USER MOD reduce.3.24.130724 H: found=0, std=0, add=1147, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1146 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 102 ASN : amide:sc= -0.164 K(o=-0.34,f=-16!) USER MOD Set 1.2: A 125 LYS NZ :NH3+ -149:sc= 2.02 (180deg=0.742) USER MOD Set 1.3: A 126 HIS : no HE2:sc= -2.19 K(o=-0.34,f=-5.8) USER MOD Set 2.1: A 92 HIS : no HD1:sc= -2.18 X(o=-0.61,f=-0.9) USER MOD Set 2.2: A 115 CYS SG : rot -31:sc= 1.43 USER MOD Set 2.3: A 119 THR OG1 : rot 162:sc= 0.135 USER MOD Set 3.1: A 100 MET CE :methyl -177:sc= 0 (180deg=-0.0192) USER MOD Set 3.2: A 108 ASN : amide:sc= -0.693 K(o=-0.69,f=-2.4) USER MOD Set 4.1: A 62 CYS SG : rot -64:sc= 1.39 USER MOD Set 4.2: A 142 MET CE :methyl -163:sc= -0.954 (180deg=-1.15) USER MOD Single : A 3 ASN : amide:sc= 0.353 K(o=0.35,f=-5.5!) USER MOD Single : A 5 THR OG1 : rot -25:sc= 0.329 USER MOD Single : A 21 SER OG : rot 46:sc= 0.847 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ -170:sc= 2.44 (180deg=2.06) USER MOD Single : A 32 THR OG1 : rot 70:sc= 0.341 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 40 SER OG : rot 69:sc= 1.03 USER MOD Single : A 41 THR OG1 : rot 89:sc= 0.933 USER MOD Single : A 44 LYS NZ :NH3+ -125:sc= 0.425 (180deg=-1.75) USER MOD Single : A 48 TYR OH : rot 91:sc= 1.14 USER MOD Single : A 49 LYS NZ :NH3+ 177:sc= 2.27 (180deg=1.95) USER MOD Single : A 51 SER OG : rot 170:sc= 0 USER MOD Single : A 52 CYS SG : rot -56:sc= 0.00526 USER MOD Single : A 54 HIS : no HE2:sc= -0.752 K(o=-0.75,f=-4) USER MOD Single : A 61 MET CE :methyl 155:sc= 0 (180deg=-0.0201) USER MOD Single : A 63 GLN : amide:sc= 1.13 K(o=1.1,f=-9.2!) USER MOD Single : A 77 SER OG : rot 80:sc= -0.69 USER MOD Single : A 79 TYR OH : rot -149:sc= 0.776 USER MOD Single : A 82 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0107) USER MOD Single : A 87 ASN : amide:sc= 0.509 K(o=0.51,f=-6.2!) USER MOD Single : A 91 LYS NZ :NH3+ -167:sc= -0.0204 (180deg=-0.275) USER MOD Single : A 93 THR OG1 : rot -106:sc= 0.0956 USER MOD Single : A 99 SER OG : rot -59:sc= -0.0477 USER MOD Single : A 106 ASN : amide:sc= -3.5! C(o=-3.5!,f=-4.8!) USER MOD Single : A 107 THR OG1 : rot 110:sc= 0.355 USER MOD Single : A 110 SER OG : rot -11:sc= 0.827 USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -162:sc= 1.27 (180deg=1.12) USER MOD Single : A 131 LYS NZ :NH3+ -138:sc= 0.759 (180deg=0.0548) USER MOD Single : A 133 LYS NZ :NH3+ 164:sc= 0.442 (180deg=-0.58) USER MOD Single : A 136 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 137 ASN : amide:sc= -0.738 K(o=-0.74,f=-1.4) USER MOD Single : A 147 SER OG : rot 180:sc= -0.0702 USER MOD Single : A 149 ASN : amide:sc= 0.112 K(o=0.11,f=-5!) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 THR OG1 : rot -62:sc= 1.11 USER MOD Single : A 153 SER OG : rot -93:sc= 0.508 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 163:sc= -0.0592 (180deg=-0.433) USER MOD Single : A 157 THR OG1 : rot -35:sc= 0.358 USER MOD Single : A 161 CYS SG : rot 111:sc= -1.34 USER MOD Single : A 163 GLN : amide:sc= -0.0187 K(o=-0.019,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 34 N ASN A 3 -1.992 -18.413 -6.261 1.00 1.89 N ATOM 35 CA ASN A 3 -1.134 -17.290 -5.929 1.00 1.28 C ATOM 36 C ASN A 3 -0.894 -17.263 -4.419 1.00 1.17 C ATOM 37 O ASN A 3 -1.762 -17.662 -3.642 1.00 1.25 O ATOM 38 CB ASN A 3 -1.782 -15.963 -6.329 1.00 0.94 C ATOM 39 CG ASN A 3 -1.748 -15.770 -7.846 1.00 1.39 C ATOM 40 OD1 ASN A 3 -0.764 -15.334 -8.420 1.00 2.65 O ATOM 41 ND2 ASN A 3 -2.875 -16.119 -8.461 1.00 1.31 N ATOM 0 HA ASN A 3 -0.197 -17.412 -6.472 1.00 1.28 H new ATOM 0 HB2 ASN A 3 -2.814 -15.938 -5.979 1.00 0.94 H new ATOM 0 HB3 ASN A 3 -1.261 -15.139 -5.842 1.00 0.94 H new ATOM 0 HD21 ASN A 3 -2.952 -16.028 -9.474 1.00 1.31 H new ATOM 0 HD22 ASN A 3 -3.662 -16.477 -7.919 1.00 1.31 H new ATOM 48 N PRO A 4 0.317 -16.777 -4.036 1.00 1.14 N ATOM 49 CA PRO A 4 0.668 -16.664 -2.630 1.00 1.09 C ATOM 50 C PRO A 4 -0.052 -15.481 -1.979 1.00 0.87 C ATOM 51 O PRO A 4 -0.640 -14.650 -2.670 1.00 1.05 O ATOM 52 CB PRO A 4 2.181 -16.521 -2.613 1.00 1.33 C ATOM 53 CG PRO A 4 2.575 -16.094 -4.017 1.00 1.44 C ATOM 54 CD PRO A 4 1.379 -16.324 -4.928 1.00 1.31 C ATOM 0 HA PRO A 4 0.357 -17.531 -2.047 1.00 1.09 H new ATOM 0 HB2 PRO A 4 2.495 -15.781 -1.877 1.00 1.33 H new ATOM 0 HB3 PRO A 4 2.659 -17.462 -2.342 1.00 1.33 H new ATOM 0 HG2 PRO A 4 2.867 -15.044 -4.029 1.00 1.44 H new ATOM 0 HG3 PRO A 4 3.435 -16.668 -4.363 1.00 1.44 H new ATOM 0 HD2 PRO A 4 1.096 -15.409 -5.449 1.00 1.31 H new ATOM 0 HD3 PRO A 4 1.600 -17.070 -5.692 1.00 1.31 H new ATOM 62 N THR A 5 0.018 -15.443 -0.656 1.00 0.76 N ATOM 63 CA THR A 5 -0.568 -14.344 0.092 1.00 0.58 C ATOM 64 C THR A 5 0.323 -13.974 1.280 1.00 0.61 C ATOM 65 O THR A 5 0.971 -14.839 1.868 1.00 0.88 O ATOM 66 CB THR A 5 -1.986 -14.751 0.499 1.00 0.76 C ATOM 67 OG1 THR A 5 -2.738 -13.547 0.384 1.00 1.99 O ATOM 68 CG2 THR A 5 -2.088 -15.114 1.982 1.00 1.35 C ATOM 0 H THR A 5 0.471 -16.155 -0.084 1.00 0.76 H new ATOM 0 HA THR A 5 -0.636 -13.443 -0.517 1.00 0.58 H new ATOM 0 HB THR A 5 -2.308 -15.599 -0.105 1.00 0.76 H new ATOM 0 HG1 THR A 5 -2.141 -12.777 0.491 1.00 1.99 H new ATOM 0 HG21 THR A 5 -3.114 -15.395 2.218 1.00 1.35 H new ATOM 0 HG22 THR A 5 -1.424 -15.951 2.198 1.00 1.35 H new ATOM 0 HG23 THR A 5 -1.799 -14.255 2.588 1.00 1.35 H new ATOM 76 N VAL A 6 0.325 -12.688 1.600 1.00 0.58 N ATOM 77 CA VAL A 6 1.120 -12.194 2.711 1.00 0.66 C ATOM 78 C VAL A 6 0.199 -11.525 3.734 1.00 0.62 C ATOM 79 O VAL A 6 -0.973 -11.281 3.452 1.00 0.67 O ATOM 80 CB VAL A 6 2.219 -11.263 2.196 1.00 0.84 C ATOM 81 CG1 VAL A 6 3.032 -11.935 1.088 1.00 1.33 C ATOM 82 CG2 VAL A 6 1.630 -9.935 1.715 1.00 1.15 C ATOM 0 H VAL A 6 -0.212 -11.973 1.109 1.00 0.58 H new ATOM 0 HA VAL A 6 1.623 -13.018 3.217 1.00 0.66 H new ATOM 0 HB VAL A 6 2.894 -11.050 3.025 1.00 0.84 H new ATOM 0 HG11 VAL A 6 3.806 -11.252 0.740 1.00 1.33 H new ATOM 0 HG12 VAL A 6 3.496 -12.842 1.476 1.00 1.33 H new ATOM 0 HG13 VAL A 6 2.374 -12.191 0.258 1.00 1.33 H new ATOM 0 HG21 VAL A 6 2.432 -9.291 1.354 1.00 1.15 H new ATOM 0 HG22 VAL A 6 0.923 -10.122 0.907 1.00 1.15 H new ATOM 0 HG23 VAL A 6 1.115 -9.445 2.541 1.00 1.15 H new ATOM 92 N PHE A 7 0.764 -11.247 4.899 1.00 0.65 N ATOM 93 CA PHE A 7 -0.010 -10.680 5.991 1.00 0.70 C ATOM 94 C PHE A 7 0.865 -9.796 6.882 1.00 0.83 C ATOM 95 O PHE A 7 2.073 -10.008 6.977 1.00 1.09 O ATOM 96 CB PHE A 7 -0.540 -11.852 6.818 1.00 1.03 C ATOM 97 CG PHE A 7 0.493 -12.461 7.768 1.00 1.01 C ATOM 98 CD1 PHE A 7 1.446 -13.303 7.287 1.00 2.13 C ATOM 99 CD2 PHE A 7 0.458 -12.161 9.094 1.00 1.74 C ATOM 100 CE1 PHE A 7 2.405 -13.868 8.168 1.00 2.42 C ATOM 101 CE2 PHE A 7 1.417 -12.726 9.975 1.00 2.10 C ATOM 102 CZ PHE A 7 2.370 -13.568 9.494 1.00 1.92 C ATOM 0 H PHE A 7 1.749 -11.404 5.111 1.00 0.65 H new ATOM 0 HA PHE A 7 -0.817 -10.064 5.595 1.00 0.70 H new ATOM 0 HB2 PHE A 7 -1.398 -11.515 7.399 1.00 1.03 H new ATOM 0 HB3 PHE A 7 -0.898 -12.628 6.142 1.00 1.03 H new ATOM 0 HD1 PHE A 7 1.473 -13.542 6.234 1.00 2.13 H new ATOM 0 HD2 PHE A 7 -0.299 -11.493 9.477 1.00 1.74 H new ATOM 0 HE1 PHE A 7 3.162 -14.536 7.785 1.00 2.42 H new ATOM 0 HE2 PHE A 7 1.390 -12.487 11.028 1.00 2.10 H new ATOM 0 HZ PHE A 7 3.099 -13.998 10.165 1.00 1.92 H new ATOM 112 N PHE A 8 0.221 -8.824 7.511 1.00 0.88 N ATOM 113 CA PHE A 8 0.882 -8.024 8.528 1.00 1.32 C ATOM 114 C PHE A 8 -0.140 -7.315 9.418 1.00 0.87 C ATOM 115 O PHE A 8 -1.274 -7.080 9.003 1.00 0.84 O ATOM 116 CB PHE A 8 1.719 -6.974 7.797 1.00 2.09 C ATOM 117 CG PHE A 8 0.912 -6.079 6.856 1.00 1.25 C ATOM 118 CD1 PHE A 8 0.314 -4.953 7.334 1.00 2.57 C ATOM 119 CD2 PHE A 8 0.790 -6.407 5.542 1.00 2.06 C ATOM 120 CE1 PHE A 8 -0.436 -4.123 6.460 1.00 3.75 C ATOM 121 CE2 PHE A 8 0.040 -5.576 4.668 1.00 3.16 C ATOM 122 CZ PHE A 8 -0.558 -4.451 5.145 1.00 3.81 C ATOM 0 H PHE A 8 -0.752 -8.572 7.336 1.00 0.88 H new ATOM 0 HA PHE A 8 1.495 -8.663 9.163 1.00 1.32 H new ATOM 0 HB2 PHE A 8 2.222 -6.348 8.534 1.00 2.09 H new ATOM 0 HB3 PHE A 8 2.496 -7.479 7.224 1.00 2.09 H new ATOM 0 HD1 PHE A 8 0.410 -4.691 8.377 1.00 2.57 H new ATOM 0 HD2 PHE A 8 1.264 -7.300 5.163 1.00 2.06 H new ATOM 0 HE1 PHE A 8 -0.910 -3.230 6.839 1.00 3.75 H new ATOM 0 HE2 PHE A 8 -0.056 -5.837 3.624 1.00 3.16 H new ATOM 0 HZ PHE A 8 -1.129 -3.819 4.481 1.00 3.81 H new ATOM 132 N ASP A 9 0.297 -6.994 10.627 1.00 0.77 N ATOM 133 CA ASP A 9 -0.599 -6.426 11.620 1.00 0.54 C ATOM 134 C ASP A 9 -0.246 -4.953 11.836 1.00 0.58 C ATOM 135 O ASP A 9 0.923 -4.575 11.771 1.00 0.77 O ATOM 136 CB ASP A 9 -0.461 -7.145 12.962 1.00 0.89 C ATOM 137 CG ASP A 9 -1.094 -6.422 14.153 1.00 1.48 C ATOM 138 OD1 ASP A 9 -0.387 -5.580 14.748 1.00 2.55 O ATOM 139 OD2 ASP A 9 -2.272 -6.728 14.441 1.00 2.44 O ATOM 0 H ASP A 9 1.260 -7.116 10.941 1.00 0.77 H new ATOM 0 HA ASP A 9 -1.620 -6.537 11.255 1.00 0.54 H new ATOM 0 HB2 ASP A 9 -0.912 -8.134 12.875 1.00 0.89 H new ATOM 0 HB3 ASP A 9 0.599 -7.295 13.169 1.00 0.89 H new ATOM 144 N ILE A 10 -1.278 -4.160 12.086 1.00 0.60 N ATOM 145 CA ILE A 10 -1.085 -2.749 12.376 1.00 0.80 C ATOM 146 C ILE A 10 -1.238 -2.516 13.880 1.00 0.81 C ATOM 147 O ILE A 10 -2.209 -2.967 14.486 1.00 0.79 O ATOM 148 CB ILE A 10 -2.023 -1.894 11.522 1.00 1.01 C ATOM 149 CG1 ILE A 10 -1.722 -2.070 10.033 1.00 1.16 C ATOM 150 CG2 ILE A 10 -1.968 -0.426 11.950 1.00 1.31 C ATOM 151 CD1 ILE A 10 -2.326 -3.370 9.500 1.00 1.12 C ATOM 0 H ILE A 10 -2.250 -4.468 12.094 1.00 0.60 H new ATOM 0 HA ILE A 10 -0.075 -2.439 12.107 1.00 0.80 H new ATOM 0 HB ILE A 10 -3.044 -2.239 11.686 1.00 1.01 H new ATOM 0 HG12 ILE A 10 -2.123 -1.224 9.475 1.00 1.16 H new ATOM 0 HG13 ILE A 10 -0.644 -2.074 9.875 1.00 1.16 H new ATOM 0 HG21 ILE A 10 -2.644 0.160 11.327 1.00 1.31 H new ATOM 0 HG22 ILE A 10 -2.270 -0.340 12.994 1.00 1.31 H new ATOM 0 HG23 ILE A 10 -0.951 -0.051 11.834 1.00 1.31 H new ATOM 0 HD11 ILE A 10 -2.097 -3.470 8.439 1.00 1.12 H new ATOM 0 HD12 ILE A 10 -1.905 -4.216 10.043 1.00 1.12 H new ATOM 0 HD13 ILE A 10 -3.407 -3.352 9.637 1.00 1.12 H new ATOM 163 N ALA A 11 -0.266 -1.812 14.440 1.00 1.02 N ATOM 164 CA ALA A 11 -0.328 -1.429 15.841 1.00 1.04 C ATOM 165 C ALA A 11 -0.598 0.072 15.943 1.00 1.03 C ATOM 166 O ALA A 11 0.308 0.884 15.759 1.00 1.26 O ATOM 167 CB ALA A 11 0.970 -1.839 16.540 1.00 1.10 C ATOM 0 H ALA A 11 0.570 -1.496 13.949 1.00 1.02 H new ATOM 0 HA ALA A 11 -1.145 -1.945 16.345 1.00 1.04 H new ATOM 0 HB1 ALA A 11 0.924 -1.552 17.591 1.00 1.10 H new ATOM 0 HB2 ALA A 11 1.099 -2.919 16.464 1.00 1.10 H new ATOM 0 HB3 ALA A 11 1.813 -1.339 16.064 1.00 1.10 H new ATOM 173 N VAL A 12 -1.848 0.398 16.239 1.00 0.92 N ATOM 174 CA VAL A 12 -2.252 1.789 16.349 1.00 0.96 C ATOM 175 C VAL A 12 -1.951 2.293 17.762 1.00 0.97 C ATOM 176 O VAL A 12 -2.743 2.086 18.680 1.00 1.02 O ATOM 177 CB VAL A 12 -3.725 1.938 15.963 1.00 1.03 C ATOM 178 CG1 VAL A 12 -4.216 3.366 16.211 1.00 1.07 C ATOM 179 CG2 VAL A 12 -3.956 1.523 14.509 1.00 1.07 C ATOM 0 H VAL A 12 -2.594 -0.277 16.406 1.00 0.92 H new ATOM 0 HA VAL A 12 -1.683 2.408 15.655 1.00 0.96 H new ATOM 0 HB VAL A 12 -4.306 1.270 16.598 1.00 1.03 H new ATOM 0 HG11 VAL A 12 -5.266 3.444 15.928 1.00 1.07 H new ATOM 0 HG12 VAL A 12 -4.106 3.610 17.268 1.00 1.07 H new ATOM 0 HG13 VAL A 12 -3.627 4.062 15.614 1.00 1.07 H new ATOM 0 HG21 VAL A 12 -5.011 1.639 14.261 1.00 1.07 H new ATOM 0 HG22 VAL A 12 -3.357 2.153 13.851 1.00 1.07 H new ATOM 0 HG23 VAL A 12 -3.664 0.481 14.377 1.00 1.07 H new ATOM 189 N ASP A 13 -0.805 2.943 17.892 1.00 0.99 N ATOM 190 CA ASP A 13 -0.382 3.466 19.180 1.00 1.04 C ATOM 191 C ASP A 13 -0.657 2.422 20.264 1.00 1.03 C ATOM 192 O ASP A 13 -1.711 2.444 20.899 1.00 1.15 O ATOM 193 CB ASP A 13 -1.155 4.736 19.540 1.00 1.22 C ATOM 194 CG ASP A 13 -2.523 4.873 18.869 1.00 1.56 C ATOM 195 OD1 ASP A 13 -2.532 5.210 17.665 1.00 2.49 O ATOM 196 OD2 ASP A 13 -3.528 4.637 19.574 1.00 2.56 O ATOM 0 H ASP A 13 -0.155 3.120 17.126 1.00 0.99 H new ATOM 0 HA ASP A 13 0.681 3.697 19.117 1.00 1.04 H new ATOM 0 HB2 ASP A 13 -1.293 4.765 20.621 1.00 1.22 H new ATOM 0 HB3 ASP A 13 -0.548 5.601 19.273 1.00 1.22 H new ATOM 201 N GLY A 14 0.308 1.531 20.442 1.00 1.05 N ATOM 202 CA GLY A 14 0.265 0.591 21.549 1.00 1.22 C ATOM 203 C GLY A 14 -1.071 -0.155 21.581 1.00 1.20 C ATOM 204 O GLY A 14 -1.567 -0.502 22.652 1.00 1.35 O ATOM 0 H GLY A 14 1.125 1.441 19.838 1.00 1.05 H new ATOM 0 HA2 GLY A 14 1.083 -0.124 21.456 1.00 1.22 H new ATOM 0 HA3 GLY A 14 0.412 1.123 22.489 1.00 1.22 H new ATOM 208 N GLU A 15 -1.615 -0.382 20.395 1.00 1.06 N ATOM 209 CA GLU A 15 -2.849 -1.140 20.269 1.00 1.08 C ATOM 210 C GLU A 15 -2.872 -1.898 18.940 1.00 0.94 C ATOM 211 O GLU A 15 -2.895 -1.286 17.873 1.00 0.95 O ATOM 212 CB GLU A 15 -4.069 -0.226 20.401 1.00 1.18 C ATOM 213 CG GLU A 15 -5.328 -1.036 20.714 1.00 