 13.564 6.349 -23.148 1.00 63.10 H new ATOM 1995 N GLN A 130 16.266 6.135 -22.300 1.00 70.11 N ATOM 1996 CA GLN A 130 17.374 5.353 -22.837 1.00 35.24 C ATOM 1997 C GLN A 130 18.116 4.625 -21.721 1.00 62.42 C ATOM 1998 O GLN A 130 18.631 3.524 -21.920 1.00 54.50 O ATOM 1999 CB GLN A 130 18.340 6.257 -23.603 1.00 40.22 C ATOM 2000 CG GLN A 130 17.754 6.825 -24.886 1.00 0.33 C ATOM 2001 CD GLN A 130 18.773 7.596 -25.701 1.00 51.44 C ATOM 2002 OE1 GLN A 130 19.940 7.213 -25.781 1.00 23.11 O ATOM 2003 NE2 GLN A 130 18.336 8.691 -26.314 1.00 32.33 N ATOM 0 H GLN A 130 16.312 7.132 -22.511 1.00 70.11 H new ATOM 0 HA GLN A 130 16.964 4.610 -23.521 1.00 35.24 H new ATOM 0 HB2 GLN A 130 18.644 7.080 -22.957 1.00 40.22 H new ATOM 0 HB3 GLN A 130 19.240 5.692 -23.844 1.00 40.22 H new ATOM 0 HG2 GLN A 130 17.353 6.011 -25.489 1.00 0.33 H new ATOM 0 HG3 GLN A 130 16.919 7.481 -24.640 1.00 0.33 H new ATOM 0 HE21 GLN A 130 17.360 8.973 -26.221 1.00 32.33 H new ATOM 0 HE22 GLN A 130 18.977 9.250 -26.878 1.00 32.33 H new ATOM 2012 N ALA A 131 18.168 5.246 -20.548 1.00 4.33 N ATOM 2013 CA ALA A 131 18.847 4.657 -19.400 1.00 72.53 C ATOM 2014 C ALA A 131 18.045 3.493 -18.827 1.00 21.10 C ATOM 2015 O ALA A 131 18.605 2.455 -18.473 1.00 44.34 O ATOM 2016 CB ALA A 131 19.088 5.711 -18.331 1.00 4.34 C ATOM 0 H ALA A 131 17.748 6.158 -20.367 1.00 4.33 H new ATOM 0 HA ALA A 131 19.809 4.271 -19.737 1.00 72.53 H new ATOM 0 HB1 ALA A 131 19.596 5.257 -17.480 1.00 4.34 H new ATOM 0 HB2 ALA A 131 19.708 6.509 -18.740 1.00 4.34 H new ATOM 0 HB3 ALA A 131 18.133 6.124 -18.006 1.00 4.34 H new ATOM 2022 N ARG A 132 16.731 3.673 -18.737 1.00 64.11 N ATOM 2023 CA ARG A 132 15.853 2.638 -18.205 1.00 2.24 C ATOM 2024 C ARG A 132 16.006 1.339 -18.989 1.00 70.45 C ATOM 2025 O ARG A 132 16.090 0.256 -18.408 1.00 62.12 O ATOM 2026 CB ARG A 132 14.397 3.104 -18.247 1.00 54.03 C ATOM 2027 CG ARG A 132 13.599 2.722 -17.011 1.00 53.33 C ATOM 2028 CD ARG A 132 12.293 3.497 -16.930 1.00 53.11 C ATOM 2029 NE ARG A 132 11.356 2.894 -15.986 1.00 22.14 N ATOM 2030 CZ ARG A 132 10.647 1.802 -16.250 1.00 11.32 C ATOM 2031 NH1 ARG A 132 10.767 1.197 -17.423 1.00 43.34 N ATOM 2032 NH2 ARG A 132 9.815 1.313 -15.339 1.00 2.43 N ATOM 0 H ARG A 132 16.251 4.526 -19.026 1.00 64.11 H new ATOM 0 HA ARG A 132 16.138 2.452 -17.169 1.00 2.24 H new ATOM 0 HB2 ARG A 132 14.374 4.188 -18.363 1.00 54.03 H new ATOM 0 HB3 ARG A 132 13.914 2.679 -19.127 1.00 54.03 H new ATOM 0 HG2 ARG A 132 13.388 1.653 -17.029 1.00 