USER MOD reduce.3.24.130724 H: found=0, std=0, add=951, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 954 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 125 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 136 HIS : no HD1:sc= -0.623 X(o=-0.62,f=-0.15) USER MOD Set 2.1: A 103 THR OG1 : rot 180:sc= 0.329 USER MOD Set 2.2: A 121 THR OG1 : rot -108:sc= -0.496 USER MOD Set 3.1: A 40 HIS : no HD1:sc= -1.18 K(o=-1.1,f=-0.51) USER MOD Set 3.2: A 100 ASN : amide:sc= 0.0324 K(o=-1.1,f=-4.7!) USER MOD Single : A 25 LYS NZ :NH3+ -160:sc= -0.0739 (180deg=-0.462) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS : no HD1:sc= -0.0157 X(o=-0.016,f=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.137 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -0.185 K(o=-0.18,f=-1.2) USER MOD Single : A 79 TYR OH : rot -78:sc= 0.00138 USER MOD Single : A 81 HIS : no HE2:sc= 0.0953 K(o=0.095,f=-5.9!) USER MOD Single : A 86 LYS NZ :NH3+ 168:sc= 1.24 (180deg=1) USER MOD Single : A 89 LYS NZ :NH3+ -176:sc= 0.879 (180deg=0.778) USER MOD Single : A 99 LYS NZ :NH3+ 155:sc= 1.27 (180deg=0.762) USER MOD Single : A 112 MET CE :methyl 146:sc= -2.08 (180deg=-5.12!) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 TYR OH : rot 121:sc= -0.896 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 SER OG : rot -141:sc= -1.73! USER MOD Single : A 123 GLN : amide:sc= 0.409 K(o=0.41,f=-0.36) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot -1:sc= 0.439 USER MOD Single : A 138 HIS : no HE2:sc= 1.07 K(o=1.1,f=-3.6!) USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 LYS NZ :NH3+ -127:sc= -0.0667 (180deg=-0.453) USER MOD Single : A 145 SER OG : rot -11:sc= 0.836 USER MOD Single : A 150 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 153 THR OG1 : rot -81:sc= 1.1 USER MOD Single : A 156 GLN : amide:sc= -0.296 X(o=-0.3,f=-0.15) USER MOD Single : A 158 CYS SG : rot 67:sc= -1.18! USER MOD Single : A 162 SER OG : rot 81:sc= 1.1 USER MOD Single : A 163 LYS NZ :NH3+ -134:sc= -0.876 (180deg=-3!) USER MOD Single : A 168 HIS : no HD1:sc= -0.0482 X(o=-0.048,f=-0.0093) USER MOD ----------------------------------------------------------------- ATOM 62 N LEU A 22 -6.283 -23.493 4.587 1.00 3.34 N ATOM 63 CA LEU A 22 -6.511 -22.504 3.518 1.00 33.32 C ATOM 64 C LEU A 22 -5.991 -21.109 3.881 1.00 34.13 C ATOM 65 O LEU A 22 -6.351 -20.107 3.258 1.00 34.34 O ATOM 66 CB LEU A 22 -7.981 -22.474 3.142 1.00 44.35 C ATOM 67 CG LEU A 22 -8.516 -23.775 2.557 1.00 20.41 C ATOM 68 CD1 LEU A 22 -10.003 -23.707 2.447 1.00 4.21 C ATOM 69 CD2 LEU A 22 -7.900 -24.047 1.190 1.00 53.22 C ATOM 0 HA LEU A 22 -5.934 -22.819 2.649 1.00 33.32 H new ATOM 0 HB2 LEU A 22 -8.564 -22.224 4.029 1.00 44.35 H new ATOM 0 HB3 LEU A 22 -8.141 -21.674 2.419 1.00 44.35 H new ATOM 0 HG LEU A 22 -8.243 -24.593 3.223 1.00 20.41 H new ATOM 0 HD11 LEU A 22 -10.380 -24.640 2.028 1.00 4.21 H new ATOM 0 HD12 LEU A 22 -10.434 -23.553 3.436 1.00 4.21 H new ATOM 0 HD13 LEU A 22 -10.282 -22.878 1.796 1.00 4.21 H new ATOM 0 HD21 LEU A 22 -8.297 -24.981 0.792 1.00 53.22 H new ATOM 0 HD22 LEU A 22 -8.145 -23.230 0.511 1.00 53.22 H new ATOM 0 HD23 LEU A 22 -6.817 -24.125 1.288 1.00 53.22 H new ATOM 81 N VAL A 23 -5.117 -21.054 4.856 1.00 25.32 N ATOM 82 CA VAL A 23 -4.506 -19.814 5.242 1.00 11.23 C ATOM 83 C VAL A 23 -3.104 -19.775 4.653 1.00 61.24 C ATOM 84 O VAL A 23 -2.363 -20.775 4.702 1.00 31.20 O ATOM 85 CB VAL A 23 -4.468 -19.622 6.796 1.00 21.33 C ATOM 86 CG1 VAL A 23 -3.629 -20.691 7.479 1.00 53.43 C ATOM 87 CG2 VAL A 23 -3.976 -18.225 7.167 1.00 11.30 C ATOM 0 H VAL A 23 -4.814 -21.863 5.398 1.00 25.32 H new ATOM 0 HA VAL A 23 -5.105 -18.990 4.855 1.00 11.23 H new ATOM 0 HB VAL A 23 -5.491 -19.730 7.157 1.00 21.33 H new ATOM 0 HG11 VAL A 23 -3.629 -20.521 8.556 1.00 53.43 H new ATOM 0 HG12 VAL A 23 -4.049 -21.674 7.267 1.00 53.43 H new ATOM 0 HG13 VAL A 23 -2.606 -20.645 7.105 1.00 53.43 H new ATOM 0 HG21 VAL A 23 -3.960 -18.121 8.252 1.00 11.30 H new ATOM 0 HG22 VAL A 23 -2.970 -18.077 6.774 1.00 11.30 H new ATOM 0 HG23 VAL A 23 -4.646 -17.478 6.741 1.00 11.30 H new ATOM 97 N GLY A 24 -2.755 -18.672 4.076 1.00 5.10 N ATOM 98 CA GLY A 24 -1.484 -18.561 3.467 1.00 63.22 C ATOM 99 C GLY A 24 -0.951 -17.183 3.591 1.00 12.21 C ATOM 100 O GLY A 24 -1.689 -16.244 3.851 1.00 4.13 O ATOM 0 H GLY A 24 -3.338 -17.837 4.017 1.00 5.10 H new ATOM 0 HA2 GLY A 24 -0.793 -19.265 3.931 1.00 63.22 H new ATOM 0 HA3 GLY A 24 -1.557 -18.833 2.414 1.00 63.22 H new ATOM 104 N LYS A 25 0.303 -17.053 3.422 1.00 50.31 N ATOM 105 CA LYS A 25 0.939 -15.793 3.496 1.00 64.12 C ATOM 106 C LYS A 25 2.095 -15.753 2.557 1.00 12.21 C ATOM 107 O LYS A 25 2.653 -16.790 2.198 1.00 72.43 O ATOM 108 CB LYS A 25 1.403 -15.449 4.913 1.00 2.12 C ATOM 109 CG LYS A 25 2.213 -16.523 5.583 1.00 70.30 C ATOM 110 CD LYS A 25 3.057 -15.964 6.710 1.00 35.14 C ATOM 111 CE LYS A 25 4.213 -15.122 6.157 1.00 14.25 C ATOM 112 NZ LYS A 25 5.161 -15.950 5.370 1.00 43.40 N ATOM 0 H LYS A 25 0.933 -17.830 3.224 1.00 50.31 H new ATOM 0 HA LYS A 25 0.201 -15.043 3.211 1.00 64.12 H new ATOM 0 HB2 LYS A 25 1.996 -14.535 4.875 1.00 2.12 H new ATOM 0 HB3 LYS A 25 0.528 -15.236 5.526 1.00 2.12 H new ATOM 0 HG2 LYS A 25 1.546 -17.292 5.974 1.00 70.30 H new ATOM 0 HG3 LYS A 25 2.859 -17.004 4.848 1.00 70.30 H new ATOM 0 HD2 LYS A 25 2.437 -15.353 7.366 1.00 35.14 H new ATOM 0 HD3 LYS A 25 3.452 -16.781 7.314 1.00 35.14 H new ATOM 0 HE2 LYS A 25 3.816 -14.325 5.528 1.00 14.25 H new ATOM 0 HE3 LYS A 25 4.743 -14.644 6.981 1.00 14.25 H new ATOM 0 HZ1 LYS A 25 6.075 -15.459 5.299 1.00 43.40 H new ATOM 0 HZ2 LYS A 25 5.296 -16.867 5.842 1.00 43.40 H new ATOM 0 HZ3 LYS A 25 4.777 -16.106 4.416 1.00 43.40 H new ATOM 126 N LEU A 26 2.443 -14.586 2.161 1.00 52.24 N ATOM 127 CA LEU A 26 3.538 -14.377 1.289 1.00 63.34 C ATOM 128 C LEU A 26 4.285 -13.185 1.796 1.00 4.30 C ATOM 129 O LEU A 26 3.692 -12.217 2.210 1.00 33.12 O ATOM 130 CB LEU A 26 3.039 -14.214 -0.178 1.00 43.20 C ATOM 131 CG LEU A 26 4.087 -14.052 -1.314 1.00 12.22 C ATOM 132 CD1 LEU A 26 3.411 -14.253 -2.646 1.00 13.11 C ATOM 133 CD2 LEU A 26 4.729 -12.666 -1.311 1.00 2.22 C ATOM 0 H LEU A 26 1.964 -13.730 2.440 1.00 52.24 H new ATOM 0 HA LEU A 26 4.213 -15.233 1.274 1.00 63.34 H new ATOM 0 HB2 LEU A 26 2.426 -15.084 -0.416 1.00 43.20 H new ATOM 0 HB3 LEU A 26 2.383 -13.344 -0.208 1.00 43.20 H new ATOM 0 HG LEU A 26 4.867 -14.795 -1.147 1.00 12.22 H new ATOM 0 HD11 LEU A 26 4.143 -14.140 -3.446 1.00 13.11 H new ATOM 0 HD12 LEU A 26 2.979 -15.253 -2.688 1.00 13.11 H new ATOM 0 HD13 LEU A 26 2.622 -13.511 -2.769 1.00 13.11 H new ATOM 0 HD21 LEU A 26 5.454 -12.599 -2.122 1.00 2.22 H new ATOM 0 HD22 LEU A 26 3.958 -11.908 -1.450 1.00 2.22 H new ATOM 0 HD23 LEU A 26 5.233 -12.501 -0.359 1.00 2.22 H new ATOM 145 N GLU A 27 5.557 -13.274 1.798 1.00 54.44 N ATOM 146 CA GLU A 27 6.371 -12.208 2.277 1.00 41.11 C ATOM 147 C GLU A 27 7.455 -11.951 1.267 1.00 42.11 C ATOM 148 O GLU A 27 8.121 -12.888 0.814 1.00 62.24 O ATOM 149 CB GLU A 27 6.950 -12.568 3.647 1.00 23.24 C ATOM 150 CG GLU A 27 7.744 -11.466 4.303 1.00 11.10 C ATOM 151 CD GLU A 27 8.259 -11.870 5.646 1.00 74.53 C ATOM 152 OE1 GLU A 27 7.490 -11.863 6.615 1.00 42.01 O ATOM 153 OE2 GLU A 27 9.447 -12.204 5.760 1.00 71.54 O ATOM 0 H GLU A 27 6.075 -14.088 1.468 1.00 54.44 H new ATOM 0 HA GLU A 27 5.781 -11.300 2.403 1.00 41.11 H new ATOM 0 HB2 GLU A 27 6.132 -12.852 4.309 1.00 23.24 H new ATOM 0 HB3 GLU A 27 7.590 -13.443 3.538 1.00 23.24 H new ATOM 0 HG2 GLU A 27 8.581 -11.191 3.661 1.00 11.10 H new ATOM 0 HG3 GLU A 27 7.117 -10.580 4.407 1.00 11.10 H new ATOM 160 N THR A 28 7.614 -10.723 0.889 1.00 72.52 N ATOM 161 CA THR A 28 8.579 -10.369 -0.100 1.00 42.40 C ATOM 162 C THR A 28 9.204 -9.036 0.246 1.00 65.42 C ATOM 163 O THR A 28 8.573 -8.178 0.850 1.00 42.04 O ATOM 164 CB THR A 28 7.937 -10.303 -1.542 1.00 4.40 C ATOM 165 OG1 THR A 28 8.939 -9.995 -2.541 1.00 54.01 O ATOM 166 CG2 THR A 28 6.826 -9.249 -1.613 1.00 54.51 C ATOM 0 H THR A 28 7.078 -9.938 1.258 1.00 72.52 H new ATOM 0 HA THR A 28 9.347 -11.143 -0.111 1.00 42.40 H new ATOM 0 HB THR A 28 7.510 -11.285 -1.744 1.00 4.40 H new ATOM 0 HG1 THR A 28 8.519 -9.961 -3.426 1.00 54.01 H new ATOM 0 HG21 THR A 28 6.406 -9.230 -2.619 1.00 54.51 H new ATOM 0 HG22 THR A 28 6.042 -9.498 -0.897 1.00 54.51 H new ATOM 0 HG23 THR A 28 7.238 -8.269 -1.374 1.00 54.51 H new ATOM 174 N ASP A 29 10.439 -8.887 -0.090 1.00 32.12 N ATOM 175 CA ASP A 29 11.107 -7.624 0.044 1.00 1.42 C ATOM 176 C ASP A 29 11.133 -6.970 -1.299 1.00 30.30 C ATOM 177 O ASP A 29 11.230 -7.656 -2.326 1.00 22.25 O ATOM 178 CB ASP A 29 12.548 -7.777 0.587 1.00 1.31 C ATOM 179 CG ASP A 29 13.409 -8.713 -0.230 1.00 10.32 C ATOM 180 OD1 ASP A 29 13.363 -9.939 0.028 1.00 62.14 O ATOM 181 OD2 ASP A 29 14.143 -8.249 -1.129 1.00 34.41 O ATOM 0 H ASP A 29 11.022 -9.635 -0.467 1.00 32.12 H new ATOM 0 HA ASP A 29 10.563 -7.015 0.766 1.00 1.42 H new ATOM 0 HB2 ASP A 29 13.021 -6.796 0.618 1.00 1.31 H new ATOM 0 HB3 ASP A 29 12.503 -8.141 1.613 1.00 1.31 H new ATOM 186 N VAL A 30 10.968 -5.688 -1.316 1.00 3.53 N ATOM 187 CA VAL A 30 11.087 -4.924 -2.529 1.00 24.33 C ATOM 188 C VAL A 30 12.051 -3.807 -2.288 1.00 73.51 C ATOM 189 O VAL A 30 11.906 -3.047 -1.327 1.00 64.23 O ATOM 190 CB VAL A 30 9.729 -4.350 -3.041 1.00 23.30 C ATOM 191 CG1 VAL A 30 9.934 -3.498 -4.289 1.00 34.23 C ATOM 192 CG2 VAL A 30 8.745 -5.465 -3.344 1.00 34.43 C ATOM 0 H VAL A 30 10.746 -5.133 -0.490 1.00 3.53 H new ATOM 0 HA VAL A 30 11.442 -5.597 -3.309 1.00 24.33 H new ATOM 0 HB VAL A 30 9.319 -3.725 -2.248 1.00 23.30 H new ATOM 0 HG11 VAL A 30 8.973 -3.110 -4.626 1.00 34.23 H new ATOM 0 HG12 VAL A 30 10.600 -2.667 -4.057 1.00 34.23 H new ATOM 0 HG13 VAL A 30 10.376 -4.108 -5.077 1.00 34.23 H new ATOM 0 HG21 VAL A 30 7.808 -5.037 -3.699 1.00 34.43 H new ATOM 0 HG22 VAL A 30 9.160 -6.117 -4.112 1.00 34.43 H new ATOM 0 HG23 VAL A 30 8.560 -6.043 -2.439 1.00 34.43 H new ATOM 202 N GLU A 31 13.046 -3.726 -3.101 1.00 21.12 N ATOM 203 CA GLU A 31 13.994 -2.687 -2.968 1.00 2.34 C ATOM 204 C GLU A 31 13.626 -1.464 -3.768 1.00 24.43 C ATOM 205 O GLU A 31 13.144 -1.548 -4.896 1.00 35.40 O ATOM 206 CB GLU A 31 15.450 -3.169 -3.160 1.00 61.22 C ATOM 207 CG GLU A 31 15.799 -3.907 -4.447 1.00 33.22 C ATOM 208 CD GLU A 31 15.782 -3.055 -5.693 1.00 63.43 C ATOM 209 OE1 GLU A 31 16.656 -2.170 -5.824 1.00 72.30 O ATOM 210 OE2 GLU A 31 14.951 -3.286 -6.588 1.00 4.42 O ATOM 0 H GLU A 31 13.221 -4.374 -3.869 1.00 21.12 H new ATOM 0 HA GLU A 31 13.957 -2.360 -1.929 1.00 2.34 H new ATOM 0 HB2 GLU A 31 16.102 -2.298 -3.088 1.00 61.22 H new ATOM 0 HB3 GLU A 31 15.698 -3.822 -2.323 1.00 61.22 H new ATOM 0 HG2 GLU A 31 16.790 -4.347 -4.339 1.00 33.22 H new ATOM 0 HG3 GLU A 31 15.097 -4.731 -4.578 1.00 33.22 H new ATOM 217 N ILE A 32 13.802 -0.353 -3.152 1.00 2.21 N ATOM 218 CA ILE A 32 13.508 0.929 -3.723 1.00 20.21 C ATOM 219 C ILE A 32 14.712 1.789 -3.574 1.00 13.43 C ATOM 220 O ILE A 32 15.741 1.368 -2.995 1.00 24.22 O ATOM 221 CB ILE A 32 12.305 1.651 -3.019 1.00 51.53 C ATOM 222 CG1 ILE A 32 12.632 1.933 -1.538 1.00 25.23 C ATOM 223 CG2 ILE A 32 11.019 0.821 -3.140 1.00 32.45 C ATOM 224 CD1 ILE A 32 11.701 2.920 -0.870 1.00 62.20 C ATOM 0 H ILE A 32 14.168 -0.299 -2.201 1.00 2.21 H new ATOM 0 HA ILE A 32 13.234 0.770 -4.766 1.00 20.21 H new ATOM 0 HB ILE A 32 12.141 2.603 -3.523 1.00 51.53 H new ATOM 0 HG12 ILE A 32 12.602 0.993 -0.987 1.00 25.23 H new ATOM 0 HG13 ILE A 32 13.652 2.311 -1.469 1.00 25.23 H new ATOM 0 HG21 ILE A 32 10.201 1.343 -2.644 1.00 32.45 H new ATOM 0 HG22 ILE A 32 10.774 0.680 -4.193 1.00 32.45 H new ATOM 0 HG23 ILE A 32 11.167 -0.151 -2.669 1.00 32.45 H new ATOM 0 HD11 ILE A 32 12.003 3.060 0.168 1.00 62.20 H new ATOM 0 HD12 ILE A 32 11.747 3.875 -1.393 1.00 62.20 H new ATOM 0 HD13 ILE A 32 10.681 2.537 -0.903 1.00 62.20 H new ATOM 236 N LYS A 33 14.602 2.952 -4.096 1.00 62.34 N ATOM 237 CA LYS A 33 15.606 3.945 -4.001 1.00 42.44 C ATOM 238 C LYS A 33 15.238 4.794 -2.786 1.00 50.43 C ATOM 239 O LYS A 33 14.744 4.249 -1.794 1.00 22.35 O ATOM 240 CB LYS A 33 15.605 4.802 -5.289 1.00 73.43 C ATOM 241 CG LYS A 33 15.888 4.051 -6.615 1.00 42.24 C ATOM 242 CD LYS A 33 14.764 3.131 -7.045 1.00 2.34 C ATOM 243 CE LYS A 33 15.059 2.470 -8.368 1.00 2.40 C ATOM 244 NZ LYS A 33 13.914 1.666 -8.833 1.00 1.33 N ATOM 0 H LYS A 33 13.780 3.251 -4.621 1.00 62.34 H new ATOM 0 HA LYS A 33 16.603 3.517 -3.892 1.00 42.44 H new ATOM 0 HB2 LYS A 33 14.635 5.291 -5.373 1.00 73.43 H new ATOM 0 HB3 LYS A 33 16.350 5.590 -5.176 1.00 73.43 H new ATOM 0 HG2 LYS A 33 16.070 4.781 -7.404 1.00 42.24 H new ATOM 0 HG3 LYS A 33 16.801 3.467 -6.504 1.00 42.24 H new ATOM 0 HD2 LYS A 33 14.608 2.367 -6.283 1.00 2.34 H new ATOM 0 HD3 LYS A 33 13.837 3.700 -7.121 1.00 2.34 H new ATOM 0 HE2 LYS A 33 15.298 3.230 -9.111 1.00 2.40 H new ATOM 0 HE3 LYS A 33 15.938 1.833 -8.270 1.00 2.40 H new ATOM 0 HZ1 LYS A 33 14.148 1.224 -9.745 1.00 1.33 H new ATOM 0 HZ2 LYS A 33 13.703 0.926 -8.134 1.00 1.33 H new ATOM 0 HZ3 LYS A 33 13.083 2.280 -8.949 1.00 1.33 H new ATOM 258 N ALA A 34 15.513 6.095 -2.831 1.00 3.24 N ATOM 259 CA ALA A 34 15.100 7.015 -1.774 1.00 45.21 C ATOM 260 C ALA A 34 15.782 6.703 -0.448 1.00 54.10 C ATOM 261 O ALA A 34 16.820 6.066 -0.406 1.00 74.42 O ATOM 262 CB ALA A 34 13.577 7.003 -1.625 1.00 23.22 C ATOM 0 H ALA A 34 16.024 6.539 -3.594 1.00 3.24 H new ATOM 0 HA ALA A 34 15.415 8.017 -2.065 1.00 45.21 H new ATOM 0 HB1 ALA A 34 13.283 7.693 -0.834 1.00 23.22 H new ATOM 0 HB2 ALA A 34 13.117 7.311 -2.564 1.00 23.22 H new ATOM 0 HB3 ALA A 34 13.244 5.997 -1.371 1.00 23.22 H new ATOM 268 N SER A 35 15.237 7.204 0.605 1.00 1.42 N ATOM 269 CA SER A 35 15.755 