1.35 C ATOM 214 CD GLU A 15 -5.406 -1.377 22.203 1.00 1.77 C ATOM 215 OE1 GLU A 15 -5.982 -0.552 22.945 1.00 2.60 O ATOM 216 OE2 GLU A 15 -4.887 -2.453 22.568 1.00 2.93 O ATOM 0 H GLU A 15 -1.224 -0.054 19.512 1.00 1.06 H new ATOM 0 HA GLU A 15 -2.892 -1.867 21.080 1.00 1.08 H new ATOM 0 HB2 GLU A 15 -3.897 0.505 21.191 1.00 1.18 H new ATOM 0 HB3 GLU A 15 -4.212 0.332 19.476 1.00 1.18 H new ATOM 0 HG2 GLU A 15 -6.211 -0.469 20.421 1.00 1.35 H new ATOM 0 HG3 GLU A 15 -5.329 -1.954 20.127 1.00 1.35 H new ATOM 223 N PRO A 16 -2.866 -3.253 19.052 1.00 0.87 N ATOM 224 CA PRO A 16 -2.889 -4.100 17.871 1.00 0.79 C ATOM 225 C PRO A 16 -4.283 -4.124 17.241 1.00 0.78 C ATOM 226 O PRO A 16 -5.215 -4.694 17.806 1.00 0.81 O ATOM 227 CB PRO A 16 -2.436 -5.467 18.360 1.00 0.82 C ATOM 228 CG PRO A 16 -2.622 -5.453 19.868 1.00 0.92 C ATOM 229 CD PRO A 16 -2.838 -4.011 20.298 1.00 0.96 C ATOM 0 HA PRO A 16 -2.234 -3.736 17.079 1.00 0.79 H new ATOM 0 HB2 PRO A 16 -3.025 -6.261 17.901 1.00 0.82 H new ATOM 0 HB3 PRO A 16 -1.394 -5.650 18.097 1.00 0.82 H new ATOM 0 HG2 PRO A 16 -3.475 -6.068 20.153 1.00 0.92 H new ATOM 0 HG3 PRO A 16 -1.747 -5.872 20.364 1.00 0.92 H new ATOM 0 HD2 PRO A 16 -3.770 -3.898 20.851 1.00 0.96 H new ATOM 0 HD3 PRO A 16 -2.036 -3.668 20.952 1.00 0.96 H new ATOM 237 N LEU A 17 -4.382 -3.498 16.077 1.00 0.85 N ATOM 238 CA LEU A 17 -5.657 -3.396 15.388 1.00 0.97 C ATOM 239 C LEU A 17 -6.095 -4.786 14.925 1.00 0.86 C ATOM 240 O LEU A 17 -7.262 -5.150 15.058 1.00 0.94 O ATOM 241 CB LEU A 17 -5.574 -2.368 14.256 1.00 1.20 C ATOM 242 CG LEU A 17 -6.623 -1.255 14.284 1.00 1.09 C ATOM 243 CD1 LEU A 17 -8.033 -1.827 14.140 1.00 1.63 C ATOM 244 CD2 LEU A 17 -6.478 -0.396 15.541 1.00 1.80 C ATOM 0 H LEU A 17 -3.600 -3.056 15.594 1.00 0.85 H new ATOM 0 HA LEU A 17 -6.427 -3.028 16.066 1.00 0.97 H new ATOM 0 HB2 LEU A 17 -4.585 -1.909 14.280 1.00 1.20 H new ATOM 0 HB3 LEU A 17 -5.658 -2.895 13.306 1.00 1.20 H new ATOM 0 HG LEU A 17 -6.452 -0.603 13.428 1.00 1.09 H new ATOM 0 HD11 LEU A 17 -8.759 -1.015 14.163 1.00 1.63 H new ATOM 0 HD12 LEU A 17 -8.114 -2.360 13.193 1.00 1.63 H new ATOM 0 HD13 LEU A 17 -8.232 -2.515 14.962 1.00 1.63 H new ATOM 0 HD21 LEU A 17 -7.236 0.388 15.536 1.00 1.80 H new ATOM 0 HD22 LEU A 17 -6.608 -1.020 16.425 1.00 1.80 H new ATOM 0 HD23 LEU A 17 -5.487 0.058 15.559 1.00 1.80 H new ATOM 256 N GLY A 18 -5.134 -5.526 14.391 1.00 0.78 N ATOM 257 CA GLY A 18 -5.390 -6.893 13.968 1.00 0.82 C ATOM 258 C GLY A 18 -4.640 -7.216 12.674 1.00 0.69 C ATOM 259 O GLY A 18 -3.928 -6.370 12.138 1.00 0.67 O ATOM 0 H GLY A 18 -4.177 -5.205 14.242 1.00 0.78 H new ATOM 0 HA2 GLY A 18 -5.083 -7.584 14.753 1.00 0.82 H new ATOM 0 HA3 GLY A 18 -6.460 -7.037 13.818 1.00 0.82 H new ATOM 263 N ARG A 19 -4.826 -8.443 12.211 1.00 0.89 N ATOM 264 CA ARG A 19 -4.093 -8.925 11.052 1.00 0.89 C ATOM 265 C ARG A 19 -4.781 -8.473 9.763 1.00 0.75 C ATOM 266 O ARG A 19 -6.007 -8.505 9.665 1.00 0.77 O ATOM 267 CB ARG A 19 -3.992 -10.451 11.061 1.00 1.00 C ATOM 268 CG ARG A 19 -3.242 -10.958 9.827 1.00 1.85 C ATOM 269 CD ARG A 19 -4.216 -11.458 8.759 1.00 3.79 C ATOM 270 NE ARG A 19 -5.003 -12.596 9.284 1.00 5.03 N ATOM 271 CZ ARG A 19 -6.112 -13.074 8.703 1.00 7.00 C ATOM 272 NH1 ARG A 19 -6.407 -12.734 7.442 1.00 8.05 N ATOM 273 NH2 ARG A 19 -6.924 -13.894 9.385 1.00 8.29 N ATOM 0 H ARG A 19 -5.474 -9.118 12.617 1.00 0.89 H new ATOM 0 HA ARG A 19 -3.088 -8.506 11.097 1.00 0.89 H new ATOM 0 HB2 ARG A 19 -3.478 -10.780 11.964 1.00 1.00 H new ATOM 0 HB3 ARG A 19 -4.991 -10.885 11.087 1.00 1.00 H new ATOM 0 HG2 ARG A 19 -2.627 -10.157 9.417 1.00 1.85 H new ATOM 0 HG3 ARG A 19 -2.566 -11.764 10.114 1.00 1.85 H new ATOM 0 HD2 ARG A 19 -4.884 -10.651 8.458 1.00 3.79 H new ATOM 0 HD3 ARG A 19 -3.666 -11.765 7.869 1.00 3.79 H new ATOM 0 HE ARG A 19 -4.681 -13.045 10.142 1.00 5.03 H new ATOM 0 HH11 ARG A 19 -5.788 -12.111 6.924 1.00 8.05 H new ATOM 0 HH12 ARG A 19 -7.251 -13.098 7.000 1.00 8.05 H new ATOM 0 HH21 ARG A 19 -6.698 -14.153 10.345 1.00 8.29 H new ATOM 0 HH22 ARG A 19 -7.768 -14.258 8.944 1.00 8.29 H new ATOM 287 N VAL A 20 -3.964 -8.062 8.805 1.00 0.88 N ATOM 288 CA VAL A 20 -4.465 -7.739 7.481 1.00 0.91 C ATOM 289 C VAL A 20 -3.700 -8.557 6.437 1.00 1.09 C ATOM 290 O VAL A 20 -2.473 -8.630 6.478 1.00 2.22 O ATOM 291 CB VAL A 20 -4.375 -6.231 7.241 1.00 0.97 C ATOM 292 CG1 VAL A 20 -5.245 -5.812 6.054 1.00 1.02 C ATOM 293 CG2 VAL A 20 -4.754 -5.451 8.501 1.00 1.24 C ATOM 0 H VAL A 20 -2.957 -7.945 8.920 1.00 0.88 H new ATOM 0 HA VAL A 20 -5.518 -8.006 7.396 1.00 0.91 H new ATOM 0 HB VAL A 20 -3.340 -5.992 6.999 1.00 0.97 H new ATOM 0 HG11 VAL A 20 -5.163 -4.735 5.905 1.00 1.02 H new ATOM 0 HG12 VAL A 20 -4.908 -6.329 5.156 1.00 1.02 H new ATOM 0 HG13 VAL A 20 -6.284 -6.072 6.255 1.00 1.02 H new ATOM 0 HG21 VAL A 20 -4.681 -4.382 8.303 1.00 1.24 H new ATOM 0 HG22 VAL A 20 -5.776 -5.698 8.788 1.00 1.24 H new ATOM 0 HG23 VAL A 20 -4.075 -5.716 9.311 1.00 1.24 H new ATOM 303 N SER A 21 -4.457 -9.151 5.527 1.00 0.66 N ATOM 304 CA SER A 21 -3.880 -10.062 4.552 1.00 0.60 C ATOM 305 C SER A 21 -4.061 -9.500 3.141 1.00 0.57 C ATOM 306 O SER A 21 -5.061 -8.845 2.853 1.00 0.68 O ATOM 307 CB SER A 21 -4.511 -11.451 4.656 1.00 0.71 C ATOM 308 OG SER A 21 -5.738 -11.428 5.379 1.00 1.49 O ATOM 0 H SER A 21 -5.465 -9.020 5.444 1.00 0.66 H new ATOM 0 HA SER A 21 -2.815 -10.160 4.763 1.00 0.60 H new ATOM 0 HB2 SER A 21 -4.688 -11.845 3.655 1.00 0.71 H new ATOM 0 HB3 SER A 21 -3.814 -12.130 5.147 1.00 0.71 H new ATOM 0 HG SER A 21 -6.287 -10.679 5.067 1.00 1.49 H new ATOM 314 N PHE A 22 -3.078 -9.778 2.297 1.00 0.56 N ATOM 315 CA PHE A 22 -3.132 -9.337 0.914 1.00 0.61 C ATOM 316 C PHE A 22 -2.590 -10.415 -0.027 1.00 0.70 C ATOM 317 O PHE A 22 -1.536 -10.995 0.228 1.00 0.93 O ATOM 318 CB PHE A 22 -2.247 -8.093 0.806 1.00 0.68 C ATOM 319 CG PHE A 22 -2.766 -6.891 1.599 1.00 0.56 C ATOM 320 CD1 PHE A 22 -2.540 -6.810 2.937 1.00 1.56 C ATOM 321 CD2 PHE A 22 -3.452 -5.903 0.964 1.00 1.63 C ATOM 322 CE1 PHE A 22 -3.020 -5.695 3.672 1.00 1.50 C ATOM 323 CE2 PHE A 22 -3.933 -4.788 1.699 1.00 1.84 C ATOM 324 CZ PHE A 22 -3.707 -4.707 3.039 1.00 0.92 C ATOM 0 H PHE A 22 -2.240 -10.303 2.545 1.00 0.56 H new ATOM 0 HA PHE A 22 -4.164 -9.129 0.630 1.00 0.61 H new ATOM 0 HB2 PHE A 22 -1.245 -8.341 1.155 1.00 0.68 H new ATOM 0 HB3 PHE A 22 -2.158 -7.812 -0.244 1.00 0.68 H new ATOM 0 HD1 PHE A 22 -1.995 -7.595 3.441 1.00 1.56 H new ATOM 0 HD2 PHE A 22 -3.631 -5.967 -0.099 1.00 1.63 H new ATOM 0 HE1 PHE A 22 -2.839 -5.631 4.735 1.00 1.50 H new ATOM 0 HE2 PHE A 22 -4.478 -4.004 1.195 1.00 1.84 H new ATOM 0 HZ PHE A 22 -4.073 -3.859 3.599 1.00 0.92 H new ATOM 334 N GLU A 23 -3.337 -10.652 -1.095 1.00 0.63 N ATOM 335 CA GLU A 23 -2.929 -11.628 -2.092 1.00 0.71 C ATOM 336 C GLU A 23 -2.287 -10.926 -3.289 1.00 0.78 C ATOM 337 O GLU A 23 -2.721 -9.846 -3.687 1.00 1.56 O ATOM 338 CB GLU A 23 -4.114 -12.489 -2.532 1.00 0.82 C ATOM 339 CG GLU A 23 -5.104 -11.675 -3.370 1.00 1.70 C ATOM 340 CD GLU A 23 -6.385 -12.471 -3.633 1.00 1.66 C ATOM 341 OE1 GLU A 23 -6.251 -13.634 -4.068 1.00 2.15 O ATOM 342 OE2 GLU A 23 -7.468 -11.896 -3.391 1.00 2.17 O ATOM 0 H GLU A 23 -4.222 -10.185 -1.292 1.00 0.63 H new ATOM 0 HA GLU A 23 -2.188 -12.290 -1.644 1.00 0.71 H new ATOM 0 HB2 GLU A 23 -3.755 -13.339 -3.112 1.00 0.82 H new ATOM 0 HB3 GLU A 23 -4.620 -12.892 -1.655 1.00 0.82 H new ATOM 0 HG2 GLU A 23 -5.348 -10.748 -2.852 1.00 1.70 H new ATOM 0 HG3 GLU A 23 -4.642 -11.399 -4.318 1.00 1.70 H new ATOM 349 N LEU A 24 -1.262 -11.569 -3.832 1.00 0.87 N ATOM 350 CA LEU A 24 -0.516 -10.990 -4.935 1.00 0.85 C ATOM 351 C LEU A 24 -0.726 -11.841 -6.189 1.00 0.88 C ATOM 352 O LEU A 24 -0.360 -13.015 -6.216 1.00 1.24 O ATOM 353 CB LEU A 24 0.955 -10.813 -4.552 1.00 0.95 C ATOM 354 CG LEU A 24 1.254 -9.720 -3.523 1.00 0.94 C ATOM 355 CD1 LEU A 24 0.644 -8.383 -3.951 1.00 2.03 C ATOM 356 CD2 LEU A 24 0.790 -10.141 -2.127 1.00 2.06 C ATOM 0 H LEU A 24 -0.932 -12.485 -3.528 1.00 0.87 H new ATOM 0 HA LEU A 24 -0.886 -9.990 -5.162 1.00 0.85 H new ATOM 0 HB2 LEU A 24 1.325 -11.762 -4.163 1.00 0.95 H new ATOM 0 HB3 LEU A 24 1.522 -10.597 -5.457 1.00 0.95 H new ATOM 0 HG LEU A 24 2.334 -9.581 -3.475 1.00 0.94 H new ATOM 0 HD11 LEU A 24 0.871 -7.623 -3.203 1.00 2.03 H new ATOM 0 HD12 LEU A 24 1.063 -8.083 -4.911 1.00 2.03 H new ATOM 0 HD13 LEU A 24 -0.437 -8.489 -4.044 1.00 2.03 H new ATOM 0 HD21 LEU A 24 1.014 -9.347 -1.414 1.00 2.06 H new ATOM 0 HD22 LEU A 24 -0.284 -10.324 -2.141 1.00 2.06 H new ATOM 0 HD23 LEU A 24 1.310 -11.052 -1.830 1.00 2.06 H new ATOM 368 N PHE A 25 -1.314 -11.214 -7.198 1.00 0.71 N ATOM 369 CA PHE A 25 -1.570 -11.897 -8.455 1.00 0.72 C ATOM 370 C PHE A 25 -0.291 -12.005 -9.290 1.00 0.74 C ATOM 371 O PHE A 25 -0.140 -11.308 -10.293 1.00 0.90 O ATOM 372 CB PHE A 25 -2.595 -11.058 -9.219 1.00 0.77 C ATOM 373 CG PHE A 25 -4.048 -11.365 -8.854 1.00 1.00 C ATOM 374 CD1 PHE A 25 -4.523 -11.039 -7.622 1.00 1.67 C ATOM 375 CD2 PHE A 25 -4.865 -11.965 -9.762 1.00 2.17 C ATOM 376 CE1 PHE A 25 -5.873 -11.326 -7.284 1.00 1.81 C ATOM 377 CE2 PHE A 25 -6.214 -12.251 -9.423 1.00 2.49 C ATOM 378 CZ PHE A 25 -6.689 -11.925 -8.190 1.00 1.72 C ATOM 0 H PHE A 25 -1.620 -10.241 -7.171 1.00 0.71 H new ATOM 0 HA PHE A 25 -1.933 -12.907 -8.263 1.00 0.72 H new ATOM 0 HB2 PHE A 25 -2.399 -10.003 -9.029 1.00 0.77 H new ATOM 0 HB3 PHE A 25 -2.458 -11.221 -10.288 1.00 0.77 H new ATOM 0 HD1 PHE A 25 -3.875 -10.563 -6.901 1.00 1.67 H new ATOM 0 HD2 PHE A 25 -4.487 -12.224 -10.740 1.00 2.17 H new ATOM 0 HE1 PHE A 25 -6.251 -11.068 -6.306 1.00 1.81 H new ATOM 0 HE2 PHE A 25 -6.863 -12.727 -10.143 1.00 2.49 H new ATOM 0 HZ PHE A 25 -7.715 -12.143 -7.932 1.00 1.72 H new ATOM 388 N ALA A 26 0.595 -12.885 -8.847 1.00 0.66 N ATOM 389 CA ALA A 26 1.835 -13.125 -9.566 1.00 0.76 C ATOM 390 C ALA A 26 1.518 -13.768 -10.918 1.00 0.81 C ATOM 391 O ALA A 26 2.311 -13.674 -11.854 1.00 1.00 O ATOM 392 CB ALA A 26 2.760 -13.992 -8.710 1.00 0.87 C ATOM 0 H ALA A 26 0.479 -13.440 -7.999 1.00 0.66 H new ATOM 0 HA ALA A 26 2.355 -12.187 -9.761 1.00 0.76 H new ATOM 0 HB1 ALA A 26 3.690 -14.173 -9.248 1.00 0.87 H new ATOM 0 HB2 ALA A 26 2.977 -13.478 -7.773 1.00 0.87 H new ATOM 0 HB3 ALA A 26 2.273 -14.944 -8.498 1.00 0.87 H new ATOM 398 N ASP A 27 0.359 -14.406 -10.977 1.00 0.85 N ATOM 399 CA ASP A 27 -0.095 -15.020 -12.213 1.00 0.93 C ATOM 400 C ASP A 27 -0.088 -13.975 -13.329 1.00 0.95 C ATOM 401 O ASP A 27 0.340 -14.258 -14.447 1.00 1.30 O ATOM 402 CB ASP A 27 -1.522 -15.554 -12.072 1.00 1.03 C ATOM 403 CG ASP A 27 -2.233 -15.855 -13.392 1.00 1.40 C ATOM 404 OD1 ASP A 27 -2.074 -16.996 -13.876 1.00 1.99 O ATOM 405 OD2 ASP A 27 -2.921 -14.936 -13.888 1.00 2.60 O ATOM 0 H ASP A 27 -0.280 -14.511 -10.189 1.00 0.85 H new ATOM 0 HA ASP A 27 0.577 -15.846 -12.445 1.00 0.93 H new ATOM 0 HB2 ASP A 27 -1.495 -16.466 -11.475 1.00 1.03 H new ATOM 0 HB3 ASP A 27 -2.113 -14.826 -11.516 1.00 1.03 H new ATOM 410 N LYS A 28 -0.570 -12.789 -12.989 1.00 0.99 N ATOM 411 CA LYS A 28 -0.771 -11.749 -13.983 1.00 1.07 C ATOM 412 C LYS A 28 0.514 -10.928 -14.123 1.00 1.02 C ATOM 413 O LYS A 28 0.845 -10.469 -15.214 1.00 1.17 O ATOM 414 CB LYS A 28 -2.002 -10.909 -13.638 1.00 1.18 C ATOM 415 CG LYS A 28 -2.779 -10.529 -14.901 1.00 1.60 C ATOM 416 CD LYS A 28 -3.658 -11.689 -15.373 1.00 2.24 C ATOM 417 CE LYS A 28 -4.999 -11.695 -14.635 1.00 2.07 C ATOM 418 NZ LYS A 28 -5.951 -10.765 -15.283 1.00 3.62 N ATOM 0 H LYS A 28 -0.827 -12.525 -12.038 1.00 0.99 H new ATOM 0 HA LYS A 28 -0.977 -12.189 -14.959 1.00 1.07 H new ATOM 0 HB2 LYS A 28 -2.650 -11.467 -12.962 1.00 1.18 H new ATOM 0 HB3 LYS A 28 -1.694 -10.006 -13.111 1.00 1.18 H new ATOM 0 HG2 LYS A 28 -3.400 -9.655 -14.702 1.00 1.60 H new ATOM 0 HG3 LYS A 28 -2.082 -10.251 -15.691 1.00 1.60 H new ATOM 0 HD2 LYS A 28 -3.830 -11.607 -16.446 1.00 2.24 H new ATOM 0 HD3 LYS A 28 -3.141 -12.634 -15.204 1.00 2.24 H new ATOM 0 HE2 LYS A 28 -5.413 -12.703 -14.629 1.00 2.07 H new ATOM 0 HE3 LYS A 28 -4.850 -11.406 -13.595 1.00 2.07 H new ATOM 0 HZ1 LYS A 28 -6.856 -10.781 -14.770 1.00 3.62 H new ATOM 0 HZ2 LYS A 28 -5.561 -9.801 -15.266 1.00 3.62 H new ATOM 0 HZ3 LYS A 28 -6.107 -11.058 -16.269 1.00 3.62 H new ATOM 432 N VAL A 29 1.201 -10.768 -13.002 1.00 0.96 N ATOM 433 CA VAL A 29 2.402 -9.951 -12.970 1.00 1.12 C ATOM 434 C VAL A 29 3.469 -10.651 -12.126 1.00 1.31 C ATOM 435 O VAL A 29 3.689 -10.288 -10.971 1.00 1.36 O ATOM 436 CB VAL A 29 2.066 -8.546 -12.464 1.00 1.10 C ATOM 437 CG1 VAL A 29 1.450 -7.696 -13.576 1.00 1.06 C ATOM 438 CG2 VAL A 29 1.142 -8.609 -11.247 1.00 1.15 C ATOM 0 H VAL A 29 0.949 -11.190 -12.109 1.00 0.96 H new ATOM 0 HA VAL A 29 2.809 -9.832 -13.974 1.00 1.12 H new ATOM 0 HB VAL A 29 2.996 -8.070 -12.155 1.00 1.10 H new ATOM 0 HG11 VAL A 29 1.221 -6.703 -13.190 1.00 1.06 H new ATOM 0 