53.33 H new ATOM 0 HG3 ARG A 132 14.194 2.915 -16.118 1.00 53.33 H new ATOM 0 HD2 ARG A 132 12.499 4.524 -16.630 1.00 53.11 H new ATOM 0 HD3 ARG A 132 11.835 3.540 -17.918 1.00 53.11 H new ATOM 0 HE ARG A 132 11.240 3.336 -15.074 1.00 22.14 H new ATOM 0 HH11 ARG A 132 11.405 1.570 -18.126 1.00 43.34 H new ATOM 0 HH12 ARG A 132 10.221 0.359 -17.623 1.00 43.34 H new ATOM 0 HH21 ARG A 132 9.719 1.776 -14.435 1.00 2.43 H new ATOM 0 HH22 ARG A 132 9.271 0.475 -15.543 1.00 2.43 H new ATOM 2046 N LEU A 133 16.040 1.453 -20.312 1.00 45.25 N ATOM 2047 CA LEU A 133 16.183 0.288 -21.178 1.00 74.40 C ATOM 2048 C LEU A 133 17.607 -0.257 -21.128 1.00 75.14 C ATOM 2049 O LEU A 133 17.830 -1.458 -21.287 1.00 12.54 O ATOM 2050 CB LEU A 133 15.812 0.649 -22.618 1.00 24.53 C ATOM 2051 CG LEU A 133 14.513 0.043 -23.148 1.00 74.24 C ATOM 2052 CD1 LEU A 133 13.370 1.039 -23.025 1.00 30.24 C ATOM 2053 CD2 LEU A 133 14.682 -0.400 -24.594 1.00 60.23 C ATOM 0 H LEU A 133 15.970 2.341 -20.809 1.00 45.25 H new ATOM 0 HA LEU A 133 15.505 -0.486 -20.818 1.00 74.40 H new ATOM 0 HB2 LEU A 133 15.740 1.734 -22.692 1.00 24.53 H new ATOM 0 HB3 LEU A 133 16.627 0.338 -23.271 1.00 24.53 H new ATOM 0 HG LEU A 133 14.272 -0.833 -22.546 1.00 74.24 H new ATOM 0 HD11 LEU A 133 12.453 0.590 -23.407 1.00 30.24 H new ATOM 0 HD12 LEU A 133 13.233 1.308 -21.978 1.00 30.24 H new ATOM 0 HD13 LEU A 133 13.604 1.934 -23.602 1.00 30.24 H new ATOM 0 HD21 LEU A 133 13.747 -0.829 -24.955 1.00 60.23 H new ATOM 0 HD22 LEU A 133 14.948 0.460 -25.209 1.00 60.23 H new ATOM 0 HD23 LEU A 133 15.472 -1.148 -24.655 1.00 60.23 H new ATOM 2065 N LYS A 134 18.567 0.633 -20.906 1.00 5.14 N ATOM 2066 CA LYS A 134 19.970 0.243 -20.831 1.00 64.30 C ATOM 2067 C LYS A 134 20.182 -0.824 -19.761 1.00 43.41 C ATOM 2068 O LYS A 134 20.971 -1.750 -19.943 1.00 63.32 O ATOM 2069 CB LYS A 134 20.845 1.462 -20.531 1.00 41.11 C ATOM 2070 CG LYS A 134 21.788 1.828 -21.664 1.00 62.42 C ATOM 2071 CD LYS A 134 21.939 3.333 -21.800 1.00 41.53 C ATOM 2072 CE LYS A 134 21.405 3.829 -23.135 1.00 73.24 C ATOM 2073 NZ LYS A 134 22.459 3.834 -24.187 1.00 72.13 N ATOM 0 H LYS A 134 18.399 1.631 -20.775 1.00 5.14 H new ATOM 0 HA LYS A 134 20.257 -0.173 -21.797 1.00 64.30 H new ATOM 0 HB2 LYS A 134 20.202 2.315 -20.314 1.00 41.11 H new ATOM 0 HB3 LYS A 134 21.429 1.267 -19.632 1.00 41.11 H new ATOM 0 HG2 LYS A 134 22.765 1.378 -21.485 1.00 62.42 H new ATOM 0 HG3 LYS A 134 21.412 1.413 -22.599 1.00 62.42 H new ATOM 0 HD2 LYS A 134 21.407 3.828 -20.988 1.00 41.53 H new ATOM 0 HD3 LYS A 134 22.990 3.604 -21.704 1.00 41.53 H new ATOM 0 HE2 LYS A 134 20.577 3.195 -23.453 1.00 73.24 H new ATOM 0 HE3 LYS A 134 21.007 4.837 -23.015 1.00 73.24 H new ATOM 0 HZ1 LYS A 134 22.055 4.178 -25.081 1.00 72.13 H new ATOM 0 HZ2 LYS A 134 23.238 4.459 -23.895 1.00 72.13 H new ATOM 0 HZ3 LYS A 134 22.821 2.868 -24.320 1.00 72.13 H new ATOM 2087 N MET A 135 19.472 -0.686 -18.646 1.00 72.44 N ATOM 2088 CA MET A 135 19.581 -1.640 -17.549 1.00 30.42 C ATOM 2089 C MET A 135 18.724 -2.874 -17.814 1.00 21.23 C ATOM 2090 O MET A 135 19.220 -4.001 -17.793 1.00 34.35 O ATOM 2091 CB MET A 135 19.160 -0.986 -16.232 1.00 14.51 C ATOM 2092 CG MET A 135 19.969 -1.455 -15.034 1.00 10.53 C ATOM 2093 SD MET A 135 19.059 -2.609 -13.990 1.00 12.24 S ATOM 2094 CE MET A 135 17.732 -1.559 -13.401 1.00 71.34 C ATOM 0 H MET A 135 18.816 0.077 -18.479 1.00 72.44 H new ATOM 0 HA MET A 135 20.623 -1.952 -17.475 1.00 30.42 H new ATOM 0 HB2 MET A 135 19.258 0.096 -16.325 1.00 14.51 H new ATOM 0 HB3 MET A 135 18.106 -1.196 -16.053 1.00 14.51 H new ATOM 0 HG2 MET A 135 20.885 -1.932 -15.383 1.00 10.53 H new ATOM 0 HG3 MET A 135 20.266 -0.591 -14.440 1.00 10.53 H new ATOM 0 HE1 MET A 135 17.396 -1.910 -12.426 1.00 71.34 H new ATOM 0 HE2 MET A 135 18.091 -0.534 -13.313 1.00 71.34 H new ATOM 0 HE3 MET A 135 16.901 -1.593 -14.105 1.00 71.34 H new ATOM 2104 N ILE A 136 17.438 -2.653 -18.062 1.00 73.42 N ATOM 2105 CA ILE A 136 16.513 -3.748 -18.332 1.00 4.23 C ATOM 2106 C ILE A 136 17.019 -4.627 -19.470 1.00 43.24 C ATOM 2107 O ILE A 136 17.318 -5.805 -19.274 1.00 10.45 O ATOM 2108 CB ILE A 136 15.109 -3.224 -18.687 1.00 63.32 C ATOM 2109 CG1 ILE A 136 14.559 -2.362 -17.549 1.00 64.11 C ATOM 2110 CG2 ILE A 136 14.170 -4.385 -18.981 1.00 42.53 C ATOM 2111 CD1 ILE A 136 13.304 -1.604 -17.918 1.00 13.30 C ATOM 0 H ILE A 136 17.012 -1.726 -18.082 1.00 73.42 H new ATOM 0 HA ILE A 136 16.450 -4.341 -17.419 1.00 4.23 H new ATOM 0 HB ILE A 136 15.183 -2.606 -19.582 1.00 63.32 H new ATOM 0 HG12 ILE A 136 14.349 -2.999 -16.690 1.00 64.11 H new ATOM 0 HG13 ILE A 136 15.325 -1.651 -17.239 1.00 64.11 H new ATOM 0 HG21 ILE A 136 13.181 -3.999 -19.230 1.00 42.53 H new ATOM 0 HG22 ILE A 136 14.557 -4.962 -19.821 1.00 42.53 H new ATOM 0 HG23 ILE A 136 14.098 -5.026 -18.103 1.00 42.53 H new ATOM 0 HD11 ILE A 136 12.971 -1.015 -17.064 1.00 13.30 H new ATOM 0 HD12 ILE A 136 13.513 -0.941 -18.757 1.00 13.30 H new ATOM 0 HD13 ILE A 136 12.522 -2.310 -18.199 1.00 