6.960 1.907 1.00 23.41 C ATOM 270 C SER A 35 14.603 6.547 2.790 1.00 41.12 C ATOM 271 O SER A 35 13.468 7.006 2.572 1.00 72.54 O ATOM 272 CB SER A 35 16.398 8.238 2.445 1.00 60.51 C ATOM 273 OG SER A 35 16.968 8.052 3.730 1.00 40.43 O ATOM 0 H SER A 35 14.410 7.801 0.587 1.00 1.42 H new ATOM 0 HA SER A 35 16.511 6.175 1.884 1.00 23.41 H new ATOM 0 HB2 SER A 35 17.170 8.573 1.752 1.00 60.51 H new ATOM 0 HB3 SER A 35 15.648 9.027 2.493 1.00 60.51 H new ATOM 0 HG SER A 35 17.369 8.893 4.035 1.00 40.43 H new ATOM 279 N ALA A 36 14.865 5.706 3.776 1.00 71.34 N ATOM 280 CA ALA A 36 13.838 5.323 4.723 1.00 30.24 C ATOM 281 C ALA A 36 13.442 6.540 5.541 1.00 62.11 C ATOM 282 O ALA A 36 12.301 6.678 5.970 1.00 24.40 O ATOM 283 CB ALA A 36 14.317 4.190 5.619 1.00 41.22 C ATOM 0 H ALA A 36 15.777 5.278 3.939 1.00 71.34 H new ATOM 0 HA ALA A 36 12.966 4.956 4.182 1.00 30.24 H new ATOM 0 HB1 ALA A 36 13.527 3.922 6.320 1.00 41.22 H new ATOM 0 HB2 ALA A 36 14.568 3.324 5.007 1.00 41.22 H new ATOM 0 HB3 ALA A 36 15.199 4.512 6.172 1.00 41.22 H new ATOM 289 N ASP A 37 14.400 7.444 5.718 1.00 41.40 N ATOM 290 CA ASP A 37 14.164 8.698 6.411 1.00 62.31 C ATOM 291 C ASP A 37 13.372 9.624 5.524 1.00 3.33 C ATOM 292 O ASP A 37 12.442 10.300 5.973 1.00 44.31 O ATOM 293 CB ASP A 37 15.474 9.385 6.797 1.00 50.02 C ATOM 294 CG ASP A 37 16.296 8.613 7.788 1.00 34.04 C ATOM 295 OD1 ASP A 37 16.009 8.685 8.994 1.00 2.02 O ATOM 296 OD2 ASP A 37 17.256 7.934 7.379 1.00 75.22 O ATOM 0 H ASP A 37 15.357 7.325 5.385 1.00 41.40 H new ATOM 0 HA ASP A 37 13.610 8.474 7.323 1.00 62.31 H new ATOM 0 HB2 ASP A 37 16.067 9.548 5.897 1.00 50.02 H new ATOM 0 HB3 ASP A 37 15.249 10.367 7.213 1.00 50.02 H new ATOM 301 N LYS A 38 13.723 9.626 4.244 1.00 11.51 N ATOM 302 CA LYS A 38 13.084 10.469 3.258 1.00 53.31 C ATOM 303 C LYS A 38 11.617 10.076 3.097 1.00 73.15 C ATOM 304 O LYS A 38 10.774 10.918 2.791 1.00 53.22 O ATOM 305 CB LYS A 38 13.837 10.387 1.925 1.00 10.21 C ATOM 306 CG LYS A 38 13.373 11.383 0.928 1.00 12.25 C ATOM 307 CD LYS A 38 14.197 11.363 -0.335 1.00 32.51 C ATOM 308 CE LYS A 38 13.778 12.502 -1.228 1.00 22.42 C ATOM 309 NZ LYS A 38 14.594 12.602 -2.466 1.00 14.12 N ATOM 0 H LYS A 38 14.464 9.037 3.865 1.00 11.51 H new ATOM 0 HA LYS A 38 13.116 11.504 3.597 1.00 53.31 H new ATOM 0 HB2 LYS A 38 14.902 10.534 2.107 1.00 10.21 H new ATOM 0 HB3 LYS A 38 13.720 9.386 1.510 1.00 10.21 H new ATOM 0 HG2 LYS A 38 12.330 11.186 0.681 1.00 12.25 H new ATOM 0 HG3 LYS A 38 13.413 12.379 1.369 1.00 12.25 H new ATOM 0 HD2 LYS A 38 15.256 11.448 -0.092 1.00 32.51 H new ATOM 0 HD3 LYS A 38 14.064 10.413 -0.853 1.00 32.51 H new ATOM 0 HE2 LYS A 38 12.730 12.376 -1.500 1.00 22.42 H new ATOM 0 HE3 LYS A 38 13.853 13.437 -0.674 1.00 22.42 H new ATOM 0 HZ1 LYS A 38 14.259 13.403 -3.039 1.00 14.12 H new ATOM 0 HZ2 LYS A 38 15.592 12.751 -2.213 1.00 14.12 H new ATOM 0 HZ3 LYS A 38 14.503 11.723 -3.014 1.00 14.12 H new ATOM 323 N PHE A 39 11.326 8.793 3.336 1.00 53.15 N ATOM 324 CA PHE A 39 9.957 8.268 3.315 1.00 73.33 C ATOM 325 C PHE A 39 9.057 9.073 4.245 1.00 53.33 C ATOM 326 O PHE A 39 7.963 9.481 3.857 1.00 34.15 O ATOM 327 CB PHE A 39 9.945 6.774 3.715 1.00 43.45 C ATOM 328 CG PHE A 39 8.563 6.163 3.841 1.00 72.12 C ATOM 329 CD1 PHE A 39 7.866 5.745 2.721 1.00 44.23 C ATOM 330 CD2 PHE A 39 7.967 6.014 5.085 1.00 72.33 C ATOM 331 CE1 PHE A 39 6.606 5.190 2.839 1.00 12.04 C ATOM 332 CE2 PHE A 39 6.707 5.461 5.207 1.00 64.01 C ATOM 333 CZ PHE A 39 6.026 5.048 4.084 1.00 51.04 C ATOM 0 H PHE A 39 12.033 8.089 3.549 1.00 53.15 H new ATOM 0 HA PHE A 39 9.571 8.360 2.300 1.00 73.33 H new ATOM 0 HB2 PHE A 39 10.511 6.209 2.974 1.00 43.45 H new ATOM 0 HB3 PHE A 39 10.465 6.662 4.667 1.00 43.45 H new ATOM 0 HD1 PHE A 39 8.312 5.854 1.743 1.00 44.23 H new ATOM 0 HD2 PHE A 39 8.496 6.335 5.970 1.00 72.33 H new ATOM 0 HE1 PHE A 39 6.074 4.867 1.956 1.00 12.04 H new ATOM 0 HE2 PHE A 39 6.256 5.353 6.183 1.00 64.01 H new ATOM 0 HZ PHE A 39 5.041 4.614 4.177 1.00 51.04 H new ATOM 343 N HIS A 40 9.553 9.331 5.457 1.00 51.52 N ATOM 344 CA HIS A 40 8.804 10.090 6.473 1.00 64.12 C ATOM 345 C HIS A 40 8.395 11.442 5.930 1.00 41.31 C ATOM 346 O HIS A 40 7.251 11.859 6.052 1.00 4.52 O ATOM 347 CB HIS A 40 9.652 10.346 7.729 1.00 54.11 C ATOM 348 CG HIS A 40 10.076 9.147 8.510 1.00 33.54 C ATOM 349 ND1 HIS A 40 9.542 8.820 9.724 1.00 4.12 N ATOM 350 CD2 HIS A 40 11.049 8.246 8.284 1.00 34.32 C ATOM 351 CE1 HIS A 40 10.175 7.775 10.210 1.00 13.22 C ATOM 352 NE2 HIS A 40 11.090 7.412 9.356 1.00 42.10 N ATOM 0 H HIS A 40 10.476 9.025 5.765 1.00 51.52 H new ATOM 0 HA HIS A 40 7.932 9.489 6.729 1.00 64.12 H new ATOM 0 HB2 HIS A 40 10.547 10.890 7.429 1.00 54.11 H new ATOM 0 HB3 HIS A 40 9.088 11.001 8.392 1.00 54.11 H new ATOM 0 HD2 HIS A 40 11.682 8.195 7.410 1.00 34.32 H new ATOM 0 HE1 HIS A 40 9.971 7.298 11.157 1.00 13.22 H new ATOM 0 HE2 HIS A 40 11.733 6.629 9.473 1.00 42.10 H new ATOM 361 N HIS A 41 9.339 12.106 5.307 1.00 13.42 N ATOM 362 CA HIS A 41 9.124 13.456 4.843 1.00 72.53 C ATOM 363 C HIS A 41 8.277 13.496 3.583 1.00 74.51 C ATOM 364 O HIS A 41 7.376 14.308 3.472 1.00 53.40 O ATOM 365 CB HIS A 41 10.452 14.196 4.623 1.00 32.23 C ATOM 366 CG HIS A 41 11.326 14.287 5.847 1.00 44.50 C ATOM 367 ND1 HIS A 41 11.197 15.267 6.802 1.00 22.40 N ATOM 368 CD2 HIS A 41 12.350 13.504 6.261 1.00 33.11 C ATOM 369 CE1 HIS A 41 12.102 15.081 7.740 1.00 24.23 C ATOM 370 NE2 HIS A 41 12.809 14.019 7.432 1.00 61.41 N ATOM 0 H HIS A 41 10.267 11.732 5.109 1.00 13.42 H new ATOM 0 HA HIS A 41 8.574 13.972 5.630 1.00 72.53 H new ATOM 0 HB2 HIS A 41 11.007 13.692 3.832 1.00 32.23 H new ATOM 0 HB3 HIS A 41 10.237 15.204 4.269 1.00 32.23 H new ATOM 0 HD2 HIS A 41 12.732 12.630 5.754 1.00 33.11 H new ATOM 0 HE1 HIS A 41 12.239 15.698 8.615 1.00 24.23 H new ATOM 0 HE2 HIS A 41 13.579 13.641 7.983 1.00 61.41 H new ATOM 778 N THR A 70 -5.405 7.950 12.137 1.00 1.32 N ATOM 779 CA THR A 70 -5.398 6.955 13.171 1.00 1.12 C ATOM 780 C THR A 70 -5.775 5.594 12.581 1.00 74.01 C ATOM 781 O THR A 70 -6.031 5.476 11.375 1.00 74.55 O ATOM 782 CB THR A 70 -6.398 7.355 14.314 1.00 30.14 C ATOM 783 OG1 THR A 70 -6.349 6.411 15.396 1.00 52.03 O ATOM 784 CG2 THR A 70 -7.829 7.452 13.785 1.00 25.30 C ATOM 0 HA THR A 70 -4.397 6.889 13.597 1.00 1.12 H new ATOM 0 HB THR A 70 -6.092 8.334 14.684 1.00 30.14 H new ATOM 0 HG1 THR A 70 -6.979 6.683 16.096 1.00 52.03 H new ATOM 0 HG21 THR A 70 -8.499 7.730 14.598 1.00 25.30 H new ATOM 0 HG22 THR A 70 -7.877 8.207 13.001 1.00 25.30 H new ATOM 0 HG23 THR A 70 -8.133 6.487 13.378 1.00 25.30 H new ATOM 792 N VAL A 71 -5.802 4.587 13.421 1.00 72.11 N ATOM 793 CA VAL A 71 -6.196 3.258 13.036 1.00 41.02 C ATOM 794 C VAL A 71 -7.667 3.283 12.629 1.00 55.15 C ATOM 795 O VAL A 71 -8.496 3.895 13.310 1.00 73.03 O ATOM 796 CB VAL A 71 -5.984 2.265 14.204 1.00 14.31 C ATOM 797 CG1 VAL A 71 -6.456 0.867 13.843 1.00 64.43 C ATOM 798 CG2 VAL A 71 -4.519 2.241 14.624 1.00 2.14 C ATOM 0 H VAL A 71 -5.547 4.672 14.405 1.00 72.11 H new ATOM 0 HA VAL A 71 -5.583 2.927 12.198 1.00 41.02 H new ATOM 0 HB VAL A 71 -6.586 2.610 15.044 1.00 14.31 H new ATOM 0 HG11 VAL A 71 -6.291 0.198 14.687 1.00 64.43 H new ATOM 0 HG12 VAL A 71 -7.519 0.893 13.603 1.00 64.43 H new ATOM 0 HG13 VAL A 71 -5.897 0.506 12.980 1.00 64.43 H new ATOM 0 HG21 VAL A 71 -4.388 1.538 15.446 1.00 2.14 H new ATOM 0 HG22 VAL A 71 -3.903 1.931 13.780 1.00 2.14 H new ATOM 0 HG23 VAL A 71 -4.217 3.237 14.947 1.00 2.14 H new ATOM 808 N GLY A 72 -7.975 2.647 11.524 1.00 23.53 N ATOM 809 CA GLY A 72 -9.318 2.675 11.011 1.00 61.21 C ATOM 810 C GLY A 72 -9.430 3.636 9.853 1.00 63.11 C ATOM 811 O GLY A 72 -10.482 3.762 9.244 1.00 54.33 O ATOM 0 H GLY A 72 -7.314 2.106 10.966 1.00 23.53 H new ATOM 0 HA2 GLY A 72 -9.610 1.675 10.689 1.00 61.21 H new ATOM 0 HA3 GLY A 72 -10.008 2.970 11.802 1.00 61.21 H new ATOM 815 N SER A 73 -8.328 4.309 9.562 1.00 43.23 N ATOM 816 CA SER A 73 -8.248 5.275 8.482 1.00 2.12 C ATOM 817 C SER A 73 -8.483 4.602 7.131 1.00 34.44 C ATOM 818 O SER A 73 -7.979 3.495 6.882 1.00 70.20 O ATOM 819 CB SER A 73 -6.857 5.944 8.504 1.00 25.24 C ATOM 820 OG SER A 73 -6.733 6.954 7.524 1.00 24.33 O ATOM 0 H SER A 73 -7.454 4.197 10.076 1.00 43.23 H new ATOM 0 HA SER A 73 -9.023 6.028 8.623 1.00 2.12 H new ATOM 0 HB2 SER A 73 -6.678 6.373 9.490 1.00 25.24 H new ATOM 0 HB3 SER A 73 -6.090 5.187 8.342 1.00 25.24 H new ATOM 0 HG SER A 73 -5.839 7.351 7.575 1.00 24.33 H new ATOM 826 N ILE A 74 -9.267 5.249 6.283 1.00 10.22 N ATOM 827 CA ILE A 74 -9.505 4.766 4.946 1.00 64.42 C ATOM 828 C ILE A 74 -9.272 5.887 3.953 1.00 44.13 C ATOM 829 O ILE A 74 -9.996 6.882 3.927 1.00 73.51 O ATOM 830 CB ILE A 74 -10.939 4.202 4.788 1.00 52.54 C ATOM 831 CG1 ILE A 74 -11.107 2.990 5.701 1.00 42.41 C ATOM 832 CG2 ILE A 74 -11.218 3.817 3.332 1.00 62.10 C ATOM 833 CD1 ILE A 74 -12.482 2.399 5.694 1.00 52.45 C ATOM 0 H ILE A 74 -9.751 6.119 6.507 1.00 10.22 H new ATOM 0 HA ILE A 74 -8.809 3.951 4.750 1.00 64.42 H new ATOM 0 HB ILE A 74 -11.656 4.973 5.071 1.00 52.54 H new ATOM 0 HG12 ILE A 74 -10.393 2.223 5.402 1.00 42.41 H new ATOM 0 HG13 ILE A 74 -10.854 3.280 6.721 1.00 42.41 H new ATOM 0 HG21 ILE A 74 -12.231 3.424 3.247 1.00 62.10 H new ATOM 0 HG22 ILE A 74 -11.116 4.697 2.697 1.00 62.10 H new ATOM 0 HG23 ILE A 74 -10.506 3.056 3.014 1.00 62.10 H new ATOM 0 HD11 ILE A 74 -12.514 1.544 6.369 1.00 52.45 H new ATOM 0 HD12 ILE A 74 -13.202 3.148 6.024 1.00 52.45 H new ATOM 0 HD13 ILE A 74 -12.733 2.074 4.684 1.00 52.45 H new ATOM 845 N VAL A 75 -8.276 5.705 3.150 1.00 10.11 N ATOM 846 CA VAL A 75 -7.875 6.656 2.136 1.00 63.34 C ATOM 847 C VAL A 75 -7.510 5.866 0.888 1.00 74.44 C ATOM 848 O VAL A 75 -7.095 4.729 1.002 1.00 11.33 O ATOM 849 CB VAL A 75 -6.677 7.543 2.638 1.00 4.12 C ATOM 850 CG1 VAL A 75 -5.471 6.703 3.033 1.00 31.21 C ATOM 851 CG2 VAL A 75 -6.289 8.608 1.618 1.00 75.25 C ATOM 0 H VAL A 75 -7.693 4.868 3.173 1.00 10.11 H new ATOM 0 HA VAL A 75 -8.689 7.345 1.911 1.00 63.34 H new ATOM 0 HB VAL A 75 -7.028 8.056 3.533 1.00 4.12 H new ATOM 0 HG11 VAL A 75 -4.668 7.357 3.373 1.00 31.21 H new ATOM 0 HG12 VAL A 75 -5.750 6.022 3.837 1.00 31.21 H new ATOM 0 HG13 VAL A 75 -5.130 6.128 2.172 1.00 31.21 H new ATOM 0 HG21 VAL A 75 -5.458 9.197 2.006 1.00 75.25 H new ATOM 0 HG22 VAL A 75 -5.990 8.128 0.686 1.00 75.25 H new ATOM 0 HG23 VAL A 75 -7.141 9.261 1.432 1.00 75.25 H new ATOM 861 N PHE A 76 -7.671 6.432 -0.280 1.00 54.21 N ATOM 862 CA PHE A 76 -7.429 5.675 -1.494 1.00 52.21 C ATOM 863 C PHE A 76 -6.376 6.329 -2.360 1.00 22.31 C ATOM 864 O PHE A 76 -6.296 7.560 -2.426 1.00 23.24 O ATOM 865 CB PHE A 76 -8.728 5.533 -2.295 1.00 45.34 C ATOM 866 CG PHE A 76 -9.849 4.902 -1.525 1.00 72.22 C ATOM 867 CD1 PHE A 76 -9.903 3.541 -1.363 1.00 34.04 C ATOM 868 CD2 PHE A 76 -10.843 5.678 -0.962 1.00 33.15 C ATOM 869 CE1 PHE A 76 -10.925 2.951 -0.657 1.00 71.12 C ATOM 870 CE2 PHE A 76 -11.869 5.098 -0.256 1.00 11.41 C ATOM 871 CZ PHE A 76 -11.909 3.727 -0.103 1.00 71.43 C ATOM 0 H PHE A 76 -7.964 7.399 -0.423 1.00 54.21 H new ATOM 0 HA PHE A 76 -7.066 4.691 -1.198 1.00 52.21 H new ATOM 0 HB2 PHE A 76 -9.044 6.519 -2.635 1.00 45.34 H new ATOM 0 HB3 PHE A 76 -8.531 4.937 -3.186 1.00 45.34 H new ATOM 0 HD1 PHE A 76 -9.131 2.923 -1.797 1.00 34.04 H new ATOM 0 HD2 PHE A 76 -10.814 6.751 -1.078 1.00 33.15 H new ATOM 0 HE1 PHE A 76 -10.952 1.878 -0.539 1.00 71.12 H new ATOM 0 HE2 PHE A 76 -12.643 5.714 0.178 1.00 11.41 H new ATOM 0 HZ PHE A 76 -12.713 3.267 0.452 1.00 71.43 H new ATOM 881 N TRP A 77 -5.559 5.521 -2.998 1.00 43.01 N ATOM 882 CA TRP A 77 -4.614 6.021 -3.963 1.00 61.44 C ATOM 883 C TRP A 77 -4.909 5.430 -5.325 1.00 71.14 C ATOM 884 O TRP A 77 -5.513 4.342 -5.432 1.00 43.42 O ATOM 885 CB TRP A 77 -3.119 5.828 -3.549 1.00 42.42 C ATOM 886 CG TRP A 77 -2.671 4.410 -3.352 1.00 12.32 C ATOM 887 CD1 TRP A 77 -2.806 3.401 -4.233 1.00 4.32 C ATOM 888 CD2 TRP A 77 -1.962 3.871 -2.228 1.00 51.22 C ATOM 889 NE1 TRP A 77 -2.272 2.247 -3.728 1.00 52.23 N ATOM 890 CE2 TRP A 77 -1.743 2.511 -2.495 1.00 43.32 C ATOM 891 CE3 TRP A 77 -1.507 4.400 -1.019 1.00 44.11 C ATOM 892 CZ2 TRP A 77 -1.088 1.671 -1.602 1.00 1.24 C ATOM 893 CZ3 TRP A 77 -0.856 3.566 -0.134 1.00 40.42 C ATOM 894 CH2 TRP A 77 -0.650 2.216 -0.429 1.00 64.21 C ATOM 0 H TRP A 77 -5.533 4.510 -2.863 1.00 43.01 H new ATOM 0 HA TRP A 77 -4.746 7.102 -4.007 1.00 61.44 H new ATOM 0 HB2 TRP A 77 -2.489 6.285 -4.312 1.00 42.42 H new ATOM 0 HB3 TRP A 77 -2.945 6.375 -2.623 1.00 42.42 H new ATOM 0 HD1 TRP A 77 -3.271 3.490 -5.204 1.00 4.32 H new ATOM 0 HE1 TRP A 77 -2.269 1.340 -4.194 1.00 52.23 H new ATOM 0 HE3 TRP A 77 -1.662 5.442 -0.781 1.00 44.11 H new ATOM 0 HZ2 TRP A 77 -0.931 0.626 -1.827 1.00 1.24 H new ATOM 0 HZ3 TRP A 77 -0.499 3.964 0.804 1.00 40.42 H new ATOM 0 HH2 TRP A 77 -0.134 1.591 0.285 1.00 64.21 H new ATOM 905 N ASN A 78 -4.521 6.134 -6.347 1.00 51.54 N ATOM 906 CA ASN A 78 -4.715 5.688 -7.701 1.00 65.23 C ATOM 907 C ASN A 78 -3.379 5.329 -8.288 1.00 4.24 C ATOM 908 O ASN A 78 -2.401 6.067 -8.122 1.00 11.41 O ATOM 909 CB ASN A 78 -5.367 6.788 -8.570 1.00 64.21 C ATOM 910 CG ASN A 78 -6.753 7.217 -8.103 1.00 62.13 C ATOM 911 OD1 ASN A 78 -7.510 6.437 -7.527 1.00 72.35 O ATOM 912 ND2 ASN A 78 -7.094 8.457 -8.351 1.00 63.21 N ATOM 0 H ASN A 78 -4.058 7.039 -6.268 1.00 51.54 H new ATOM 0 HA ASN A 78 -5.380 4.824 -7.688 1.00 65.23 H new ATOM 0 HB2 ASN A 78 -4.714 7.661 -8.581 1.00 64.21 H new ATOM 0 HB3 ASN A 78 -5.437 6.429 -9.597 1.00 64.21 H new ATOM 0 HD21 ASN A 78 -8.011 8.801 -8.064 1.00 63.21 H new ATOM 0 HD22 ASN A 78 -6.443 9.079 -8.831 1.00 63.21 H new ATOM 919 N TYR A 79 -3.318 4.218 -8.945 1.00 51.12 N ATOM 920 CA TYR A 79 -2.115 3.782 -9.615 1.00 32.55 