HG12 VAL A 29 2.156 -7.610 -14.402 1.00 1.06 H new ATOM 0 HG13 VAL A 29 0.534 -8.168 -13.930 1.00 1.06 H new ATOM 0 HG21 VAL A 29 0.919 -7.598 -10.907 1.00 1.15 H new ATOM 0 HG22 VAL A 29 0.215 -9.113 -11.520 1.00 1.15 H new ATOM 0 HG23 VAL A 29 1.633 -9.161 -10.446 1.00 1.15 H new ATOM 448 N PRO A 30 4.119 -11.669 -12.750 1.00 1.52 N ATOM 449 CA PRO A 30 5.186 -12.396 -12.084 1.00 1.79 C ATOM 450 C PRO A 30 6.468 -11.562 -12.032 1.00 2.12 C ATOM 451 O PRO A 30 7.499 -11.970 -12.564 1.00 3.57 O ATOM 452 CB PRO A 30 5.345 -13.680 -12.881 1.00 1.99 C ATOM 453 CG PRO A 30 4.689 -13.419 -14.227 1.00 1.95 C ATOM 454 CD PRO A 30 3.857 -12.154 -14.103 1.00 1.63 C ATOM 0 HA PRO A 30 4.958 -12.616 -11.041 1.00 1.79 H new ATOM 0 HB2 PRO A 30 6.397 -13.936 -13.003 1.00 1.99 H new ATOM 0 HB3 PRO A 30 4.870 -14.518 -12.371 1.00 1.99 H new ATOM 0 HG2 PRO A 30 5.445 -13.304 -15.004 1.00 1.95 H new ATOM 0 HG3 PRO A 30 4.061 -14.262 -14.515 1.00 1.95 H new ATOM 0 HD2 PRO A 30 4.145 -11.416 -14.851 1.00 1.63 H new ATOM 0 HD3 PRO A 30 2.797 -12.361 -14.251 1.00 1.63 H new ATOM 462 N LYS A 31 6.362 -10.411 -11.386 1.00 1.34 N ATOM 463 CA LYS A 31 7.493 -9.505 -11.279 1.00 1.41 C ATOM 464 C LYS A 31 7.178 -8.423 -10.244 1.00 1.30 C ATOM 465 O LYS A 31 7.989 -8.150 -9.360 1.00 1.36 O ATOM 466 CB LYS A 31 7.868 -8.950 -12.655 1.00 1.55 C ATOM 467 CG LYS A 31 8.896 -7.824 -12.529 1.00 1.67 C ATOM 468 CD LYS A 31 9.234 -7.235 -13.901 1.00 2.02 C ATOM 469 CE LYS A 31 9.519 -5.736 -13.799 1.00 3.08 C ATOM 470 NZ LYS A 31 9.568 -5.126 -15.146 1.00 4.10 N ATOM 0 H LYS A 31 5.510 -10.084 -10.931 1.00 1.34 H new ATOM 0 HA LYS A 31 8.376 -10.038 -10.925 1.00 1.41 H new ATOM 0 HB2 LYS A 31 8.273 -9.749 -13.276 1.00 1.55 H new ATOM 0 HB3 LYS A 31 6.975 -8.578 -13.157 1.00 1.55 H new ATOM 0 HG2 LYS A 31 8.505 -7.041 -11.879 1.00 1.67 H new ATOM 0 HG3 LYS A 31 9.803 -8.205 -12.059 1.00 1.67 H new ATOM 0 HD2 LYS A 31 10.102 -7.746 -14.316 1.00 2.02 H new ATOM 0 HD3 LYS A 31 8.405 -7.405 -14.588 1.00 2.02 H new ATOM 0 HE2 LYS A 31 8.746 -5.252 -13.202 1.00 3.08 H new ATOM 0 HE3 LYS A 31 10.466 -5.574 -13.285 1.00 3.08 H new ATOM 0 HZ1 LYS A 31 9.927 -4.153 -15.073 1.00 4.10 H new ATOM 0 HZ2 LYS A 31 10.199 -5.683 -15.757 1.00 4.10 H new ATOM 0 HZ3 LYS A 31 8.612 -5.113 -15.556 1.00 4.10 H new ATOM 484 N THR A 32 5.998 -7.837 -10.388 1.00 1.18 N ATOM 485 CA THR A 32 5.569 -6.787 -9.480 1.00 1.10 C ATOM 486 C THR A 32 5.218 -7.376 -8.112 1.00 0.97 C ATOM 487 O THR A 32 5.353 -6.705 -7.090 1.00 0.95 O ATOM 488 CB THR A 32 4.406 -6.041 -10.137 1.00 1.06 C ATOM 489 OG1 THR A 32 4.960 -5.525 -11.343 1.00 1.04 O ATOM 490 CG2 THR A 32 3.993 -4.793 -9.353 1.00 1.11 C ATOM 0 H THR A 32 5.326 -8.069 -11.119 1.00 1.18 H new ATOM 0 HA THR A 32 6.370 -6.072 -9.295 1.00 1.10 H new ATOM 0 HB THR A 32 3.552 -6.712 -10.229 1.00 1.06 H new ATOM 0 HG1 THR A 32 5.140 -6.263 -11.962 1.00 1.04 H new ATOM 0 HG21 THR A 32 3.164 -4.301 -9.862 1.00 1.11 H new ATOM 0 HG22 THR A 32 3.682 -5.081 -8.349 1.00 1.11 H new ATOM 0 HG23 THR A 32 4.838 -4.107 -9.289 1.00 1.11 H new ATOM 498 N ALA A 33 4.774 -8.625 -8.137 1.00 0.96 N ATOM 499 CA ALA A 33 4.420 -9.318 -6.910 1.00 0.89 C ATOM 500 C ALA A 33 5.653 -9.411 -6.008 1.00 0.74 C ATOM 501 O ALA A 33 5.544 -9.292 -4.789 1.00 0.73 O ATOM 502 CB ALA A 33 3.842 -10.694 -7.249 1.00 1.02 C ATOM 0 H ALA A 33 4.652 -9.174 -8.988 1.00 0.96 H new ATOM 0 HA ALA A 33 3.653 -8.767 -6.366 1.00 0.89 H new ATOM 0 HB1 ALA A 33 3.576 -11.214 -6.329 1.00 1.02 H new ATOM 0 HB2 ALA A 33 2.952 -10.573 -7.867 1.00 1.02 H new ATOM 0 HB3 ALA A 33 4.585 -11.277 -7.793 1.00 1.02 H new ATOM 508 N GLU A 34 6.797 -9.620 -6.642 1.00 0.74 N ATOM 509 CA GLU A 34 8.042 -9.771 -5.909 1.00 0.76 C ATOM 510 C GLU A 34 8.251 -8.584 -4.968 1.00 0.75 C ATOM 511 O GLU A 34 8.617 -8.763 -3.807 1.00 0.80 O ATOM 512 CB GLU A 34 9.226 -9.928 -6.865 1.00 0.93 C ATOM 513 CG GLU A 34 10.544 -10.025 -6.095 1.00 1.25 C ATOM 514 CD GLU A 34 10.619 -11.329 -5.298 1.00 2.20 C ATOM 515 OE1 GLU A 34 10.107 -12.343 -5.819 1.00 2.58 O ATOM 516 OE2 GLU A 34 11.187 -11.282 -4.184 1.00 3.52 O ATOM 0 H GLU A 34 6.888 -9.688 -7.656 1.00 0.74 H new ATOM 0 HA GLU A 34 7.979 -10.679 -5.309 1.00 0.76 H new ATOM 0 HB2 GLU A 34 9.090 -10.822 -7.474 1.00 0.93 H new ATOM 0 HB3 GLU A 34 9.261 -9.079 -7.548 1.00 0.93 H new ATOM 0 HG2 GLU A 34 11.381 -9.972 -6.791 1.00 1.25 H new ATOM 0 HG3 GLU A 34 10.637 -9.175 -5.419 1.00 1.25 H new ATOM 523 N ASN A 35 8.010 -7.395 -5.503 1.00 0.84 N ATOM 524 CA ASN A 35 8.279 -6.173 -4.765 1.00 1.01 C ATOM 525 C ASN A 35 7.615 -6.257 -3.389 1.00 1.08 C ATOM 526 O ASN A 35 8.289 -6.170 -2.363 1.00 1.65 O ATOM 527 CB ASN A 35 7.710 -4.954 -5.491 1.00 1.35 C ATOM 528 CG ASN A 35 8.047 -3.663 -4.743 1.00 2.24 C ATOM 529 OD1 ASN A 35 7.201 -3.028 -4.135 1.00 3.74 O ATOM 530 ND2 ASN A 35 9.328 -3.311 -4.821 1.00 2.58 N ATOM 0 H ASN A 35 7.631 -7.253 -6.439 1.00 0.84 H new ATOM 0 HA ASN A 35 9.360 -6.065 -4.674 1.00 1.01 H new ATOM 0 HB2 ASN A 35 8.113 -4.908 -6.503 1.00 1.35 H new ATOM 0 HB3 ASN A 35 6.628 -5.053 -5.583 1.00 1.35 H new ATOM 0 HD21 ASN A 35 9.653 -2.464 -4.355 1.00 2.58 H new ATOM 0 HD22 ASN A 35 9.984 -3.888 -5.347 1.00 2.58 H new ATOM 537 N PHE A 36 6.300 -6.424 -3.410 1.00 0.99 N ATOM 538 CA PHE A 36 5.517 -6.350 -2.190 1.00 1.01 C ATOM 539 C PHE A 36 5.742 -7.586 -1.317 1.00 0.94 C ATOM 540 O PHE A 36 5.873 -7.475 -0.099 1.00 0.98 O ATOM 541 CB PHE A 36 4.045 -6.296 -2.606 1.00 1.12 C ATOM 542 CG PHE A 36 3.094 -5.888 -1.479 1.00 1.70 C ATOM 543 CD1 PHE A 36 2.640 -6.821 -0.601 1.00 2.99 C ATOM 544 CD2 PHE A 36 2.704 -4.591 -1.356 1.00 2.47 C ATOM 545 CE1 PHE A 36 1.757 -6.442 0.445 1.00 3.69 C ATOM 546 CE2 PHE A 36 1.821 -4.211 -0.311 1.00 3.13 C ATOM 547 CZ PHE A 36 1.366 -5.145 0.568 1.00 3.33 C ATOM 0 H PHE A 36 5.758 -6.610 -4.254 1.00 0.99 H new ATOM 0 HA PHE A 36 5.810 -5.473 -1.613 1.00 1.01 H new ATOM 0 HB2 PHE A 36 3.937 -5.592 -3.431 1.00 1.12 H new ATOM 0 HB3 PHE A 36 3.748 -7.275 -2.981 1.00 1.12 H new ATOM 0 HD1 PHE A 36 2.951 -7.851 -0.699 1.00 2.99 H new ATOM 0 HD2 PHE A 36 3.066 -3.850 -2.053 1.00 2.47 H new ATOM 0 HE1 PHE A 36 1.396 -7.183 1.142 1.00 3.69 H new ATOM 0 HE2 PHE A 36 1.511 -3.181 -0.214 1.00 3.13 H new ATOM 0 HZ PHE A 36 0.695 -4.856 1.363 1.00 3.33 H new ATOM 557 N ARG A 37 5.782 -8.737 -1.974 1.00 0.91 N ATOM 558 CA ARG A 37 5.975 -9.993 -1.271 1.00 0.99 C ATOM 559 C ARG A 37 7.343 -10.014 -0.586 1.00 0.97 C ATOM 560 O ARG A 37 7.502 -10.625 0.469 1.00 1.06 O ATOM 561 CB ARG A 37 5.875 -11.182 -2.230 1.00 1.10 C ATOM 562 CG ARG A 37 5.891 -12.507 -1.465 1.00 1.58 C ATOM 563 CD ARG A 37 7.133 -13.327 -1.815 1.00 1.64 C ATOM 564 NE ARG A 37 7.077 -13.753 -3.232 1.00 2.38 N ATOM 565 CZ ARG A 37 8.115 -13.690 -4.077 1.00 3.53 C ATOM 566 NH1 ARG A 37 9.368 -13.696 -3.602 1.00 4.51 N ATOM 567 NH2 ARG A 37 7.900 -13.621 -5.398 1.00 4.70 N ATOM 0 H ARG A 37 5.684 -8.825 -2.985 1.00 0.91 H new ATOM 0 HA ARG A 37 5.188 -10.077 -0.521 1.00 0.99 H new ATOM 0 HB2 ARG A 37 4.958 -11.106 -2.814 1.00 1.10 H new ATOM 0 HB3 ARG A 37 6.705 -11.155 -2.936 1.00 1.10 H new ATOM 0 HG2 ARG A 37 5.870 -12.312 -0.393 1.00 1.58 H new ATOM 0 HG3 ARG A 37 4.994 -13.079 -1.703 1.00 1.58 H new ATOM 0 HD2 ARG A 37 8.031 -12.734 -1.640 1.00 1.64 H new ATOM 0 HD3 ARG A 37 7.196 -14.201 -1.166 1.00 1.64 H new ATOM 0 HE ARG A 37 6.193 -14.117 -3.587 1.00 2.38 H new ATOM 0 HH11 ARG A 37 9.532 -13.749 -2.597 1.00 4.51 H new ATOM 0 HH12 ARG A 37 10.158 -13.648 -4.246 1.00 4.51 H new ATOM 0 HH21 ARG A 37 6.946 -13.616 -5.760 1.00 4.70 H new ATOM 0 HH22 ARG A 37 8.690 -13.573 -6.041 1.00 4.70 H new ATOM 581 N ALA A 38 8.294 -9.338 -1.213 1.00 0.94 N ATOM 582 CA ALA A 38 9.639 -9.260 -0.670 1.00 0.98 C ATOM 583 C ALA A 38 9.641 -8.330 0.544 1.00 0.99 C ATOM 584 O ALA A 38 10.248 -8.641 1.568 1.00 1.11 O ATOM 585 CB ALA A 38 10.605 -8.797 -1.762 1.00 0.99 C ATOM 0 H ALA A 38 8.160 -8.839 -2.092 1.00 0.94 H new ATOM 0 HA ALA A 38 9.975 -10.241 -0.334 1.00 0.98 H new ATOM 0 HB1 ALA A 38 11.614 -8.739 -1.354 1.00 0.99 H new ATOM 0 HB2 ALA A 38 10.588 -9.508 -2.588 1.00 0.99 H new ATOM 0 HB3 ALA A 38 10.302 -7.814 -2.123 1.00 0.99 H new ATOM 591 N LEU A 39 8.955 -7.207 0.390 1.00 0.92 N ATOM 592 CA LEU A 39 8.904 -6.210 1.447 1.00 0.99 C ATOM 593 C LEU A 39 8.208 -6.806 2.671 1.00 1.09 C ATOM 594 O LEU A 39 8.580 -6.511 3.806 1.00 1.30 O ATOM 595 CB LEU A 39 8.257 -4.921 0.936 1.00 1.02 C ATOM 596 CG LEU A 39 9.087 -4.099 -0.052 1.00 1.00 C ATOM 597 CD1 LEU A 39 8.192 -3.186 -0.893 1.00 1.31 C ATOM 598 CD2 LEU A 39 10.185 -3.318 0.671 1.00 1.31 C ATOM 0 H LEU A 39 8.430 -6.965 -0.450 1.00 0.92 H new ATOM 0 HA LEU A 39 9.911 -5.932 1.758 1.00 0.99 H new ATOM 0 HB2 LEU A 39 7.311 -5.177 0.460 1.00 1.02 H new ATOM 0 HB3 LEU A 39 8.022 -4.291 1.794 1.00 1.02 H new ATOM 0 HG LEU A 39 9.581 -4.787 -0.738 1.00 1.00 H new ATOM 0 HD11 LEU A 39 8.807 -2.613 -1.587 1.00 1.31 H new ATOM 0 HD12 LEU A 39 7.480 -3.791 -1.454 1.00 1.31 H new ATOM 0 HD13 LEU A 39 7.651 -2.503 -0.238 1.00 1.31 H new ATOM 0 HD21 LEU A 39 10.760 -2.742 -0.054 1.00 1.31 H new ATOM 0 HD22 LEU A 39 9.733 -2.641 1.395 1.00 1.31 H new ATOM 0 HD23 LEU A 39 10.846 -4.014 1.188 1.00 1.31 H new ATOM 610 N SER A 40 7.209 -7.633 2.400 1.00 1.11 N ATOM 611 CA SER A 40 6.454 -8.269 3.466 1.00 1.24 C ATOM 612 C SER A 40 7.301 -9.358 4.128 1.00 1.43 C ATOM 613 O SER A 40 7.205 -9.576 5.334 1.00 1.71 O ATOM 614 CB SER A 40 5.147 -8.861 2.937 1.00 1.40 C ATOM 615 OG SER A 40 4.371 -7.897 2.230 1.00 2.47 O ATOM 0 H SER A 40 6.905 -7.877 1.458 1.00 1.11 H new ATOM 0 HA SER A 40 6.203 -7.511 4.208 1.00 1.24 H new ATOM 0 HB2 SER A 40 5.370 -9.700 2.278 1.00 1.40 H new ATOM 0 HB3 SER A 40 4.564 -9.255 3.770 1.00 1.40 H new ATOM 0 HG SER A 40 4.824 -7.662 1.393 1.00 2.47 H new ATOM 621 N THR A 41 8.109 -10.014 3.309 1.00 1.45 N ATOM 622 CA THR A 41 8.973 -11.074 3.801 1.00 1.75 C ATOM 623 C THR A 41 10.031 -10.503 4.748 1.00 2.06 C ATOM 624 O THR A 41 10.231 -11.022 5.845 1.00 3.06 O ATOM 625 CB THR A 41 9.568 -11.798 2.591 1.00 1.81 C ATOM 626 OG1 THR A 41 8.505 -12.623 2.123 1.00 3.52 O ATOM 627 CG2 THR A 41 10.664 -12.792 2.984 1.00 1.74 C ATOM 0 H THR A 41 8.184 -9.832 2.308 1.00 1.45 H new ATOM 0 HA THR A 41 8.413 -11.800 4.390 1.00 1.75 H new ATOM 0 HB THR A 41 9.974 -11.065 1.894 1.00 1.81 H new ATOM 0 HG1 THR A 41 7.960 -12.121 1.481 1.00 3.52 H new ATOM 0 HG21 THR A 41 11.052 -13.278 2.089 1.00 1.74 H new ATOM 0 HG22 THR A 41 11.472 -12.262 3.489 1.00 1.74 H new ATOM 0 HG23 THR A 41 10.249 -13.545 3.655 1.00 1.74 H new ATOM 635 N GLY A 42 10.680 -9.443 4.289 1.00 1.68 N ATOM 636 CA GLY A 42 11.665 -8.756 5.107 1.00 2.42 C ATOM 637 C GLY A 42 13.077 -9.263 4.808 1.00 2.21 C ATOM 638 O GLY A 42 14.003 -8.471 4.645 1.00 2.43 O ATOM 0 H GLY A 42 10.543 -9.043 3.361 1.00 1.68 H new ATOM 0 HA2 GLY A 42 11.613 -7.683 4.921 1.00 2.42 H new ATOM 0 HA3 GLY A 42 11.436 -8.908 6.162 1.00 2.42 H new ATOM 642 N GLU A 43 13.196 -10.581 4.745 1.00 2.54 N ATOM 643 CA GLU A 43 14.472 -11.203 4.435 1.00 2.95 C ATOM 644 C GLU A 43 14.753 -11.120 2.932 1.00 3.28 C ATOM 645 O GLU A 43 15.029 -12.133 2.292 1.00 4.44 O ATOM 646 CB GLU A 43 14.507 -12.655 4.919 1.00 3.94 C ATOM 647 CG GLU A 43 14.384 -12.726 6.443 1.00 5.13 C ATOM 648 CD GLU A 43 14.368 -14.179 6.923 1.00 6.30 C ATOM 649 OE1 GLU A 43 13.297 -14.811 6.784 1.00 6.82 O ATOM 650 OE2 GLU A 43 15.425 -14.626 7.418 1.00 7.14 O ATOM 0 H GLU A 43 12.430 -11.235 4.903 1.00 2.54 H new ATOM 0 HA GLU A 43 15.256 -10.659 4.962 1.00 2.95 H new ATOM 0 HB2 GLU A 43 13.694 -13.216 4.458 1.00 3.94 H new ATOM 0 HB3 GLU A 43 15.438 -13.126 4.603 1.00 3.94 H new ATOM 0 HG2 GLU A 43 15.217 -12.196 6.904 1.00 5.13 H new ATOM 0 HG3 GLU A 43 13.471 -12.223 6.762 1.00 5.13 H new ATOM 657 N LYS A 44 14.673 -9.903 2.415 1.00 2.86 N ATOM 658 CA LYS A 44 14.923 -9.673 1.003 1.00 3.48 C ATOM 659 C LYS A 44 15.059 -8.170 0.752 1.00 3.61 C ATOM 660 O LYS A 44 14.665 -7.675 -0.303 1.00 4.97 O ATOM 661 CB LYS A 44 13.843 -10.343 0.151 1.00 4.43 C ATOM 662 CG LYS A 44 14.468 -11.174 -0.971 1.00 4.72 C ATOM 663 CD LYS A 44 15.244 -10.286 -1.946 1.00 3.77 C ATOM 664 CE LYS A 44 14.291 -9.498 -2.848 1.00 3.61 C ATOM 665 NZ LYS A 44 13.531 -10.415 -3.724 1.00 4.92 N ATOM 0 H LYS A 44 14.439 -9.066 2.949 1.00 2.86 H new ATOM 0 HA LYS A 44 15.864 -10.134 0.703 1.00 3.48 H new ATOM 0 HB2 LYS A 44 13.223 -10.982 0.780 1.00 4.43 H new ATOM 0 HB3 LYS A 44 13.188 -9.583 -0.276 1.00 4.43 H new ATOM 0 HG2 LYS A 44 15.136 -11.922 -0.545 1.00 4.72 H new ATOM 0 HG3 LYS A 44 13.687 -11.713 -1.507 1.00 4.72 H new ATOM 0 HD2 LYS A 44 15.878 -9.596 -1.389 1.00 3.77 H new ATOM 0 HD3 LYS A 44 15.904 -10.901 -2.558 1.00 3.77 H new ATOM 0 HE2 LYS A 44 13.602 -8.914 -2.237 1.00 3.61 H new ATOM 0 HE3 LYS A 44 14.856 -8.791 -3.455 