13.30 H new ATOM 2123 N SER A 137 17.115 -4.046 -20.662 1.00 14.50 N ATOM 2124 CA SER A 137 17.583 -4.776 -21.834 1.00 31.32 C ATOM 2125 C SER A 137 19.096 -4.966 -21.787 1.00 0.21 C ATOM 2126 O SER A 137 19.833 -4.348 -22.555 1.00 70.41 O ATOM 2127 CB SER A 137 17.190 -4.036 -23.114 1.00 13.15 C ATOM 2128 OG SER A 137 15.789 -3.830 -23.173 1.00 50.54 O ATOM 0 H SER A 137 16.875 -3.071 -20.841 1.00 14.50 H new ATOM 0 HA SER A 137 17.110 -5.758 -21.832 1.00 31.32 H new ATOM 0 HB2 SER A 137 17.704 -3.076 -23.155 1.00 13.15 H new ATOM 0 HB3 SER A 137 17.514 -4.609 -23.983 1.00 13.15 H new ATOM 0 HG SER A 137 15.563 -3.354 -23.999 1.00 50.54 H new ATOM 2272 N GLU A 162 2.357 10.584 -31.114 1.00 2.42 N ATOM 2273 CA GLU A 162 1.146 11.367 -30.894 1.00 62.45 C ATOM 2274 C GLU A 162 1.488 12.815 -30.558 1.00 51.42 C ATOM 2275 O GLU A 162 0.840 13.746 -31.040 1.00 22.21 O ATOM 2276 CB GLU A 162 0.313 10.753 -29.767 1.00 61.24 C ATOM 2277 CG GLU A 162 -1.148 10.549 -30.132 1.00 1.10 C ATOM 2278 CD GLU A 162 -2.010 11.746 -29.779 1.00 24.24 C ATOM 2279 OE1 GLU A 162 -1.933 12.210 -28.622 1.00 1.32 O ATOM 2280 OE2 GLU A 162 -2.760 12.217 -30.658 1.00 14.31 O ATOM 0 HA GLU A 162 0.563 11.354 -31.815 1.00 62.45 H new ATOM 0 HB2 GLU A 162 0.747 9.793 -29.488 1.00 61.24 H new ATOM 0 HB3 GLU A 162 0.373 11.397 -28.890 1.00 61.24 H new ATOM 0 HG2 GLU A 162 -1.227 10.351 -31.201 1.00 1.10 H new ATOM 0 HG3 GLU A 162 -1.528 9.667 -29.616 1.00 1.10 H new ATOM 2287 N LEU A 163 2.509 12.999 -29.728 1.00 72.23 N ATOM 2288 CA LEU A 163 2.937 14.334 -29.326 1.00 65.11 C ATOM 2289 C LEU A 163 3.708 15.020 -30.450 1.00 15.22 C ATOM 2290 O LEU A 163 3.616 16.235 -30.627 1.00 10.13 O ATOM 2291 CB LEU A 163 3.807 14.255 -28.070 1.00 65.04 C ATOM 2292 CG LEU A 163 3.075 13.945 -26.765 1.00 32.53 C ATOM 2293 CD1 LEU A 163 2.698 12.473 -26.701 1.00 21.51 C ATOM 2294 CD2 LEU A 163 3.932 14.330 -25.568 1.00 33.03 C ATOM 0 H LEU A 163 3.056 12.240 -29.320 1.00 72.23 H new ATOM 0 HA LEU A 163 2.047 14.924 -29.108 1.00 65.11 H new ATOM 0 HB2 LEU A 163 4.568 13.490 -28.227 1.00 65.04 H new ATOM 0 HB3 LEU A 163 4.329 15.205 -27.954 1.00 65.04 H new ATOM 0 HG LEU A 163 2.159 14.535 -26.736 1.00 32.53 H new ATOM 0 HD11 LEU A 163 2.178 12.271 -25.765 1.00 21.51 H new ATOM 0 HD12 LEU A 163 2.046 12.228 -27.539 1.00 21.51 H new ATOM 0 HD13 LEU A 163 3.600 11.864 -26.753 1.00 21.51 H new ATOM 0 HD21 LEU A 163 3.395 14.102 -24.647 1.00 33.03 H new ATOM 0 HD22 LEU A 163 4.865 13.767 -25.592 