C ATOM 921 C TYR A 79 -2.472 3.440 -11.037 1.00 45.05 C ATOM 922 O TYR A 79 -3.558 2.957 -11.288 1.00 52.45 O ATOM 923 CB TYR A 79 -1.422 2.606 -8.871 1.00 32.12 C ATOM 924 CG TYR A 79 -2.237 1.329 -8.691 1.00 63.21 C ATOM 925 CD1 TYR A 79 -3.175 1.212 -7.671 1.00 32.41 C ATOM 926 CD2 TYR A 79 -2.050 0.237 -9.533 1.00 45.43 C ATOM 927 CE1 TYR A 79 -3.902 0.049 -7.495 1.00 14.02 C ATOM 928 CE2 TYR A 79 -2.773 -0.931 -9.360 1.00 5.31 C ATOM 929 CZ TYR A 79 -3.699 -1.018 -8.339 1.00 21.22 C ATOM 930 OH TYR A 79 -4.424 -2.185 -8.161 1.00 55.24 O ATOM 0 H TYR A 79 -4.103 3.574 -9.039 1.00 51.12 H new ATOM 0 HA TYR A 79 -1.379 4.586 -9.613 1.00 32.55 H new ATOM 0 HB2 TYR A 79 -0.510 2.353 -9.411 1.00 32.12 H new ATOM 0 HB3 TYR A 79 -1.121 2.959 -7.884 1.00 32.12 H new ATOM 0 HD1 TYR A 79 -3.339 2.045 -7.004 1.00 32.41 H new ATOM 0 HD2 TYR A 79 -1.329 0.302 -10.335 1.00 45.43 H new ATOM 0 HE1 TYR A 79 -4.627 -0.021 -6.697 1.00 14.02 H new ATOM 0 HE2 TYR A 79 -2.614 -1.770 -10.021 1.00 5.31 H new ATOM 0 HH TYR A 79 -4.041 -2.698 -7.419 1.00 55.24 H new ATOM 940 N VAL A 80 -1.598 3.690 -11.958 1.00 73.53 N ATOM 941 CA VAL A 80 -1.940 3.510 -13.344 1.00 53.21 C ATOM 942 C VAL A 80 -1.278 2.268 -13.896 1.00 13.40 C ATOM 943 O VAL A 80 -0.054 2.102 -13.812 1.00 14.11 O ATOM 944 CB VAL A 80 -1.565 4.760 -14.197 1.00 31.20 C ATOM 945 CG1 VAL A 80 -1.978 4.582 -15.653 1.00 44.04 C ATOM 946 CG2 VAL A 80 -2.205 6.015 -13.620 1.00 63.01 C ATOM 0 H VAL A 80 -0.648 4.017 -11.785 1.00 73.53 H new ATOM 0 HA VAL A 80 -3.021 3.386 -13.404 1.00 53.21 H new ATOM 0 HB VAL A 80 -0.481 4.870 -14.163 1.00 31.20 H new ATOM 0 HG11 VAL A 80 -1.703 5.471 -16.221 1.00 44.04 H new ATOM 0 HG12 VAL A 80 -1.471 3.713 -16.071 1.00 44.04 H new ATOM 0 HG13 VAL A 80 -3.057 4.435 -15.710 1.00 44.04 H new ATOM 0 HG21 VAL A 80 -1.931 6.876 -14.229 1.00 63.01 H new ATOM 0 HG22 VAL A 80 -3.289 5.902 -13.617 1.00 63.01 H new ATOM 0 HG23 VAL A 80 -1.854 6.166 -12.599 1.00 63.01 H new ATOM 956 N HIS A 81 -2.087 1.398 -14.445 1.00 53.22 N ATOM 957 CA HIS A 81 -1.628 0.151 -15.001 1.00 22.05 C ATOM 958 C HIS A 81 -2.406 -0.091 -16.297 1.00 65.32 C ATOM 959 O HIS A 81 -3.630 -0.013 -16.305 1.00 22.33 O ATOM 960 CB HIS A 81 -1.848 -0.987 -13.976 1.00 72.34 C ATOM 961 CG HIS A 81 -1.238 -2.312 -14.347 1.00 61.41 C ATOM 962 ND1 HIS A 81 -0.004 -2.711 -13.917 1.00 3.53 N ATOM 963 CD2 HIS A 81 -1.709 -3.326 -15.082 1.00 2.15 C ATOM 964 CE1 HIS A 81 0.261 -3.909 -14.375 1.00 73.11 C ATOM 965 NE2 HIS A 81 -0.759 -4.308 -15.087 1.00 22.11 N ATOM 0 H HIS A 81 -3.095 1.537 -14.519 1.00 53.22 H new ATOM 0 HA HIS A 81 -0.561 0.182 -15.223 1.00 22.05 H new ATOM 0 HB2 HIS A 81 -1.439 -0.673 -13.016 1.00 72.34 H new ATOM 0 HB3 HIS A 81 -2.920 -1.125 -13.836 1.00 72.34 H new ATOM 0 HD1 HIS A 81 0.618 -2.158 -13.327 1.00 3.53 H new ATOM 0 HD2 HIS A 81 -2.666 -3.362 -15.581 1.00 2.15 H new ATOM 0 HE1 HIS A 81 1.166 -4.470 -14.195 1.00 73.11 H new ATOM 974 N ASP A 82 -1.672 -0.329 -17.381 1.00 52.01 N ATOM 975 CA ASP A 82 -2.213 -0.508 -18.767 1.00 33.30 C ATOM 976 C ASP A 82 -2.928 0.756 -19.219 1.00 52.54 C ATOM 977 O ASP A 82 -3.798 0.724 -20.103 1.00 53.43 O ATOM 978 CB ASP A 82 -3.209 -1.692 -18.885 1.00 74.33 C ATOM 979 CG ASP A 82 -2.628 -3.043 -18.576 1.00 72.21 C ATOM 980 OD1 ASP A 82 -1.695 -3.484 -19.280 1.00 54.33 O ATOM 981 OD2 ASP A 82 -3.092 -3.689 -17.617 1.00 43.14 O ATOM 0 H ASP A 82 -0.656 -0.409 -17.341 1.00 52.01 H new ATOM 0 HA ASP A 82 -1.352 -0.723 -19.400 1.00 33.30 H new ATOM 0 HB2 ASP A 82 -4.047 -1.511 -18.212 1.00 74.33 H new ATOM 0 HB3 ASP A 82 -3.612 -1.709 -19.898 1.00 74.33 H new ATOM 986 N GLY A 83 -2.501 1.875 -18.687 1.00 20.31 N ATOM 987 CA GLY A 83 -3.102 3.137 -19.025 1.00 32.51 C ATOM 988 C GLY A 83 -4.380 3.416 -18.243 1.00 73.43 C ATOM 989 O GLY A 83 -4.938 4.511 -18.339 1.00 41.04 O ATOM 0 H GLY A 83 -1.736 1.935 -18.015 1.00 20.31 H new ATOM 0 HA2 GLY A 83 -2.385 3.936 -18.837 1.00 32.51 H new ATOM 0 HA3 GLY A 83 -3.325 3.153 -20.092 1.00 32.51 H new ATOM 993 N GLU A 84 -4.843 2.448 -17.465 1.00 10.12 N ATOM 994 CA GLU A 84 -6.054 2.621 -16.701 1.00 14.10 C ATOM 995 C GLU A 84 -5.702 3.061 -15.310 1.00 41.33 C ATOM 996 O GLU A 84 -4.681 2.626 -14.752 1.00 13.40 O ATOM 997 CB GLU A 84 -6.858 1.311 -16.625 1.00 34.45 C ATOM 998 CG GLU A 84 -8.236 1.484 -16.000 1.00 4.44 C ATOM 999 CD GLU A 84 -9.028 0.212 -15.951 1.00 51.05 C ATOM 1000 OE1 GLU A 84 -9.479 -0.262 -17.004 1.00 54.45 O ATOM 1001 OE2 GLU A 84 -9.234 -0.333 -14.844 1.00 73.11 O ATOM 0 H GLU A 84 -4.394 1.539 -17.351 1.00 10.12 H new ATOM 0 HA GLU A 84 -6.667 3.374 -17.197 1.00 14.10 H new ATOM 0 HB2 GLU A 84 -6.971 0.904 -17.630 1.00 34.45 H new ATOM 0 HB3 GLU A 84 -6.294 0.580 -16.046 1.00 34.45 H new ATOM 0 HG2 GLU A 84 -8.122 1.872 -14.988 1.00 4.44 H new ATOM 0 HG3 GLU A 84 -8.794 2.230 -16.567 1.00 4.44 H new ATOM 1008 N ALA A 85 -6.512 3.912 -14.752 1.00 5.41 N ATOM 1009 CA ALA A 85 -6.315 4.324 -13.405 1.00 31.45 C ATOM 1010 C ALA A 85 -6.953 3.281 -12.528 1.00 4.14 C ATOM 1011 O ALA A 85 -8.177 3.085 -12.549 1.00 42.03 O ATOM 1012 CB ALA A 85 -6.932 5.695 -13.165 1.00 73.01 C ATOM 0 H ALA A 85 -7.317 4.332 -15.216 1.00 5.41 H new ATOM 0 HA ALA A 85 -5.253 4.414 -13.178 1.00 31.45 H new ATOM 0 HB1 ALA A 85 -6.770 5.991 -12.128 1.00 73.01 H new ATOM 0 HB2 ALA A 85 -6.466 6.425 -13.828 1.00 73.01 H new ATOM 0 HB3 ALA A 85 -8.002 5.653 -13.367 1.00 73.01 H new ATOM 1018 N LYS A 86 -6.149 2.613 -11.781 1.00 73.41 N ATOM 1019 CA LYS A 86 -6.598 1.548 -10.953 1.00 35.34 C ATOM 1020 C LYS A 86 -6.631 2.102 -9.561 1.00 51.35 C ATOM 1021 O LYS A 86 -5.771 2.913 -9.193 1.00 14.21 O ATOM 1022 CB LYS A 86 -5.600 0.390 -10.999 1.00 2.23 C ATOM 1023 CG LYS A 86 -4.976 0.117 -12.373 1.00 63.33 C ATOM 1024 CD LYS A 86 -5.956 -0.312 -13.469 1.00 74.23 C ATOM 1025 CE LYS A 86 -6.543 -1.674 -13.205 1.00 34.22 C ATOM 1026 NZ LYS A 86 -7.384 -2.149 -14.315 1.00 54.32 N ATOM 0 H LYS A 86 -5.146 2.792 -11.726 1.00 73.41 H new ATOM 0 HA LYS A 86 -7.570 1.177 -11.278 1.00 35.34 H new ATOM 0 HB2 LYS A 86 -4.799 0.594 -10.289 1.00 2.23 H new ATOM 0 HB3 LYS A 86 -6.103 -0.516 -10.660 1.00 2.23 H new ATOM 0 HG2 LYS A 86 -4.460 1.018 -12.704 1.00 63.33 H new ATOM 0 HG3 LYS A 86 -4.220 -0.660 -12.261 1.00 63.33 H new ATOM 0 HD2 LYS A 86 -6.760 0.420 -13.542 1.00 74.23 H new ATOM 0 HD3 LYS A 86 -5.443 -0.319 -14.431 1.00 74.23 H new ATOM 0 HE2 LYS A 86 -5.736 -2.387 -13.033 1.00 34.22 H new ATOM 0 HE3 LYS A 86 -7.137 -1.639 -12.292 1.00 34.22 H new ATOM 0 HZ1 LYS A 86 -7.597 -3.158 -14.182 1.00 54.32 H new ATOM 0 HZ2 LYS A 86 -8.272 -1.607 -14.334 1.00 54.32 H new ATOM 0 HZ3 LYS A 86 -6.879 -2.018 -15.214 1.00 54.32 H new ATOM 1040 N VAL A 87 -7.567 1.700 -8.797 1.00 22.34 N ATOM 1041 CA VAL A 87 -7.704 2.255 -7.474 1.00 32.53 C ATOM 1042 C VAL A 87 -7.474 1.161 -6.442 1.00 42.03 C ATOM 1043 O VAL A 87 -7.833 0.004 -6.672 1.00 0.44 O ATOM 1044 CB VAL A 87 -9.114 2.887 -7.278 1.00 64.31 C ATOM 1045 CG1 VAL A 87 -9.213 3.639 -5.950 1.00 22.22 C ATOM 1046 CG2 VAL A 87 -9.476 3.798 -8.444 1.00 73.41 C ATOM 0 H VAL A 87 -8.258 0.992 -9.045 1.00 22.34 H new ATOM 0 HA VAL A 87 -6.961 3.042 -7.346 1.00 32.53 H new ATOM 0 HB VAL A 87 -9.835 2.070 -7.251 1.00 64.31 H new ATOM 0 HG11 VAL A 87 -10.210 4.067 -5.847 1.00 22.22 H new ATOM 0 HG12 VAL A 87 -9.028 2.949 -5.127 1.00 22.22 H new ATOM 0 HG13 VAL A 87 -8.472 4.438 -5.928 1.00 22.22 H new ATOM 0 HG21 VAL A 87 -10.465 4.225 -8.279 1.00 73.41 H new ATOM 0 HG22 VAL A 87 -8.743 4.601 -8.520 1.00 73.41 H new ATOM 0 HG23 VAL A 87 -9.479 3.221 -9.369 1.00 73.41 H new ATOM 1056 N ALA A 88 -6.867 1.508 -5.340 1.00 62.22 N ATOM 1057 CA ALA A 88 -6.621 0.557 -4.287 1.00 22.24 C ATOM 1058 C ALA A 88 -7.516 0.862 -3.114 1.00 21.34 C ATOM 1059 O ALA A 88 -7.582 2.002 -2.663 1.00 55.04 O ATOM 1060 CB ALA A 88 -5.166 0.599 -3.858 1.00 64.51 C ATOM 0 H ALA A 88 -6.530 2.451 -5.146 1.00 62.22 H new ATOM 0 HA ALA A 88 -6.839 -0.444 -4.658 1.00 22.24 H new ATOM 0 HB1 ALA A 88 -5.000 -0.127 -3.062 1.00 64.51 H new ATOM 0 HB2 ALA A 88 -4.529 0.356 -4.708 1.00 64.51 H new ATOM 0 HB3 ALA A 88 -4.922 1.598 -3.495 1.00 64.51 H new ATOM 1066 N LYS A 89 -8.225 -0.141 -2.656 1.00 25.34 N ATOM 1067 CA LYS A 89 -9.115 0.003 -1.531 1.00 24.41 C ATOM 1068 C LYS A 89 -8.487 -0.645 -0.313 1.00 41.40 C ATOM 1069 O LYS A 89 -8.219 -1.850 -0.309 1.00 13.44 O ATOM 1070 CB LYS A 89 -10.541 -0.565 -1.821 1.00 73.00 C ATOM 1071 CG LYS A 89 -11.356 0.200 -2.899 1.00 24.32 C ATOM 1072 CD LYS A 89 -10.759 0.092 -4.297 1.00 72.04 C ATOM 1073 CE LYS A 89 -11.482 0.985 -5.299 1.00 44.13 C ATOM 1074 NZ LYS A 89 -12.898 0.635 -5.495 1.00 24.43 N ATOM 0 H LYS A 89 -8.201 -1.080 -3.053 1.00 25.34 H new ATOM 0 HA LYS A 89 -9.257 1.066 -1.337 1.00 24.41 H new ATOM 0 HB2 LYS A 89 -10.443 -1.605 -2.134 1.00 73.00 H new ATOM 0 HB3 LYS A 89 -11.110 -0.564 -0.891 1.00 73.00 H new ATOM 0 HG2 LYS A 89 -12.375 -0.187 -2.916 1.00 24.32 H new ATOM 0 HG3 LYS A 89 -11.419 1.251 -2.619 1.00 24.32 H new ATOM 0 HD2 LYS A 89 -9.705 0.366 -4.263 1.00 72.04 H new ATOM 0 HD3 LYS A 89 -10.809 -0.944 -4.633 1.00 72.04 H new ATOM 0 HE2 LYS A 89 -11.417 2.020 -4.962 1.00 44.13 H new ATOM 0 HE3 LYS A 89 -10.968 0.929 -6.258 1.00 44.13 H new ATOM 0 HZ1 LYS A 89 -13.305 1.239 -6.237 1.00 24.43 H new ATOM 0 HZ2 LYS A 89 -12.973 -0.362 -5.780 1.00 24.43 H new ATOM 0 HZ3 LYS A 89 -13.418 0.781 -4.606 1.00 24.43 H new ATOM 1088 N GLU A 90 -8.309 0.143 0.724 1.00 23.33 N ATOM 1089 CA GLU A 90 -7.554 -0.252 1.881 1.00 14.22 C ATOM 1090 C GLU A 90 -8.160 0.351 3.142 1.00 41.25 C ATOM 1091 O GLU A 90 -8.939 1.306 3.080 1.00 61.44 O ATOM 1092 CB GLU A 90 -6.120 0.283 1.744 1.00 14.22 C ATOM 1093 CG GLU A 90 -6.086 1.805 1.590 1.00 71.22 C ATOM 1094 CD GLU A 90 -4.701 2.401 1.552 1.00 23.10 C ATOM 1095 OE1 GLU A 90 -4.123 2.526 0.451 1.00 3.10 O ATOM 1096 OE2 GLU A 90 -4.191 2.793 2.624 1.00 65.53 O ATOM 0 H GLU A 90 -8.691 1.087 0.783 1.00 23.33 H new ATOM 0 HA GLU A 90 -7.565 -1.340 1.952 1.00 14.22 H new ATOM 0 HB2 GLU A 90 -5.541 -0.005 2.621 1.00 14.22 H new ATOM 0 HB3 GLU A 90 -5.642 -0.179 0.880 1.00 14.22 H new ATOM 0 HG2 GLU A 90 -6.609 2.076 0.673 1.00 71.22 H new ATOM 0 HG3 GLU A 90 -6.638 2.253 2.416 1.00 71.22 H new ATOM 1103 N ARG A 91 -7.831 -0.238 4.255 1.00 43.15 N ATOM 1104 CA ARG A 91 -8.147 0.296 5.554 1.00 32.14 C ATOM 1105 C ARG A 91 -6.914 0.133 6.425 1.00 32.14 C ATOM 1106 O ARG A 91 -6.236 -0.896 6.344 1.00 10.32 O ATOM 1107 CB ARG A 91 -9.327 -0.430 6.209 1.00 73.31 C ATOM 1108 CG ARG A 91 -9.675 0.145 7.573 1.00 43.44 C ATOM 1109 CD ARG A 91 -10.703 -0.674 8.319 1.00 4.13 C ATOM 1110 NE ARG A 91 -12.029 -0.727 7.685 1.00 74.21 N ATOM 1111 CZ ARG A 91 -13.148 -1.088 8.350 1.00 13.13 C ATOM 1112 NH1 ARG A 91 -13.067 -1.474 9.627 1.00 54.43 N ATOM 1113 NH2 ARG A 91 -14.329 -1.078 7.742 1.00 74.05 N ATOM 0 H ARG A 91 -7.324 -1.123 4.289 1.00 43.15 H new ATOM 0 HA ARG A 91 -8.434 1.342 5.446 1.00 32.14 H new ATOM 0 HB2 ARG A 91 -10.198 -0.364 5.557 1.00 73.31 H new ATOM 0 HB3 ARG A 91 -9.086 -1.488 6.314 1.00 73.31 H new ATOM 0 HG2 ARG A 91 -8.768 0.213 8.174 1.00 43.44 H new ATOM 0 HG3 ARG A 91 -10.051 1.161 7.447 1.00 43.44 H new ATOM 0 HD2 ARG A 91 -10.327 -1.691 8.428 1.00 4.13 H new ATOM 0 HD3 ARG A 91 -10.812 -0.266 9.324 1.00 4.13 H new ATOM 0 HE ARG A 91 -12.107 -0.480 6.698 1.00 74.21 H new ATOM 0 HH11 ARG A 91 -12.162 -1.495 10.097 1.00 54.43 H new ATOM 0 HH12 ARG A 91 -13.910 -1.747 10.132 1.00 54.43 H new ATOM 0 HH21 ARG A 91 -14.397 -0.796 6.764 1.00 74.05 H new ATOM 0 HH22 ARG A 91 -15.168 -1.352 8.253 1.00 74.05 H new ATOM 1127 N ILE A 92 -6.610 1.125 7.225 1.00 15.21 N ATOM 1128 CA ILE A 92 -5.463 1.062 8.106 1.00 20.34 C ATOM 1129 C ILE A 92 -5.777 0.230 9.342 1.00 23.14 C ATOM 1130 O ILE A 92 -6.707 0.547 10.101 1.00 53.42 O ATOM 1131 CB ILE A 92 -5.015 2.488 8.539 1.00 44.43 C ATOM 1132 CG1 ILE A 92 -4.621 3.333 7.315 1.00 60.02 C ATOM 1133 CG2 ILE A 92 -3.891 2.449 9.581 1.00 3.33 C ATOM 1134 CD1 ILE A 92 -3.555 2.709 6.445 1.00 4.24 C ATOM 0 H ILE A 92 -7.143 1.993 7.286 1.00 15.21 H new ATOM 0 HA ILE A 92 -4.650 0.589 7.555 1.00 20.34 H new ATOM 0 HB ILE A 92 -5.869 2.966 9.019 1.00 44.43 H new ATOM 0 HG12 ILE A 92 -5.510 3.510 6.709 1.00 60.02 H new ATOM 0 HG13 ILE A 92 -4.270 4.306 7.658 1.00 60.02 H new ATOM 0 HG21 ILE A 92 -3.611 3.467 9.853 1.00 3.33 H new ATOM 0 HG22 ILE A 92 -4.236 1.918 10.468 1.00 3.33 H new ATOM 0 HG23 ILE A 92 -3.026 1.934 9.164 1.00 3.33 H new ATOM 0 HD11 ILE A 92 -3.337 3.370 5.606 1.00 4.24 H new ATOM 0 HD12 ILE A 92 -2.649 2.557 7.032 1.00 4.24 H new ATOM 0 HD13 ILE A 92 -3.908 1.749 6.069 1.00 4.24 H new ATOM 1146 N GLU A 93 -4.989 -0.804 9.552 1.00 71.30 N ATOM 1147 CA GLU A 93 -5.139 -1.673 10.708 1.00 51.15 C ATOM 1148 C GLU A 93 -4.137 -1.293 11.792 1.00 52.02 C ATOM 1149 O GLU A 93 -4.408 -1.435 12.981 1.00 11.14 O ATOM 1150 CB GLU A 93 -4.946 -3.133 10.304 1.00 70.45 C ATOM 1151 CG GLU A 93 -5.968 -3.650 9.303 1.00 31.40 C ATOM 1152 CD GLU A 93 -7.376 -3.732 9.856 1.00 54.10 C ATOM 1153 OE1 GLU A 93 -8.086 -2.717 9.861 1.00 31.23 O ATOM 1154 OE2 GLU A 93 -7.796 -4.833 10.286 1.00 23.52 O ATOM 0 H GLU A 93 -4.226 -1.068 8.929 1.00 71.30 H new ATOM 0 HA GLU A 93 -6.147 -1.549 11.104 1.00 51.15 H new ATOM 0 HB2 GLU A 93 -3.949 -3.251 9.880 1.00 70.45 H new ATOM 0 HB3 GLU A 93 -4.987 -3.753 11.199 1.00 70.45 H new ATOM 0 HG2 GLU A 93 -5.968 -2.999 8.429 1.00 31.40 H new ATOM 0 HG3 GLU A 93 -5.662 -4.640 8.964 1.00 31.40 H new ATOM 1161 N ALA A 94 -2.987 -0.802 11.367 1.00 3.21 N ATOM 1162 CA ALA A 94 -1.923 -0.375 12.266 1.00 14.42 C ATOM 1163 C ALA A 94 -1.005 0.546 11.504 1.00 0.11 C ATOM 1164 O ALA A 94 -0.765 0.319 10.315 1.00 35.13 O ATOM 