1.00 3.61 H new ATOM 0 HZ1 LYS A 44 13.662 -10.135 -4.717 1.00 4.92 H new ATOM 0 HZ2 LYS A 44 13.875 -11.387 -3.591 1.00 4.92 H new ATOM 0 HZ3 LYS A 44 12.521 -10.369 -3.481 1.00 4.92 H new ATOM 679 N GLY A 45 15.620 -7.486 1.738 1.00 2.69 N ATOM 680 CA GLY A 45 15.688 -6.035 1.699 1.00 3.29 C ATOM 681 C GLY A 45 14.529 -5.410 2.477 1.00 3.24 C ATOM 682 O GLY A 45 13.789 -4.586 1.942 1.00 4.61 O ATOM 0 H GLY A 45 16.032 -7.910 2.569 1.00 2.69 H new ATOM 0 HA2 GLY A 45 16.636 -5.701 2.121 1.00 3.29 H new ATOM 0 HA3 GLY A 45 15.662 -5.694 0.664 1.00 3.29 H new ATOM 686 N PHE A 46 14.405 -5.826 3.728 1.00 2.20 N ATOM 687 CA PHE A 46 13.514 -5.152 4.658 1.00 2.18 C ATOM 688 C PHE A 46 12.128 -4.953 4.042 1.00 1.78 C ATOM 689 O PHE A 46 11.831 -5.503 2.984 1.00 1.76 O ATOM 690 CB PHE A 46 14.130 -3.781 4.952 1.00 2.21 C ATOM 691 CG PHE A 46 14.303 -2.898 3.715 1.00 1.88 C ATOM 692 CD1 PHE A 46 13.252 -2.176 3.243 1.00 2.55 C ATOM 693 CD2 PHE A 46 15.508 -2.837 3.087 1.00 2.17 C ATOM 694 CE1 PHE A 46 13.414 -1.356 2.095 1.00 2.76 C ATOM 695 CE2 PHE A 46 15.669 -2.016 1.939 1.00 2.35 C ATOM 696 CZ PHE A 46 14.617 -1.294 1.467 1.00 2.33 C ATOM 0 H PHE A 46 14.907 -6.622 4.120 1.00 2.20 H new ATOM 0 HA PHE A 46 13.398 -5.749 5.562 1.00 2.18 H new ATOM 0 HB2 PHE A 46 13.501 -3.259 5.673 1.00 2.21 H new ATOM 0 HB3 PHE A 46 15.103 -3.925 5.422 1.00 2.21 H new ATOM 0 HD1 PHE A 46 12.295 -2.226 3.741 1.00 2.55 H new ATOM 0 HD2 PHE A 46 16.342 -3.412 3.461 1.00 2.17 H new ATOM 0 HE1 PHE A 46 12.580 -0.781 1.721 1.00 2.76 H new ATOM 0 HE2 PHE A 46 16.626 -1.965 1.441 1.00 2.35 H new ATOM 0 HZ PHE A 46 14.738 -0.671 0.593 1.00 2.33 H new ATOM 706 N GLY A 47 11.317 -4.165 4.732 1.00 1.74 N ATOM 707 CA GLY A 47 10.004 -3.809 4.219 1.00 1.67 C ATOM 708 C GLY A 47 8.963 -3.798 5.341 1.00 1.80 C ATOM 709 O GLY A 47 8.975 -4.666 6.213 1.00 3.07 O ATOM 0 H GLY A 47 11.543 -3.763 5.642 1.00 1.74 H new ATOM 0 HA2 GLY A 47 10.047 -2.827 3.748 1.00 1.67 H new ATOM 0 HA3 GLY A 47 9.706 -4.519 3.448 1.00 1.67 H new ATOM 713 N TYR A 48 8.086 -2.806 5.280 1.00 1.46 N ATOM 714 CA TYR A 48 7.039 -2.672 6.279 1.00 1.58 C ATOM 715 C TYR A 48 7.537 -3.110 7.658 1.00 1.29 C ATOM 716 O TYR A 48 6.992 -4.038 8.253 1.00 2.30 O ATOM 717 CB TYR A 48 5.913 -3.608 5.837 1.00 1.96 C ATOM 718 CG TYR A 48 5.210 -3.171 4.550 1.00 3.02 C ATOM 719 CD1 TYR A 48 4.359 -2.085 4.563 1.00 4.16 C ATOM 720 CD2 TYR A 48 5.427 -3.863 3.375 1.00 3.80 C ATOM 721 CE1 TYR A 48 3.696 -1.674 3.352 1.00 5.38 C ATOM 722 CE2 TYR A 48 4.765 -3.451 2.165 1.00 4.98 C ATOM 723 CZ TYR A 48 3.933 -2.377 2.213 1.00 5.50 C ATOM 724 OH TYR A 48 3.308 -1.989 1.069 1.00 6.77 O ATOM 0 H TYR A 48 8.079 -2.088 4.555 1.00 1.46 H new ATOM 0 HA TYR A 48 6.715 -1.634 6.358 1.00 1.58 H new ATOM 0 HB2 TYR A 48 6.321 -4.609 5.694 1.00 1.96 H new ATOM 0 HB3 TYR A 48 5.176 -3.676 6.637 1.00 1.96 H new ATOM 0 HD1 TYR A 48 4.190 -1.543 5.482 1.00 4.16 H new ATOM 0 HD2 TYR A 48 6.093 -4.713 3.364 1.00 3.80 H new ATOM 0 HE1 TYR A 48 3.026 -0.827 3.349 1.00 5.38 H new ATOM 0 HE2 TYR A 48 4.926 -3.984 1.239 1.00 4.98 H new ATOM 0 HH TYR A 48 3.876 -1.353 0.586 1.00 6.77 H new ATOM 734 N LYS A 49 8.566 -2.419 8.126 1.00 1.00 N ATOM 735 CA LYS A 49 9.080 -2.658 9.464 1.00 1.03 C ATOM 736 C LYS A 49 9.527 -1.330 10.078 1.00 1.25 C ATOM 737 O LYS A 49 10.582 -0.803 9.728 1.00 1.59 O ATOM 738 CB LYS A 49 10.180 -3.721 9.433 1.00 1.34 C ATOM 739 CG LYS A 49 9.679 -5.046 10.013 1.00 2.08 C ATOM 740 CD LYS A 49 9.528 -4.956 11.533 1.00 1.63 C ATOM 741 CE LYS A 49 9.307 -6.341 12.144 1.00 2.22 C ATOM 742 NZ LYS A 49 8.786 -6.222 13.524 1.00 2.58 N ATOM 0 H LYS A 49 9.057 -1.694 7.603 1.00 1.00 H new ATOM 0 HA LYS A 49 8.297 -3.060 10.107 1.00 1.03 H new ATOM 0 HB2 LYS A 49 10.515 -3.873 8.407 1.00 1.34 H new ATOM 0 HB3 LYS A 49 11.042 -3.374 10.002 1.00 1.34 H new ATOM 0 HG2 LYS A 49 8.720 -5.305 9.563 1.00 2.08 H new ATOM 0 HG3 LYS A 49 10.376 -5.845 9.760 1.00 2.08 H new ATOM 0 HD2 LYS A 49 10.420 -4.502 11.965 1.00 1.63 H new ATOM 0 HD3 LYS A 49 8.688 -4.307 11.781 1.00 1.63 H new ATOM 0 HE2 LYS A 49 8.605 -6.907 11.532 1.00 2.22 H new ATOM 0 HE3 LYS A 49 10.245 -6.896 12.150 1.00 2.22 H new ATOM 0 HZ1 LYS A 49 8.594 -7.170 13.905 1.00 2.58 H new ATOM 0 HZ2 LYS A 49 9.491 -5.745 14.121 1.00 2.58 H new ATOM 0 HZ3 LYS A 49 7.906 -5.667 13.516 1.00 2.58 H new ATOM 756 N GLY A 50 8.701 -0.827 10.985 1.00 1.80 N ATOM 757 CA GLY A 50 8.946 0.478 11.576 1.00 2.20 C ATOM 758 C GLY A 50 8.422 1.596 10.673 1.00 1.74 C ATOM 759 O GLY A 50 8.672 2.774 10.929 1.00 2.49 O ATOM 0 H GLY A 50 7.863 -1.299 11.324 1.00 1.80 H new ATOM 0 HA2 GLY A 50 8.462 0.536 12.551 1.00 2.20 H new ATOM 0 HA3 GLY A 50 10.015 0.611 11.742 1.00 2.20 H new ATOM 763 N SER A 51 7.706 1.190 9.635 1.00 1.58 N ATOM 764 CA SER A 51 7.166 2.141 8.680 1.00 2.33 C ATOM 765 C SER A 51 5.891 2.777 9.238 1.00 1.72 C ATOM 766 O SER A 51 5.369 2.334 10.260 1.00 2.19 O ATOM 767 CB SER A 51 6.879 1.469 7.335 1.00 3.82 C ATOM 768 OG SER A 51 5.745 0.609 7.400 1.00 4.67 O ATOM 0 H SER A 51 7.487 0.214 9.435 1.00 1.58 H new ATOM 0 HA SER A 51 7.911 2.920 8.515 1.00 2.33 H new ATOM 0 HB2 SER A 51 6.711 2.233 6.576 1.00 3.82 H new ATOM 0 HB3 SER A 51 7.752 0.895 7.023 1.00 3.82 H new ATOM 0 HG SER A 51 5.497 0.326 6.495 1.00 4.67 H new ATOM 774 N CYS A 52 5.427 3.805 8.544 1.00 1.94 N ATOM 775 CA CYS A 52 4.247 4.532 8.980 1.00 1.80 C ATOM 776 C CYS A 52 3.468 4.972 7.739 1.00 1.78 C ATOM 777 O CYS A 52 4.060 5.263 6.701 1.00 2.73 O ATOM 778 CB CYS A 52 4.612 5.717 9.877 1.00 2.56 C ATOM 779 SG CYS A 52 3.146 6.785 10.128 1.00 3.71 S ATOM 0 H CYS A 52 5.847 4.152 7.682 1.00 1.94 H new ATOM 0 HA CYS A 52 3.619 3.881 9.589 1.00 1.80 H new ATOM 0 HB2 CYS A 52 4.979 5.357 10.838 1.00 2.56 H new ATOM 0 HB3 CYS A 52 5.419 6.293 9.423 1.00 2.56 H new ATOM 0 HG CYS A 52 2.679 7.160 8.974 1.00 3.71 H new ATOM 785 N PHE A 53 2.152 5.007 7.889 1.00 1.63 N ATOM 786 CA PHE A 53 1.285 5.402 6.790 1.00 1.85 C ATOM 787 C PHE A 53 1.308 6.919 6.591 1.00 1.41 C ATOM 788 O PHE A 53 1.357 7.675 7.560 1.00 1.97 O ATOM 789 CB PHE A 53 -0.134 4.971 7.163 1.00 2.87 C ATOM 790 CG PHE A 53 -0.387 3.468 7.014 1.00 4.37 C ATOM 791 CD1 PHE A 53 -0.032 2.617 8.013 1.00 4.91 C ATOM 792 CD2 PHE A 53 -0.966 2.986 5.882 1.00 5.92 C ATOM 793 CE1 PHE A 53 -0.268 1.223 7.876 1.00 6.66 C ATOM 794 CE2 PHE A 53 -1.201 1.591 5.744 1.00 7.50 C ATOM 795 CZ PHE A 53 -0.846 0.741 6.744 1.00 7.72 C ATOM 0 H PHE A 53 1.665 4.769 8.753 1.00 1.63 H new ATOM 0 HA PHE A 53 1.622 4.936 5.864 1.00 1.85 H new ATOM 0 HB2 PHE A 53 -0.332 5.262 8.195 1.00 2.87 H new ATOM 0 HB3 PHE A 53 -0.844 5.512 6.537 1.00 2.87 H new ATOM 0 HD1 PHE A 53 0.429 3.001 8.911 1.00 4.91 H new ATOM 0 HD2 PHE A 53 -1.247 3.663 5.088 1.00 5.92 H new ATOM 0 HE1 PHE A 53 0.011 0.547 8.670 1.00 6.66 H new ATOM 0 HE2 PHE A 53 -1.661 1.207 4.846 1.00 7.50 H new ATOM 0 HZ PHE A 53 -1.024 -0.319 6.639 1.00 7.72 H new ATOM 805 N HIS A 54 1.272 7.319 5.329 1.00 1.41 N ATOM 806 CA HIS A 54 1.437 8.720 4.982 1.00 1.37 C ATOM 807 C HIS A 54 0.138 9.476 5.268 1.00 1.20 C ATOM 808 O HIS A 54 0.112 10.377 6.106 1.00 1.78 O ATOM 809 CB HIS A 54 1.904 8.870 3.533 1.00 2.14 C ATOM 810 CG HIS A 54 3.111 8.033 3.186 1.00 1.77 C ATOM 811 ND1 HIS A 54 3.547 7.848 1.885 1.00 1.92 N ATOM 812 CD2 HIS A 54 3.972 7.336 3.983 1.00 2.63 C ATOM 813 CE1 HIS A 54 4.620 7.071 1.911 1.00 2.21 C ATOM 814 NE2 HIS A 54 4.882 6.755 3.211 1.00 3.06 N ATOM 0 H HIS A 54 1.131 6.697 4.533 1.00 1.41 H new ATOM 0 HA HIS A 54 2.218 9.162 5.601 1.00 1.37 H new ATOM 0 HB2 HIS A 54 1.084 8.599 2.868 1.00 2.14 H new ATOM 0 HB3 HIS A 54 2.135 9.918 3.343 1.00 2.14 H new ATOM 0 HD1 HIS A 54 3.116 8.243 1.049 1.00 1.92 H new ATOM 0 HD2 HIS A 54 3.921 7.269 5.060 1.00 2.63 H new ATOM 0 HE1 HIS A 54 5.188 6.745 1.052 1.00 2.21 H new ATOM 822 N ARG A 55 -0.908 9.082 4.557 1.00 1.02 N ATOM 823 CA ARG A 55 -2.194 9.746 4.687 1.00 1.04 C ATOM 824 C ARG A 55 -3.284 8.728 5.027 1.00 0.82 C ATOM 825 O ARG A 55 -3.249 7.594 4.552 1.00 1.03 O ATOM 826 CB ARG A 55 -2.569 10.474 3.394 1.00 1.57 C ATOM 827 CG ARG A 55 -1.575 11.596 3.088 1.00 1.29 C ATOM 828 CD ARG A 55 -2.115 12.525 1.999 1.00 1.35 C ATOM 829 NE ARG A 55 -1.230 12.485 0.814 1.00 1.74 N ATOM 830 CZ ARG A 55 -1.046 11.398 0.051 1.00 3.34 C ATOM 831 NH1 ARG A 55 -1.957 10.415 0.054 1.00 4.53 N ATOM 832 NH2 ARG A 55 0.048 11.295 -0.716 1.00 4.63 N ATOM 0 H ARG A 55 -0.891 8.311 3.889 1.00 1.02 H new ATOM 0 HA ARG A 55 -2.112 10.477 5.492 1.00 1.04 H new ATOM 0 HB2 ARG A 55 -2.589 9.765 2.566 1.00 1.57 H new ATOM 0 HB3 ARG A 55 -3.573 10.888 3.484 1.00 1.57 H new ATOM 0 HG2 ARG A 55 -1.377 12.169 3.994 1.00 1.29 H new ATOM 0 HG3 ARG A 55 -0.625 11.168 2.768 1.00 1.29 H new ATOM 0 HD2 ARG A 55 -3.124 12.223 1.720 1.00 1.35 H new ATOM 0 HD3 ARG A 55 -2.181 13.544 2.379 1.00 1.35 H new ATOM 0 HE ARG A 55 -0.729 13.337 0.562 1.00 1.74 H new ATOM 0 HH11 ARG A 55 -2.790 10.494 0.637 1.00 4.53 H new ATOM 0 HH12 ARG A 55 -1.817 9.588 -0.527 1.00 4.53 H new ATOM 0 HH21 ARG A 55 0.741 12.044 -0.719 1.00 4.63 H new ATOM 0 HH22 ARG A 55 0.188 10.468 -1.296 1.00 4.63 H new ATOM 846 N ILE A 56 -4.228 9.171 5.844 1.00 0.75 N ATOM 847 CA ILE A 56 -5.350 8.327 6.220 1.00 0.71 C ATOM 848 C ILE A 56 -6.647 9.127 6.097 1.00 0.81 C ATOM 849 O ILE A 56 -6.883 10.056 6.869 1.00 1.01 O ATOM 850 CB ILE A 56 -5.127 7.725 7.609 1.00 0.75 C ATOM 851 CG1 ILE A 56 -3.820 6.931 7.659 1.00 0.88 C ATOM 852 CG2 ILE A 56 -6.327 6.881 8.039 1.00 0.94 C ATOM 853 CD1 ILE A 56 -3.745 6.077 8.926 1.00 0.95 C ATOM 0 H ILE A 56 -4.239 10.104 6.256 1.00 0.75 H new ATOM 0 HA ILE A 56 -5.433 7.478 5.541 1.00 0.71 H new ATOM 0 HB ILE A 56 -5.035 8.542 8.325 1.00 0.75 H new ATOM 0 HG12 ILE A 56 -3.745 6.291 6.780 1.00 0.88 H new ATOM 0 HG13 ILE A 56 -2.973 7.616 7.627 1.00 0.88 H new ATOM 0 HG21 ILE A 56 -6.143 6.465 9.029 1.00 0.94 H new ATOM 0 HG22 ILE A 56 -7.220 7.506 8.068 1.00 0.94 H new ATOM 0 HG23 ILE A 56 -6.475 6.070 7.326 1.00 0.94 H new ATOM 0 HD11 ILE A 56 -2.806 5.523 8.936 1.00 0.95 H new ATOM 0 HD12 ILE A 56 -3.795 6.722 9.803 1.00 0.95 H new ATOM 0 HD13 ILE A 56 -4.580 5.376 8.943 1.00 0.95 H new ATOM 865 N ILE A 57 -7.455 8.737 5.123 1.00 0.78 N ATOM 866 CA ILE A 57 -8.757 9.358 4.937 1.00 0.92 C ATOM 867 C ILE A 57 -9.831 8.270 4.867 1.00 0.88 C ATOM 868 O ILE A 57 -9.708 7.320 4.094 1.00 0.73 O ATOM 869 CB ILE A 57 -8.740 10.284 3.718 1.00 0.99 C ATOM 870 CG1 ILE A 57 -7.830 11.490 3.960 1.00 1.24 C ATOM 871 CG2 ILE A 57 -10.158 10.704 3.329 1.00 1.11 C ATOM 872 CD1 ILE A 57 -7.628 12.291 2.672 1.00 1.36 C ATOM 0 H ILE A 57 -7.235 7.999 4.454 1.00 0.78 H new ATOM 0 HA ILE A 57 -9.001 9.993 5.788 1.00 0.92 H new ATOM 0 HB ILE A 57 -8.326 9.732 2.874 1.00 0.99 H new ATOM 0 HG12 ILE A 57 -8.266 12.131 4.727 1.00 1.24 H new ATOM 0 HG13 ILE A 57 -6.865 11.152 4.338 1.00 1.24 H new ATOM 0 HG21 ILE A 57 -10.117 11.361 2.460 1.00 1.11 H new ATOM 0 HG22 ILE A 57 -10.746 9.819 3.087 1.00 1.11 H new ATOM 0 HG23 ILE A 57 -10.623 11.232 4.162 1.00 1.11 H new ATOM 0 HD11 ILE A 57 -6.978 13.143 2.871 1.00 1.36 H new ATOM 0 HD12 ILE A 57 -7.170 11.654 1.915 1.00 1.36 H new ATOM 0 HD13 ILE A 57 -8.592 12.648 2.310 1.00 1.36 H new ATOM 884 N PRO A 58 -10.885 8.448 5.707 1.00 1.10 N ATOM 885 CA PRO A 58 -11.951 7.463 5.789 1.00 1.20 C ATOM 886 C PRO A 58 -12.866 7.543 4.566 1.00 1.18 C ATOM 887 O PRO A 58 -13.598 8.517 4.396 1.00 1.46 O ATOM 888 CB PRO A 58 -12.671 7.772 7.092 1.00 1.48 C ATOM 889 CG PRO A 58 -12.279 9.195 7.457 1.00 1.56 C ATOM 890 CD PRO A 58 -11.091 9.587 6.596 1.00 1.34 C ATOM 0 HA PRO A 58 -11.579 6.438 5.788 1.00 1.20 H new ATOM 0 HB2 PRO A 58 -13.751 7.683 6.972 1.00 1.48 H new ATOM 0 HB3 PRO A 58 -12.378 7.073 7.875 1.00 1.48 H new ATOM 0 HG2 PRO A 58 -13.113 9.876 7.289 1.00 1.56 H new ATOM 0 HG3 PRO A 58 -12.022 9.261 8.514 1.00 1.56 H new ATOM 0 HD2 PRO A 58 -11.294 10.498 6.032 1.00 1.34 H new ATOM 0 HD3 PRO A 58 -10.207 9.779 7.205 1.00 1.34 H new ATOM 898 N GLY A 59 -12.795 6.505 3.745 1.00 1.03 N ATOM 899 CA GLY A 59 -13.671 6.403 2.590 1.00 1.06 C ATOM 900 C GLY A 59 -12.959 6.874 1.320 1.00 0.89 C ATOM 901 O GLY A 59 -13.570 7.503 0.458 1.00 0.96 O ATOM 0 H GLY A 59 -12.144 5.727 3.857 1.00 1.03 H new ATOM 0 HA2 GLY A 59 -13.998 5.370 2.467 1.00 1.06 H new ATOM 0 HA3 GLY A 59 -14.566 7.003 2.754 1.00 1.06 H new ATOM 905 N PHE A 60 -11.676 6.551 1.245 1.00 0.73 N ATOM 906 CA PHE A 60 -10.897 6.850 0.055 1.00 0.63 C ATOM 907 C PHE A 60 -9.745 5.856 -0.111 1.00 0.61 C ATOM 908 O PHE A 60 -9.745 5.052 -1.041 1.00 0.69 O ATOM 909 CB PHE A 60 -10.320 8.255 0.240 1.00 0.61 C ATOM 910 CG PHE A 60 -9.437 8.723 -0.919 1.00 0.58 C ATOM 911 CD1 PHE A 60 -9.519 8.106 -2.128 1.00 1.71 C ATOM 912 CD2 PHE A 60 -8.570 9.756 -0.739 1.00 2.03 C ATOM 913 CE1 PHE A 60 -8.699 