1.00 33.03 H new ATOM 0 HD23 LEU A 163 4.151 15.397 -25.606 1.00 33.03 H new ATOM 2306 N ASP A 164 4.464 14.234 -31.207 1.00 61.24 N ATOM 2307 CA ASP A 164 5.248 14.765 -32.317 1.00 32.13 C ATOM 2308 C ASP A 164 4.338 15.333 -33.402 1.00 22.23 C ATOM 2309 O ASP A 164 4.542 16.452 -33.873 1.00 73.31 O ATOM 2310 CB ASP A 164 6.144 13.674 -32.905 1.00 32.45 C ATOM 2311 CG ASP A 164 6.894 12.902 -31.836 1.00 54.42 C ATOM 2312 OD1 ASP A 164 7.073 13.447 -30.726 1.00 75.33 O ATOM 2313 OD2 ASP A 164 7.301 11.754 -32.110 1.00 12.24 O ATOM 0 H ASP A 164 4.551 13.227 -31.073 1.00 61.24 H new ATOM 0 HA ASP A 164 5.874 15.571 -31.934 1.00 32.13 H new ATOM 0 HB2 ASP A 164 5.535 12.983 -33.488 1.00 32.45 H new ATOM 0 HB3 ASP A 164 6.859 14.126 -33.592 1.00 32.45 H new ATOM 2318 N ARG A 165 3.336 14.554 -33.794 1.00 34.41 N ATOM 2319 CA ARG A 165 2.396 14.978 -34.825 1.00 64.01 C ATOM 2320 C ARG A 165 1.690 16.268 -34.419 1.00 74.10 C ATOM 2321 O ARG A 165 1.743 17.269 -35.134 1.00 53.33 O ATOM 2322 CB ARG A 165 1.365 13.880 -35.088 1.00 74.44 C ATOM 2323 CG ARG A 165 0.961 13.761 -36.549 1.00 21.51 C ATOM 2324 CD ARG A 165 -0.379 14.430 -36.813 1.00 64.21 C ATOM 2325 NE ARG A 165 -1.483 13.475 -36.779 1.00 54.43 N ATOM 2326 CZ ARG A 165 -2.753 13.813 -36.979 1.00 64.10 C ATOM 2327 NH1 ARG A 165 -3.075 15.075 -37.226 1.00 74.11 N ATOM 2328 NH2 ARG A 165 -3.702 12.887 -36.932 1.00 61.04 N ATOM 0 H ARG A 165 3.154 13.625 -33.413 1.00 34.41 H new ATOM 0 HA ARG A 165 2.958 15.165 -35.740 1.00 64.01 H new ATOM 0 HB2 ARG A 165 1.770 12.925 -34.753 1.00 74.44 H new ATOM 0 HB3 ARG A 165 0.476 14.077 -34.489 1.00 74.44 H new ATOM 0 HG2 ARG A 165 1.726 14.216 -37.177 1.00 21.51 H new ATOM 0 HG3 ARG A 165 0.905 12.709 -36.827 1.00 21.51 H new ATOM 0 HD2 ARG A 165 -0.549 15.207 -36.068 1.00 64.21 H new ATOM 0 HD3 ARG A 165 -0.354 14.921 -37.786 1.00 64.21 H new ATOM 0 HE ARG A 165 -1.268 12.496 -36.592 1.00 54.43 H new ATOM 0 HH11 ARG A 165 -2.348 15.789 -37.263 1.00 74.11 H new ATOM 0 HH12 ARG A 165 -4.050 15.332 -37.379 1.00 74.11 H new ATOM 0 HH21 ARG A 165 -3.457 11.915 -36.742 1.00 61.04 H new ATOM 0 HH22 ARG A 165 -4.676 13.147 -37.086 1.00 61.04 H new ATOM 2342 N LEU A 166 1.028 16.236 -33.268 1.00 12.54 N ATOM 2343 CA LEU A 166 0.310 17.403 -32.766 1.00 35.21 C ATOM 2344 C LEU A 166 1.213 18.632 -32.747 1.00 75.02 C ATOM 2345 O LEU A 166 0.759 19.753 -32.982 1.00 33.21 O ATOM 2346 CB LEU A 166 -0.228 17.129 -31.360 1.00 51.41 C ATOM 2347 CG LEU A 166 -1.294 16.038 -31.249 1.00 44.34 C ATOM 2348 CD1 LEU A 166 -1.496 15.635 -29.797 1.00 51.31 C ATOM 2349 CD2 LEU A 166 -2.605 16.509 -31.862 1.00 3.00 C ATOM 0 H LEU A 166 0.973 15.415 -32.665 1.00 12.54 H new ATOM 0 HA LEU A 166 -0.526 17.601 -33.437 1.00 35.21 H new ATOM 0 HB2 LEU A 166 0.610 16.856 -30.719 1.00 51.41 H new ATOM 0 HB3 LEU A 166 -0.643 18.056 -30.965 1.00 51.41 H new ATOM 0 HG LEU A 166 -0.951 15.164 -31.802 1.00 44.34 H new ATOM 0 HD11 LEU A 166 -2.258 14.858 -29.738 1.00 51.31 H new ATOM 0 HD12 LEU A 166 -0.558 15.256 -29.391 1.00 51.31 H new ATOM 0 HD13 LEU A 166 -1.817 16.502 -29.220 1.00 51.31 H new ATOM 0 HD21 LEU A 166 -3.352 15.720 -31.774 1.00 3.00 H new ATOM 0 HD22 LEU A 166 -2.953 17.399 -31.337 1.00 3.00 H new ATOM 0 HD23 LEU A 166 -2.450 16.746 -32.915 1.00 3.00 H new ATOM 2361 N LEU A 167 2.493 18.415 -32.469 1.00 21.44 N ATOM 2362 CA LEU A 167 3.462 19.504 -32.422 1.00 14.53 C ATOM 2363 C LEU A 167 3.597 20.171 -33.787 1.00 4.53 C ATOM 2364 O LEU A 167 3.548 21.397 -33.898 1.00 51.25 O ATOM 2365 CB LEU A 167 4.823 18.984 -31.958 1.00 61.52 C ATOM 2366 CG LEU A 167 5.179 19.246 -30.494 1.00 63.35 C ATOM 2367 CD1 LEU A 167 6.191 18.224 -30.000 1.00 63.10 C ATOM 2368 CD2 LEU A 167 5.717 20.659 -30.321 1.00 62.33 C ATOM 0 H LEU A 167 2.885 17.494 -32.272 1.00 21.44 H new ATOM 0 HA LEU A 167 3.103 20.246 -31.709 1.00 14.53 H new ATOM 0 HB2 LEU A 167 4.857 17.909 -32.132 1.00 61.52 H new ATOM 0 HB3 LEU A 167 5.594 19.433 -32.584 1.00 61.52 H new ATOM 0 HG LEU A 167 4.273 19.148 -29.896 1.00 63.35 H new ATOM 0 HD11 LEU A 167 6.432 18.426 -28.956 1.00 63.10 H new ATOM 0 HD12 LEU A 167 5.769 17.223 -30.088 1.00 63.10 H new ATOM 0 HD13 LEU A 167 7.098 18.290 -30.601 1.00 63.10 H new ATOM 0 HD21 LEU A 167 5.965 20.828 -29.273 1.00 62.33 H new ATOM 0 HD22 LEU A 167 6.612 20.785 -30.931 1.00 62.33 H new ATOM 0 HD23 LEU A 167 4.960 21.378 -30.635 1.00 62.33 H new ATOM 2380 N LEU A 168 3.767 19.357 -34.823 1.00 13.52 N ATOM 2381 CA LEU A 168 3.907 19.868 -36.182 1.00 42.20 C ATOM 2382 C LEU A 168 2.767 20.822 -36.526 1.00 64.41 C ATOM 2383 O LEU A 168 2.987 21.878 -37.117 1.00 0.53 O ATOM 2384 CB LEU A 168 3.939 18.711 -37.182 1.00 12.00 C ATOM 2385 CG LEU A 168 3.961 19.102 -38.660 1.00 63.31 C ATOM 2386 CD1 LEU A 168 5.019 18.304 -39.407 1.00 75.42 C ATOM 2387 CD2 LEU A 168 2.591 18.893 -39.288 1.00 13.23 C ATOM 0 H LEU A 168 3.811 18.341 -34.748 1.00 13.52 H new ATOM 0 HA LEU A 168 4.846 20.418 -36.242 1.00 42.20 H new ATOM 0 HB2 LEU A 168 