1165 CB ALA A 94 -1.139 -1.581 12.780 1.00 3.04 C ATOM 0 H ALA A 94 -2.760 -0.686 10.379 1.00 3.21 H new ATOM 0 HA ALA A 94 -2.352 0.141 13.125 1.00 14.42 H new ATOM 0 HB1 ALA A 94 -0.349 -1.242 13.450 1.00 3.04 H new ATOM 0 HB2 ALA A 94 -1.811 -2.249 13.320 1.00 3.04 H new ATOM 0 HB3 ALA A 94 -0.697 -2.114 11.938 1.00 3.04 H new ATOM 1171 N VAL A 95 -0.515 1.586 12.145 1.00 4.52 N ATOM 1172 CA VAL A 95 0.356 2.526 11.472 1.00 65.40 C ATOM 1173 C VAL A 95 1.430 3.109 12.413 1.00 63.15 C ATOM 1174 O VAL A 95 1.122 3.674 13.476 1.00 74.15 O ATOM 1175 CB VAL A 95 -0.450 3.666 10.756 1.00 42.15 C ATOM 1176 CG1 VAL A 95 -1.312 4.467 11.731 1.00 75.44 C ATOM 1177 CG2 VAL A 95 0.478 4.582 9.968 1.00 64.02 C ATOM 0 H VAL A 95 -0.703 1.801 13.124 1.00 4.52 H new ATOM 0 HA VAL A 95 0.878 1.959 10.701 1.00 65.40 H new ATOM 0 HB VAL A 95 -1.129 3.181 10.055 1.00 42.15 H new ATOM 0 HG11 VAL A 95 -1.850 5.244 11.188 1.00 75.44 H new ATOM 0 HG12 VAL A 95 -2.027 3.802 12.216 1.00 75.44 H new ATOM 0 HG13 VAL A 95 -0.675 4.927 12.486 1.00 75.44 H new ATOM 0 HG21 VAL A 95 -0.108 5.363 9.482 1.00 64.02 H new ATOM 0 HG22 VAL A 95 1.200 5.038 10.645 1.00 64.02 H new ATOM 0 HG23 VAL A 95 1.006 4.001 9.212 1.00 64.02 H new ATOM 1187 N GLU A 96 2.671 2.947 12.018 1.00 64.11 N ATOM 1188 CA GLU A 96 3.808 3.489 12.724 1.00 63.31 C ATOM 1189 C GLU A 96 4.474 4.525 11.840 1.00 11.32 C ATOM 1190 O GLU A 96 5.141 4.164 10.862 1.00 75.01 O ATOM 1191 CB GLU A 96 4.853 2.405 12.978 1.00 14.44 C ATOM 1192 CG GLU A 96 4.416 1.249 13.846 1.00 4.35 C ATOM 1193 CD GLU A 96 4.138 1.672 15.259 1.00 62.03 C ATOM 1194 OE1 GLU A 96 5.102 1.810 16.045 1.00 64.03 O ATOM 1195 OE2 GLU A 96 2.965 1.878 15.615 1.00 12.44 O ATOM 0 H GLU A 96 2.924 2.424 11.180 1.00 64.11 H new ATOM 0 HA GLU A 96 3.458 3.908 13.667 1.00 63.31 H new ATOM 0 HB2 GLU A 96 5.176 2.008 12.016 1.00 14.44 H new ATOM 0 HB3 GLU A 96 5.724 2.870 13.440 1.00 14.44 H new ATOM 0 HG2 GLU A 96 3.520 0.797 13.421 1.00 4.35 H new ATOM 0 HG3 GLU A 96 5.191 0.483 13.844 1.00 4.35 H new ATOM 1202 N PRO A 97 4.320 5.806 12.149 1.00 53.55 N ATOM 1203 CA PRO A 97 4.962 6.871 11.387 1.00 54.05 C ATOM 1204 C PRO A 97 6.468 6.855 11.609 1.00 63.04 C ATOM 1205 O PRO A 97 7.241 7.073 10.695 1.00 54.13 O ATOM 1206 CB PRO A 97 4.352 8.158 11.970 1.00 5.31 C ATOM 1207 CG PRO A 97 3.157 7.705 12.741 1.00 65.05 C ATOM 1208 CD PRO A 97 3.484 6.333 13.230 1.00 65.30 C ATOM 0 HA PRO A 97 4.805 6.773 10.313 1.00 54.05 H new ATOM 0 HB2 PRO A 97 5.064 8.676 12.613 1.00 5.31 H new ATOM 0 HB3 PRO A 97 4.071 8.855 11.180 1.00 5.31 H new ATOM 0 HG2 PRO A 97 2.951 8.378 13.573 1.00 65.05 H new ATOM 0 HG3 PRO A 97 2.267 7.694 12.112 1.00 65.05 H new ATOM 0 HD2 PRO A 97 4.016 6.357 14.181 1.00 65.30 H new ATOM 0 HD3 PRO A 97 2.588 5.731 13.381 1.00 65.30 H new ATOM 1216 N ASP A 98 6.861 6.549 12.833 1.00 32.52 N ATOM 1217 CA ASP A 98 8.269 6.532 13.222 1.00 23.44 C ATOM 1218 C ASP A 98 8.985 5.261 12.776 1.00 43.11 C ATOM 1219 O ASP A 98 10.145 5.301 12.399 1.00 52.33 O ATOM 1220 CB ASP A 98 8.411 6.758 14.734 1.00 71.03 C ATOM 1221 CG ASP A 98 9.839 6.616 15.250 1.00 74.24 C ATOM 1222 OD1 ASP A 98 10.624 7.592 15.156 1.00 74.04 O ATOM 1223 OD2 ASP A 98 10.174 5.527 15.791 1.00 74.30 O ATOM 0 H ASP A 98 6.219 6.305 13.587 1.00 32.52 H new ATOM 0 HA ASP A 98 8.760 7.355 12.702 1.00 23.44 H new ATOM 0 HB2 ASP A 98 8.045 7.755 14.978 1.00 71.03 H new ATOM 0 HB3 ASP A 98 7.773 6.047 15.259 1.00 71.03 H new ATOM 1228 N LYS A 99 8.285 4.140 12.787 1.00 35.01 N ATOM 1229 CA LYS A 99 8.911 2.874 12.409 1.00 32.03 C ATOM 1230 C LYS A 99 8.759 2.557 10.930 1.00 3.42 C ATOM 1231 O LYS A 99 9.266 1.525 10.462 1.00 62.34 O ATOM 1232 CB LYS A 99 8.352 1.719 13.204 1.00 51.20 C ATOM 1233 CG LYS A 99 8.549 1.830 14.687 1.00 35.23 C ATOM 1234 CD LYS A 99 8.150 0.541 15.336 1.00 41.51 C ATOM 1235 CE LYS A 99 8.308 0.584 16.839 1.00 3.53 C ATOM 1236 NZ LYS A 99 7.435 1.595 17.459 1.00 44.25 N ATOM 0 H LYS A 99 7.301 4.074 13.047 1.00 35.01 H new ATOM 0 HA LYS A 99 9.971 3.001 12.630 1.00 32.03 H new ATOM 0 HB2 LYS A 99 7.285 1.635 12.997 1.00 51.20 H new ATOM 0 HB3 LYS A 99 8.817 0.797 12.857 1.00 51.20 H new ATOM 0 HG2 LYS A 99 9.591 2.056 14.911 1.00 35.23 H new ATOM 0 HG3 LYS A 99 7.952 2.651 15.085 1.00 35.23 H new ATOM 0 HD2 LYS A 99 7.112 0.318 15.088 1.00 41.51 H new ATOM 0 HD3 LYS A 99 8.756 -0.270 14.932 1.00 41.51 H new ATOM 0 HE2 LYS A 99 8.079 -0.397 17.255 1.00 3.53 H new ATOM 0 HE3 LYS A 99 9.347 0.801 17.088 1.00 3.53 H new ATOM 0 HZ1 LYS A 99 7.243 1.330 18.446 1.00 44.25 H new ATOM 0 HZ2 LYS A 99 7.906 2.522 17.435 1.00 44.25 H new ATOM 0 HZ3 LYS A 99 6.538 1.648 16.935 1.00 44.25 H new ATOM 1250 N ASN A 100 8.062 3.431 10.191 1.00 34.30 N ATOM 1251 CA ASN A 100 7.775 3.206 8.741 1.00 2.15 C ATOM 1252 C ASN A 100 7.012 1.905 8.534 1.00 73.22 C ATOM 1253 O ASN A 100 7.215 1.217 7.537 1.00 32.51 O ATOM 1254 CB ASN A 100 9.063 3.157 7.882 1.00 3.51 C ATOM 1255 CG ASN A 100 9.827 4.448 7.835 1.00 2.33 C ATOM 1256 OD1 ASN A 100 9.262 5.520 7.969 1.00 61.43 O ATOM 1257 ND2 ASN A 100 11.110 4.353 7.612 1.00 44.34 N ATOM 0 H ASN A 100 7.681 4.303 10.559 1.00 34.30 H new ATOM 0 HA ASN A 100 7.172 4.055 8.419 1.00 2.15 H new ATOM 0 HB2 ASN A 100 9.716 2.377 8.273 1.00 3.51 H new ATOM 0 HB3 ASN A 100 8.796 2.870 6.865 1.00 3.51 H new ATOM 0 HD21 ASN A 100 11.680 5.196 7.544 1.00 44.34 H new ATOM 0 HD22 ASN A 100 11.543 3.435 7.506 1.00 44.34 H new ATOM 1264 N LEU A 101 6.096 1.608 9.426 1.00 2.01 N ATOM 1265 CA LEU A 101 5.348 0.366 9.370 1.00 31.15 C ATOM 1266 C LEU A 101 3.898 0.685 9.192 1.00 33.54 C ATOM 1267 O LEU A 101 3.371 1.562 9.864 1.00 52.21 O ATOM 1268 CB LEU A 101 5.501 -0.414 10.682 1.00 21.44 C ATOM 1269 CG LEU A 101 4.693 -1.707 10.773 1.00 3.35 C ATOM 1270 CD1 LEU A 101 5.237 -2.761 9.856 1.00 61.44 C ATOM 1271 CD2 LEU A 101 4.581 -2.201 12.192 1.00 62.05 C ATOM 0 H LEU A 101 5.847 2.214 10.208 1.00 2.01 H new ATOM 0 HA LEU A 101 5.727 -0.233 8.542 1.00 31.15 H new ATOM 0 HB2 LEU A 101 6.555 -0.654 10.822 1.00 21.44 H new ATOM 0 HB3 LEU A 101 5.210 0.236 11.507 1.00 21.44 H new ATOM 0 HG LEU A 101 3.681 -1.479 10.438 1.00 3.35 H new ATOM 0 HD11 LEU A 101 4.638 -3.667 9.947 1.00 61.44 H new ATOM 0 HD12 LEU A 101 5.199 -2.403 8.827 1.00 61.44 H new ATOM 0 HD13 LEU A 101 6.270 -2.980 10.126 1.00 61.44 H new ATOM 0 HD21 LEU A 101 3.999 -3.122 12.212 1.00 62.05 H new ATOM 0 HD22 LEU A 101 5.577 -2.393 12.590 1.00 62.05 H new ATOM 0 HD23 LEU A 101 4.086 -1.446 12.802 1.00 62.05 H new ATOM 1283 N ILE A 102 3.251 0.000 8.300 1.00 12.14 N ATOM 1284 CA ILE A 102 1.864 0.241 8.074 1.00 52.11 C ATOM 1285 C ILE A 102 1.141 -1.022 7.582 1.00 53.32 C ATOM 1286 O ILE A 102 1.553 -1.667 6.606 1.00 71.04 O ATOM 1287 CB ILE A 102 1.665 1.465 7.135 1.00 63.33 C ATOM 1288 CG1 ILE A 102 0.188 1.767 6.877 1.00 43.32 C ATOM 1289 CG2 ILE A 102 2.441 1.299 5.835 1.00 41.12 C ATOM 1290 CD1 ILE A 102 -0.027 3.027 6.062 1.00 74.24 C ATOM 0 H ILE A 102 3.663 -0.729 7.718 1.00 12.14 H new ATOM 0 HA ILE A 102 1.398 0.495 9.026 1.00 52.11 H new ATOM 0 HB ILE A 102 2.073 2.332 7.655 1.00 63.33 H new ATOM 0 HG12 ILE A 102 -0.264 0.923 6.356 1.00 43.32 H new ATOM 0 HG13 ILE A 102 -0.329 1.866 7.832 1.00 43.32 H new ATOM 0 HG21 ILE A 102 2.280 2.171 5.201 1.00 41.12 H new ATOM 0 HG22 ILE A 102 3.504 1.202 6.056 1.00 41.12 H new ATOM 0 HG23 ILE A 102 2.095 0.405 5.316 1.00 41.12 H new ATOM 0 HD11 ILE A 102 -1.095 3.186 5.913 1.00 74.24 H new ATOM 0 HD12 ILE A 102 0.397 3.880 6.592 1.00 74.24 H new ATOM 0 HD13 ILE A 102 0.463 2.922 5.094 1.00 74.24 H new ATOM 1302 N THR A 103 0.114 -1.390 8.299 1.00 51.23 N ATOM 1303 CA THR A 103 -0.710 -2.540 7.976 1.00 10.00 C ATOM 1304 C THR A 103 -2.007 -2.113 7.241 1.00 71.21 C ATOM 1305 O THR A 103 -2.826 -1.351 7.786 1.00 63.41 O ATOM 1306 CB THR A 103 -1.089 -3.298 9.270 1.00 4.34 C ATOM 1307 OG1 THR A 103 0.108 -3.676 9.970 1.00 50.23 O ATOM 1308 CG2 THR A 103 -1.888 -4.548 8.956 1.00 42.52 C ATOM 0 H THR A 103 -0.185 -0.896 9.140 1.00 51.23 H new ATOM 0 HA THR A 103 -0.133 -3.190 7.318 1.00 10.00 H new ATOM 0 HB THR A 103 -1.699 -2.637 9.886 1.00 4.34 H new ATOM 0 HG1 THR A 103 -0.131 -4.155 10.791 1.00 50.23 H new ATOM 0 HG21 THR A 103 -2.141 -5.061 9.884 1.00 42.52 H new ATOM 0 HG22 THR A 103 -2.804 -4.273 8.433 1.00 42.52 H new ATOM 0 HG23 THR A 103 -1.295 -5.210 8.325 1.00 42.52 H new ATOM 1316 N PHE A 104 -2.174 -2.623 6.025 1.00 10.04 N ATOM 1317 CA PHE A 104 -3.330 -2.354 5.180 1.00 60.52 C ATOM 1318 C PHE A 104 -4.244 -3.579 5.158 1.00 12.01 C ATOM 1319 O PHE A 104 -3.769 -4.719 5.213 1.00 52.21 O ATOM 1320 CB PHE A 104 -2.885 -2.104 3.725 1.00 61.33 C ATOM 1321 CG PHE A 104 -1.920 -0.991 3.508 1.00 30.20 C ATOM 1322 CD1 PHE A 104 -2.345 0.315 3.473 1.00 4.41 C ATOM 1323 CD2 PHE A 104 -0.580 -1.262 3.312 1.00 20.42 C ATOM 1324 CE1 PHE A 104 -1.451 1.339 3.250 1.00 73.45 C ATOM 1325 CE2 PHE A 104 0.314 -0.247 3.085 1.00 62.40 C ATOM 1326 CZ PHE A 104 -0.118 1.056 3.055 1.00 54.12 C ATOM 0 H PHE A 104 -1.495 -3.248 5.591 1.00 10.04 H new ATOM 0 HA PHE A 104 -3.843 -1.480 5.581 1.00 60.52 H new ATOM 0 HB2 PHE A 104 -2.439 -3.022 3.342 1.00 61.33 H new ATOM 0 HB3 PHE A 104 -3.774 -1.907 3.125 1.00 61.33 H new ATOM 0 HD1 PHE A 104 -3.391 0.541 3.622 1.00 4.41 H new ATOM 0 HD2 PHE A 104 -0.232 -2.284 3.338 1.00 20.42 H new ATOM 0 HE1 PHE A 104 -1.795 2.362 3.228 1.00 73.45 H new ATOM 0 HE2 PHE A 104 1.359 -0.473 2.930 1.00 62.40 H new ATOM 0 HZ PHE A 104 0.586 1.856 2.879 1.00 54.12 H new ATOM 1336 N ARG A 105 -5.519 -3.341 5.085 1.00 70.44 N ATOM 1337 CA ARG A 105 -6.525 -4.384 4.937 1.00 61.53 C ATOM 1338 C ARG A 105 -7.335 -4.097 3.683 1.00 74.04 C ATOM 1339 O ARG A 105 -7.687 -2.944 3.446 1.00 24.24 O ATOM 1340 CB ARG A 105 -7.481 -4.348 6.134 1.00 43.12 C ATOM 1341 CG ARG A 105 -8.656 -5.300 6.009 1.00 62.24 C ATOM 1342 CD ARG A 105 -9.689 -5.056 7.084 1.00 41.50 C ATOM 1343 NE ARG A 105 -10.880 -5.892 6.879 1.00 25.15 N ATOM 1344 CZ ARG A 105 -12.104 -5.612 7.347 1.00 11.10 C ATOM 1345 NH1 ARG A 105 -12.288 -4.606 8.189 1.00 53.25 N ATOM 1346 NH2 ARG A 105 -13.133 -6.370 7.001 1.00 14.02 N ATOM 0 H ARG A 105 -5.911 -2.400 5.126 1.00 70.44 H new ATOM 0 HA ARG A 105 -6.037 -5.357 4.876 1.00 61.53 H new ATOM 0 HB2 ARG A 105 -6.924 -4.590 7.039 1.00 43.12 H new ATOM 0 HB3 ARG A 105 -7.859 -3.333 6.254 1.00 43.12 H new ATOM 0 HG2 ARG A 105 -9.117 -5.183 5.028 1.00 62.24 H new ATOM 0 HG3 ARG A 105 -8.300 -6.328 6.073 1.00 62.24 H new ATOM 0 HD2 ARG A 105 -9.257 -5.269 8.062 1.00 41.50 H new ATOM 0 HD3 ARG A 105 -9.976 -4.004 7.084 1.00 41.50 H new ATOM 0 HE ARG A 105 -10.766 -6.750 6.340 1.00 25.15 H new ATOM 0 HH11 ARG A 105 -11.495 -4.038 8.486 1.00 53.25 H new ATOM 0 HH12 ARG A 105 -13.223 -4.400 8.540 1.00 53.25 H new ATOM 0 HH21 ARG A 105 -12.994 -7.166 6.379 1.00 14.02 H new ATOM 0 HH22 ARG A 105 -14.065 -6.158 7.357 1.00 14.02 H new ATOM 1360 N VAL A 106 -7.637 -5.111 2.883 1.00 55.30 N ATOM 1361 CA VAL A 106 -8.500 -4.873 1.731 1.00 33.20 C ATOM 1362 C VAL A 106 -9.949 -4.904 2.224 1.00 3.34 C ATOM 1363 O VAL A 106 -10.297 -5.727 3.088 1.00 40.33 O ATOM 1364 CB VAL A 106 -8.303 -5.907 0.568 1.00 70.52 C ATOM 1365 CG1 VAL A 106 -8.799 -7.292 0.947 1.00 34.14 C ATOM 1366 CG2 VAL A 106 -8.969 -5.402 -0.707 1.00 75.44 C ATOM 0 H VAL A 106 -7.313 -6.071 3.001 1.00 55.30 H new ATOM 0 HA VAL A 106 -8.236 -3.905 1.306 1.00 33.20 H new ATOM 0 HB VAL A 106 -7.233 -6.002 0.382 1.00 70.52 H new ATOM 0 HG11 VAL A 106 -8.643 -7.975 0.112 1.00 34.14 H new ATOM 0 HG12 VAL A 106 -8.249 -7.650 1.817 1.00 34.14 H new ATOM 0 HG13 VAL A 106 -9.862 -7.246 1.184 1.00 34.14 H new ATOM 0 HG21 VAL A 106 -8.824 -6.129 -1.506 1.00 75.44 H new ATOM 0 HG22 VAL A 106 -10.036 -5.264 -0.530 1.00 75.44 H new ATOM 0 HG23 VAL A 106 -8.524 -4.451 -0.998 1.00 75.44 H new ATOM 1376 N ILE A 107 -10.785 -4.009 1.738 1.00 53.43 N ATOM 1377 CA ILE A 107 -12.148 -3.964 2.264 1.00 14.35 C ATOM 1378 C ILE A 107 -13.236 -4.061 1.189 1.00 4.52 C ATOM 1379 O ILE A 107 -14.365 -4.441 1.497 1.00 41.40 O ATOM 1380 CB ILE A 107 -12.445 -2.684 3.137 1.00 42.35 C ATOM 1381 CG1 ILE A 107 -12.554 -1.388 2.290 1.00 60.42 C ATOM 1382 CG2 ILE A 107 -11.380 -2.497 4.207 1.00 4.15 C ATOM 1383 CD1 ILE A 107 -11.277 -0.916 1.665 1.00 4.42 C ATOM 0 H ILE A 107 -10.566 -3.327 1.011 1.00 53.43 H new ATOM 0 HA ILE A 107 -12.191 -4.853 2.893 1.00 14.35 H new ATOM 0 HB ILE A 107 -13.414 -2.858 3.606 1.00 42.35 H new ATOM 0 HG12 ILE A 107 -13.286 -1.552 1.499 1.00 60.42 H new ATOM 0 HG13 ILE A 107 -12.943 -0.592 2.925 1.00 60.42 H new ATOM 0 HG21 ILE A 107 -11.607 -1.608 4.795 1.00 4.15 H new ATOM 0 HG22 ILE A 107 -11.363 -3.370 4.860 1.00 4.15 H new ATOM 0 HG23 ILE A 107 -10.405 -2.379 3.734 1.00 4.15 H new ATOM 0 HD11 ILE A 107 -11.465 -0.005 1.097 1.00 4.42 H new ATOM 0 HD12 ILE A 107 -10.544 -0.712 2.445 1.00 4.42 H new ATOM 0 HD13 ILE A 107 -10.892 -1.687 0.998 1.00 4.42 H new ATOM 1395 N GLU A 108 -12.920 -3.711 -0.051 1.00 31.01 N ATOM 1396 CA GLU A 108 -13.974 -3.640 -1.057 1.00 23.15 C ATOM 1397 C GLU A 108 -14.298 -4.962 -1.782 1.00 11.13 C ATOM 1398 O GLU A 108 -15.092 -5.754 -1.281 1.00 73.02 O ATOM 1399 CB GLU A 108 -13.778 -2.497 -2.039 1.00 3.31 C ATOM 1400 CG GLU A 108 -14.984 -2.272 -2.937 1.00 72.30 C ATOM 1401 CD GLU A 108 -14.747 -1.216 -3.956 1.00 35.34 C ATOM 1402 OE1 GLU A 108 -14.645 -0.042 -3.591 1.00 55.14 O ATOM 1403 OE2 GLU A 108 -14.610 -1.552 -5.156 1.00 31.22 O ATOM 0 H GLU A 108 -11.982 -3.480 -0.377 1.00 31.01 H new ATOM 0 HA GLU A 108 -14.864 -3.427 -0.465 1.00 23.15 H new ATOM 0 HB2 GLU A 108 -13.568 -1.582 -1.486 1.00 3.31 H new ATOM 0 HB3 GLU A 108 -12.905 -2.703 -2.658 1.00 3.31 H new ATOM 0 HG2 GLU A 108 -15.238 -3.206 -3.439 1.00 72.30 H new ATOM 0 HG3 GLU A 108 -15.842 -1.995 -2.325 1.00 72.30 H new ATOM 1410 N GLY A 109 -13.674 -5.232 -2.936 1.00 4.45 N ATOM 1411 CA GLY A 109 -14.155 -6.363 -3.699 1.00 20.24 C ATOM 1412 C GLY A 109 -13.137 -7.202 -4.432 1.00 14.01 C ATOM 1413 O GLY A 109 -13.112 -8.392 -4.234 1.00 33.41 O ATOM 0 H GLY A 109 -12.889 -4.716 -3.332 1.00 4.45 H new ATOM 0 HA2 GLY A 109 -14.701 -7.017 -3.020 1.00 20.24 H new ATOM 0 HA3 GLY A 109 -14.873 -5.992 -4.431 1.00 20.24 H new ATOM 1417 N ASP A 110 -12.291 -6.591 -5.268 1.00 53.13 N ATOM 1418 CA ASP A 110 -11.382 -7.366 -6.180 1.00 71.14 C ATOM 1419 C ASP A 110 -10.600 -8.479 -5.481 1.00 14.40 C ATOM 1420 O ASP A 110 -10.630 -9.627 -5.916 1.00 60.54 O ATOM 1421 CB ASP A 110 -10.400 -6.437 -6.904 1.00 72.34 C ATOM 1422 CG ASP A 110 -9.460 -7.191 -7.838 1.00 0.13 C ATOM 1423 OD1 ASP A 110 -9.858 -7.483 -8.992 1.00 72.20 O ATOM 1424 OD2 ASP A 110 -8.324 -7.506 -7.437 1.00 41.02 O ATOM 0 H ASP A 110 -12.202 -5.578 -5.347 1.00 53.13 H new ATOM 0 HA ASP A 110 -12.047 -7.845 -6.899 1.00 71.14 H new ATOM 0 HB2 ASP A 110 -10.960 -5.698 -7.477 1.00 72.34 H new ATOM 0 HB3 ASP A 110 -9.812 -5.890 -6.167 1.00 72.34 H new ATOM 1429 N LEU A 111 -9.943 -8.154 -4.398 1.00 74.22 N ATOM 1430 CA LEU A 111 -9.192 -9.156 -3.647 1.00 22.23 C ATOM 1431 C LEU A 111 -10.113 -10.045 -2.806 1.00 40.14 C ATOM 1432 O LEU A 111 -9.789 -11.176 -2.501 1.00 50.21 O ATOM 1433 CB LEU A 111 -8.097 -8.506 -2.815 1.00 15.25 C ATOM 1434 CG LEU A 111 -7.058 -7.700 -3.622 1.00 11.13 C ATOM 1435 CD1 LEU A 111 -6.060 -7.029 -2.705 1.00 54.22 C ATOM 1436 CD2 LEU A 111 -6.334 -8.597 -4.625 1.00 1.33 C ATOM 0 H LEU A 111 -9.906 -7.212 -4.009 1.00 74.22 H new ATOM 0 HA LEU A 111 -8.703 -9.814 -4.365 1.00 22.23 H new ATOM 0 HB2 LEU A 111 -8.561 -7.843 -2.085 1.00 15.25 H new ATOM 0 HB3 LEU A 111 -7.577 -9.283 -2.255 1.00 15.25 H new ATOM 0 HG LEU A 111 -7.593 -6.926 -4.172 1.00 11.13 H new ATOM 0 HD11 LEU A 111 -5.339 -6.468 -3.300 1.00 54.22 H new ATOM 0 HD12 LEU A 111 -6.583 -6.349 -2.033 1.00 54.22 H new ATOM 0 HD13 LEU A 111 -5.537 -7.786 -2.120 1.00 54.22 H new ATOM 0 HD21 LEU A 111 -5.607 -8.007 -5.182 1.00 1.33 H new ATOM 0 HD22 LEU A 111 -5.820 -9.397 -4.093 1.00 1.33 H new ATOM 0 HD23 LEU A 111 -7.058 -9.028 -5.317 1.00 1.33 H new ATOM 1448 N MET A 112 -11.282 -9.519 -2.471 1.00 24.44 N ATOM 1449 CA MET A 112 -12.270 -10.229 -1.639 1.00 21.50 C ATOM 1450 C MET A 112 -12.946 -11.343 -2.441 1.00 64.32 C ATOM 1451 O MET A 112 -13.578 -12.230 -1.881 1.00 52.45 O ATOM 1452 CB MET A 112 -13.346 -9.258 -1.131 1.00 53.21 C ATOM 1453 CG MET A 112 -12.881 -8.115 -0.206 1.00 60.15 C ATOM 1454 SD MET A 112 -12.654 -8.549 1.559 1.00 34.52 S ATOM 1455 CE MET A 112 -11.354 -9.778 1.543 1.00 14.14 C ATOM 0 H MET A 112 -11.582 -8.589 -2.763 1.00 24.44 H new ATOM 0 HA MET A 112 -11.741 -10.661 -0.790 1.00 21.50 H new ATOM 0 HB2 MET A 112 -13.837 -8.814 -1.997 1.00 53.21 H new ATOM 0 HB3 MET A 112 -14.101 -9.838 -0.599 1.00 53.21 H new ATOM 0 HG2 MET A 112 -11.937 -7.727 -0.588 1.00 60.15 H new ATOM 0 HG3 MET A 112 -13.608 -7.305 -0.270 1.00 60.15 H new ATOM 0 HE1 MET A 112 -10.743 -9.673 2.440 1.00 14.14 H new ATOM 0 HE2 MET A 112 -11.795 -10.774 1.519 1.00 14.14 H new ATOM 0 HE3 MET A 112 -10.730 -9.636 0.660 1.00 14.14 H new ATOM 1465 N LYS A 113 -12.831 -11.261 -3.754 1.00 64.44 N ATOM 1466 CA LYS A 113 -13.390 -12.260 -4.647 1.00 71.11 C ATOM 1467 C LYS A 113 -12.572 -13.524 -4.595 1.00 2.35 C ATOM 1468 O LYS A 113 -13.080 -14.621 -4.801 1.00 61.41 O ATOM 1469 CB LYS A 113 -13.403 -11.734 -6.066 1.00 51.45 C ATOM 1470 CG LYS A 113 -14.225 -10.487 -6.231 1.00 73.54 C ATOM 1471 CD LYS A 113 -14.237 -10.056 -7.655 1.00 64.42 C ATOM 1472 CE LYS A 113 -15.026 -8.772 -7.840 1.00 33.22 C ATOM 1473 NZ LYS A 113 -15.055 -8.329 -9.247 1.00 32.21 N ATOM 0 H LYS A 113 -12.348 -10.500 -4.231 1.00 64.44 H new ATOM 0 HA LYS A 113 -14.409 -12.478 -4.328 1.00 71.11 H new ATOM 0 HB2 LYS A 113 -12.379 -11.530 -6.380 1.00 51.45 H new ATOM 0 HB3 LYS A 113 -13.791 -12.507 -6.729 1.00 51.45 H new ATOM 0 HG2 LYS A 113 -15.245 -10.669 -5.891 1.00 73.54 H new ATOM 0 HG3 LYS A 113 -13.818 -9.691 -5.607 1.00 73.54 H new ATOM 0 HD2 LYS A 113 -13.214 -9.909 -8.000 1.00 64.42 H new ATOM 0 HD3 LYS A 113 -14.671 -10.843 -8.271 1.00 64.42 H new ATOM 0 HE2 LYS A 113 -16.047 -8.922 -7.488 1.00 33.22 H new ATOM 0 HE3 LYS A 113 -14.588 -7.987 -7.223 1.00 33.22 H new ATOM 0 HZ1 LYS A 113 -15.605 -7.449 -9.323 1.00 32.21 H new ATOM 0 HZ2 LYS A 113 -14.084 -8.160 -9.578 1.00 32.21 H new ATOM 0 HZ3 LYS A 113 -15.497 -9.065 -9.834 1.00 32.21 H new ATOM 1487 N GLU A 114 -11.309 -13.355 -4.302 1.00 30.35 N ATOM 1488 CA GLU A 114 -10.375 -14.454 -4.262 1.00 60.33 C ATOM 1489 C GLU A 114 -10.093 -14.892 -2.840 1.00 51.04 C ATOM 1490 O GLU A 114 -10.090 -16.096 -2.517 1.00 52.33 O ATOM 1491 CB GLU A 114 -9.076 -14.054 -4.955 1.00 10.44 C ATOM 1492 CG GLU A 114 -9.211 -13.853 -6.451 1.00 73.35 C ATOM 1493 CD GLU A 114 -7.910 -13.477 -7.105 1.00 32.32 C ATOM 1494 OE1 GLU A 114 -6.881 -14.070 -6.763 1.00 4.03 O ATOM 1495 OE2 GLU A 114 -7.908 -12.568 -7.977 1.00 25.42 O ATOM 0 H GLU A 114 -10.896 -12.448 -4.083 1.00 30.35 H new ATOM 0 HA GLU A 114 -10.823 -15.298 -4.787 1.00 60.33 H new ATOM 0 HB2 GLU A 114 -8.706 -13.132 -4.507 1.00 10.44 H new ATOM 0 HB3 GLU A 114 -8.325 -14.822 -4.768 1.00 10.44 H new ATOM 0 HG2 GLU A 114 -9.589 -14.769 -6.904 1.00 73.35 H new ATOM 0 HG3 GLU A 114 -9.949 -13.074 -6.644 1.00 73.35 H new ATOM 1502 N TYR A 115 -9.867 -13.936 -1.989 1.00 73.44 N ATOM 1503 CA TYR A 115 -9.523 -14.219 -0.635 1.00 72.42 C ATOM 1504 C TYR A 115 -10.623 -13.687 0.240 1.00 41.40 C ATOM 1505 O TYR A 115 -11.227 -12.676 -0.075 1.00 1.21 O ATOM 1506 CB TYR A 115 -8.214 -13.510 -0.278 1.00 20.40 C ATOM 1507 CG TYR A 115 -7.169 -13.590 -1.368 1.00 70.43 C ATOM 1508 CD1 TYR A 115 -6.404 -14.733 -1.587 1.00 54.05 C ATOM 1509 CD2 TYR A 115 -6.969 -12.506 -2.198 1.00 23.21 C ATOM 1510 CE1 TYR A 115 -5.473 -14.770 -2.601 1.00 51.02 C ATOM 1511 CE2 TYR A 115 -6.051 -12.539 -3.203 1.00 61.05 C ATOM 1512 CZ TYR A 115 -5.305 -13.667 -3.401 1.00 54.11 C ATOM 1513 OH TYR A 115 -4.393 -13.690 -4.405 1.00 34.03 O ATOM 0 H TYR A 115 -9.917 -12.943 -2.216 1.00 73.44 H new ATOM 0 HA TYR A 115 -9.398 -15.292 -0.493 1.00 72.42 H new ATOM 0 HB2 TYR A 115 -8.424 -12.462 -0.063 1.00 20.40 H new ATOM 0 HB3 TYR A 115 -7.810 -13.948 0.635 1.00 20.40 H new ATOM 0 HD1 TYR A 115 -6.542 -15.598 -0.956 1.00 54.05 H new ATOM 0 HD2 TYR A 115 -7.554 -11.611 -2.047 1.00 23.21 H new ATOM 0 HE1 TYR A 115 -4.881 -15.658 -2.765 1.00 51.02 H new ATOM 0 HE2 TYR A 115 -5.913 -11.678 -3.840 1.00 61.05 H new ATOM 0 HH TYR A 115 -4.843 -13.526 -5.260 1.00 34.03 H new ATOM 1523 N LYS A 116 -10.878 -14.347 1.322 1.00 71.30 N ATOM 1524 CA LYS A 116 -11.915 -13.916 2.235 1.00 2.44 C ATOM 1525 C LYS A 116 -11.375 -12.934 3.244 1.00 63.34 C ATOM 1526 O LYS A 116 -12.124 -12.348 4.020 1.00 74.22 O ATOM 1527 CB LYS A 116 -12.639 -15.114 2.863 1.00 40.32 C ATOM 1528 CG LYS A 116 -11.719 -16.187 3.400 1.00 70.43 C ATOM 1529 CD LYS A 116 -12.485 -17.439 3.793 1.00 70.33 C ATOM 1530 CE LYS A 116 -13.426 -17.201 4.958 1.00 63.12 C ATOM 1531 NZ LYS A 116 -14.178 -18.420 5.313 1.00 22.41 N ATOM 0 H LYS A 116 -10.385 -15.194 1.607 1.00 71.30 H new ATOM 0 HA LYS A 116 -12.675 -13.377 1.670 1.00 2.44 H new ATOM 0 HB2 LYS A 116 -13.272 -14.756 3.675 1.00 40.32 H new ATOM 0 HB3 LYS A 116 -13.298 -15.557 2.116 1.00 40.32 H new ATOM 0 HG2 LYS A 116 -10.974 -16.438 2.645 1.00 70.43 H new ATOM 0 HG3 LYS A 116 -11.179 -15.804 4.266 1.00 70.43 H new ATOM 0 HD2 LYS A 116 -13.056 -17.796 2.936 1.00 70.33 H new ATOM 0 HD3 LYS A 116 -11.778 -18.226 4.056 1.00 70.33 H new ATOM 0 HE2 LYS A 116 -12.856 -16.861 5.822 1.00 63.12 H new ATOM 0 HE3 LYS A 116 -14.125 -16.404 4.704 1.00 63.12 H new ATOM 0 HZ1 LYS A 116 -14.810 -18.217 6.113 1.00 22.41 H new ATOM 0 HZ2 LYS A 116 -14.742 -18.730 4.496 1.00 22.41 H new ATOM 0 HZ3 LYS A 116 -13.512 -19.173 5.580 1.00 22.41 H new ATOM 1545 N SER A 117 -10.076 -12.756 3.211 1.00 51.35 N ATOM 1546 CA SER A 117 -9.409 -11.764 3.988 1.00 11.43 C ATOM 1547 C SER A 117 -8.017 -11.557 3.411 1.00 44.43 C ATOM 1548 O SER A 117 -7.355 -12.529 3.009 1.00 53.40 O ATOM 1549 CB SER A 117 -9.349 -12.167 5.461 1.00 62.33 C ATOM 1550 OG SER A 117 -8.588 -13.327 5.650 1.00 63.33 O ATOM 0 H SER A 117 -9.450 -13.312 2.629 1.00 51.35 H new ATOM 0 HA SER A 117 -9.963 -10.826 3.943 1.00 11.43 H new ATOM 0 HB2 SER A 117 -8.921 -11.352 6.044 1.00 62.33 H new ATOM 0 HB3 SER A 117 -10.360 -12.330 5.835 1.00 62.33 H new ATOM 0 HG SER A 117 -9.012 -13.889 6.332 1.00 63.33 H new ATOM 1556 N PHE A 118 -7.603 -10.319 3.305 1.00 4.43 N ATOM 1557 CA PHE A 118 -6.284 -9.992 2.819 1.00 4.40 C ATOM 1558 C PHE A 118 -5.718 -8.855 3.622 1.00 23.24 C ATOM 1559 O PHE A 118 -6.258 -7.734 3.625 1.00 24.10 O ATOM 1560 CB PHE A 118 -6.280 -9.672 1.306 1.00 12.21 C ATOM 1561 CG PHE A 118 -4.947 -9.221 0.772 1.00 72.12 C ATOM 1562 CD1 PHE A 118 -3.895 -10.098 0.673 1.00 25.04 C ATOM 1563 CD2 PHE A 118 -4.753 -7.914 0.383 1.00 53.34 C ATOM 1564 CE1 PHE A 118 -2.674 -9.686 0.202 1.00 21.54 C ATOM 1565 CE2 PHE A 118 -3.532 -7.494 -0.094 1.00 42.40 C ATOM 1566 CZ PHE A 118 -2.489 -8.381 -0.185 1.00 54.02 C ATOM 0 H PHE A 118 -8.170 -9.509 3.553 1.00 4.43 H new ATOM 0 HA PHE A 118 -5.648 -10.868 2.946 1.00 4.40 H new ATOM 0 HB2 PHE A 118 -6.596 -10.560 0.758 1.00 12.21 H new ATOM 0 HB3 PHE A 118 -7.019 -8.895 1.109 1.00 12.21 H new ATOM 0 HD1 PHE A 118 -4.031 -11.127 0.970 1.00 25.04 H new ATOM 0 HD2 PHE A 118 -5.569 -7.210 0.453 1.00 53.34 H new ATOM 0 HE1 PHE A 118 -1.857 -10.389 0.135 1.00 21.54 H new ATOM 0 HE2 PHE A 118 -3.395 -6.466 -0.397 1.00 42.40 H new ATOM 0 HZ PHE A 118 -1.529 -8.055 -0.558 1.00 54.02 H new ATOM 1576 N LEU A 119 -4.658 -9.142 4.308 1.00 34.21 N ATOM 1577 CA LEU A 119 -4.013 -8.205 5.162 1.00 52.31 C ATOM 1578 C LEU A 119 -2.558 -8.094 4.725 1.00 11.35 C ATOM 1579 O LEU A 119 -1.890 -9.102 4.550 1.00 10.24 O ATOM 1580 CB LEU A 119 -4.093 -8.736 6.598 1.00 24.14 C ATOM 1581 CG LEU A 119 -3.618 -7.808 7.705 1.00 3.43 C ATOM 1582 CD1 LEU A 119 -4.511 -6.588 7.775 1.00 32.42 C ATOM 1583 CD2 LEU A 119 -3.597 -8.536 9.038 1.00 73.02 C ATOM 0 H LEU A 119 -4.209 -10.057 4.287 1.00 34.21 H new ATOM 0 HA LEU A 119 -4.486 -7.224 5.110 1.00 52.31 H new ATOM 0 HB2 LEU A 119 -5.129 -9.004 6.803 1.00 24.14 H new ATOM 0 HB3 LEU A 119 -3.509 -9.655 6.652 1.00 24.14 H new ATOM 0 HG LEU A 119 -2.602 -7.484 7.481 1.00 3.43 H new ATOM 0 HD11 LEU A 119 -4.164 -5.928 8.570 1.00 32.42 H new ATOM 0 HD12 LEU A 119 -4.478 -6.058 6.823 1.00 32.42 H new ATOM 0 HD13 LEU A 119 -5.535 -6.898 7.982 1.00 32.42 H new ATOM 0 HD21 LEU A 119 -3.255 -7.856 9.818 1.00 73.02 H new ATOM 0 HD22 LEU A 119 -4.601 -8.887 9.277 1.00 73.02 H new ATOM 0 HD23 LEU A 119 -2.920 -9.388 8.976 1.00 73.02 H new ATOM 1595 N LEU A 120 -2.072 -6.901 4.532 1.00 32.14 N ATOM 1596 CA LEU A 120 -0.697 -6.731 4.112 1.00 52.43 C ATOM 1597 C LEU A 120 -0.041 -5.636 4.903 1.00 63.12 C ATOM 1598 O LEU A 120 -0.632 -4.607 5.158 1.00 32.11 O ATOM 1599 CB LEU A 120 -0.541 -6.475 2.587 1.00 25.53 C ATOM 1600 CG LEU A 120 -1.115 -5.166 1.996 1.00 33.32 C ATOM 1601 CD1 LEU A 120 -0.707 -5.039 0.544 1.00 23.14 C ATOM 1602 CD2 LEU A 120 -2.631 -5.116 2.094 1.00 74.11 C ATOM 0 H LEU A 120 -2.596 -6.035 4.655 1.00 32.14 H new ATOM 0 HA LEU A 120 -0.194 -7.677 4.312 1.00 52.43 H new ATOM 0 HB2 LEU A 120 0.523 -6.506 2.353 1.00 25.53 H new ATOM 0 HB3 LEU A 120 -1.007 -7.308 2.062 1.00 25.53 H new ATOM 0 HG LEU A 120 -0.710 -4.338 2.578 1.00 33.32 H new ATOM 0 HD11 LEU A 120 -1.113 -4.116 0.131 1.00 23.14 H new ATOM 0 HD12 LEU A 120 0.380 -5.021 0.472 1.00 23.14 H new ATOM 0 HD13 LEU A 120 -1.094 -5.889 -0.018 1.00 23.14 H new ATOM 0 HD21 LEU A 120 -2.993 -4.180 1.668 1.00 74.11 H new ATOM 0 HD22 LEU A 120 -3.059 -5.954 1.544 1.00 74.11 H new ATOM 0 HD23 LEU A 120 -2.930 -5.177 3.140 1.00 74.11 H new ATOM 1614 N THR A 121 1.154 -5.865 5.309 1.00 4.43 N ATOM 1615 CA THR A 121 1.876 -4.917 6.091 1.00 60.15 C ATOM 1616 C THR A 121 3.208 -4.610 5.440 1.00 44.35 C ATOM 1617 O THR A 121 3.942 -5.524 5.069 1.00 13.33 O ATOM 1618 CB THR A 121 2.119 -5.492 7.482 1.00 24.33 C ATOM 1619 OG1 THR A 121 0.864 -5.887 8.046 1.00 24.54 O ATOM 1620 CG2 THR A 121 2.767 -4.476 8.380 1.00 33.22 C ATOM 0 H THR A 121 1.668 -6.723 5.108 1.00 4.43 H new ATOM 0 HA THR A 121 1.293 -3.999 6.164 1.00 60.15 H new ATOM 0 HB THR A 121 2.786 -6.349 7.395 1.00 24.33 H new ATOM 0 HG1 THR A 121 0.618 -5.266 8.763 1.00 24.54 H new ATOM 0 HG21 THR A 121 2.929 -4.912 9.366 1.00 33.22 H new ATOM 0 HG22 THR A 121 3.724 -4.173 7.956 1.00 33.22 H new ATOM 0 HG23 THR A 121 2.118 -3.605 8.471 1.00 33.22 H new ATOM 1628 N ILE A 122 3.516 -3.344 5.297 1.00 11.10 N ATOM 1629 CA ILE A 122 4.772 -2.946 4.721 1.00 61.31 C ATOM 1630 C ILE A 122 5.573 -2.163 5.726 1.00 11.25 C ATOM 1631 O ILE A 122 5.006 -1.484 6.595 1.00 13.03 O ATOM 1632 CB ILE A 122 4.610 -2.093 3.435 1.00 21.10 C ATOM 1633 CG1 ILE A 122 3.898 -0.782 3.715 1.00 75.01 C ATOM 1634 CG2 ILE A 122 3.863 -2.867 2.385 1.00 20.11 C ATOM 1635 CD1 ILE A 122 3.797 0.138 2.505 1.00 32.13 C ATOM 0 H ILE A 122 2.910 -2.571 5.573 1.00 11.10 H new ATOM 0 HA ILE A 122 5.288 -3.865 4.443 1.00 61.31 H new ATOM 0 HB ILE A 122 5.610 -1.860 3.070 1.00 21.10 H new ATOM 0 HG12 ILE A 122 2.894 -0.996 4.081 1.00 75.01 H new ATOM 0 HG13 ILE A 122 4.423 -0.258 4.514 1.00 75.01 H new ATOM 0 HG21 ILE A 122 3.757 -2.256 1.489 1.00 20.11 H new ATOM 0 HG22 ILE A 122 4.414 -3.775 2.142 1.00 20.11 H new ATOM 0 HG23 ILE A 122 2.875 -3.132 2.762 1.00 20.11 H new ATOM 0 HD11 ILE