4.819 18.102 -36.975 1.00 12.00 H new ATOM 0 HB3 LEU A 168 3.067 18.081 -37.006 1.00 12.00 H new ATOM 0 HG LEU A 168 4.214 20.160 -38.732 1.00 63.31 H new ATOM 0 HD11 LEU A 168 5.020 18.595 -40.457 1.00 75.42 H new ATOM 0 HD12 LEU A 168 5.999 18.504 -38.974 1.00 75.42 H new ATOM 0 HD13 LEU A 168 4.797 17.240 -39.326 1.00 75.42 H new ATOM 0 HD21 LEU A 168 2.626 19.177 -40.340 1.00 13.23 H new ATOM 0 HD22 LEU A 168 2.309 17.844 -39.204 1.00 13.23 H new ATOM 0 HD23 LEU A 168 1.856 19.509 -38.770 1.00 13.23 H new ATOM 2399 N GLU A 169 1.550 20.441 -36.150 1.00 63.24 N ATOM 2400 CA GLU A 169 0.377 21.263 -36.419 1.00 14.45 C ATOM 2401 C GLU A 169 0.510 22.633 -35.759 1.00 11.00 C ATOM 2402 O GLU A 169 0.202 23.660 -36.366 1.00 63.20 O ATOM 2403 CB GLU A 169 -0.889 20.565 -35.917 1.00 22.41 C ATOM 2404 CG GLU A 169 -1.039 19.140 -36.423 1.00 25.32 C ATOM 2405 CD GLU A 169 -1.103 19.062 -37.936 1.00 32.32 C ATOM 2406 OE1 GLU A 169 -1.843 19.866 -38.540 1.00 12.44 O ATOM 2407 OE2 GLU A 169 -0.415 18.196 -38.516 1.00 4.52 O ATOM 0 H GLU A 169 1.351 19.569 -35.659 1.00 63.24 H new ATOM 0 HA GLU A 169 0.303 21.403 -37.497 1.00 14.45 H new ATOM 0 HB2 GLU A 169 -0.881 20.556 -34.827 1.00 22.41 H new ATOM 0 HB3 GLU A 169 -1.760 21.144 -36.224 1.00 22.41 H new ATOM 0 HG2 GLU A 169 -0.200 18.542 -36.067 1.00 25.32 H new ATOM 0 HG3 GLU A 169 -1.944 18.702 -36.002 1.00 25.32 H new ATOM 2414 N LEU A 170 0.970 22.641 -34.513 1.00 34.53 N ATOM 2415 CA LEU A 170 1.144 23.883 -33.769 1.00 13.42 C ATOM 2416 C LEU A 170 1.975 24.883 -34.566 1.00 40.32 C ATOM 2417 O LEU A 170 1.661 26.072 -34.609 1.00 73.23 O ATOM 2418 CB LEU A 170 1.813 23.605 -32.422 1.00 45.10 C ATOM 2419 CG LEU A 170 2.050 24.822 -31.526 1.00 63.52 C ATOM 2420 CD1 LEU A 170 2.003 24.422 -30.060 1.00 31.33 C ATOM 2421 CD2 LEU A 170 3.382 25.478 -31.859 1.00 62.22 C ATOM 0 H LEU A 170 1.229 21.801 -33.996 1.00 34.53 H new ATOM 0 HA LEU A 170 0.158 24.315 -33.595 1.00 13.42 H new ATOM 0 HB2 LEU A 170 1.199 22.890 -31.875 1.00 45.10 H new ATOM 0 HB3 LEU A 170 2.773 23.124 -32.608 1.00 45.10 H new ATOM 0 HG LEU A 170 1.255 25.545 -31.710 1.00 63.52 H new ATOM 0 HD11 LEU A 170 2.174 25.300 -29.438 1.00 31.33 H new ATOM 0 HD12 LEU A 170 1.025 23.998 -29.830 1.00 31.33 H new ATOM 0 HD13 LEU A 170 2.776 23.680 -29.860 1.00 31.33 H new ATOM 0 HD21 LEU A 170 3.534 26.342 -31.212 1.00 62.22 H new ATOM 0 HD22 LEU A 170 4.189 24.762 -31.704 1.00 62.22 H new ATOM 0 HD23 LEU A 170 3.378 25.801 -32.900 1.00 62.22 H new