A 122 3.276 1.053 2.786 1.00 32.13 H new ATOM 0 HD12 ILE A 122 4.798 0.385 2.151 1.00 32.13 H new ATOM 0 HD13 ILE A 122 3.245 -0.365 1.711 1.00 32.13 H new ATOM 1647 N GLN A 123 6.865 -2.287 5.649 1.00 31.40 N ATOM 1648 CA GLN A 123 7.740 -1.519 6.476 1.00 40.14 C ATOM 1649 C GLN A 123 8.973 -1.178 5.679 1.00 5.22 C ATOM 1650 O GLN A 123 9.581 -2.062 5.056 1.00 53.51 O ATOM 1651 CB GLN A 123 8.091 -2.268 7.766 1.00 3.14 C ATOM 1652 CG GLN A 123 8.854 -1.426 8.786 1.00 14.25 C ATOM 1653 CD GLN A 123 9.024 -2.130 10.117 1.00 32.23 C ATOM 1654 OE1 GLN A 123 9.106 -3.354 10.182 1.00 41.23 O ATOM 1655 NE2 GLN A 123 9.057 -1.369 11.186 1.00 54.02 N ATOM 0 H GLN A 123 7.340 -2.925 5.010 1.00 31.40 H new ATOM 0 HA GLN A 123 7.241 -0.599 6.782 1.00 40.14 H new ATOM 0 HB2 GLN A 123 7.171 -2.631 8.225 1.00 3.14 H new ATOM 0 HB3 GLN A 123 8.688 -3.144 7.514 1.00 3.14 H new ATOM 0 HG2 GLN A 123 9.836 -1.177 8.383 1.00 14.25 H new ATOM 0 HG3 GLN A 123 8.326 -0.485 8.942 1.00 14.25 H new ATOM 0 HE21 GLN A 123 8.986 -0.356 11.093 1.00 54.02 H new ATOM 0 HE22 GLN A 123 9.154 -1.791 12.110 1.00 54.02 H new ATOM 1664 N VAL A 124 9.339 0.081 5.677 1.00 23.12 N ATOM 1665 CA VAL A 124 10.470 0.534 4.895 1.00 35.45 C ATOM 1666 C VAL A 124 11.712 0.543 5.761 1.00 24.14 C ATOM 1667 O VAL A 124 11.828 1.330 6.709 1.00 23.52 O ATOM 1668 CB VAL A 124 10.225 1.952 4.304 1.00 10.13 C ATOM 1669 CG1 VAL A 124 11.405 2.407 3.451 1.00 12.15 C ATOM 1670 CG2 VAL A 124 8.938 1.975 3.488 1.00 31.21 C ATOM 0 H VAL A 124 8.870 0.814 6.209 1.00 23.12 H new ATOM 0 HA VAL A 124 10.605 -0.155 4.061 1.00 35.45 H new ATOM 0 HB VAL A 124 10.124 2.649 5.136 1.00 10.13 H new ATOM 0 HG11 VAL A 124 11.204 3.401 3.052 1.00 12.15 H new ATOM 0 HG12 VAL A 124 12.306 2.437 4.063 1.00 12.15 H new ATOM 0 HG13 VAL A 124 11.549 1.708 2.627 1.00 12.15 H new ATOM 0 HG21 VAL A 124 8.782 2.975 3.082 1.00 31.21 H new ATOM 0 HG22 VAL A 124 9.013 1.259 2.670 1.00 31.21 H new ATOM 0 HG23 VAL A 124 8.097 1.708 4.128 1.00 31.21 H new ATOM 1680 N THR A 125 12.609 -0.347 5.451 1.00 13.00 N ATOM 1681 CA THR A 125 13.820 -0.535 6.185 1.00 74.01 C ATOM 1682 C THR A 125 15.019 -0.182 5.283 1.00 73.14 C ATOM 1683 O THR A 125 15.082 -0.633 4.143 1.00 14.22 O ATOM 1684 CB THR A 125 13.884 -2.017 6.616 1.00 63.13 C ATOM 1685 OG1 THR A 125 12.686 -2.329 7.354 1.00 53.22 O ATOM 1686 CG2 THR A 125 15.090 -2.312 7.487 1.00 42.05 C ATOM 0 H THR A 125 12.512 -0.979 4.656 1.00 13.00 H new ATOM 0 HA THR A 125 13.851 0.108 7.065 1.00 74.01 H new ATOM 0 HB THR A 125 13.970 -2.628 5.717 1.00 63.13 H new ATOM 0 HG1 THR A 125 12.709 -3.268 7.634 1.00 53.22 H new ATOM 0 HG21 THR A 125 15.090 -3.366 7.764 1.00 42.05 H new ATOM 0 HG22 THR A 125 16.002 -2.081 6.936 1.00 42.05 H new ATOM 0 HG23 THR A 125 15.046 -1.700 8.388 1.00 42.05 H new ATOM 1694 N PRO A 126 15.956 0.645 5.768 1.00 44.22 N ATOM 1695 CA PRO A 126 17.123 1.062 4.981 1.00 15.52 C ATOM 1696 C PRO A 126 18.031 -0.119 4.635 1.00 45.01 C ATOM 1697 O PRO A 126 18.240 -1.026 5.450 1.00 74.42 O ATOM 1698 CB PRO A 126 17.852 2.040 5.909 1.00 52.02 C ATOM 1699 CG PRO A 126 17.397 1.668 7.273 1.00 54.44 C ATOM 1700 CD PRO A 126 15.973 1.229 7.121 1.00 72.10 C ATOM 0 HA PRO A 126 16.836 1.499 4.024 1.00 15.52 H new ATOM 0 HB2 PRO A 126 18.934 1.947 5.812 1.00 52.02 H new ATOM 0 HB3 PRO A 126 17.598 3.074 5.674 1.00 52.02 H new ATOM 0 HG2 PRO A 126 18.011 0.868 7.686 1.00 54.44 H new ATOM 0 HG3 PRO A 126 17.475 2.514 7.956 1.00 54.44 H new ATOM 0 HD2 PRO A 126 15.691 0.500 7.880 1.00 72.10 H new ATOM 0 HD3 PRO A 126 15.280 2.066 7.210 1.00 72.10 H new ATOM 1708 N LYS A 127 18.556 -0.111 3.439 1.00 65.32 N ATOM 1709 CA LYS A 127 19.431 -1.170 3.001 1.00 42.23 C ATOM 1710 C LYS A 127 20.880 -0.764 3.261 1.00 65.04 C ATOM 1711 O LYS A 127 21.146 0.423 3.514 1.00 15.34 O ATOM 1712 CB LYS A 127 19.196 -1.480 1.508 1.00 3.13 C ATOM 1713 CG LYS A 127 19.456 -0.315 0.564 1.00 61.32 C ATOM 1714 CD LYS A 127 19.185 -0.686 -0.894 1.00 52.14 C ATOM 1715 CE LYS A 127 20.143 -1.755 -1.400 1.00 42.34 C ATOM 1716 NZ LYS A 127 19.914 -2.075 -2.826 1.00 70.23 N ATOM 0 H LYS A 127 18.393 0.620 2.746 1.00 65.32 H new ATOM 0 HA LYS A 127 19.215 -2.079 3.562 1.00 42.23 H new ATOM 0 HB2 LYS A 127 19.837 -2.313 1.219 1.00 3.13 H new ATOM 0 HB3 LYS A 127 18.166 -1.811 1.378 1.00 3.13 H new ATOM 0 HG2 LYS A 127 18.825 0.528 0.847 1.00 61.32 H new ATOM 0 HG3 LYS A 127 20.491 0.012 0.668 1.00 61.32 H new ATOM 0 HD2 LYS A 127 18.160 -1.043 -0.992 1.00 52.14 H new ATOM 0 HD3 LYS A 127 19.274 0.204 -1.517 1.00 52.14 H new ATOM 0 HE2 LYS A 127 21.170 -1.415 -1.265 1.00 42.34 H new ATOM 0 HE3 LYS A 127 20.026 -2.659 -0.802 1.00 42.34 H new ATOM 0 HZ1 LYS A 127 20.587 -2.807 -3.130 1.00 70.23 H new ATOM 0 HZ2 LYS A 127 18.943 -2.424 -2.952 1.00 70.23 H new ATOM 0 HZ3 LYS A 127 20.051 -1.219 -3.400 1.00 70.23 H new ATOM 1772 N GLY A 132 18.586 4.187 -0.924 1.00 43.03 N ATOM 1773 CA GLY A 132 17.972 2.931 -1.166 1.00 44.22 C ATOM 1774 C GLY A 132 17.406 2.347 0.100 1.00 15.30 C ATOM 1775 O GLY A 132 17.927 2.592 1.203 1.00 74.52 O ATOM 0 HA2 GLY A 132 17.177 3.048 -1.902 1.00 44.22 H new ATOM 0 HA3 GLY A 132 18.702 2.243 -1.592 1.00 44.22 H new ATOM 1779 N SER A 133 16.344 1.606 -0.025 1.00 24.51 N ATOM 1780 CA SER A 133 15.718 0.951 1.098 1.00 42.33 C ATOM 1781 C SER A 133 14.970 -0.290 0.629 1.00 23.24 C ATOM 1782 O SER A 133 14.671 -0.430 -0.555 1.00 64.03 O ATOM 1783 CB SER A 133 14.761 1.919 1.824 1.00 35.03 C ATOM 1784 OG SER A 133 15.464 3.043 2.348 1.00 3.31 O ATOM 0 H SER A 133 15.879 1.434 -0.917 1.00 24.51 H new ATOM 0 HA SER A 133 16.493 0.646 1.802 1.00 42.33 H new ATOM 0 HB2 SER A 133 13.990 2.259 1.133 1.00 35.03 H new ATOM 0 HB3 SER A 133 14.254 1.394 2.634 1.00 35.03 H new ATOM 0 HG SER A 133 16.419 2.955 2.146 1.00 3.31 H new ATOM 1790 N ILE A 134 14.716 -1.189 1.539 1.00 15.32 N ATOM 1791 CA ILE A 134 13.930 -2.365 1.279 1.00 61.11 C ATOM 1792 C ILE A 134 12.615 -2.281 2.034 1.00 44.02 C ATOM 1793 O ILE A 134 12.592 -2.092 3.260 1.00 3.23 O ATOM 1794 CB ILE A 134 14.674 -3.735 1.619 1.00 34.43 C ATOM 1795 CG1 ILE A 134 15.459 -4.292 0.440 1.00 3.52 C ATOM 1796 CG2 ILE A 134 13.738 -4.801 2.120 1.00 1.21 C ATOM 1797 CD1 ILE A 134 16.598 -3.484 -0.009 1.00 0.11 C ATOM 0 H ILE A 134 15.055 -1.125 2.499 1.00 15.32 H new ATOM 0 HA ILE A 134 13.753 -2.382 0.204 1.00 61.11 H new ATOM 0 HB ILE A 134 15.370 -3.472 2.415 1.00 34.43 H new ATOM 0 HG12 ILE A 134 15.824 -5.284 0.707 1.00 3.52 H new ATOM 0 HG13 ILE A 134 14.775 -4.420 -0.399 1.00 3.52 H new ATOM 0 HG21 ILE A 134 14.302 -5.709 2.334 1.00 1.21 H new ATOM 0 HG22 ILE A 134 13.247 -4.456 3.030 1.00 1.21 H new ATOM 0 HG23 ILE A 134 12.986 -5.012 1.359 1.00 1.21 H new ATOM 0 HD11 ILE A 134 17.083 -3.976 -0.852 1.00 0.11 H new ATOM 0 HD12 ILE A 134 16.247 -2.499 -0.316 1.00 0.11 H new ATOM 0 HD13 ILE A 134 17.312 -3.376 0.808 1.00 0.11 H new ATOM 1809 N VAL A 135 11.543 -2.383 1.322 1.00 73.43 N ATOM 1810 CA VAL A 135 10.262 -2.439 1.931 1.00 14.31 C ATOM 1811 C VAL A 135 9.879 -3.900 2.117 1.00 54.24 C ATOM 1812 O VAL A 135 9.870 -4.687 1.163 1.00 71.13 O ATOM 1813 CB VAL A 135 9.174 -1.631 1.146 1.00 31.43 C ATOM 1814 CG1 VAL A 135 9.056 -2.065 -0.298 1.00 51.43 C ATOM 1815 CG2 VAL A 135 7.825 -1.692 1.850 1.00 42.33 C ATOM 0 H VAL A 135 11.533 -2.430 0.303 1.00 73.43 H new ATOM 0 HA VAL A 135 10.315 -1.951 2.904 1.00 14.31 H new ATOM 0 HB VAL A 135 9.506 -0.593 1.135 1.00 31.43 H new ATOM 0 HG11 VAL A 135 8.288 -1.472 -0.794 1.00 51.43 H new ATOM 0 HG12 VAL A 135 10.011 -1.916 -0.802 1.00 51.43 H new ATOM 0 HG13 VAL A 135 8.784 -3.120 -0.340 1.00 51.43 H new ATOM 0 HG21 VAL A 135 7.091 -1.122 1.280 1.00 42.33 H new ATOM 0 HG22 VAL A 135 7.500 -2.730 1.924 1.00 42.33 H new ATOM 0 HG23 VAL A 135 7.917 -1.268 2.850 1.00 42.33 H new ATOM 1825 N HIS A 136 9.643 -4.270 3.345 1.00 51.22 N ATOM 1826 CA HIS A 136 9.284 -5.628 3.672 1.00 1.23 C ATOM 1827 C HIS A 136 7.784 -5.787 3.615 1.00 50.33 C ATOM 1828 O HIS A 136 7.061 -5.216 4.435 1.00 73.32 O ATOM 1829 CB HIS A 136 9.809 -6.035 5.067 1.00 63.43 C ATOM 1830 CG HIS A 136 11.310 -6.131 5.192 1.00 54.45 C ATOM 1831 ND1 HIS A 136 11.982 -7.330 5.223 1.00 13.51 N ATOM 1832 CD2 HIS A 136 12.260 -5.174 5.343 1.00 70.45 C ATOM 1833 CE1 HIS A 136 13.263 -7.115 5.388 1.00 45.32 C ATOM 1834 NE2 HIS A 136 13.464 -5.819 5.461 1.00 24.41 N ATOM 0 H HIS A 136 9.693 -3.643 4.148 1.00 51.22 H new ATOM 0 HA HIS A 136 9.749 -6.286 2.938 1.00 1.23 H new ATOM 0 HB2 HIS A 136 9.446 -5.312 5.798 1.00 63.43 H new ATOM 0 HB3 HIS A 136 9.377 -7.000 5.332 1.00 63.43 H new ATOM 0 HD2 HIS A 136 12.098 -4.106 5.366 1.00 70.45 H new ATOM 0 HE1 HIS A 136 14.027 -7.876 5.453 1.00 45.32 H new ATOM 0 HE2 HIS A 136 14.369 -5.366 5.585 1.00 24.41 H new ATOM 1843 N TRP A 137 7.325 -6.533 2.647 1.00 4.43 N ATOM 1844 CA TRP A 137 5.920 -6.790 2.474 1.00 12.03 C ATOM 1845 C TRP A 137 5.552 -8.071 3.160 1.00 24.21 C ATOM 1846 O TRP A 137 6.116 -9.122 2.866 1.00 42.11 O ATOM 1847 CB TRP A 137 5.570 -6.925 0.992 1.00 4.13 C ATOM 1848 CG TRP A 137 5.731 -5.687 0.183 1.00 74.24 C ATOM 1849 CD1 TRP A 137 6.891 -5.110 -0.249 1.00 31.13 C ATOM 1850 CD2 TRP A 137 4.675 -4.879 -0.317 1.00 65.34 C ATOM 1851 NE1 TRP A 137 6.604 -3.997 -0.979 1.00 5.22 N ATOM 1852 CE2 TRP A 137 5.260 -3.829 -1.030 1.00 72.12 C ATOM 1853 CE3 TRP A 137 3.285 -4.940 -0.223 1.00 43.32 C ATOM 1854 CZ2 TRP A 137 4.513 -2.848 -1.645 1.00 51.14 C ATOM 1855 CZ3 TRP A 137 2.542 -3.960 -0.837 1.00 13.43 C ATOM 1856 CH2 TRP A 137 3.155 -2.933 -1.537 1.00 44.43 C ATOM 0 H TRP A 137 7.919 -6.983 1.951 1.00 4.43 H new ATOM 0 HA TRP A 137 5.370 -5.953 2.903 1.00 12.03 H new ATOM 0 HB2 TRP A 137 6.195 -7.706 0.558 1.00 4.13 H new ATOM 0 HB3 TRP A 137 4.536 -7.261 0.909 1.00 4.13 H new ATOM 0 HD1 TRP A 137 7.884 -5.480 -0.043 1.00 31.13 H new ATOM 0 HE1 TRP A 137 7.292 -3.386 -1.418 1.00 5.22 H new ATOM 0 HE3 TRP A 137 2.803 -5.739 0.320 1.00 43.32 H new ATOM 0 HZ2 TRP A 137 4.983 -2.044 -2.191 1.00 51.14 H new ATOM 0 HZ3 TRP A 137 1.464 -3.991 -0.773 1.00 13.43 H new ATOM 0 HH2 TRP A 137 2.542 -2.180 -2.010 1.00 44.43 H new ATOM 1867 N HIS A 138 4.632 -7.988 4.061 1.00 34.11 N ATOM 1868 CA HIS A 138 4.123 -9.148 4.748 1.00 10.01 C ATOM 1869 C HIS A 138 2.683 -9.271 4.348 1.00 25.43 C ATOM 1870 O HIS A 138 1.885 -8.395 4.676 1.00 73.44 O ATOM 1871 CB HIS A 138 4.186 -8.962 6.279 1.00 25.31 C ATOM 1872 CG HIS A 138 5.518 -8.571 6.828 1.00 2.11 C ATOM 1873 ND1 HIS A 138 6.501 -9.464 7.179 1.00 22.12 N ATOM 1874 CD2 HIS A 138 6.012 -7.353 7.110 1.00 52.41 C ATOM 1875 CE1 HIS A 138 7.535 -8.805 7.658 1.00 44.00 C ATOM 1876 NE2 HIS A 138 7.264 -7.522 7.624 1.00 23.34 N ATOM 0 H HIS A 138 4.202 -7.110 4.351 1.00 34.11 H new ATOM 0 HA HIS A 138 4.713 -10.027 4.489 1.00 10.01 H new ATOM 0 HB2 HIS A 138 3.458 -8.202 6.565 1.00 25.31 H new ATOM 0 HB3 HIS A 138 3.877 -9.894 6.753 1.00 25.31 H new ATOM 0 HD1 HIS A 138 6.439 -10.478 7.084 1.00 22.12 H new ATOM 0 HD2 HIS A 138 5.508 -6.410 6.957 1.00 52.41 H new ATOM 0 HE1 HIS A 138 8.452 -9.247 8.018 1.00 44.00 H new ATOM 1885 N LEU A 139 2.352 -10.284 3.615 1.00 13.51 N ATOM 1886 CA LEU A 139 0.996 -10.467 3.187 1.00 22.13 C ATOM 1887 C LEU A 139 0.440 -11.698 3.850 1.00 32.35 C ATOM 1888 O LEU A 139 0.971 -12.777 3.670 1.00 52.05 O ATOM 1889 CB LEU A 139 0.890 -10.653 1.641 1.00 72.11 C ATOM 1890 CG LEU A 139 1.405 -9.526 0.700 1.00 40.35 C ATOM 1891 CD1 LEU A 139 2.916 -9.372 0.746 1.00 20.32 C ATOM 1892 CD2 LEU A 139 0.953 -9.787 -0.724 1.00 72.02 C ATOM 0 H LEU A 139 3.002 -11.002 3.297 1.00 13.51 H new ATOM 0 HA LEU A 139 0.435 -9.574 3.464 1.00 22.13 H new ATOM 0 HB2 LEU A 139 1.428 -11.566 1.384 1.00 72.11 H new ATOM 0 HB3 LEU A 139 -0.160 -10.824 1.403 1.00 72.11 H new ATOM 0 HG LEU A 139 0.975 -8.590 1.058 1.00 40.35 H new ATOM 0 HD11 LEU A 139 3.221 -8.572 0.071 1.00 20.32 H new ATOM 0 HD12 LEU A 139 3.226 -9.127 1.762 1.00 20.32 H new ATOM 0 HD13 LEU A 139 3.386 -10.306 0.438 1.00 20.32 H new ATOM 0 HD21 LEU A 139 1.319 -8.992 -1.373 1.00 72.02 H new ATOM 0 HD22 LEU A 139 1.350 -10.744 -1.062 1.00 72.02 H new ATOM 0 HD23 LEU A 139 -0.136 -9.813 -0.761 1.00 72.02 H new ATOM 1904 N GLU A 140 -0.627 -11.537 4.570 1.00 25.04 N ATOM 1905 CA GLU A 140 -1.306 -12.627 5.229 1.00 15.14 C ATOM 1906 C GLU A 140 -2.710 -12.690 4.688 1.00 10.34 C ATOM 1907 O GLU A 140 -3.414 -11.669 4.648 1.00 45.42 O ATOM 1908 CB GLU A 140 -1.357 -12.477 6.767 1.00 44.53 C ATOM 1909 CG GLU A 140 -0.021 -12.573 7.524 1.00 71.23 C ATOM 1910 CD GLU A 140 0.906 -11.376 7.374 1.00 45.13 C ATOM 1911 OE1 GLU A 140 0.597 -10.304 7.960 1.00 65.14 O ATOM 1912 OE2 GLU A 140 1.980 -11.512 6.756 1.00 55.34 O ATOM 0 H GLU A 140 -1.065 -10.629 4.724 1.00 25.04 H new ATOM 0 HA GLU A 140 -0.748 -13.541 5.027 1.00 15.14 H new ATOM 0 HB2 GLU A 140 -1.809 -11.512 6.998 1.00 44.53 H new ATOM 0 HB3 GLU A 140 -2.025 -13.244 7.160 1.00 44.53 H new ATOM 0 HG2 GLU A 140 -0.234 -12.715 8.584 1.00 71.23 H new ATOM 0 HG3 GLU A 140 0.507 -13.464 7.183 1.00 71.23 H new ATOM 1919 N TYR A 141 -3.130 -13.848 4.258 1.00 13.03 N ATOM 1920 CA TYR A 141 -4.424 -13.947 3.621 1.00 64.33 C ATOM 1921 C TYR A 141 -5.079 -15.306 3.754 1.00 52.12 C ATOM 1922 O TYR A 141 -4.425 -16.339 3.902 1.00 73.02 O ATOM 1923 CB TYR A 141 -4.349 -13.464 2.166 1.00 54.22 C ATOM 1924 CG TYR A 141 -3.273 -14.128 1.342 1.00 60.02 C ATOM 1925 CD1 TYR A 141 -1.945 -13.746 1.480 1.00 22.04 C ATOM 1926 CD2 TYR A 141 -3.574 -15.121 0.449 1.00 3.24 C ATOM 1927 CE1 TYR A 141 -0.948 -14.340 0.758 1.00 14.23 C ATOM 1928 CE2 TYR A 141 -2.586 -15.730 -0.296 1.00 43.12 C ATOM 1929 CZ TYR A 141 -1.270 -15.342 -0.139 1.00 73.14 C ATOM 1930 OH TYR A 141 -0.279 -15.958 -0.878 1.00 51.03 O ATOM 0 H TYR A 141 -2.611 -14.723 4.332 1.00 13.03 H new ATOM 0 HA TYR A 141 -5.089 -13.278 4.167 1.00 64.33 H new ATOM 0 HB2 TYR A 141 -5.314 -13.637 1.689 1.00 54.22 H new ATOM 0 HB3 TYR A 141 -4.180 -12.387 2.162 1.00 54.22 H new ATOM 0 HD1 TYR A 141 -1.694 -12.959 2.176 1.00 22.04 H new ATOM 0 HD2 TYR A 141 -4.601 -15.432 0.326 1.00 3.24 H new ATOM 0 HE1 TYR A 141 0.079 -14.031 0.886 1.00 14.23 H new ATOM 0 HE2 TYR A 141 -2.841 -16.508 -1.000 1.00 43.12 H new ATOM 0 HH TYR A 141 -0.679 -16.639 -1.458 1.00 51.03 H new ATOM 1940 N GLU A 142 -6.362 -15.291 3.682 1.00 12.23 N ATOM 1941 CA GLU A 142 -7.164 -16.455 3.871 1.00 54.11 C ATOM 1942 C GLU A 142 -7.926 -16.759 2.576 1.00 52.31 C ATOM 1943 O GLU A 142 -8.702 -15.925 2.084 1.00 21.31 O ATOM 1944 CB GLU A 142 -8.079 -16.157 5.055 1.00 53.35 C ATOM 1945 CG GLU A 142 -9.023 -17.223 5.505 1.00 74.22 C ATOM 1946 CD GLU A 142 -9.732 -16.798 6.770 1.00 13.42 C ATOM 1947 OE1 GLU A 142 -9.127 -16.902 7.869 1.00 43.43 O ATOM 1948 OE2 GLU A 142 -10.872 -16.324 6.699 1.00 64.54 O ATOM 0 H GLU A 142 -6.901 -14.448 3.485 1.00 12.23 H new ATOM 0 HA GLU A 142 -6.578 -17.347 4.092 1.00 54.11 H new ATOM 0 HB2 GLU A 142 -7.449 -15.891 5.904 1.00 53.35 H new ATOM 0 HB3 GLU A 142 -8.668 -15.274 4.806 1.00 53.35 H new ATOM 0 HG2 GLU A 142 -9.753 -17.426 4.722 1.00 74.22 H new ATOM 0 HG3 GLU A 142 -8.478 -18.150 5.680 1.00 74.22 H new ATOM 1955 N LYS A 143 -7.669 -17.927 2.012 1.00 65.34 N ATOM 1956 CA LYS A 143 -8.276 -18.338 0.752 1.00 74.23 C ATOM 1957 C LYS A 143 -9.718 -18.708 0.949 1.00 52.32 C ATOM 1958 O LYS A 143 -10.074 -19.329 1.952 1.00 70.52 O ATOM 1959 CB LYS A 143 -7.561 -19.569 0.123 1.00 25.13 C ATOM 1960 CG LYS A 143 -6.160 -19.360 -0.450 1.00 40.13 C ATOM 1961 CD LYS A 143 -5.151 -18.893 0.574 1.00 62.34 C ATOM 1962 CE LYS A 143 -3.764 -18.878 -0.013 1.00 20.53 C ATOM 1963 NZ LYS A 143 -3.296 -20.234 -0.352 1.00 21.12 N ATOM 0 H LYS A 143 -7.035 -18.618 2.412 1.00 65.34 H new ATOM 0 HA LYS A 143 -8.180 -17.483 0.083 1.00 74.23 H new ATOM 0 HB2 LYS A 143 -7.499 -20.346 0.885 1.00 25.13 H new ATOM 0 HB3 LYS A 143 -8.196 -19.954 -0.675 1.00 25.13 H new ATOM 0 HG2 LYS A 143 -5.813 -20.295 -0.889 1.00 40.13 H new ATOM 0 HG3 LYS A 143 -6.212 -18.629 -1.257 1.00 40.13 H new ATOM 0 HD2 LYS A 143 -5.415 -17.894 0.922 1.00 62.34 H new ATOM 0 HD3 LYS A 143 -5.176 -19.551 1.443 1.00 62.34 H new ATOM 0 HE2 LYS A 143 -3.755 -18.257 -0.908 1.00 20.53 H new ATOM 0 HE3 LYS A 143 -3.074 -18.423 0.697 1.00 20.53 H new ATOM 0 HZ1 LYS A 143 -2.371 -20.403 0.092 1.00 21.12 H new ATOM 0 HZ2 LYS A 143 -3.981 -20.935 -0.004 1.00 21.12 H new ATOM 0 HZ3 LYS A 143 -3.205 -20.322 -1.384 1.00 21.12 H new ATOM 1977 N ILE A 144 -10.552 -18.326 0.008 1.00 32.55 N ATOM 1978 CA ILE A 144 -11.922 -18.777 0.016 1.00 62.44 C ATOM 1979 C ILE A 144 -11.932 -20.211 -0.440 1.00 62.35 C ATOM 1980 O ILE A 144 -12.542 -21.085 0.178 1.00 32.45 O ATOM 1981 CB ILE A 144 -12.795 -17.937 -0.945 1.00 52.02 C ATOM 1982 CG1 ILE A 144 -12.871 -16.502 -0.448 1.00 52.41 C ATOM 1983 CG2 ILE A 144 -14.186 -18.552 -1.104 1.00 13.20 C ATOM 1984 CD1 ILE A 144 -13.688 -15.579 -1.307 1.00 51.03 C ATOM 0 H ILE A 144 -10.307 -17.709 -0.766 1.00 32.55 H new ATOM 0 HA ILE A 144 -12.331 -18.672 1.021 1.00 62.44 H new ATOM 0 HB ILE A 144 -12.333 -17.935 -1.932 1.00 52.02 H new ATOM 0 HG12 ILE A 144 -13.289 -16.503 0.559 1.00 52.41 H new ATOM 0 HG13 ILE A 144 -11.859 -16.104 -0.373 1.00 52.41 H new ATOM 0 HG21 ILE A 144 -14.778 -17.941 -1.785 1.00 13.20 H new ATOM 0 HG22 ILE A 144 -14.094 -19.560 -1.508 1.00 13.20 H new ATOM 0 HG23 ILE A 144 -14.678 -18.594 -0.133 1.00 13.20 H new ATOM 0 HD11 ILE A 144 -13.684 -14.579 -0.873 1.00 51.03 H new ATOM 0 HD12 ILE A 144 -13.261 -15.541 -2.309 1.00 51.03 H new ATOM 0 HD13 ILE A 144 -14.713 -15.946 -1.363 1.00 51.03 H new ATOM 1996 N SER A 145 -11.226 -20.442 -1.505 1.00 52.13 N ATOM 1997 CA SER A 145 -11.082 -21.726 -2.100 1.00 24.21 C ATOM 1998 C SER A 145 -9.847 -21.677 -2.988 1.00 53.22 C ATOM 1999 O SER A 145 -9.398 -20.583 -3.366 1.00 33.42 O ATOM 2000 CB SER A 145 -12.338 -22.073 -2.921 1.00 43.43 C ATOM 2001 OG SER A 145 -13.510 -22.097 -2.110 1.00 72.22 O ATOM 0 H SER A 145 -10.717 -19.709 -1.999 1.00 52.13 H new ATOM 0 HA SER A 145 -10.967 -22.499 -1.340 1.00 24.21 H new ATOM 0 HB2 SER A 145 -12.464 -21.342 -3.720 1.00 43.43 H new ATOM 0 HB3 SER A 145 -12.205 -23.045 -3.396 1.00 43.43 H new ATOM 0 HG SER A 145 -13.254 -22.060 -1.165 1.00 72.22 H new ATOM 2007 N GLU A 146 -9.324 -22.820 -3.321 1.00 75.14 N ATOM 2008 CA GLU A 146 -8.099 -22.935 -4.101 1.00 44.41 C ATOM 2009 C GLU A 146 -8.275 -22.416 -5.500 1.00 12.25 C ATOM 2010 O GLU A 146 -7.560 -21.517 -5.929 1.00 3.23 O ATOM 2011 CB GLU A 146 -7.661 -24.378 -4.164 1.00 64.30 C ATOM 2012 CG GLU A 146 -7.158 -24.945 -2.849 1.00 73.34 C ATOM 2013 CD GLU A 146 -5.868 -24.292 -2.411 1.00 65.42 C ATOM 2014 OE1 GLU A 146 -5.905 -23.231 -1.763 1.00 12.34 O ATOM 2015 OE2 GLU A 146 -4.780 -24.836 -2.727 1.00 62.54 O ATOM 0 H GLU A 146 -9.732 -23.718 -3.061 1.00 75.14 H new ATOM 0 HA GLU A 146 -7.340 -22.331 -3.604 1.00 44.41 H new ATOM 0 HB2 GLU A 146 -8.499 -24.984 -4.508 1.00 64.30 H new ATOM 0 HB3 GLU A 146 -6.872 -24.472 -4.910 1.00 64.30 H new ATOM 0 HG2 GLU A 146 -7.916 -24.804 -2.079 1.00 73.34 H new ATOM 0 HG3 GLU A 146 -7.005 -26.019 -2.952 1.00 73.34 H new ATOM 2022 N GLU A 147 -9.251 -22.968 -6.201 1.00 13.21 N ATOM 2023 CA GLU A 147 -9.528 -22.623 -7.610 1.00 63.42 C ATOM 2024 C GLU A 147 -9.872 -21.143 -7.730 1.00 2.42 C ATOM 2025 O GLU A 147 -9.787 -20.545 -8.799 1.00 22.35 O ATOM 2026 CB GLU A 147 -10.738 -23.410 -8.171 1.00 31.51 C ATOM 2027 CG GLU A 147 -10.879 -24.867 -7.733 1.00 43.54 C ATOM 2028 CD GLU A 147 -11.442 -24.981 -6.330 1.00 34.22 C ATOM 2029 OE1 GLU A 147 -12.659 -24.795 -6.162 1.00 14.11 O ATOM 2030 OE2 GLU A 147 -10.675 -25.216 -5.378 1.00 24.33 O ATOM 0 H GLU A 147 -9.883 -23.672 -5.820 1.00 13.21 H new ATOM 0 HA GLU A 147 -8.629 -22.874 -8.173 1.00 63.42 H new ATOM 0 HB2 GLU A 147 -11.648 -22.881 -7.887 1.00 31.51 H new ATOM 0 HB3 GLU A 147 -10.682 -23.387 -9.259 1.00 31.51 H new ATOM 0 HG2 GLU A 147 -11.530 -25.395 -8.430 1.00 43.54 H new ATOM 0 HG3 GLU A 147 -9.905 -25.355 -7.775 1.00 43.54 H new ATOM 2037 N VAL A 148 -10.260 -20.579 -6.629 1.00 64.31 N ATOM 2038 CA VAL A 148 -10.768 -19.232 -6.597 1.00 13.24 C ATOM 2039 C VAL A 148 -9.664 -18.202 -6.318 1.00 61.33 C ATOM 2040 O VAL A 148 -9.671 -17.123 -6.888 1.00 43.50 O ATOM 2041 CB VAL A 148 -11.881 -19.122 -5.528 1.00 60.42 C ATOM 2042 CG1 VAL A 148 -12.498 -17.742 -5.500 1.00 23.22 C ATOM 2043 CG2 VAL A 148 -12.941 -20.185 -5.762 1.00 54.33 C ATOM 0 H VAL A 148 -10.235 -21.038 -5.719 1.00 64.31 H new ATOM 0 HA VAL A 148 -11.176 -19.008 -7.582 1.00 13.24 H new ATOM 0 HB VAL A 148 -11.425 -19.290 -4.552 1.00 60.42 H new ATOM 0 HG11 VAL A 148 -13.275 -17.706 -4.736 1.00 23.22 H new ATOM 0 HG12 VAL A 148 -11.729 -17.004 -5.270 1.00 23.22 H new ATOM 0 HG13 VAL A 148 -12.935 -17.519 -6.473 1.00 23.22 H new ATOM 0 HG21 VAL A 148 -13.718 -20.097 -5.003 1.00 54.33 H new ATOM 0 HG22 VAL A 148 -13.381 -20.049 -6.750 1.00 54.33 H new ATOM 0 HG23 VAL A 148 -12.485 -21.173 -5.701 1.00 54.33 H new ATOM 2053 N ALA A 149 -8.706 -18.554 -5.489 1.00 35.00 N ATOM 2054 CA ALA A 149 -7.670 -17.604 -5.109 1.00 75.11 C ATOM 2055 C ALA A 149 -6.463 -17.697 -6.007 1.00 52.33 C ATOM 2056 O ALA A 149 -5.991 -18.788 -6.309 1.00 73.41 O ATOM 2057 CB ALA A 149 -7.282 -17.783 -3.655 1.00 25.22 C ATOM 0 H ALA A 149 -8.618 -19.478 -5.067 1.00 35.00 H new ATOM 0 HA ALA A 149 -8.085 -16.604 -5.232 1.00 75.11 H new ATOM 0 HB1 ALA A 149 -6.507 -17.063 -3.394 1.00 25.22 H new ATOM 0 HB2 ALA A 149 -8.155 -17.621 -3.023 1.00 25.22 H new ATOM 0 HB3 ALA A 149 -6.905 -18.794 -3.501 1.00 25.22 H new ATOM 2063 N HIS A 150 -5.965 -16.558 -6.445 1.00 53.04 N ATOM 2064 CA HIS A 150 -4.813 -16.522 -7.331 1.00 51.33 C ATOM 2065 C HIS A 150 -3.727 -15.640 -6.723 1.00 64.42 C ATOM 2066 O HIS A 150 -3.714 -14.453 -6.972 1.00 34.33 O ATOM 2067 CB HIS A 150 -5.183 -15.921 -8.705 1.00 55.35 C ATOM 2068 CG HIS A 150 -6.403 -16.488 -9.362 1.00 50.50 C ATOM 2069 ND1 HIS A 150 -7.239 -15.731 -10.140 1.00 54.43 N ATOM 2070 CD2 HIS A 150 -6.905 -17.739 -9.393 1.00 41.23 C ATOM 2071 CE1 HIS A 150 -8.194 -16.482 -10.623 1.00 24.24 C ATOM 2072 NE2 HIS A 150 -8.019 -17.710 -10.190 1.00 22.14 N ATOM 0 H HIS A 150 -6.340 -15.641 -6.202 1.00 53.04 H new ATOM 0 HA HIS A 150 -4.465 -17.547 -7.460 1.00 51.33 H new ATOM 0 HB2 HIS A 150 -5.326 -14.847 -8.583 1.00 55.35 H new ATOM 0 HB3 HIS A 150 -4.336 -16.055 -9.378 1.00 55.35 H new ATOM 0 HD2 HIS A 150 -6.504 -18.603 -8.884 1.00 41.23 H new ATOM 0 HE1 HIS A 150 -8.993 -16.149 -11.269 1.00 24.24 H new ATOM 0 HE2 HIS A 150 -8.614 -18.509 -10.411 1.00 22.14 H new ATOM 2081 N PRO A 151 -2.815 -16.197 -5.878 1.00 75.42 N ATOM 2082 CA PRO A 151 -1.701 -15.414 -5.223 1.00 44.23 C ATOM 2083 C PRO A 151 -0.798 -14.650 -6.225 1.00 22.42 C ATOM 2084 O PRO A 151 0.019 -13.802 -5.834 1.00 75.02 O ATOM 2085 CB PRO A 151 -0.896 -16.499 -4.509 1.00 32.01 C ATOM 2086 CG PRO A 151 -1.891 -17.575 -4.242 1.00 65.45 C ATOM 2087 CD PRO A 151 -2.805 -17.602 -5.434 1.00 71.14 C ATOM 0 HA PRO A 151 -2.096 -14.633 -4.573 1.00 44.23 H new ATOM 0 HB2 PRO A 151 -0.076 -16.860 -5.130 1.00 32.01 H new ATOM 0 HB3 PRO A 151 -0.456 -16.125 -3.585 1.00 32.01 H new ATOM 0 HG2 PRO A 151 -1.398 -18.538 -4.107 1.00 65.45 H new ATOM 0 HG3 PRO A 151 -2.449 -17.372 -3.328 1.00 65.45 H new ATOM 0 HD2 PRO A 151 -2.433 -18.268 -6.212 1.00 71.14 H new ATOM 0 HD3 PRO A 151 -3.804 -17.948 -5.169 1.00 71.14 H new ATOM 2095 N GLU A 152 -0.973 -14.964 -7.497 1.00 72.22 N ATOM 2096 CA GLU A 152 -0.277 -14.342 -8.627 1.00 43.14 C ATOM 2097 C GLU A 152 -0.421 -12.835 -8.552 1.00 63.45 C ATOM 2098 O GLU A 152 0.545 -12.066 -8.680 1.00 40.05 O ATOM 2099 CB GLU A 152 -1.007 -14.771 -9.908 1.00 1.13 C ATOM 2100 CG GLU A 152 -1.179 -16.254 -10.059 1.00 71.42 C ATOM 2101 CD GLU A 152 -1.991 -16.641 -11.281 1.00 44.21 C ATOM 2102 OE1 GLU A 152 -1.423 -16.775 -12.388 1.00 34.23 O ATOM 2103 OE2 GLU A 152 -3.215 -16.819 -11.154 1.00 21.11 O ATOM 0 H GLU A 152 -1.629 -15.688 -7.790 1.00 72.22 H new ATOM 0 HA GLU A 152 0.773 -14.634 -8.613 1.00 43.14 H new ATOM 0 HB2 GLU A 152 -1.990 -14.300 -9.926 1.00 1.13 H new ATOM 0 HB3 GLU A 152 -0.456 -14.392 -10.769 1.00 1.13 H new ATOM 0 HG2 GLU A 152 -0.197 -16.723 -10.120 1.00 71.42 H new ATOM 0 HG3 GLU A 152 -1.666 -16.649 -9.167 1.00 71.42 H new ATOM 2110 N THR A 153 -1.632 -12.456 -8.299 1.00 54.13 N ATOM 2111 CA THR A 153 -2.098 -11.108 -8.360 1.00 40.04 C ATOM 2112 C THR A 153 -1.555 -10.243 -7.203 1.00 20.24 C ATOM 2113 O THR A 153 -1.257 -9.055 -7.385 1.00 15.53 O ATOM 2114 CB THR A 153 -3.634 -11.153 -8.332 1.00 61.43 C ATOM 2115 OG1 THR A 153 -4.051 -11.687 -7.071 1.00 3.33 O ATOM 2116 CG2 THR A 153 -4.123 -12.098 -9.440 1.00 54.34 C ATOM 0 H THR A 153 -2.363 -13.115 -8.029 1.00 54.13 H new ATOM 0 HA THR A 153 -1.735 -10.641 -9.276 1.00 40.04 H new ATOM 0 HB THR A 153 -4.041 -10.153 -8.480 1.00 61.43 H new ATOM 0 HG1 THR A 153 -3.997 -12.665 -7.096 1.00 3.33 H new ATOM 0 HG21 THR A 153 -5.212 -12.138 -9.430 1.00 54.34 H new ATOM 0 HG22 THR A 153 -3.782 -11.731 -10.408 1.00 54.34 H new ATOM 0 HG23 THR A 153 -3.722 -13.097 -9.269 1.00 54.34 H new ATOM 2124 N LEU A 154 -1.397 -10.852 -6.041 1.00 11.23 N ATOM 2125 CA LEU A 154 -0.935 -10.160 -4.839 1.00 33.15 C ATOM 2126 C LEU A 154 0.464 -9.630 -4.992 1.00 13.41 C ATOM 2127 O LEU A 154 0.746 -8.484 -4.632 1.00 5.33 O ATOM 2128 CB LEU A 154 -0.986 -11.082 -3.641 1.00 34.24 C ATOM 2129 CG LEU A 154 -2.347 -11.622 -3.280 1.00 13.21 C ATOM 2130 CD1 LEU A 154 -2.243 -12.514 -2.071 1.00 40.13 C ATOM 2131 CD2 LEU A 154 -3.327 -10.493 -3.031 1.00 53.23 C ATOM 0 H LEU A 154 -1.585 -11.844 -5.899 1.00 11.23 H new ATOM 0 HA LEU A 154 -1.606 -9.315 -4.686 1.00 33.15 H new ATOM 0 HB2 LEU A 154 -0.320 -11.925 -3.827 1.00 34.24 H new ATOM 0 HB3 LEU A 154 -0.589 -10.547 -2.778 1.00 34.24 H new ATOM 0 HG LEU A 154 -2.721 -12.210 -4.118 1.00 13.21 H new ATOM 0 HD11 LEU A 154 -3.230 -12.900 -1.817 1.00 40.13 H new ATOM 0 HD12 LEU A 154 -1.574 -13.346 -2.289 1.00 40.13 H new ATOM 0 HD13 LEU A 154 -1.850 -11.943 -1.230 1.00 40.13 H new ATOM 0 HD21 LEU A 154 -4.301 -10.907 -2.772 1.00 53.23 H new ATOM 0 HD22 LEU A 154 -2.967 -9.873 -2.210 1.00 53.23 H new ATOM 0 HD23 LEU A 154 -3.419 -9.885 -3.931 1.00 53.23 H new ATOM 2143 N LEU A 155 1.341 -10.440 -5.537 1.00 24.43 N ATOM 2144 CA LEU A 155 2.683 -10.069 -5.688 1.00 12.23 C ATOM 2145 C LEU A 155 2.818 -8.968 -6.745 1.00 72.34 C ATOM 2146 O LEU A 155 3.691 -8.123 -6.660 1.00 1.51 O ATOM 2147 CB LEU A 155 3.497 -11.301 -6.016 1.00 13.42 C ATOM 2148 CG LEU A 155 4.957 -11.071 -6.237 1.00 52.44 C ATOM 2149 CD1 LEU A 155 5.602 -10.410 -5.015 1.00 51.22 C ATOM 2150 CD2 LEU A 155 5.648 -12.362 -6.565 1.00 13.15 C ATOM 0 H LEU A 155 1.119 -11.374 -5.882 1.00 24.43 H new ATOM 0 HA LEU A 155 3.069 -9.649 -4.759 1.00 12.23 H new ATOM 0 HB2 LEU A 155 3.379 -12.019 -5.204 1.00 13.42 H new ATOM 0 HB3 LEU A 155 3.080 -11.762 -6.912 1.00 13.42 H new ATOM 0 HG LEU A 155 5.068 -10.393 -7.083 1.00 52.44 H new ATOM 0 HD11 LEU A 155 6.664 -10.255 -5.204 1.00 51.22 H new ATOM 0 HD12 LEU A 155 5.123 -9.450 -4.825 1.00 51.22 H new ATOM 0 HD13 LEU A 155 5.479 -11.055 -4.145 1.00 51.22 H new ATOM 0 HD21 LEU A 155 6.710 -12.176 -6.723 1.00 13.15 H new ATOM 0 HD22 LEU A 155 5.521 -13.063 -5.740 1.00 13.15 H new ATOM 0 HD23 LEU A 155 5.215 -12.786 -7.471 1.00 13.15 H new ATOM 2162 N GLN A 156 1.914 -8.968 -7.714 1.00 3.44 N ATOM 2163 CA GLN A 156 1.898 -7.927 -8.735 1.00 51.41 C ATOM 2164 C GLN A 156 1.401 -6.624 -8.132 1.00 42.23 C ATOM 2165 O GLN A 156 1.913 -5.551 -8.437 1.00 43.32 O ATOM 2166 CB GLN A 156 1.040 -8.345 -9.920 1.00 12.35 C ATOM 2167 CG GLN A 156 1.538 -9.599 -10.614 1.00 23.34 C ATOM 2168 CD GLN A 156 2.931 -9.441 -11.194 1.00 31.11 C ATOM 2169 OE1 GLN A 156 3.095 -9.041 -12.342 1.00 34.15 O ATOM 2170 NE2 GLN A 156 3.940 -9.754 -10.415 1.00 41.12 N ATOM 0 H GLN A 156 1.184 -9.673 -7.816 1.00 3.44 H new ATOM 0 HA GLN A 156 2.913 -7.776 -9.102 1.00 51.41 H new ATOM 0 HB2 GLN A 156 0.018 -8.510 -9.579 1.00 12.35 H new ATOM 0 HB3 GLN A 156 1.008 -7.528 -10.641 1.00 12.35 H new ATOM 0 HG2 GLN A 156 1.538 -10.426 -9.903 1.00 23.34 H new ATOM 0 HG3 GLN A 156 0.846 -9.865 -11.413 1.00 23.34 H new ATOM 0 HE21 GLN A 156 3.768 -10.084 -9.465 1.00 41.12 H new ATOM 0 HE22 GLN A 156 4.896 -9.668 -10.759 1.00 41.12 H new ATOM 2179 N PHE A 157 0.414 -6.740 -7.238 1.00 44.01 N ATOM 2180 CA PHE A 157 -0.128 -5.598 -6.512 1.00 11.34 C ATOM 2181 C PHE A 157 0.991 -4.928 -5.719 1.00 40.51 C ATOM 2182 O PHE A 157 1.090 -3.700 -5.677 1.00 1.34 O ATOM 2183 CB PHE A 157 -1.273 -6.057 -5.575 1.00 70.44 C ATOM 2184 CG PHE A 157 -1.939 -4.957 -4.779 1.00 14.44 C ATOM 2185 CD1 PHE A 157 -2.753 -4.027 -5.406 1.00 50.51 C ATOM 2186 CD2 PHE A 157 -1.762 -4.869 -3.403 1.00 51.55 C ATOM 2187 CE1 PHE A 157 -3.377 -3.028 -4.683 1.00 11.14 C ATOM 2188 CE2 PHE A 157 -2.385 -3.865 -2.670 1.00 44.33 C ATOM 2189 CZ PHE A 157 -3.193 -2.947 -3.314 1.00 31.52 C ATOM 0 H PHE A 157 -0.028 -7.628 -7.001 1.00 44.01 H new ATOM 0 HA PHE A 157 -0.540 -4.876 -7.217 1.00 11.34 H new ATOM 0 HB2 PHE A 157 -2.032 -6.559 -6.175 1.00 70.44 H new ATOM 0 HB3 PHE A 157 -0.876 -6.797 -4.880 1.00 70.44 H new ATOM 0 HD1 PHE A 157 -2.902 -4.084 -6.474 1.00 50.51 H new ATOM 0 HD2 PHE A 157 -1.134 -5.588 -2.898 1.00 51.55 H new ATOM 0 HE1 PHE A 157 -4.008 -2.311 -5.186 1.00 11.14 H new ATOM 0 HE2 PHE A 157 -2.238 -3.803 -1.602 1.00 44.33 H new ATOM 0 HZ PHE A 157 -3.681 -2.167 -2.749 1.00 31.52 H new ATOM 2199 N CYS A 158 1.847 -5.751 -5.127 1.00 3.51 N ATOM 2200 CA CYS A 158 2.987 -5.273 -4.372 1.00 4.03 C ATOM 2201 C CYS A 158 3.917 -4.453 -5.264 1.00 20.24 C ATOM 2202 O CYS A 158 4.348 -3.369 -4.888 1.00 2.24 O ATOM 2203 CB CYS A 158 3.754 -6.445 -3.753 1.00 13.32 C ATOM 2204 SG CYS A 158 2.759 -7.489 -2.668 1.00 3.23 S ATOM 0 H CYS A 158 1.766 -6.767 -5.160 1.00 3.51 H new ATOM 0 HA CYS A 158 2.618 -4.634 -3.570 1.00 4.03 H new ATOM 0 HB2 CYS A 158 4.164 -7.060 -4.554 1.00 13.32 H new ATOM 0 HB3 CYS A 158 4.599 -6.053 -3.187 1.00 13.32 H new ATOM 0 HG CYS A 158 1.861 -8.114 -3.371 1.00 3.23 H new ATOM 2210 N VAL A 159 4.192 -4.964 -6.457 1.00 51.22 N ATOM 2211 CA VAL A 159 5.081 -4.296 -7.405 1.00 62.03 C ATOM 2212 C VAL A 159 4.522 -2.926 -7.809 1.00 24.03 C ATOM 2213 O VAL A 159 5.250 -1.915 -7.799 1.00 72.32 O ATOM 2214 CB VAL A 159 5.300 -5.147 -8.685 1.00 2.24 C ATOM 2215 CG1 VAL A 159 6.235 -4.433 -9.651 1.00 72.40 C ATOM 2216 CG2 VAL A 159 5.845 -6.525 -8.341 1.00 20.30 C ATOM 0 H VAL A 159 3.809 -5.847 -6.795 1.00 51.22 H new ATOM 0 HA VAL A 159 6.038 -4.167 -6.900 1.00 62.03 H new ATOM 0 HB VAL A 159 4.332 -5.277 -9.169 1.00 2.24 H new ATOM 0 HG11 VAL A 159 6.375 -5.046 -10.541 1.00 72.40 H new ATOM 0 HG12 VAL A 159 5.802 -3.474 -9.935 1.00 72.40 H new ATOM 0 HG13 VAL A 159 7.198 -4.267 -9.169 1.00 72.40 H new ATOM 0 HG21 VAL A 159 5.988 -7.099 -9.257 1.00 20.30 H new ATOM 0 HG22 VAL A 159 6.799 -6.420 -7.825 1.00 20.30 H new ATOM 0 HG23 VAL A 159 5.138 -7.045 -7.694 1.00 20.30 H new ATOM 2226 N GLU A 160 3.238 -2.894 -8.128 1.00 2.22 N ATOM 2227 CA GLU A 160 2.591 -1.672 -8.575 1.00 34.32 C ATOM 2228 C GLU A 160 2.565 -0.617 -7.491 1.00 62.24 C ATOM 2229 O GLU A 160 2.713 0.566 -7.762 1.00 64.34 O ATOM 2230 CB GLU A 160 1.190 -1.951 -9.106 1.00 20.34 C ATOM 2231 CG GLU A 160 1.184 -2.877 -10.303 1.00 51.21 C ATOM 2232 CD GLU A 160 2.046 -2.359 -11.430 1.00 5.32 C ATOM 2233 OE1 GLU A 160 1.562 -1.532 -12.224 1.00 44.42 O ATOM 2234 OE2 GLU A 160 3.205 -2.783 -11.548 1.00 73.20 O ATOM 0 H GLU A 160 2.621 -3.705 -8.085 1.00 2.22 H new ATOM 0 HA GLU A 160 3.188 -1.275 -9.396 1.00 34.32 H new ATOM 0 HB2 GLU A 160 0.587 -2.390 -8.311 1.00 20.34 H new ATOM 0 HB3 GLU A 160 0.717 -1.008 -9.381 1.00 20.34 H new ATOM 0 HG2 GLU A 160 1.539 -3.862 -10.000 1.00 51.21 H new ATOM 0 HG3 GLU A 160 0.161 -3.002 -10.658 1.00 51.21 H new ATOM 2241 N VAL A 161 2.393 -1.044 -6.269 1.00 3.24 N ATOM 2242 CA VAL A 161 2.418 -0.129 -5.152 1.00 75.32 C ATOM 2243 C VAL A 161 3.861 0.310 -4.848 1.00 44.21 C ATOM 2244 O VAL A 161 4.104 1.482 -4.535 1.00 14.25 O ATOM 2245 CB VAL A 161 1.746 -0.737 -3.901 1.00 43.32 C ATOM 2246 CG1 VAL A 161 1.885 0.187 -2.693 1.00 31.43 C ATOM 2247 CG2 VAL A 161 0.274 -1.014 -4.172 1.00 43.31 C ATOM 0 H VAL A 161 2.234 -2.020 -6.018 1.00 3.24 H new ATOM 0 HA VAL A 161 1.841 0.753 -5.430 1.00 75.32 H new ATOM 0 HB VAL A 161 2.253 -1.675 -3.675 1.00 43.32 H new ATOM 0 HG11 VAL A 161 1.402 -0.269 -1.829 1.00 31.43 H new ATOM 0 HG12 VAL A 161 2.941 0.346 -2.476 1.00 31.43 H new ATOM 0 HG13 VAL A 161 1.411 1.144 -2.911 1.00 31.43 H new ATOM 0 HG21 VAL A 161 -0.186 -1.442 -3.281 1.00 43.31 H new ATOM 0 HG22 VAL A 161 -0.230 -0.082 -4.428 1.00 43.31 H new ATOM 0 HG23 VAL A 161 0.182 -1.716 -5.001 1.00 43.31 H new ATOM 2257 N SER A 162 4.818 -0.621 -4.983 1.00 34.11 N ATOM 2258 CA SER A 162 6.224 -0.315 -4.750 1.00 34.54 C ATOM 2259 C SER A 162 6.701 0.805 -5.659 1.00 31.31 C ATOM 2260 O SER A 162 7.374 1.721 -5.215 1.00 30.04 O ATOM 2261 CB SER A 162 7.084 -1.555 -4.948 1.00 51.15 C ATOM 2262 OG SER A 162 6.726 -2.569 -4.027 1.00 4.10 O ATOM 0 H SER A 162 4.637 -1.588 -5.252 1.00 34.11 H new ATOM 0 HA SER A 162 6.323 0.019 -3.717 1.00 34.54 H new ATOM 0 HB2 SER A 162 6.967 -1.925 -5.967 1.00 51.15 H new ATOM 0 HB3 SER A 162 8.136 -1.297 -4.821 1.00 51.15 H new ATOM 0 HG SER A 162 5.930 -3.039 -4.351 1.00 4.10 H new ATOM 2268 N LYS A 163 6.313 0.748 -6.928 1.00 53.23 N ATOM 2269 CA LYS A 163 6.718 1.774 -7.868 1.00 41.32 C ATOM 2270 C LYS A 163 6.064 3.117 -7.562 1.00 63.32 C ATOM 2271 O LYS A 163 6.694 4.153 -7.710 1.00 45.20 O ATOM 2272 CB LYS A 163 6.494 1.353 -9.324 1.00 75.34 C ATOM 2273 CG LYS A 163 5.073 0.988 -9.679 1.00 70.21 C ATOM 2274 CD LYS A 163 4.863 0.655 -11.171 1.00 52.25 C ATOM 2275 CE LYS A 163 5.618 -0.592 -11.682 1.00 34.22 C ATOM 2276 NZ LYS A 163 7.091 -0.413 -11.797 1.00 14.31 N ATOM 0 H LYS A 163 5.727 0.011 -7.321 1.00 53.23 H new ATOM 0 HA LYS A 163 7.793 1.902 -7.741 1.00 41.32 H new ATOM 0 HB2 LYS A 163 6.816 2.167 -9.974 1.00 75.34 H new ATOM 0 HB3 LYS A 163 7.136 0.499 -9.541 1.00 75.34 H new ATOM 0 HG2 LYS A 163 4.769 0.130 -9.080 1.00 70.21 H new ATOM 0 HG3 LYS A 163 4.418 1.815 -9.406 1.00 70.21 H new ATOM 0 HD2 LYS A 163 3.797 0.512 -11.348 1.00 52.25 H new ATOM 0 HD3 LYS A 163 5.172 1.515 -11.765 1.00 52.25 H new ATOM 0 HE2 LYS A 163 5.417 -1.425 -11.009 1.00 34.22 H new ATOM 0 HE3 LYS A 163 5.220 -0.868 -12.659 1.00 34.22 H new ATOM 0 HZ1 LYS A 163 7.416 -0.787 -12.711 1.00 14.31 H new ATOM 0 HZ2 LYS A 163 7.324 0.599 -11.735 1.00 14.31 H new ATOM 0 HZ3 LYS A 163 7.564 -0.925 -11.025 1.00 14.31 H new ATOM 2290 N GLU A 164 4.812 3.090 -7.108 1.00 40.15 N ATOM 2291 CA GLU A 164 4.104 4.317 -6.751 1.00 31.21 C ATOM 2292 C GLU A 164 4.809 5.055 -5.658 1.00 10.22 C ATOM 2293 O GLU A 164 5.075 6.254 -5.775 1.00 1.40 O ATOM 2294 CB GLU A 164 2.676 4.043 -6.306 1.00 33.02 C ATOM 2295 CG GLU A 164 1.775 3.539 -7.403 1.00 63.35 C ATOM 2296 CD GLU A 164 1.709 4.511 -8.557 1.00 65.42 C ATOM 2297 OE1 GLU A 164 1.051 5.567 -8.429 1.00 33.42 O ATOM 2298 OE2 GLU A 164 2.334 4.253 -9.603 1.00 52.14 O ATOM 0 H GLU A 164 4.270 2.236 -6.979 1.00 40.15 H new ATOM 0 HA GLU A 164 4.084 4.927 -7.654 1.00 31.21 H new ATOM 0 HB2 GLU A 164 2.693 3.310 -5.499 1.00 33.02 H new ATOM 0 HB3 GLU A 164 2.253 4.960 -5.895 1.00 33.02 H new ATOM 0 HG2 GLU A 164 2.138 2.575 -7.759 1.00 63.35 H new ATOM 0 HG3 GLU A 164 0.773 3.376 -7.006 1.00 63.35 H new ATOM 2305 N ILE A 165 5.122 4.345 -4.603 1.00 33.21 N ATOM 2306 CA ILE A 165 5.733 4.949 -3.459 1.00 64.13 C ATOM 2307 C ILE A 165 7.177 5.365 -3.751 1.00 35.20 C ATOM 2308 O ILE A 165 7.583 6.474 -3.423 1.00 25.41 O ATOM 2309 CB ILE A 165 5.612 4.052 -2.181 1.00 73.32 C ATOM 2310 CG1 ILE A 165 6.191 4.748 -0.953 1.00 11.20 C ATOM 2311 CG2 ILE A 165 6.250 2.678 -2.372 1.00 22.43 C ATOM 2312 CD1 ILE A 165 5.550 6.083 -0.662 1.00 13.23 C ATOM 0 H ILE A 165 4.960 3.342 -4.519 1.00 33.21 H new ATOM 0 HA ILE A 165 5.179 5.862 -3.239 1.00 64.13 H new ATOM 0 HB ILE A 165 4.546 3.895 -2.015 1.00 73.32 H new ATOM 0 HG12 ILE A 165 6.070 4.099 -0.086 1.00 11.20 H new ATOM 0 HG13 ILE A 165 7.262 4.891 -1.097 1.00 11.20 H new ATOM 0 HG21 ILE A 165 6.139 2.095 -1.458 1.00 22.43 H new ATOM 0 HG22 ILE A 165 5.758 2.159 -3.195 1.00 22.43 H new ATOM 0 HG23 ILE A 165 7.309 2.797 -2.600 1.00 22.43 H new ATOM 0 HD11 ILE A 165 6.009 6.522 0.224 1.00 13.23 H new ATOM 0 HD12 ILE A 165 5.694 6.749 -1.513 1.00 13.23 H new ATOM 0 HD13 ILE A 165 4.483 5.944 -0.486 1.00 13.23 H new ATOM 2324 N ASP A 166 7.901 4.492 -4.399 1.00 21.40 N ATOM 2325 CA ASP A 166 9.302 4.740 -4.795 1.00 11.14 C ATOM 2326 C ASP A 166 9.412 5.990 -5.660 1.00 71.42 C ATOM 2327 O ASP A 166 10.181 6.908 -5.351 1.00 23.11 O ATOM 2328 CB ASP A 166 9.843 3.530 -5.550 1.00 2.03 C ATOM 2329 CG ASP A 166 11.229 3.718 -6.114 1.00 50.41 C ATOM 2330 OD1 ASP A 166 12.210 3.484 -5.397 1.00 11.52 O ATOM 2331 OD2 ASP A 166 11.341 4.036 -7.317 1.00 4.25 O ATOM 0 H ASP A 166 7.552 3.575 -4.679 1.00 21.40 H new ATOM 0 HA ASP A 166 9.894 4.900 -3.894 1.00 11.14 H new ATOM 0 HB2 ASP A 166 9.850 2.671 -4.879 1.00 2.03 H new ATOM 0 HB3 ASP A 166 9.161 3.291 -6.366 1.00 2.03 H new ATOM 2336 N GLU A 167 8.602 6.050 -6.709 1.00 24.54 N ATOM 2337 CA GLU A 167 8.584 7.204 -7.588 1.00 44.31 C ATOM 2338 C GLU A 167 8.098 8.449 -6.861 1.00 4.22 C ATOM 2339 O GLU A 167 8.491 9.545 -7.190 1.00 22.33 O ATOM 2340 CB GLU A 167 7.786 6.953 -8.875 1.00 11.11 C ATOM 2341 CG GLU A 167 8.390 5.883 -9.783 1.00 64.45 C ATOM 2342 CD GLU A 167 7.640 5.732 -11.084 1.00 53.42 C ATOM 2343 OE1 GLU A 167 7.851 6.561 -12.000 1.00 51.31 O ATOM 2344 OE2 GLU A 167 6.837 4.782 -11.231 1.00 5.23 O ATOM 0 H GLU A 167 7.949 5.310 -6.969 1.00 24.54 H new ATOM 0 HA GLU A 167 9.615 7.379 -7.894 1.00 44.31 H new ATOM 0 HB2 GLU A 167 6.771 6.658 -8.609 1.00 11.11 H new ATOM 0 HB3 GLU A 167 7.711 7.887 -9.432 1.00 11.11 H new ATOM 0 HG2 GLU A 167 9.429 6.136 -9.995 1.00 64.45 H new ATOM 0 HG3 GLU A 167 8.395 4.928 -9.258 1.00 64.45 H new ATOM 2351 N HIS A 168 7.229 8.264 -5.875 1.00 42.14 N ATOM 2352 CA HIS A 168 6.721 9.376 -5.056 1.00 11.14 C ATOM 2353 C HIS A 168 7.851 9.957 -4.204 1.00 42.31 C ATOM 2354 O HIS A 168 7.917 11.157 -3.986 1.00 33.44 O ATOM 2355 CB HIS A 168 5.570 8.883 -4.140 1.00 54.44 C ATOM 2356 CG HIS A 168 4.940 9.933 -3.247 1.00 60.25 C ATOM 2357 ND1 HIS A 168 3.713 10.488 -3.498 1.00 62.41 N ATOM 2358 CD2 HIS A 168 5.360 10.484 -2.076 1.00 60.13 C ATOM 2359 CE1 HIS A 168 3.407 11.328 -2.535 1.00 32.13 C ATOM 2360 NE2 HIS A 168 4.388 11.344 -1.658 1.00 3.11 N ATOM 0 H HIS A 168 6.855 7.351 -5.616 1.00 42.14 H new ATOM 0 HA HIS A 168 6.338 10.153 -5.718 1.00 11.14 H new ATOM 0 HB2 HIS A 168 4.790 8.453 -4.768 1.00 54.44 H new ATOM 0 HB3 HIS A 168 5.951 8.079 -3.510 1.00 54.44 H new ATOM 0 HD2 HIS A 168 6.292 10.278 -1.571 1.00 60.13 H new ATOM 0 HE1 HIS A 168 2.499 11.910 -2.473 1.00 32.13 H new ATOM 0 HE2 HIS A 168 4.416 11.906 -0.807 1.00 3.11 H new ATOM 2369 N LEU A 169 8.728 9.096 -3.736 1.00 51.13 N ATOM 2370 CA LEU A 169 9.824 9.507 -2.872 1.00 54.03 C ATOM 2371 C LEU A 169 10.930 10.192 -3.667 1.00 42.14 C ATOM 2372 O LEU A 169 11.633 11.062 -3.152 1.00 51.22 O ATOM 2373 CB LEU A 169 10.387 8.307 -2.109 1.00 11.15 C ATOM 2374 CG LEU A 169 9.404 7.527 -1.226 1.00 65.53 C ATOM 2375 CD1 LEU A 169 10.100 6.360 -0.553 1.00 43.43 C ATOM 2376 CD2 LEU A 169 8.764 8.430 -0.192 1.00 54.14 C ATOM 0 H LEU A 169 8.706 8.097 -3.939 1.00 51.13 H new ATOM 0 HA LEU A 169 9.428 10.226 -2.155 1.00 54.03 H new ATOM 0 HB2 LEU A 169 10.816 7.615 -2.833 1.00 11.15 H new ATOM 0 HB3 LEU A 169 11.205 8.658 -1.480 1.00 11.15 H new ATOM 0 HG LEU A 169 8.615 7.137 -1.868 1.00 65.53 H new ATOM 0 HD11 LEU A 169 9.386 5.820 0.069 1.00 43.43 H new ATOM 0 HD12 LEU A 169 10.501 5.689 -1.312 1.00 43.43 H new ATOM 0 HD13 LEU A 169 10.914 6.732 0.069 1.00 43.43 H new ATOM 0 HD21 LEU A 169 8.072 7.850 0.419 1.00 54.14 H new ATOM 0 HD22 LEU A 169 9.538 8.860 0.444 1.00 54.14 H new ATOM 0 HD23 LEU A 169 8.221 9.231 -0.694 1.00 54.14 H new ATOM 2388 N LEU A 170 11.086 9.789 -4.908 1.00 63.51 N ATOM 2389 CA LEU A 170 12.081 10.383 -5.795 1.00 1.21 C ATOM 2390 C LEU A 170 11.538 11.655 -6.422 1.00 51.51 C ATOM 2391 O LEU A 170 12.290 12.494 -6.941 1.00 73.54 O ATOM 2392 CB LEU A 170 12.497 9.392 -6.869 1.00 62.25 C ATOM 2393 CG LEU A 170 13.098 8.083 -6.360 1.00 43.33 C ATOM 2394 CD1 LEU A 170 13.475 7.191 -7.524 1.00 2.41 C ATOM 2395 CD2 LEU A 170 14.303 8.352 -5.456 1.00 23.32 C ATOM 0 H LEU A 170 10.534 9.045 -5.336 1.00 63.51 H new ATOM 0 HA LEU A 170 12.962 10.638 -5.206 1.00 1.21 H new ATOM 0 HB2 LEU A 170 11.625 9.158 -7.480 1.00 62.25 H new ATOM 0 HB3 LEU A 170 13.223 9.875 -7.522 1.00 62.25 H new ATOM 0 HG LEU A 170 12.347 7.565 -5.763 1.00 43.33 H new ATOM 0 HD11 LEU A 170 13.902 6.262 -7.147 1.00 2.41 H new ATOM 0 HD12 LEU A 170 12.586 6.969 -8.115 1.00 2.41 H new ATOM 0 HD13 LEU A 170 14.208 7.700 -8.150 1.00 2.41 H new ATOM 0 HD21 LEU A 170 14.714 7.405 -5.106 1.00 23.32 H new ATOM 0 HD22 LEU A 170 15.065 8.893 -6.017 1.00 23.32 H new ATOM 0 HD23 LEU A 170 13.990 8.950 -4.600 1.00 23.32 H new