8.539 -3.202 1.00 1.63 C ATOM 914 CE2 PHE A 60 -7.751 10.189 -1.814 1.00 2.15 C ATOM 915 CZ PHE A 60 -7.833 9.572 -3.023 1.00 0.78 C ATOM 0 H PHE A 60 -11.156 6.085 1.989 1.00 0.73 H new ATOM 0 HA PHE A 60 -11.529 6.783 -0.830 1.00 0.63 H new ATOM 0 HB2 PHE A 60 -11.142 8.960 0.365 1.00 0.61 H new ATOM 0 HB3 PHE A 60 -9.736 8.279 1.160 1.00 0.61 H new ATOM 0 HD1 PHE A 60 -10.208 7.287 -2.271 1.00 1.71 H new ATOM 0 HD2 PHE A 60 -8.505 10.246 0.221 1.00 2.03 H new ATOM 0 HE1 PHE A 60 -8.763 8.048 -4.162 1.00 1.63 H new ATOM 0 HE2 PHE A 60 -7.062 11.009 -1.672 1.00 2.15 H new ATOM 0 HZ PHE A 60 -7.210 9.902 -3.841 1.00 0.78 H new ATOM 925 N MET A 61 -8.792 5.946 0.806 1.00 0.57 N ATOM 926 CA MET A 61 -7.557 5.193 0.676 1.00 0.67 C ATOM 927 C MET A 61 -6.782 5.178 1.996 1.00 0.64 C ATOM 928 O MET A 61 -7.140 5.884 2.937 1.00 0.57 O ATOM 929 CB MET A 61 -6.690 5.817 -0.419 1.00 0.79 C ATOM 930 CG MET A 61 -5.735 6.860 0.166 1.00 1.16 C ATOM 931 SD MET A 61 -6.661 8.124 1.020 1.00 1.80 S ATOM 932 CE MET A 61 -5.423 8.688 2.176 1.00 1.62 C ATOM 0 H MET A 61 -8.851 6.529 1.641 1.00 0.57 H new ATOM 0 HA MET A 61 -7.807 4.165 0.411 1.00 0.67 H new ATOM 0 HB2 MET A 61 -6.119 5.038 -0.924 1.00 0.79 H new ATOM 0 HB3 MET A 61 -7.327 6.283 -1.171 1.00 0.79 H new ATOM 0 HG2 MET A 61 -5.038 6.381 0.853 1.00 1.16 H new ATOM 0 HG3 MET A 61 -5.141 7.308 -0.630 1.00 1.16 H new ATOM 0 HE1 MET A 61 -5.640 9.715 2.469 1.00 1.62 H new ATOM 0 HE2 MET A 61 -5.432 8.049 3.059 1.00 1.62 H new ATOM 0 HE3 MET A 61 -4.440 8.644 1.707 1.00 1.62 H new ATOM 942 N CYS A 62 -5.736 4.367 2.022 1.00 0.91 N ATOM 943 CA CYS A 62 -4.829 4.352 3.156 1.00 0.98 C ATOM 944 C CYS A 62 -3.404 4.160 2.630 1.00 1.25 C ATOM 945 O CYS A 62 -2.954 3.030 2.446 1.00 1.57 O ATOM 946 CB CYS A 62 -5.211 3.275 4.173 1.00 1.16 C ATOM 947 SG CYS A 62 -4.288 3.529 5.732 1.00 2.75 S ATOM 0 H CYS A 62 -5.496 3.715 1.275 1.00 0.91 H new ATOM 0 HA CYS A 62 -4.894 5.301 3.688 1.00 0.98 H new ATOM 0 HB2 CYS A 62 -6.283 3.310 4.366 1.00 1.16 H new ATOM 0 HB3 CYS A 62 -4.992 2.287 3.768 1.00 1.16 H new ATOM 0 HG CYS A 62 -3.016 3.377 5.513 1.00 2.75 H new ATOM 953 N GLN A 63 -2.735 5.281 2.404 1.00 1.67 N ATOM 954 CA GLN A 63 -1.447 5.261 1.732 1.00 2.18 C ATOM 955 C GLN A 63 -0.318 5.114 2.753 1.00 1.94 C ATOM 956 O GLN A 63 -0.356 5.730 3.818 1.00 2.25 O ATOM 957 CB GLN A 63 -1.255 6.516 0.878 1.00 2.84 C ATOM 958 CG GLN A 63 0.162 6.575 0.302 1.00 3.72 C ATOM 959 CD GLN A 63 0.214 7.478 -0.932 1.00 5.27 C ATOM 960 OE1 GLN A 63 -0.195 8.627 -0.911 1.00 6.12 O ATOM 961 NE2 GLN A 63 0.738 6.895 -2.007 1.00 6.15 N ATOM 0 H GLN A 63 -3.061 6.209 2.674 1.00 1.67 H new ATOM 0 HA GLN A 63 -1.420 4.400 1.064 1.00 2.18 H new ATOM 0 HB2 GLN A 63 -1.982 6.523 0.066 1.00 2.84 H new ATOM 0 HB3 GLN A 63 -1.443 7.404 1.482 1.00 2.84 H new ATOM 0 HG2 GLN A 63 0.851 6.948 1.060 1.00 3.72 H new ATOM 0 HG3 GLN A 63 0.493 5.571 0.037 1.00 3.72 H new ATOM 0 HE21 GLN A 63 1.062 5.929 -1.957 1.00 6.15 H new ATOM 0 HE22 GLN A 63 0.816 7.414 -2.882 1.00 6.15 H new ATOM 970 N GLY A 64 0.660 4.296 2.393 1.00 1.67 N ATOM 971 CA GLY A 64 1.821 4.099 3.244 1.00 1.73 C ATOM 972 C GLY A 64 2.965 3.443 2.466 1.00 1.99 C ATOM 973 O GLY A 64 2.728 2.712 1.506 1.00 2.81 O ATOM 0 H GLY A 64 0.672 3.762 1.524 1.00 1.67 H new ATOM 0 HA2 GLY A 64 2.151 5.058 3.643 1.00 1.73 H new ATOM 0 HA3 GLY A 64 1.551 3.475 4.096 1.00 1.73 H new ATOM 977 N GLY A 65 4.180 3.729 2.910 1.00 2.04 N ATOM 978 CA GLY A 65 5.359 3.144 2.295 1.00 2.51 C ATOM 979 C GLY A 65 6.555 4.094 2.386 1.00 2.10 C ATOM 980 O GLY A 65 7.060 4.561 1.368 1.00 2.89 O ATOM 0 H GLY A 65 4.373 4.359 3.689 1.00 2.04 H new ATOM 0 HA2 GLY A 65 5.600 2.202 2.787 1.00 2.51 H new ATOM 0 HA3 GLY A 65 5.152 2.914 1.250 1.00 2.51 H new ATOM 984 N ASP A 66 6.973 4.350 3.617 1.00 1.97 N ATOM 985 CA ASP A 66 8.111 5.221 3.855 1.00 2.26 C ATOM 986 C ASP A 66 9.244 4.412 4.488 1.00 1.80 C ATOM 987 O ASP A 66 9.017 3.322 5.010 1.00 2.29 O ATOM 988 CB ASP A 66 7.745 6.354 4.817 1.00 3.29 C ATOM 989 CG ASP A 66 6.988 5.918 6.072 1.00 4.58 C ATOM 990 OD1 ASP A 66 6.769 4.695 6.206 1.00 5.25 O ATOM 991 OD2 ASP A 66 6.645 6.818 6.870 1.00 5.69 O ATOM 0 H ASP A 66 6.544 3.969 4.460 1.00 1.97 H new ATOM 0 HA ASP A 66 8.418 5.644 2.898 1.00 2.26 H new ATOM 0 HB2 ASP A 66 8.660 6.862 5.121 1.00 3.29 H new ATOM 0 HB3 ASP A 66 7.139 7.084 4.281 1.00 3.29 H new ATOM 1142 N SER A 77 12.528 0.983 -3.484 1.00 1.22 N ATOM 1143 CA SER A 77 12.129 -0.336 -3.944 1.00 1.18 C ATOM 1144 C SER A 77 13.361 -1.229 -4.104 1.00 1.10 C ATOM 1145 O SER A 77 14.480 -0.734 -4.227 1.00 1.48 O ATOM 1146 CB SER A 77 11.362 -0.249 -5.266 1.00 1.40 C ATOM 1147 OG SER A 77 12.004 0.615 -6.200 1.00 2.47 O ATOM 0 HA SER A 77 11.466 -0.773 -3.197 1.00 1.18 H new ATOM 0 HB2 SER A 77 11.270 -1.246 -5.698 1.00 1.40 H new ATOM 0 HB3 SER A 77 10.351 0.110 -5.075 1.00 1.40 H new ATOM 0 HG SER A 77 12.745 0.139 -6.630 1.00 2.47 H new ATOM 1153 N ILE A 78 13.113 -2.532 -4.096 1.00 0.99 N ATOM 1154 CA ILE A 78 14.191 -3.499 -4.206 1.00 1.01 C ATOM 1155 C ILE A 78 14.932 -3.283 -5.527 1.00 1.11 C ATOM 1156 O ILE A 78 16.124 -3.569 -5.628 1.00 1.36 O ATOM 1157 CB ILE A 78 13.655 -4.921 -4.028 1.00 1.09 C ATOM 1158 CG1 ILE A 78 12.882 -5.375 -5.268 1.00 1.56 C ATOM 1159 CG2 ILE A 78 12.815 -5.035 -2.755 1.00 1.46 C ATOM 1160 CD1 ILE A 78 12.398 -6.818 -5.114 1.00 1.74 C ATOM 0 H ILE A 78 12.181 -2.939 -4.015 1.00 0.99 H new ATOM 0 HA ILE A 78 14.916 -3.353 -3.405 1.00 1.01 H new ATOM 0 HB ILE A 78 14.505 -5.594 -3.914 1.00 1.09 H new ATOM 0 HG12 ILE A 78 12.029 -4.717 -5.430 1.00 1.56 H new ATOM 0 HG13 ILE A 78 13.519 -5.293 -6.148 1.00 1.56 H new ATOM 0 HG21 ILE A 78 12.446 -6.056 -2.653 1.00 1.46 H new ATOM 0 HG22 ILE A 78 13.429 -4.782 -1.890 1.00 1.46 H new ATOM 0 HG23 ILE A 78 11.971 -4.348 -2.814 1.00 1.46 H new ATOM 0 HD11 ILE A 78 11.852 -7.116 -6.009 1.00 1.74 H new ATOM 0 HD12 ILE A 78 13.256 -7.477 -4.976 1.00 1.74 H new ATOM 0 HD13 ILE A 78 11.742 -6.891 -4.247 1.00 1.74 H new ATOM 1172 N TYR A 79 14.196 -2.778 -6.506 1.00 1.13 N ATOM 1173 CA TYR A 79 14.717 -2.679 -7.860 1.00 1.31 C ATOM 1174 C TYR A 79 15.640 -1.469 -8.004 1.00 1.27 C ATOM 1175 O TYR A 79 16.278 -1.289 -9.040 1.00 1.49 O ATOM 1176 CB TYR A 79 13.499 -2.489 -8.766 1.00 1.53 C ATOM 1177 CG TYR A 79 12.692 -3.767 -9.002 1.00 1.78 C ATOM 1178 CD1 TYR A 79 13.034 -4.619 -10.032 1.00 2.04 C ATOM 1179 CD2 TYR A 79 11.623 -4.069 -8.183 1.00 3.26 C ATOM 1180 CE1 TYR A 79 12.274 -5.822 -10.254 1.00 2.26 C ATOM 1181 CE2 TYR A 79 10.864 -5.272 -8.403 1.00 3.60 C ATOM 1182 CZ TYR A 79 11.227 -6.090 -9.429 1.00 2.52 C ATOM 1183 OH TYR A 79 10.510 -7.226 -9.637 1.00 2.94 O ATOM 0 H TYR A 79 13.243 -2.433 -6.389 1.00 1.13 H new ATOM 0 HA TYR A 79 15.294 -3.567 -8.116 1.00 1.31 H new ATOM 0 HB2 TYR A 79 12.846 -1.736 -8.326 1.00 1.53 H new ATOM 0 HB3 TYR A 79 13.832 -2.099 -9.728 1.00 1.53 H new ATOM 0 HD1 TYR A 79 13.872 -4.384 -10.672 1.00 2.04 H new ATOM 0 HD2 TYR A 79 11.356 -3.402 -7.377 1.00 3.26 H new ATOM 0 HE1 TYR A 79 12.530 -6.496 -11.058 1.00 2.26 H new ATOM 0 HE2 TYR A 79 10.026 -5.520 -7.769 1.00 3.60 H new ATOM 0 HH TYR A 79 9.578 -7.078 -9.373 1.00 2.94 H new ATOM 1193 N GLY A 80 15.683 -0.667 -6.950 1.00 1.13 N ATOM 1194 CA GLY A 80 16.611 0.449 -6.895 1.00 1.20 C ATOM 1195 C GLY A 80 15.864 1.779 -6.773 1.00 1.34 C ATOM 1196 O GLY A 80 15.872 2.586 -7.701 1.00 2.81 O ATOM 0 H GLY A 80 15.089 -0.768 -6.127 1.00 1.13 H new ATOM 0 HA2 GLY A 80 17.283 0.326 -6.046 1.00 1.20 H new ATOM 0 HA3 GLY A 80 17.230 0.456 -7.792 1.00 1.20 H new ATOM 1200 N GLU A 81 15.237 1.966 -5.622 1.00 1.54 N ATOM 1201 CA GLU A 81 14.671 3.258 -5.279 1.00 1.46 C ATOM 1202 C GLU A 81 13.324 3.450 -5.979 1.00 1.39 C ATOM 1203 O GLU A 81 12.352 3.881 -5.358 1.00 1.50 O ATOM 1204 CB GLU A 81 15.637 4.391 -5.629 1.00 1.58 C ATOM 1205 CG GLU A 81 17.033 4.115 -5.067 1.00 3.21 C ATOM 1206 CD GLU A 81 16.960 3.724 -3.589 1.00 4.54 C ATOM 1207 OE1 GLU A 81 16.426 4.543 -2.810 1.00 4.75 O ATOM 1208 OE2 GLU A 81 17.441 2.614 -3.272 1.00 6.10 O ATOM 0 H GLU A 81 15.108 1.243 -4.914 1.00 1.54 H new ATOM 0 HA GLU A 81 14.506 3.286 -4.202 1.00 1.46 H new ATOM 0 HB2 GLU A 81 15.693 4.505 -6.712 1.00 1.58 H new ATOM 0 HB3 GLU A 81 15.260 5.332 -5.229 1.00 1.58 H new ATOM 0 HG2 GLU A 81 17.507 3.315 -5.636 1.00 3.21 H new ATOM 0 HG3 GLU A 81 17.657 5.001 -5.182 1.00 3.21 H new ATOM 1215 N LYS A 82 13.307 3.122 -7.263 1.00 1.31 N ATOM 1216 CA LYS A 82 12.083 3.200 -8.040 1.00 1.30 C ATOM 1217 C LYS A 82 11.858 1.871 -8.763 1.00 1.47 C ATOM 1218 O LYS A 82 12.734 1.007 -8.770 1.00 1.66 O ATOM 1219 CB LYS A 82 12.118 4.410 -8.976 1.00 1.20 C ATOM 1220 CG LYS A 82 12.581 5.664 -8.232 1.00 1.90 C ATOM 1221 CD LYS A 82 12.874 6.805 -9.209 1.00 2.25 C ATOM 1222 CE LYS A 82 14.378 7.062 -9.317 1.00 3.17 C ATOM 1223 NZ LYS A 82 15.059 5.901 -9.933 1.00 4.06 N ATOM 0 H LYS A 82 14.123 2.801 -7.784 1.00 1.31 H new ATOM 0 HA LYS A 82 11.226 3.357 -7.385 1.00 1.30 H new ATOM 0 HB2 LYS A 82 12.789 4.209 -9.811 1.00 1.20 H new ATOM 0 HB3 LYS A 82 11.127 4.578 -9.397 1.00 1.20 H new ATOM 0 HG2 LYS A 82 11.813 5.975 -7.524 1.00 1.90 H new ATOM 0 HG3 LYS A 82 13.476 5.438 -7.653 1.00 1.90 H new ATOM 0 HD2 LYS A 82 12.472 6.559 -10.192 1.00 2.25 H new ATOM 0 HD3 LYS A 82 12.369 7.712 -8.876 1.00 2.25 H new ATOM 0 HE2 LYS A 82 14.558 7.956 -9.914 1.00 3.17 H new ATOM 0 HE3 LYS A 82 14.793 7.251 -8.327 1.00 3.17 H new ATOM 0 HZ1 LYS A 82 16.065 6.124 -10.077 1.00 4.06 H new ATOM 0 HZ2 LYS A 82 14.974 5.076 -9.306 1.00 4.06 H new ATOM 0 HZ3 LYS A 82 14.618 5.686 -10.850 1.00 4.06 H new ATOM 1237 N PHE A 83 10.678 1.748 -9.354 1.00 1.57 N ATOM 1238 CA PHE A 83 10.296 0.509 -10.012 1.00 1.99 C ATOM 1239 C PHE A 83 9.332 0.779 -11.170 1.00 1.70 C ATOM 1240 O PHE A 83 8.605 1.771 -11.159 1.00 1.43 O ATOM 1241 CB PHE A 83 9.589 -0.354 -8.966 1.00 2.69 C ATOM 1242 CG PHE A 83 8.839 -1.552 -9.553 1.00 1.68 C ATOM 1243 CD1 PHE A 83 9.531 -2.585 -10.104 1.00 1.96 C ATOM 1244 CD2 PHE A 83 7.479 -1.584 -9.522 1.00 2.34 C ATOM 1245 CE1 PHE A 83 8.834 -3.696 -10.648 1.00 2.37 C ATOM 1246 CE2 PHE A 83 6.783 -2.695 -10.066 1.00 2.15 C ATOM 1247 CZ PHE A 83 7.475 -3.728 -10.617 1.00 1.94 C ATOM 0 H PHE A 83 9.974 2.485 -9.391 1.00 1.57 H new ATOM 0 HA PHE A 83 11.179 0.015 -10.417 1.00 1.99 H new ATOM 0 HB2 PHE A 83 10.326 -0.715 -8.249 1.00 2.69 H new ATOM 0 HB3 PHE A 83 8.885 0.267 -8.413 1.00 2.69 H new ATOM 0 HD1 PHE A 83 10.610 -2.560 -10.128 1.00 1.96 H new ATOM 0 HD2 PHE A 83 6.929 -0.764 -9.084 1.00 2.34 H new ATOM 0 HE1 PHE A 83 9.383 -4.516 -11.087 1.00 2.37 H new ATOM 0 HE2 PHE A 83 5.704 -2.720 -10.042 1.00 2.15 H new ATOM 0 HZ PHE A 83 6.945 -4.574 -11.030 1.00 1.94 H new ATOM 1257 N GLU A 84 9.358 -0.122 -12.141 1.00 1.88 N ATOM 1258 CA GLU A 84 8.630 0.093 -13.381 1.00 1.64 C ATOM 1259 C GLU A 84 7.180 -0.371 -13.232 1.00 1.39 C ATOM 1260 O GLU A 84 6.879 -1.219 -12.392 1.00 1.40 O ATOM 1261 CB GLU A 84 9.316 -0.617 -14.549 1.00 1.78 C ATOM 1262 CG GLU A 84 10.825 -0.720 -14.318 1.00 2.59 C ATOM 1263 CD GLU A 84 11.197 -2.082 -13.728 1.00 3.86 C ATOM 1264 OE1 GLU A 84 11.178 -3.061 -14.504 1.00 3.89 O ATOM 1265 OE2 GLU A 84 11.493 -2.111 -12.514 1.00 5.44 O ATOM 0 H GLU A 84 9.871 -1.002 -12.095 1.00 1.88 H new ATOM 0 HA GLU A 84 8.628 1.161 -13.599 1.00 1.64 H new ATOM 0 HB2 GLU A 84 8.894 -1.615 -14.671 1.00 1.78 H new ATOM 0 HB3 GLU A 84 9.122 -0.074 -15.474 1.00 1.78 H new ATOM 0 HG2 GLU A 84 11.352 -0.572 -15.261 1.00 2.59 H new ATOM 0 HG3 GLU A 84 11.148 0.073 -13.644 1.00 2.59 H new ATOM 1272 N ASP A 85 6.320 0.205 -14.059 1.00 1.37 N ATOM 1273 CA ASP A 85 4.948 -0.263 -14.157 1.00 1.16 C ATOM 1274 C ASP A 85 4.876 -1.413 -15.165 1.00 1.09 C ATOM 1275 O ASP A 85 5.409 -1.309 -16.269 1.00 1.86 O ATOM 1276 CB ASP A 85 4.019 0.851 -14.643 1.00 1.18 C ATOM 1277 CG ASP A 85 4.468 1.554 -15.926 1.00 2.13 C ATOM 1278 OD1 ASP A 85 5.590 2.105 -15.907 1.00 3.30 O ATOM 1279 OD2 ASP A 85 3.680 1.525 -16.895 1.00 3.40 O ATOM 0 H ASP A 85 6.547 0.992 -14.667 1.00 1.37 H new ATOM 0 HA ASP A 85 4.632 -0.589 -13.166 1.00 1.16 H new ATOM 0 HB2 ASP A 85 3.026 0.431 -14.805 1.00 1.18 H new ATOM 0 HB3 ASP A 85 3.925 1.596 -13.853 1.00 1.18 H new ATOM 1284 N GLU A 86 4.214 -2.482 -14.749 1.00 0.92 N ATOM 1285 CA GLU A 86 4.132 -3.677 -15.570 1.00 0.88 C ATOM 1286 C GLU A 86 3.111 -3.481 -16.693 1.00 0.85 C ATOM 1287 O GLU A 86 3.450 -3.586 -17.871 1.00 1.03 O ATOM 1288 CB GLU A 86 3.785 -4.903 -14.722 1.00 0.91 C ATOM 1289 CG GLU A 86 4.635 -6.108 -15.127 1.00 2.06 C ATOM 1290 CD GLU A 86 6.078 -5.947 -14.646 1.00 2.89 C ATOM 1291 OE1 GLU A 86 6.305 -6.180 -13.439 1.00 3.70 O ATOM 1292 OE2 GLU A 86 6.924 -5.594 -15.497 1.00 3.88 O ATOM 0 H GLU A 86 3.729 -2.545 -13.854 1.00 0.92 H new ATOM 0 HA GLU A 86 5.109 -3.852 -16.020 1.00 0.88 H new ATOM 0 HB2 GLU A 86 3.946 -4.678 -13.668 1.00 0.91 H new ATOM 0 HB3 GLU A 86 2.728 -5.143 -14.839 1.00 0.91 H new ATOM 0 HG2 GLU A 86 4.207 -7.018 -14.706 1.00 2.06 H new ATOM 0 HG3 GLU A 86 4.620 -6.221 -16.211 1.00 2.06 H new ATOM 1299 N ASN A 87 1.881 -3.199 -16.289 1.00 0.72 N ATOM 1300 CA ASN A 87 0.806 -3.001 -17.245 1.00 0.71 C ATOM 1301 C ASN A 87 -0.452 -2.540 -16.505 1.00 0.64 C ATOM 1302 O ASN A 87 -0.435 -2.383 -15.284 1.00 0.78 O ATOM 1303 CB ASN A 87 0.473 -4.301 -17.978 1.00 0.79 C ATOM 1304 CG ASN A 87 0.067 -5.399 -16.992 1.00 0.98 C ATOM 1305 OD1 ASN A 87 -1.022 -5.401 -16.441 1.00 2.29 O ATOM 1306 ND2 ASN A 87 1.000 -6.326 -16.800 1.00 1.04 N ATOM 0 H ASN A 87 1.605 -3.103 -15.312 1.00 0.72 H new ATOM 0 HA ASN A 87 1.133 -2.253 -17.968 1.00 0.71 H new ATOM 0 HB2 ASN A 87 -0.337 -4.126 -18.686 1.00 0.79 H new ATOM 0 HB3 ASN A 87 1.337 -4.628 -18.556 1.00 0.79 H new ATOM 0 HD21 ASN A 87 0.826 -7.100 -16.159 1.00 1.04 H new ATOM 0 HD22 ASN A 87 1.890 -6.264 -17.294 1.00 1.04 H new ATOM 1313 N PHE A 88 -1.511 -2.335 -17.274 1.00 0.63 N ATOM 1314 CA PHE A 88 -2.795 -1.973 -16.698 1.00 0.62 C ATOM 1315 C PHE A 88 -3.895 -2.929 -17.167 1.00 0.67 C ATOM 1316 O PHE A 88 -4.991 -2.494 -17.518 1.00 0.76 O ATOM 1317 CB PHE A 88 -3.121 -0.560 -17.184 1.00 0.70 C ATOM 1318 CG PHE A 88 -2.060 0.482 -16.827 1.00 0.69 C ATOM 1319 CD1 PHE A 88 -1.861 0.833 -15.527 1.00 1.92 C ATOM 1320 CD2 PHE A 88 -1.314 1.058 -17.807 1.00 2.03 C ATOM 1321 CE1 PHE A 88 -0.876 1.799 -15.196 1.00 2.02 C ATOM 1322 CE2 PHE A 88 -0.328 2.025 -17.476 1.00 1.98 C ATOM 1323 CZ PHE A 88 -0.130 2.375 -16.176 1.00 0.83 C ATOM 0 H PHE A 88 -1.506 -2.413 -18.291 1.00 0.63 H new ATOM 0 HA PHE A 88 -2.744 -2.027 -15.611 1.00 0.62 H new ATOM 0 HB2 PHE A 88 -3.246 -0.579 -18.267 1.00 0.70 H new ATOM 0 HB3 PHE A 88 -4.076 -0.252 -16.758 1.00 0.70 H new ATOM 0 HD1 PHE A 88 -2.453 0.376 -14.748 1.00 1.92 H new ATOM 0 HD2 PHE A 88 -1.471 0.780 -18.839 1.00 2.03 H new ATOM 0 HE1 PHE A 88 -0.719 2.077 -14.164 1.00 2.02 H new ATOM 0 HE2 PHE A 88 0.264 2.482 -18.255 1.00 1.98 H new ATOM 0 HZ PHE A 88 0.620 3.110 -15.923 1.00 0.83 H new ATOM 1333 N ILE A 89 -3.564 -4.212 -17.157 1.00 0.66 N ATOM 1334 CA ILE A 89 -4.531 -5.236 -17.510 1.00 0.72 C ATOM 1335 C ILE A 89 -5.612 -5.305 -16.429 1.00 0.70 C ATOM 1336 O ILE A 89 -6.727 -5.755 -16.690 1.00 0.84 O ATOM 1337 CB ILE A 89 -3.828 -6.572 -17.762 1.00 0.81 C ATOM 1338 CG1 ILE A 89 -2.916 -6.488 -18.988 1.00 0.88 C ATOM 1339 CG2 ILE A 89 -4.843 -7.711 -17.881 1.00 0.96 C ATOM 1340 CD1 ILE A 89 -1.895 -7.628 -18.989 1.00 0.92 C ATOM 0 H ILE A 89 -2.640 -4.565 -16.910 1.00 0.66 H new ATOM 0 HA ILE A 89 -5.030 -4.983 -18.445 1.00 0.72 H new ATOM 0 HB ILE A 89 -3.195 -6.793 -16.903 1.00 0.81 H new ATOM 0 HG12 ILE A 89 -3.517 -6.532 -19.897 1.00 0.88 H new ATOM 0 HG13 ILE A 89 -2.397 -5.530 -18.995 1.00 0.88 H new ATOM 0 HG21 ILE A 89 -4.318 -8.649 -18.060 1.00 0.96 H new ATOM 0 HG22 ILE A 89 -5.416 -7.786 -16.957 1.00 0.96 H new ATOM 0 HG23 ILE A 89 -5.520 -7.510 -18.712 1.00 0.96 H new ATOM 0 HD11 ILE A 89 -1.259 -7.546 -19.870 1.00 0.92 H new ATOM 0 HD12 ILE A 89 -1.280 -7.567 -18.091 1.00 0.92 H new ATOM 0 HD13 ILE A 89 -2.418 -8.584 -19.007 1.00 0.92 H new ATOM 1352 N LEU A 90 -5.245 -4.851 -15.241 1.00 0.64 N ATOM 1353 CA LEU A 90 -6.171 -4.854 -14.120 1.00 0.61 C ATOM 1354 C LEU A 90 -7.050 -3.604 -14.186 1.00 0.65 C ATOM 1355 O LEU A 90 -6.861 -2.753 -15.053 1.00 0.98 O ATOM 1356 CB LEU A 90 -5.412 -5.003 -12.799 1.00 0.69 C ATOM 1357 CG LEU A 90 -4.506 -6.230 -12.680 1.00 1.13 C ATOM 1358 CD1 LEU A 90 -5.205 -7.482 -13.216 1.00 1.08 C ATOM 1359 CD2 LEU A 90 -3.161 -5.988 -13.367 1.00 2.93 C ATOM 0 H LEU A 90 -4.319 -4.478 -15.029 1.00 0.64 H new ATOM 0 HA LEU A 90 -6.837 -5.715 -14.178 1.00 0.61 H new ATOM 0 HB2 LEU A 90 -4.803 -4.111 -12.650 1.00 0.69 H new ATOM 0 HB3 LEU A 90 -6.138 -5.032 -11.987 1.00 0.69 H new ATOM 0 HG LEU A 90 -4.302 -6.402 -11.623 1.00 1.13 H new ATOM 0 HD11 LEU A 90 -4.539 -8.340 -13.120 1.00 1.08 H new ATOM 0 HD12 LEU A 90 -6.115 -7.663 -12.645 1.00 1.08 H new ATOM 0 HD13 LEU A 90 -5.459 -7.336 -14.266 1.00 1.08 H new ATOM 0 HD21 LEU A 90 -2.537 -6.876 -13.267 1.00 2.93 H new ATOM 0 HD22 LEU A 90 -3.325 -5.776 -14.424 1.00 2.93 H new ATOM 0 HD23 LEU A 90 -2.662 -5.139 -12.900 1.00 2.93 H new ATOM 1371 N LYS A 91 -7.995 -3.535 -13.260 1.00 0.55 N ATOM 1372 CA LYS A 91 -8.880 -2.385 -13.178 1.00 0.57 C ATOM 1373 C LYS A 91 -9.100 -2.020 -11.709 1.00 0.55 C ATOM 1374 O LYS A 91 -8.562 -2.673 -10.816 1.00 0.56 O ATOM 1375 CB LYS A 91 -10.175 -2.650 -13.947 1.00 0.69 C ATOM 1376 CG LYS A 91 -9.920 -2.688 -15.455 1.00 1.27 C ATOM 1377 CD LYS A 91 -11.221 -2.494 -16.236 1.00 1.28 C ATOM 1378 CE LYS A 91 -12.250 -3.564 -15.863 1.00 2.48 C ATOM 1379 NZ LYS A 91 -11.721 -4.915 -16.151 1.00 4.48 N ATOM 0 H LYS A 91 -8.167 -4.257 -12.560 1.00 0.55 H new ATOM 0 HA LYS A 91 -8.424 -1.518 -13.657 1.00 0.57 H new ATOM 0 HB2 LYS A 91 -10.607 -3.597 -13.624 1.00 0.69 H new ATOM 0 HB3 LYS A 91 -10.904 -1.873 -13.717 1.00 0.69 H new ATOM 0 HG2 LYS A 91 -9.209 -1.908 -15.727 1.00 1.27 H new ATOM 0 HG3 LYS A 91 -9.467 -3.641 -15.727 1.00 1.27 H new ATOM 0 HD2 LYS A 91 -11.629 -1.505 -16.030 1.00 1.28 H new ATOM 0 HD3 LYS A 91 -11.017 -2.538 -17.306 1.00 1.28 H new ATOM 0 HE2 LYS A 91 -12.500 -3.483 -14.805 1.00 2.48 H new ATOM 0 HE3 LYS A 91 -13.171 -3.401 -16.422 1.00 2.48 H new ATOM 0 HZ1 LYS A 91 -12.495 -5.608 -16.104 1.00 4.48 H new ATOM 0 HZ2 LYS A 91 -11.302 -4.928 -17.103 1.00 4.48 H new ATOM 0 HZ3 LYS A 91 -10.994 -5.160 -15.449 1.00 4.48 H new ATOM 1393 N HIS A 92 -9.892 -0.978 -11.503 1.00 0.59 N ATOM 1394 CA HIS A 92 -10.239 -0.556 -10.156 1.00 0.57 C ATOM 1395 C HIS A 92 -11.729 -0.804 -9.908 1.00 0.55 C ATOM 1396 O HIS A 92 -12.554 0.081 -10.128 1.00 0.62 O ATOM 1397 CB HIS A 92 -9.833 0.900 -9.922 1.00 0.65 C ATOM 1398 CG HIS A 92 -8.346 1.146 -10.013 1.00 0.81 C ATOM 1399 ND1 HIS A 92 -7.653 1.902 -9.083 1.00 1.08 N ATOM 1400 CD2 HIS A 92 -7.428 0.727 -10.930 1.00 2.32 C ATOM 1401 CE1 HIS A 92 -6.376 1.931 -9.435 1.00 0.73 C ATOM 1402 NE2 HIS A 92 -6.238 1.202 -10.580 1.00 1.86 N ATOM 0 H HIS A 92 -10.303 -0.413 -12.246 1.00 0.59 H new ATOM 0 HA HIS A 92 -9.682 -1.149 -9.430 1.00 0.57 H new ATOM 0 HB2 HIS A 92 -10.340 1.530 -10.653 1.00 0.65 H new ATOM 0 HB3 HIS A 92 -10.182 1.210 -8.937 1.00 0.65 H new ATOM 0 HD2 HIS A 92 -7.634 0.113 -11.794 1.00 2.32 H new ATOM 0 HE1 HIS A 92 -5.584 2.442 -8.908 1.00 0.73 H new ATOM 0 HE2 HIS A 92 -5.365 1.047 -11.084 1.00 1.86 H new ATOM 1410 N THR A 93 -12.027 -2.012 -9.454 1.00 0.52 N ATOM 1411 CA THR A 93 -13.408 -2.418 -9.260 1.00 0.55 C ATOM 1412 C THR A 93 -14.068 -1.563 -8.177 1.00 0.58 C ATOM 1413 O THR A 93 -15.249 -1.233 -8.274 1.00 0.68 O ATOM 1414 CB THR A 93 -13.421 -3.915 -8.944 1.00 0.59 C ATOM 1415 OG1 THR A 93 -12.298 -4.099 -8.086 1.00 0.63 O ATOM 1416 CG2 THR A 93 -13.099 -4.775 -10.168 1.00 0.70 C ATOM 0 H THR A 93 -11.336 -2.723 -9.215 1.00 0.52 H new ATOM 0 HA THR A 93 -13.998 -2.256 -10.162 1.00 0.55 H new ATOM 0 HB THR A 93 -14.399 -4.194 -8.551 1.00 0.59 H new ATOM 0 HG1 THR A 93 -11.579 -4.545 -8.580 1.00 0.63 H new ATOM 0 HG21 THR A 93 -13.121 -5.828 -9.889 1.00 0.70 H new ATOM 0 HG22 THR A 93 -13.839 -4.590 -10.947 1.00 0.70 H new ATOM 0 HG23 THR A 93 -12.107 -4.520 -10.541 1.00 0.70 H new ATOM 1424 N GLY A 94 -13.277 -1.227 -7.169 1.00 0.57 N ATOM 1425 CA GLY A 94 -13.773 -0.429 -6.060 1.00 0.63 C ATOM 1426 C GLY A 94 -12.867 -0.569 -4.835 1.00 0.61 C ATOM 1427 O GLY A 94 -11.647 -0.466 -4.946 1.00 0.62 O ATOM 0 H GLY A 94 -12.295 -1.493 -7.097 1.00 0.57 H new ATOM 0 HA2 GLY A 94 -13.829 0.618 -6.357 1.00 0.63 H new ATOM 0 HA3 GLY A 94 -14.785 -0.743 -5.806 1.00 0.63 H new ATOM 1431 N PRO A 95 -13.518 -0.806 -3.664 1.00 0.60 N ATOM 1432 CA PRO A 95 -12.785 -0.951 -2.418 1.00 0.60 C ATOM 1433 C PRO A 95 -12.087 -2.311 -2.347 1.00 0.65 C ATOM 1434 O PRO A 95 -12.591 -3.300 -2.877 1.00 0.71 O ATOM 1435 CB PRO A 95 -13.824 -0.760 -1.326 1.00 0.60 C ATOM 1436 CG PRO A 95 -15.173 -0.978 -1.992 1.00 0.62 C ATOM 1437 CD PRO A 95 -14.961 -0.944 -3.497 1.00 0.61 C ATOM 0 HA PRO A 95 -11.981 -0.222 -2.316 1.00 0.60 H new ATOM 0 HB2 PRO A 95 -13.671 -1.469 -0.513 1.00 0.60 H new ATOM 0 HB3 PRO A 95 -13.758 0.239 -0.895 1.00 0.60 H new ATOM 0 HG2 PRO A 95 -15.599 -1.934 -1.688 1.00 0.62 H new ATOM 0 HG3 PRO A 95 -15.878 -0.204 -1.688 1.00 0.62 H new ATOM 0 HD2 PRO A 95 -15.329 -1.855 -3.970 1.00 0.61 H new ATOM 0 HD3 PRO A 95 -15.494 -0.110 -3.953 1.00 0.61 H new ATOM 1445 N GLY A 96 -10.937 -2.317 -1.688 1.00 0.68 N ATOM 1446 CA GLY A 96 -10.202 -3.552 -1.475 1.00 0.72 C ATOM 1447 C GLY A 96 -9.296 -3.863 -2.668 1.00 0.71 C ATOM 1448 O GLY A 96 -9.066 -5.027 -2.992 1.00 0.87 O ATOM 0 H GLY A 96 -10.496 -1.486 -1.294 1.00 0.68 H new ATOM 0 HA2 GLY A 96 -9.601 -3.470 -0.569 1.00 0.72 H new ATOM 0 HA3 GLY A 96 -10.901 -4.374 -1.321 1.00 0.72 H new ATOM 1452 N ILE A 97 -8.805 -2.800 -3.290 1.00 0.67 N ATOM 1453 CA ILE A 97 -7.931 -2.945 -4.442 1.00 0.67 C ATOM 1454 C ILE A 97 -6.592 -2.267 -4.149 1.00 0.73 C ATOM 1455 O ILE A 97 -6.519 -1.042 -4.056 1.00 1.04 O ATOM 1456 CB ILE A 97 -8.620 -2.425 -5.705 1.00 0.62 C ATOM 1457 CG1 ILE A 97 -9.791 -3.328 -6.102 1.00 0.78 C ATOM 1458 CG2 ILE A 97 -7.616 -2.253 -6.847 1.00 0.77 C ATOM 1459 CD1 ILE A 97 -9.301 -4.555 -6.872 1.00 0.78 C ATOM 0 H ILE A 97 -8.996 -1.836 -3.018 1.00 0.67 H new ATOM 0 HA ILE A 97 -7.721 -3.998 -4.631 1.00 0.67 H new ATOM 0 HB ILE A 97 -9.032 -1.439 -5.488 1.00 0.62 H new ATOM 0 HG12 ILE A 97 -10.329 -3.646 -5.209 1.00 0.78 H new ATOM 0 HG13 ILE A 97 -10.496 -2.767 -6.716 1.00 0.78 H new ATOM 0 HG21 ILE A 97 -8.132 -1.882 -7.733 1.00 0.77 H new ATOM 0 HG22 ILE A 97 -6.846 -1.540 -6.551 1.00 0.77 H new ATOM 0 HG23 ILE A 97 -7.153 -3.214 -7.072 1.00 0.77 H new ATOM 0 HD11 ILE A 97 -10.153 -5.179 -7.142 1.00 0.78 H new ATOM 0 HD12 ILE A 97 -8.785 -4.234 -7.777 1.00 0.78 H new ATOM 0 HD13 ILE A 97 -8.615 -5.127 -6.247 1.00 0.78 H new ATOM 1471 N LEU A 98 -5.565 -3.091 -4.012 1.00 0.62 N ATOM 1472 CA LEU A 98 -4.227 -2.585 -3.758 1.00 0.69 C ATOM 1473 C LEU A 98 -3.607 -2.113 -5.074 1.00 0.60 C ATOM 1474 O LEU A 98 -3.467 -2.893 -6.015 1.00 0.53 O ATOM 1475 CB LEU A 98 -3.387 -3.633 -3.024 1.00 0.82 C ATOM 1476 CG LEU A 98 -2.037 -3.154 -2.487 1.00 1.06 C ATOM 1477 CD1 LEU A 98 -1.722 -3.804 -1.138 1.00 0.96 C ATOM 1478 CD2 LEU A 98 -0.925 -3.389 -3.510 1.00 2.14 C ATOM 0 H LEU A 98 -5.632 -4.107 -4.072 1.00 0.62 H new ATOM 0 HA LEU A 98 -4.267 -1.721 -3.095 1.00 0.69 H new ATOM 0 HB2 LEU A 98 -3.972 -4.019 -2.189 1.00 0.82 H new ATOM 0 HB3 LEU A 98 -3.210 -4.468 -3.702 1.00 0.82 H new ATOM 0 HG LEU A 98 -2.098 -2.079 -2.320 1.00 1.06 H new ATOM 0 HD11 LEU A 98 -0.757 -3.447 -0.778 1.00 0.96 H new ATOM 0 HD12 LEU A 98 -2.497 -3.542 -0.418 1.00 0.96 H new ATOM 0 HD13 LEU A 98 -1.687 -4.887 -1.255 1.00 0.96 H new ATOM 0 HD21 LEU A 98 0.024 -3.040 -3.103 1.00 2.14 H new ATOM 0 HD22 LEU A 98 -0.854 -4.454 -3.732 1.00 2.14 H new ATOM 0 HD23 LEU A 98 -1.151 -2.841 -4.425 1.00 2.14 H new ATOM 1490 N SER A 99 -3.251 -0.836 -5.100 1.00 0.85 N ATOM 1491 CA SER A 99 -2.629 -0.256 -6.277 1.00 0.93 C ATOM 1492 C SER A 99 -1.351 0.487 -5.883 1.00 0.89 C ATOM 1493 O SER A 99 -1.037 0.603 -4.698 1.00 0.89 O ATOM 1494 CB SER A 99 -3.592 0.690 -6.999 1.00 1.08 C ATOM 1495 OG SER A 99 -3.401 2.047 -6.607 1.00 1.85 O ATOM 0 H SER A 99 -3.382 -0.187 -4.324 1.00 0.85 H new ATOM 0 HA SER A 99 -2.374 -1.065 -6.962 1.00 0.93 H new ATOM 0 HB2 SER A 99 -3.449 0.600 -8.076 1.00 1.08 H new ATOM 0 HB3 SER A 99 -4.619 0.393 -6.788 1.00 1.08 H new ATOM 0 HG SER A 99 -3.533 2.130 -5.639 1.00 1.85 H new ATOM 1501 N MET A 100 -0.649 0.972 -6.896 1.00 0.93 N ATOM 1502 CA MET A 100 0.555 1.751 -6.666 1.00 0.92 C ATOM 1503 C MET A 100 0.281 3.247 -6.835 1.00 0.77 C ATOM 1504 O MET A 100 -0.787 3.636 -7.304 1.00 1.00 O ATOM 1505 CB MET A 100 1.641 1.317 -7.655 1.00 1.20 C ATOM 1506 CG MET A 100 1.974 -0.166 -7.485 1.00 1.26 C ATOM 1507 SD MET A 100 3.531 -0.536 -8.275 1.00 1.90 S ATOM 1508 CE MET A 100 4.656 -0.139 -6.947 1.00 1.13 C ATOM 0 H MET A 100 -0.891 0.841 -7.878 1.00 0.93 H new ATOM 0 HA MET A 100 0.889 1.574 -5.644 1.00 0.92 H new ATOM 0 HB2 MET A 100 1.305 1.504 -8.675 1.00 1.20 H new ATOM 0 HB3 MET A 100 2.539 1.915 -7.501 1.00 1.20 H new ATOM 0 HG2 MET A 100 2.026 -0.416 -6.425 1.00 1.26 H new ATOM 0 HG3 MET A 100 1.182 -0.777 -7.919 1.00 1.26 H new ATOM 0 HE1 MET A 100 5.683 -0.264 -7.291 1.00 1.13 H new ATOM 0 HE2 MET A 100 4.501 0.894 -6.635 1.00 1.13 H new ATOM 0 HE3 MET A 100 4.472 -0.804 -6.103 1.00 1.13 H new ATOM 1518 N ALA A 101 1.264 4.044 -6.443 1.00 0.92 N ATOM 1519 CA ALA A 101 1.186 5.481 -6.642 1.00 0.85 C ATOM 1520 C ALA A 101 2.517 5.987 -7.201 1.00 1.07 C ATOM 1521 O ALA A 101 3.583 5.581 -6.740 1.00 1.93 O ATOM 1522 CB ALA A 101 0.813 6.160 -5.322 1.00 0.77 C ATOM 0 H ALA A 101 2.119 3.722 -5.989 1.00 0.92 H new ATOM 0 HA ALA A 101 0.409 5.726 -7.366 1.00 0.85 H new ATOM 0 HB1 ALA A 101 0.754 7.238 -5.471 1.00 0.77 H new ATOM 0 HB2 ALA A 101 -0.153 5.788 -4.982 1.00 0.77 H new ATOM 0 HB3 ALA A 101 1.572 5.938 -4.572 1.00 0.77 H new ATOM 1528 N ASN A 102 2.412 6.868 -8.186 1.00 1.10 N ATOM 1529 CA ASN A 102 3.592 7.368 -8.871 1.00 1.23 C ATOM 1530 C ASN A 102 3.390 8.847 -9.209 1.00 1.18 C ATOM 1531 O ASN A 102 2.270 9.353 -9.158 1.00 1.19 O ATOM 1532 CB ASN A 102 3.831 6.612 -10.179 1.00 1.45 C ATOM 1533 CG ASN A 102 2.556 6.557 -11.022 1.00 2.20 C ATOM 1534 OD1 ASN A 102 1.798 7.508 -11.111 1.00 3.33 O ATOM 1535 ND2 ASN A 102 2.363 5.391 -11.633 1.00 2.48 N ATOM 0 H ASN A 102 1.528 7.248 -8.526 1.00 1.10 H new ATOM 0 HA ASN A 102 4.450 7.229 -8.213 1.00 1.23 H new ATOM 0 HB2 ASN A 102 4.625 7.100 -10.745 1.00 1.45 H new ATOM 0 HB3 ASN A 102 4.171 5.600 -9.961 1.00 1.45 H new ATOM 0 HD21 ASN A 102 1.540 5.252 -12.219 1.00 2.48 H new ATOM 0 HD22 ASN A 102 3.038 4.636 -11.515 1.00 2.48 H new ATOM 1542 N ALA A 103 4.493 9.499 -9.549 1.00 1.28 N ATOM 1543 CA ALA A 103 4.459 10.919 -9.855 1.00 1.29 C ATOM 1544 C ALA A 103 5.112 11.158 -11.218 1.00 1.35 C ATOM 1545 O ALA A 103 5.547 12.269 -11.515 1.00 1.60 O ATOM 1546 CB ALA A 103 5.146 11.700 -8.734 1.00 1.42 C ATOM 0 H ALA A 103 5.416 9.070 -9.619 1.00 1.28 H new ATOM 0 HA ALA A 103 3.430 11.274 -9.915 1.00 1.29 H new ATOM 0 HB1 ALA A 103 5.120 12.765 -8.964 1.00 1.42 H new ATOM 0 HB2 ALA A 103 4.626 11.519 -7.793 1.00 1.42 H new ATOM 0 HB3 ALA A 103 6.182 11.373 -8.645 1.00 1.42 H new ATOM 1552 N GLY A 104 5.159 10.096 -12.010 1.00 1.37 N ATOM 1553 CA GLY A 104 5.821 10.156 -13.302 1.00 1.59 C ATOM 1554 C GLY A 104 6.169 8.754 -13.805 1.00 1.66 C ATOM 1555 O GLY A 104 5.545 7.774 -13.404 1.00 1.47 O ATOM 0 H GLY A 104 4.750 9.190 -11.782 1.00 1.37 H new ATOM 0 HA2 GLY A 104 5.174 10.655 -14.023 1.00 1.59 H new ATOM 0 HA3 GLY A 104 6.729 10.753 -13.222 1.00 1.59 H new ATOM 1559 N PRO A 105 7.192 8.702 -14.700 1.00 2.15 N ATOM 1560 CA PRO A 105 7.624 7.437 -15.270 1.00 2.31 C ATOM 1561 C PRO A 105 8.427 6.624 -14.252 1.00 1.95 C ATOM 1562 O PRO A 105 9.493 7.052 -13.812 1.00 2.11 O ATOM 1563 CB PRO A 105 8.434 7.816 -16.499 1.00 3.12 C ATOM 1564 CG PRO A 105 8.815 9.276 -16.315 1.00 3.35 C ATOM 1565 CD PRO A 105 7.960 9.842 -15.192 1.00 2.71 C ATOM 0 HA PRO A 105 6.790 6.791 -15.543 1.00 2.31 H new ATOM 0 HB2 PRO A 105 9.321 7.190 -16.590 1.00 3.12 H new ATOM 0 HB3 PRO A 105 7.851 7.677 -17.409 1.00 3.12 H new ATOM 0 HG2 PRO A 105 9.874 9.367 -16.072 1.00 3.35 H new ATOM 0 HG3 PRO A 105 8.651 9.833 -17.238 1.00 3.35 H new ATOM 0 HD2 PRO A 105 8.577 10.274 -14.404 1.00 2.71 H new ATOM 0 HD3 PRO A 105 7.305 10.634 -15.554 1.00 2.71 H new ATOM 1573 N ASN A 106 7.886 5.465 -13.909 1.00 1.73 N ATOM 1574 CA ASN A 106 8.597 4.531 -13.054 1.00 1.75 C ATOM 1575 C ASN A 106 9.311 5.305 -11.943 1.00 1.69 C ATOM 1576 O ASN A 106 10.538 5.298 -11.867 1.00 1.68 O ATOM 1577 CB ASN A 106 9.654 3.755 -13.843 1.00 1.98 C ATOM 1578 CG ASN A 106 10.449 4.688 -14.757 1.00 2.99 C ATOM 1579 OD1 ASN A 106 10.078 4.958 -15.887 1.00 3.49 O ATOM 1580 ND2 ASN A 106 11.563 5.165 -14.207 1.00 4.49 N ATOM 0 H ASN A 106 6.963 5.151 -14.208 1.00 1.73 H new ATOM 0 HA ASN A 106 7.870 3.832 -12.642 1.00 1.75 H new ATOM 0 HB2 ASN A 106 10.331 3.252 -13.153 1.00 1.98 H new ATOM 0 HB3 ASN A 106 9.172 2.980 -14.439 1.00 1.98 H new ATOM 0 HD21 ASN A 106 12.164 5.797 -14.737 1.00 4.49 H new ATOM 0 HD22 ASN A 106 11.816 4.899 -13.255 1.00 4.49 H new ATOM 1587 N THR A 107 8.510 5.953 -11.109 1.00 1.75 N ATOM 1588 CA THR A 107 9.041 6.639 -9.944 1.00 1.79 C ATOM 1589 C THR A 107 8.605 5.927 -8.662 1.00 1.94 C ATOM 1590 O THR A 107 9.202 6.124 -7.604 1.00 2.57 O ATOM 1591 CB THR A 107 8.593 8.100 -10.010 1.00 1.78 C ATOM 1592 OG1 THR A 107 7.210 8.055 -9.664 1.00 2.95 O ATOM 1593 CG2 THR A 107 8.600 8.651 -11.437 1.00 1.58 C ATOM 0 H THR A 107 7.498 6.017 -11.217 1.00 1.75 H new ATOM 0 HA THR A 107 10.131 6.619 -9.936 1.00 1.79 H new ATOM 0 HB THR A 107 9.245 8.708 -9.382 1.00 1.78 H new ATOM 0 HG1 THR A 107 7.081 8.458 -8.780 1.00 2.95 H new ATOM 0 HG21 THR A 107 8.274 9.691 -11.427 1.00 1.58 H new ATOM 0 HG22 THR A 107 9.609 8.591 -11.845 1.00 1.58 H new ATOM 0 HG23 THR A 107 7.922 8.064 -12.057 1.00 1.58 H new ATOM 1601 N ASN A 108 7.567 5.114 -8.797 1.00 1.84 N ATOM 1602 CA ASN A 108 6.928 4.518 -7.637 1.00 2.06 C ATOM 1603 C ASN A 108 7.956 3.695 -6.859 1.00 1.89 C ATOM 1604 O ASN A 108 8.267 2.567 -7.237 1.00 1.92 O ATOM 1605 CB ASN A 108 5.791 3.583 -8.055 1.00 2.36 C ATOM 1606 CG ASN A 108 6.108 2.896 -9.385 1.00 2.46 C ATOM 1607 OD1 ASN A 108 5.771 3.374 -10.456 1.00 3.19 O ATOM 1608 ND2 ASN A 108 6.773 1.751 -9.258 1.00 3.36 N ATOM 0 H ASN A 108 7.153 4.854 -9.692 1.00 1.84 H new ATOM 0 HA ASN A 108 6.526 5.324 -7.023 1.00 2.06 H new ATOM 0 HB2 ASN A 108 5.631 2.831 -7.282 1.00 2.36 H new ATOM 0 HB3 ASN A 108 4.864 4.149 -8.146 1.00 2.36 H new ATOM 0 HD21 ASN A 108 7.032 1.217 -10.087 1.00 3.36 H new ATOM 0 HD22 ASN A 108 7.024 1.407 -8.331 1.00 3.36 H new ATOM 1615 N GLY A 109 8.456 4.292 -5.787 1.00 2.26 N ATOM 1616 CA GLY A 109 9.418 3.615 -4.934 1.00 2.34 C ATOM 1617 C GLY A 109 8.719 2.924 -3.761 1.00 2.25 C ATOM 1618 O GLY A 109 8.793 3.393 -2.627 1.00 3.77 O ATOM 0 H GLY A 109 8.213 5.237 -5.490 1.00 2.26 H new ATOM 0 HA2 GLY A 109 9.972 2.879 -5.517 1.00 2.34 H new ATOM 0 HA3 GLY A 109 10.144 4.335 -4.556 1.00 2.34 H new ATOM 1622 N SER A 110 8.058 1.819 -4.075 1.00 1.22 N ATOM 1623 CA SER A 110 7.337 1.065 -3.064 1.00 1.24 C ATOM 1624 C SER A 110 6.368 1.984 -2.318 1.00 1.49 C ATOM 1625 O SER A 110 6.076 1.762 -1.144 1.00 2.49 O ATOM 1626 CB SER A 110 8.303 0.402 -2.080 1.00 1.61 C ATOM 1627 OG SER A 110 8.875 1.342 -1.176 1.00 2.75 O ATOM 0 H SER A 110 8.007 1.428 -5.016 1.00 1.22 H new ATOM 0 HA SER A 110 6.771 0.278 -3.562 1.00 1.24 H new ATOM 0 HB2 SER A 110 7.775 -0.367 -1.517 1.00 1.61 H new ATOM 0 HB3 SER A 110 9.098 -0.098 -2.634 1.00 1.61 H new ATOM 0 HG SER A 110 8.675 2.252 -1.480 1.00 2.75 H new ATOM 1633 N GLN A 111 5.897 2.997 -3.030 1.00 1.54 N ATOM 1634 CA GLN A 111 4.859 3.866 -2.499 1.00 1.85 C ATOM 1635 C GLN A 111 3.492 3.458 -3.052 1.00 1.86 C ATOM 1636 O GLN A 111 3.132 3.833 -4.167 1.00 2.36 O ATOM 1637 CB GLN A 111 5.161 5.333 -2.811 1.00 2.13 C ATOM 1638 CG GLN A 111 5.333 6.142 -1.523 1.00 2.67 C ATOM 1639 CD GLN A 111 5.712 7.592 -1.833 1.00 3.76 C ATOM 1640 OE1 GLN A 111 6.811 7.894 -2.271 1.00 4.38 O ATOM 1641 NE2 GLN A 111 4.744 8.469 -1.583 1.00 4.92 N ATOM 0 H GLN A 111 6.214 3.236 -3.969 1.00 1.54 H new ATOM 0 HA GLN A 111 4.838 3.756 -1.415 1.00 1.85 H new ATOM 0 HB2 GLN A 111 6.068 5.402 -3.412 1.00 2.13 H new ATOM 0 HB3 GLN A 111 4.352 5.756 -3.406 1.00 2.13 H new ATOM 0 HG2 GLN A 111 4.407 6.119 -0.949 1.00 2.67 H new ATOM 0 HG3 GLN A 111 6.104 5.685 -0.903 1.00 2.67 H new ATOM 0 HE21 GLN A 111 3.848 8.149 -1.217 1.00 4.92 H new ATOM 0 HE22 GLN A 111 4.898 9.462 -1.757 1.00 4.92 H new ATOM 1650 N PHE A 112 2.767 2.695 -2.247 1.00 1.53 N ATOM 1651 CA PHE A 112 1.541 2.069 -2.712 1.00 1.40 C ATOM 1652 C PHE A 112 0.322 2.922 -2.359 1.00 1.64 C ATOM 1653 O PHE A 112 0.461 4.014 -1.808 1.00 2.26 O ATOM 1654 CB PHE A 112 1.430 0.721 -1.998 1.00 1.45 C ATOM 1655 CG PHE A 112 2.705 -0.123 -2.058 1.00 2.33 C ATOM 1656 CD1 PHE A 112 2.959 -0.894 -3.149 1.00 3.97 C ATOM 1657 CD2 PHE A 112 3.584 -0.102 -1.020 1.00 2.71 C ATOM 1658 CE1 PHE A 112 4.142 -1.678 -3.205 1.00 5.42 C ATOM 1659 CE2 PHE A 112 4.767 -0.885 -1.076 1.00 3.84 C ATOM 1660 CZ PHE A 112 5.021 -1.656 -2.167 1.00 5.10 C ATOM 0 H PHE A 112 3.005 2.496 -1.275 1.00 1.53 H new ATOM 0 HA PHE A 112 1.569 1.955 -3.796 1.00 1.40 H new ATOM 0 HB2 PHE A 112 1.171 0.895 -0.954 1.00 1.45 H new ATOM 0 HB3 PHE A 112 0.610 0.154 -2.440 1.00 1.45 H new ATOM 0 HD1 PHE A 112 2.261 -0.910 -3.973 1.00 3.97 H new ATOM 0 HD2 PHE A 112 3.382 0.510 -0.153 1.00 2.71 H new ATOM 0 HE1 PHE A 112 4.344 -2.291 -4.071 1.00 5.42 H new ATOM 0 HE2 PHE A 112 5.465 -0.868 -0.252 1.00 3.84 H new ATOM 0 HZ PHE A 112 5.921 -2.251 -2.209 1.00 5.10 H new ATOM 1670 N PHE A 113 -0.846 2.393 -2.691 1.00 1.31 N ATOM 1671 CA PHE A 113 -2.084 3.132 -2.503 1.00 1.62 C ATOM 1672 C PHE A 113 -3.297 2.210 -2.634 1.00 1.61 C ATOM 1673 O PHE A 113 -3.656 1.802 -3.738 1.00 2.10 O ATOM 1674 CB PHE A 113 -2.143 4.194 -3.602 1.00 1.98 C ATOM 1675 CG PHE A 113 -3.557 4.489 -4.107 1.00 2.54 C ATOM 1676 CD1 PHE A 113 -4.577 4.645 -3.220 1.00 3.23 C ATOM 1677 CD2 PHE A 113 -3.794 4.593 -5.442 1.00 4.12 C ATOM 1678 CE1 PHE A 113 -5.889 4.919 -3.690 1.00 5.01 C ATOM 1679 CE2 PHE A 113 -5.107 4.867 -5.910 1.00 5.40 C ATOM 1680 CZ PHE A 113 -6.126 5.024 -5.024 1.00 5.72 C ATOM 0 H PHE A 113 -0.962 1.461 -3.089 1.00 1.31 H new ATOM 0 HA PHE A 113 -2.105 3.576 -1.508 1.00 1.62 H new ATOM 0 HB2 PHE A 113 -1.703 5.117 -3.225 1.00 1.98 H new ATOM 0 HB3 PHE A 113 -1.529 3.868 -4.442 1.00 1.98 H new ATOM 0 HD1 PHE A 113 -4.389 4.561 -2.160 1.00 3.23 H new ATOM 0 HD2 PHE A 113 -2.985 4.467 -6.146 1.00 4.12 H new ATOM 0 HE1 PHE A 113 -6.699 5.044 -2.987 1.00 5.01 H new ATOM 0 HE2 PHE A 113 -5.296 4.951 -6.970 1.00 5.40 H new ATOM 0 HZ PHE A 113 -7.124 5.232 -5.380 1.00 5.72 H new ATOM 1690 N ILE A 114 -3.899 1.909 -1.492 1.00 1.41 N ATOM 1691 CA ILE A 114 -5.019 0.985 -1.457 1.00 1.33 C ATOM 1692 C ILE A 114 -6.319 1.757 -1.695 1.00 1.20 C ATOM 1693 O ILE A 114 -6.596 2.739 -1.008 1.00 1.41 O ATOM 1694 CB ILE A 114 -5.011 0.181 -0.156 1.00 1.39 C ATOM 1695 CG1 ILE A 114 -3.683 -0.556 0.025 1.00 1.57 C ATOM 1696 CG2 ILE A 114 -6.208 -0.771 -0.091 1.00 1.40 C ATOM 1697 CD1 ILE A 114 -3.372 -0.771 1.508 1.00 1.51 C ATOM 0 H ILE A 114 -3.632 2.289 -0.584 1.00 1.41 H new ATOM 0 HA ILE A 114 -4.932 0.251 -2.258 1.00 1.33 H new ATOM 0 HB ILE A 114 -5.109 0.878 0.676 1.00 1.39 H new ATOM 0 HG12 ILE A 114 -3.725 -1.519 -0.485 1.00 1.57 H new ATOM 0 HG13 ILE A 114 -2.880 0.016 -0.439 1.00 1.57 H new ATOM 0 HG21 ILE A 114 -6.178 -1.330 0.844 1.00 1.40 H new ATOM 0 HG22 ILE A 114 -7.133 -0.196 -0.140 1.00 1.40 H new ATOM 0 HG23 ILE A 114 -6.167 -1.465 -0.930 1.00 1.40 H new ATOM 0 HD11 ILE A 114 -2.423 -1.297 1.608 1.00 1.51 H new ATOM 0 HD12 ILE A 114 -3.307 0.194 2.010 1.00 1.51 H new ATOM 0 HD13 ILE A 114 -4.165 -1.364 1.964 1.00 1.51 H new ATOM 1709 N CYS A 115 -7.081 1.283 -2.670 1.00 1.03 N ATOM 1710 CA CYS A 115 -8.373 1.878 -2.965 1.00 0.91 C ATOM 1711 C CYS A 115 -9.403 1.292 -1.997 1.00 0.84 C ATOM 1712 O CYS A 115 -9.635 0.084 -1.987 1.00 0.94 O ATOM 1713 CB CYS A 115 -8.776 1.661 -4.426 1.00 0.91 C ATOM 1714 SG CYS A 115 -7.422 2.195 -5.534 1.00 1.81 S ATOM 0 H CYS A 115 -6.828 0.494 -3.265 1.00 1.03 H new ATOM 0 HA CYS A 115 -8.319 2.958 -2.828 1.00 0.91 H new ATOM 0 HB2 CYS A 115 -9.003 0.609 -4.597 1.00 0.91 H new ATOM 0 HB3 CYS A 115 -9.683 2.223 -4.649 1.00 0.91 H new ATOM 0 HG CYS A 115 -6.766 3.170 -4.979 1.00 1.81 H new ATOM 1720 N THR A 116 -9.994 2.176 -1.206 1.00 0.79 N ATOM 1721 CA THR A 116 -11.043 1.774 -0.285 1.00 0.79 C ATOM 1722 C THR A 116 -12.391 2.344 -0.729 1.00 0.68 C ATOM 1723 O THR A 116 -13.303 2.497 0.083 1.00 0.74 O ATOM 1724 CB THR A 116 -10.631 2.212 1.122 1.00 0.97 C ATOM 1725 OG1 THR A 116 -9.239 1.913 1.185 1.00 1.57 O ATOM 1726 CG2 THR A 116 -11.251 1.337 2.213 1.00 1.15 C ATOM 0 H THR A 116 -9.766 3.170 -1.184 1.00 0.79 H new ATOM 0 HA THR A 116 -11.170 0.691 -0.279 1.00 0.79 H new ATOM 0 HB THR A 116 -10.925 3.250 1.280 1.00 0.97 H new ATOM 0 HG1 THR A 116 -8.889 2.167 2.064 1.00 1.57 H new ATOM 0 HG21 THR A 116 -10.926 1.691 3.192 1.00 1.15 H new ATOM 0 HG22 THR A 116 -12.338 1.392 2.150 1.00 1.15 H new ATOM 0 HG23 THR A 116 -10.931 0.304 2.076 1.00 1.15 H new ATOM 1734 N ALA A 117 -12.475 2.645 -2.017 1.00 0.63 N ATOM 1735 CA ALA A 117 -13.706 3.169 -2.584 1.00 0.57 C ATOM 1736 C ALA A 117 -13.582 3.213 -4.108 1.00 0.58 C ATOM 1737 O ALA A 117 -12.541 2.859 -4.661 1.00 0.63 O ATOM 1738 CB ALA A 117 -13.999 4.545 -1.983 1.00 0.60 C ATOM 0 H ALA A 117 -11.711 2.536 -2.684 1.00 0.63 H new ATOM 0 HA ALA A 117 -14.548 2.521 -2.340 1.00 0.57 H new ATOM 0 HB1 ALA A 117 -14.922 4.939 -2.408 1.00 0.60 H new ATOM 0 HB2 ALA A 117 -14.107 4.454 -0.902 1.00 0.60 H new ATOM 0 HB3 ALA A 117 -13.177 5.224 -2.210 1.00 0.60 H new ATOM 1744 N LYS A 118 -14.658 3.650 -4.746 1.00 0.65 N ATOM 1745 CA LYS A 118 -14.668 3.784 -6.193 1.00 0.78 C ATOM 1746 C LYS A 118 -13.561 4.750 -6.619 1.00 0.71 C ATOM 1747 O LYS A 118 -13.567 5.918 -6.230 1.00 1.21 O ATOM 1748 CB LYS A 118 -16.060 4.189 -6.684 1.00 1.25 C ATOM 1749 CG LYS A 118 -16.088 4.315 -8.207 1.00 1.66 C ATOM 1750 CD LYS A 118 -17.497 4.647 -8.705 1.00 2.36 C ATOM 1751 CE LYS A 118 -17.480 5.034 -10.184 1.00 3.13 C ATOM 1752 NZ LYS A 118 -17.312 3.833 -11.033 1.00 3.21 N ATOM 0 H LYS A 118 -15.529 3.916 -4.287 1.00 0.65 H new ATOM 0 HA LYS A 118 -14.455 2.825 -6.666 1.00 0.78 H new ATOM 0 HB2 LYS A 118 -16.793 3.448 -6.363 1.00 1.25 H new ATOM 0 HB3 LYS A 118 -16.347 5.138 -6.232 1.00 1.25 H new ATOM 0 HG2 LYS A 118 -15.394 5.093 -8.524 1.00 1.66 H new ATOM 0 HG3 LYS A 118 -15.749 3.383 -8.659 1.00 1.66 H new ATOM 0 HD2 LYS A 118 -18.150 3.787 -8.558 1.00 2.36 H new ATOM 0 HD3 LYS A 118 -17.911 5.466 -8.116 1.00 2.36 H new ATOM 0 HE2 LYS A 118 -18.408 5.543 -10.443 1.00 3.13 H new ATOM 0 HE3 LYS A 118 -16.668 5.736 -10.373 1.00 3.13 H new ATOM 0 HZ1 LYS A 118 -17.000 4.120 -11.983 1.00 3.21 H new ATOM 0 HZ2 LYS A 118 -16.599 3.205 -10.609 1.00 3.21 H new ATOM 0 HZ3 LYS A 118 -18.219 3.329 -11.104 1.00 3.21 H new ATOM 1766 N THR A 119 -12.637 4.228 -7.412 1.00 0.62 N ATOM 1767 CA THR A 119 -11.520 5.027 -7.887 1.00 0.70 C ATOM 1768 C THR A 119 -11.354 4.865 -9.398 1.00 0.66 C ATOM 1769 O THR A 119 -10.341 4.344 -9.864 1.00 0.78 O ATOM 1770 CB THR A 119 -10.277 4.619 -7.092 1.00 1.00 C ATOM 1771 OG1 THR A 119 -10.463 3.228 -6.846 1.00 1.07 O ATOM 1772 CG2 THR A 119 -10.245 5.244 -5.695 1.00 1.03 C ATOM 0 H THR A 119 -12.639 3.261 -7.738 1.00 0.62 H new ATOM 0 HA THR A 119 -11.695 6.090 -7.723 1.00 0.70 H new ATOM 0 HB THR A 119 -9.382 4.912 -7.641 1.00 1.00 H new ATOM 0 HG1 THR A 119 -9.604 2.820 -6.608 1.00 1.07 H new ATOM 0 HG21 THR A 119 -9.344 4.923 -5.173 1.00 1.03 H new ATOM 0 HG22 THR A 119 -10.246 6.330 -5.782 1.00 1.03 H new ATOM 0 HG23 THR A 119 -11.123 4.924 -5.133 1.00 1.03 H new ATOM 1780 N GLU A 120 -12.363 5.324 -10.125 1.00 0.62 N ATOM 1781 CA GLU A 120 -12.425 5.082 -11.556 1.00 0.67 C ATOM 1782 C GLU A 120 -11.519 6.064 -12.300 1.00 0.65 C ATOM 1783 O GLU A 120 -11.100 5.798 -13.426 1.00 0.71 O ATOM 1784 CB GLU A 120 -13.866 5.171 -12.065 1.00 0.87 C ATOM 1785 CG GLU A 120 -13.935 4.887 -13.567 1.00 2.34 C ATOM 1786 CD GLU A 120 -15.351 4.482 -13.983 1.00 2.78 C ATOM 1787 OE1 GLU A 120 -16.288 4.854 -13.244 1.00 2.63 O ATOM 1788 OE2 GLU A 120 -15.463 3.809 -15.031 1.00 4.01 O ATOM 0 H GLU A 120 -13.144 5.862 -9.749 1.00 0.62 H new ATOM 0 HA GLU A 120 -12.068 4.071 -11.750 1.00 0.67 H new ATOM 0 HB2 GLU A 120 -14.490 4.457 -11.527 1.00 0.87 H new ATOM 0 HB3 GLU A 120 -14.267 6.163 -11.860 1.00 0.87 H new ATOM 0 HG2 GLU A 120 -13.628 5.773 -14.123 1.00 2.34 H new ATOM 0 HG3 GLU A 120 -13.235 4.092 -13.823 1.00 2.34 H new ATOM 1795 N TRP A 121 -11.242 7.181 -11.642 1.00 0.68 N ATOM 1796 CA TRP A 121 -10.497 8.256 -12.273 1.00 0.76 C ATOM 1797 C TRP A 121 -9.006 7.982 -12.067 1.00 0.73 C ATOM 1798 O TRP A 121 -8.160 8.665 -12.641 1.00 0.88 O ATOM 1799 CB TRP A 121 -10.934 9.618 -11.730 1.00 0.85 C ATOM 1800 CG TRP A 121 -10.504 9.879 -10.285 1.00 0.80 C ATOM 1801 CD1 TRP A 121 -9.378 10.460 -9.851 1.00 0.80 C ATOM 1802 CD2 TRP A 121 -11.246 9.543 -9.093 1.00 0.81 C ATOM 1803 NE1 TRP A 121 -9.338 10.523 -8.474 1.00 0.81 N ATOM 1804 CE2 TRP A 121 -10.510 9.948 -7.998 1.00 0.80 C ATOM 1805 CE3 TRP A 121 -12.496 8.918 -8.946 1.00 0.88 C ATOM 1806 CZ2 TRP A 121 -10.942 9.772 -6.678 1.00 0.84 C ATOM 1807 CZ3 TRP A 121 -12.914 8.750 -7.620 1.00 0.92 C ATOM 1808 CH2 TRP A 121 -12.185 9.151 -6.506 1.00 0.90 C ATOM 0 H TRP A 121 -11.521 7.364 -10.678 1.00 0.68 H new ATOM 0 HA TRP A 121 -10.701 8.290 -13.343 1.00 0.76 H new ATOM 0 HB2 TRP A 121 -10.523 10.401 -12.368 1.00 0.85 H new ATOM 0 HB3 TRP A 121 -12.020 9.692 -11.794 1.00 0.85 H new ATOM 0 HD1 TRP A 121 -8.598 10.833 -10.499 1.00 0.80 H new ATOM 0 HE1 TRP A 121 -8.587 10.919 -7.909 1.00 0.81 H new ATOM 0 HE3 TRP A 121 -13.088 8.593 -9.789 1.00 0.88 H new ATOM 0 HZ2 TRP A 121 -10.348 10.098 -5.837 1.00 0.84 H new ATOM 0 HZ3 TRP A 121 -13.869 8.276 -7.451 1.00 0.92 H new ATOM 0 HH2 TRP A 121 -12.576 8.984 -5.513 1.00 0.90 H new ATOM 1819 N LEU A 122 -8.729 6.979 -11.245 1.00 0.60 N ATOM 1820 CA LEU A 122 -7.356 6.594 -10.972 1.00 0.64 C ATOM 1821 C LEU A 122 -7.035 5.298 -11.720 1.00 0.67 C ATOM 1822 O LEU A 122 -5.886 4.861 -11.747 1.00 0.91 O ATOM 1823 CB LEU A 122 -7.114 6.508 -9.463 1.00 0.66 C ATOM 1824 CG LEU A 122 -7.364 7.793 -8.670 1.00 0.73 C ATOM 1825 CD1 LEU A 122 -7.315 7.526 -7.165 1.00 0.82 C ATOM 1826 CD2 LEU A 122 -6.388 8.895 -9.089 1.00 0.79 C ATOM 0 H LEU A 122 -9.433 6.422 -10.760 1.00 0.60 H new ATOM 0 HA LEU A 122 -6.667 7.354 -11.340 1.00 0.64 H new ATOM 0 HB2 LEU A 122 -7.752 5.724 -9.057 1.00 0.66 H new ATOM 0 HB3 LEU A 122 -6.082 6.197 -9.297 1.00 0.66 H new ATOM 0 HG LEU A 122 -8.368 8.148 -8.902 1.00 0.73 H new ATOM 0 HD11 LEU A 122 -7.496 8.455 -6.625 1.00 0.82 H new ATOM 0 HD12 LEU A 122 -8.081 6.797 -6.900 1.00 0.82 H new ATOM 0 HD13 LEU A 122 -6.334 7.135 -6.897 1.00 0.82 H new ATOM 0 HD21 LEU A 122 -6.587 9.797 -8.510 1.00 0.79 H new ATOM 0 HD22 LEU A 122 -5.366 8.565 -8.905 1.00 0.79 H new ATOM 0 HD23 LEU A 122 -6.515 9.109 -10.150 1.00 0.79 H new ATOM 1838 N ASP A 123 -8.072 4.720 -12.309 1.00 0.57 N ATOM 1839 CA ASP A 123 -7.924 3.459 -13.015 1.00 0.69 C ATOM 1840 C ASP A 123 -7.122 3.690 -14.297 1.00 0.91 C ATOM 1841 O ASP A 123 -7.469 4.549 -15.105 1.00 2.39 O ATOM 1842 CB ASP A 123 -9.287 2.885 -13.407 1.00 0.71 C ATOM 1843 CG ASP A 123 -9.262 1.433 -13.891 1.00 0.96 C ATOM 1844 OD1 ASP A 123 -8.230 1.051 -14.483 1.00 2.03 O ATOM 1845 OD2 ASP A 123 -10.274 0.740 -13.658 1.00 1.65 O ATOM 0 H ASP A 123 -9.018 5.102 -12.312 1.00 0.57 H new ATOM 0 HA ASP A 123 -7.414 2.759 -12.353 1.00 0.69 H new ATOM 0 HB2 ASP A 123 -9.954 2.955 -12.548 1.00 0.71 H new ATOM 0 HB3 ASP A 123 -9.714 3.507 -14.194 1.00 0.71 H new ATOM 1850 N GLY A 124 -6.064 2.906 -14.445 1.00 1.58 N ATOM 1851 CA GLY A 124 -5.246 2.968 -15.644 1.00 1.62 C ATOM 1852 C GLY A 124 -4.027 3.868 -15.430 1.00 1.60 C ATOM 1853 O GLY A 124 -3.099 3.865 -16.237 1.00 2.37 O ATOM 0 H GLY A 124 -5.754 2.224 -13.753 1.00 1.58 H new ATOM 0 HA2 GLY A 124 -4.918 1.965 -15.917 1.00 1.62 H new ATOM 0 HA3 GLY A 124 -5.841 3.347 -16.475 1.00 1.62 H new ATOM 1857 N LYS A 125 -4.067 4.616 -14.337 1.00 1.06 N ATOM 1858 CA LYS A 125 -2.997 5.548 -14.028 1.00 1.07 C ATOM 1859 C LYS A 125 -2.093 4.940 -12.953 1.00 1.05 C ATOM 1860 O LYS A 125 -1.086 5.537 -12.573 1.00 1.61 O ATOM 1861 CB LYS A 125 -3.569 6.915 -13.649 1.00 1.11 C ATOM 1862 CG LYS A 125 -2.968 8.022 -14.519 1.00 1.84 C ATOM 1863 CD LYS A 125 -1.510 8.285 -14.141 1.00 3.09 C ATOM 1864 CE LYS A 125 -1.413 8.965 -12.773 1.00 4.04 C ATOM 1865 NZ LYS A 125 -0.680 8.104 -11.817 1.00 5.41 N ATOM 0 H LYS A 125 -4.825 4.595 -13.654 1.00 1.06 H new ATOM 0 HA LYS A 125 -2.377 5.721 -14.907 1.00 1.07 H new ATOM 0 HB2 LYS A 125 -4.653 6.904 -13.765 1.00 1.11 H new ATOM 0 HB3 LYS A 125 -3.363 7.121 -12.599 1.00 1.11 H new ATOM 0 HG2 LYS A 125 -3.029 7.738 -15.569 1.00 1.84 H new ATOM 0 HG3 LYS A 125 -3.549 8.937 -14.402 1.00 1.84 H new ATOM 0 HD2 LYS A 125 -0.960 7.344 -14.124 1.00 3.09 H new ATOM 0 HD3 LYS A 125 -1.042 8.914 -14.898 1.00 3.09 H new ATOM 0 HE2 LYS A 125 -0.904 9.924 -12.872 1.00 4.04 H new ATOM 0 HE3 LYS A 125 -2.413 9.173 -12.392 1.00 4.04 H new ATOM 0 HZ1 LYS A 125 -1.042 8.267 -10.856 1.00 5.41 H new ATOM 0 HZ2 LYS A 125 -0.817 7.106 -12.074 1.00 5.41 H new ATOM 0 HZ3 LYS A 125 0.334 8.334 -11.849 1.00 5.41 H new ATOM 1879 N HIS A 126 -2.485 3.762 -12.492 1.00 1.06 N ATOM 1880 CA HIS A 126 -1.767 3.104 -11.413 1.00 1.07 C ATOM 1881 C HIS A 126 -1.821 1.588 -11.611 1.00 1.07 C ATOM 1882 O HIS A 126 -2.728 1.075 -12.267 1.00 1.71 O ATOM 1883 CB HIS A 126 -2.309 3.544 -10.052 1.00 1.09 C ATOM 1884 CG HIS A 126 -1.891 4.937 -9.646 1.00 1.24 C ATOM 1885 ND1 HIS A 126 -2.771 5.854 -9.098 1.00 1.07 N ATOM 1886 CD2 HIS A 126 -0.678 5.558 -9.712 1.00 3.02 C ATOM 1887 CE1 HIS A 126 -2.107 6.974 -8.850 1.00 0.74 C ATOM 1888 NE2 HIS A 126 -0.810 6.789 -9.233 1.00 2.40 N ATOM 0 H HIS A 126 -3.290 3.246 -12.846 1.00 1.06 H new ATOM 0 HA HIS A 126 -0.719 3.401 -11.434 1.00 1.07 H new ATOM 0 HB2 HIS A 126 -3.398 3.494 -10.072 1.00 1.09 H new ATOM 0 HB3 HIS A 126 -1.972 2.839 -9.293 1.00 1.09 H new ATOM 0 HD1 HIS A 126 -3.762 5.695 -8.916 1.00 1.07 H new ATOM 0 HD2 HIS A 126 0.235 5.122 -10.090 1.00 3.02 H new ATOM 0 HE1 HIS A 126 -2.520 7.875 -8.420 1.00 0.74 H new ATOM 1896 N VAL A 127 -0.839 0.912 -11.032 1.00 1.07 N ATOM 1897 CA VAL A 127 -0.703 -0.521 -11.224 1.00 1.01 C ATOM 1898 C VAL A 127 -1.439 -1.255 -10.102 1.00 0.96 C ATOM 1899 O VAL A 127 -1.171 -1.024 -8.924 1.00 1.30 O ATOM 1900 CB VAL A 127 0.777 -0.899 -11.314 1.00 1.08 C ATOM 1901 CG1 VAL A 127 0.952 -2.416 -11.408 1.00 1.07 C ATOM 1902 CG2 VAL A 127 1.451 -0.195 -12.495 1.00 1.18 C ATOM 0 H VAL A 127 -0.130 1.331 -10.430 1.00 1.07 H new ATOM 0 HA VAL A 127 -1.161 -0.824 -12.166 1.00 1.01 H new ATOM 0 HB VAL A 127 1.265 -0.562 -10.399 1.00 1.08 H new ATOM 0 HG11 VAL A 127 2.013 -2.657 -11.471 1.00 1.07 H new ATOM 0 HG12 VAL A 127 0.525 -2.887 -10.523 1.00 1.07 H new ATOM 0 HG13 VAL A 127 0.443 -2.787 -12.298 1.00 1.07 H new ATOM 0 HG21 VAL A 127 2.502 -0.480 -12.537 1.00 1.18 H new ATOM 0 HG22 VAL A 127 0.958 -0.487 -13.422 1.00 1.18 H new ATOM 0 HG23 VAL A 127 1.373 0.885 -12.368 1.00 1.18 H new ATOM 1912 N VAL A 128 -2.354 -2.125 -10.506 1.00 0.61 N ATOM 1913 CA VAL A 128 -3.037 -2.988 -9.558 1.00 0.55 C ATOM 1914 C VAL A 128 -2.486 -4.410 -9.680 1.00 0.54 C ATOM 1915 O VAL A 128 -2.404 -4.956 -10.779 1.00 0.65 O ATOM 1916 CB VAL A 128 -4.549 -2.912 -9.777 1.00 0.57 C ATOM 1917 CG1 VAL A 128 -5.274 -3.998 -8.978 1.00 0.83 C ATOM 1918 CG2 VAL A 128 -5.086 -1.522 -9.428 1.00 0.67 C ATOM 0 H VAL A 128 -2.638 -2.250 -11.478 1.00 0.61 H new ATOM 0 HA VAL A 128 -2.853 -2.655 -8.537 1.00 0.55 H new ATOM 0 HB VAL A 128 -4.743 -3.089 -10.835 1.00 0.57 H new ATOM 0 HG11 VAL A 128 -6.347 -3.922 -9.151 1.00 0.83 H new ATOM 0 HG12 VAL A 128 -4.924 -4.980 -9.297 1.00 0.83 H new ATOM 0 HG13 VAL A 128 -5.068 -3.867 -7.916 1.00 0.83 H new ATOM 0 HG21 VAL A 128 -6.163 -1.496 -9.593 1.00 0.67 H new ATOM 0 HG22 VAL A 128 -4.874 -1.302 -8.382 1.00 0.67 H new ATOM 0 HG23 VAL A 128 -4.604 -0.776 -10.060 1.00 0.67 H new ATOM 1928 N PHE A 129 -2.122 -4.969 -8.535 1.00 0.59 N ATOM 1929 CA PHE A 129 -1.553 -6.306 -8.503 1.00 0.66 C ATOM 1930 C PHE A 129 -1.750 -6.952 -7.131 1.00 0.65 C ATOM 1931 O PHE A 129 -0.978 -7.825 -6.734 1.00 0.85 O ATOM 1932 CB PHE A 129 -0.054 -6.161 -8.774 1.00 0.90 C ATOM 1933 CG PHE A 129 0.730 -5.535 -7.619 1.00 1.42 C ATOM 1934 CD1 PHE A 129 0.571 -4.215 -7.326 1.00 2.23 C ATOM 1935 CD2 PHE A 129 1.585 -6.296 -6.885 1.00 2.80 C ATOM 1936 CE1 PHE A 129 1.299 -3.634 -6.255 1.00 2.97 C ATOM 1937 CE2 PHE A 129 2.312 -5.715 -5.813 1.00 3.54 C ATOM 1938 CZ PHE A 129 2.154 -4.396 -5.520 1.00 3.22 C ATOM 0 H PHE A 129 -2.210 -4.521 -7.623 1.00 0.59 H new ATOM 0 HA PHE A 129 -2.042 -6.936 -9.246 1.00 0.66 H new ATOM 0 HB2 PHE A 129 0.362 -7.145 -8.991 1.00 0.90 H new ATOM 0 HB3 PHE A 129 0.086 -5.552 -9.667 1.00 0.90 H new ATOM 0 HD1 PHE A 129 -0.109 -3.610 -7.908 1.00 2.23 H new ATOM 0 HD2 PHE A 129 1.711 -7.343 -7.118 1.00 2.80 H new ATOM 0 HE1 PHE A 129 1.174 -2.587 -6.023 1.00 2.97 H new ATOM 0 HE2 PHE A 129 2.991 -6.320 -5.230 1.00 3.54 H new ATOM 0 HZ PHE A 129 2.707 -3.954 -4.704 1.00 3.22 H new ATOM 1948 N GLY A 130 -2.788 -6.500 -6.443 1.00 0.61 N ATOM 1949 CA GLY A 130 -3.060 -6.978 -5.097 1.00 0.83 C ATOM 1950 C GLY A 130 -4.523 -6.743 -4.717 1.00 0.68 C ATOM 1951 O GLY A 130 -5.068 -5.670 -4.966 1.00 0.91 O ATOM 0 H GLY A 130 -3.451 -5.808 -6.792 1.00 0.61 H new ATOM 0 HA2 GLY A 130 -2.830 -8.041 -5.031 1.00 0.83 H new ATOM 0 HA3 GLY A 130 -2.410 -6.467 -4.387 1.00 0.83 H new ATOM 1955 N LYS A 131 -5.117 -7.766 -4.119 1.00 0.57 N ATOM 1956 CA LYS A 131 -6.477 -7.654 -3.621 1.00 0.63 C ATOM 1957 C LYS A 131 -6.477 -7.844 -2.104 1.00 0.56 C ATOM 1958 O LYS A 131 -5.615 -8.534 -1.561 1.00 0.77 O ATOM 1959 CB LYS A 131 -7.400 -8.624 -4.362 1.00 0.95 C ATOM 1960 CG LYS A 131 -8.093 -7.930 -5.538 1.00 1.87 C ATOM 1961 CD LYS A 131 -7.102 -7.643 -6.667 1.00 3.87 C ATOM 1962 CE LYS A 131 -7.814 -7.590 -8.021 1.00 5.20 C ATOM 1963 NZ LYS A 131 -7.959 -8.952 -8.583 1.00 5.81 N ATOM 0 H LYS A 131 -4.681 -8.676 -3.968 1.00 0.57 H new ATOM 0 HA LYS A 131 -6.874 -6.658 -3.818 1.00 0.63 H new ATOM 0 HB2 LYS A 131 -6.823 -9.475 -4.725 1.00 0.95 H new ATOM 0 HB3 LYS A 131 -8.149 -9.017 -3.674 1.00 0.95 H new ATOM 0 HG2 LYS A 131 -8.902 -8.559 -5.910 1.00 1.87 H new ATOM 0 HG3 LYS A 131 -8.544 -6.997 -5.200 1.00 1.87 H new ATOM 0 HD2 LYS A 131 -6.597 -6.695 -6.480 1.00 3.87 H new ATOM 0 HD3 LYS A 131 -6.333 -8.416 -6.686 1.00 3.87 H new ATOM 0 HE2 LYS A 131 -8.796 -7.132 -7.905 1.00 5.20 H new ATOM 0 HE3 LYS A 131 -7.249 -6.963 -8.711 1.00 5.20 H new ATOM 0 HZ1 LYS A 131 -7.749 -8.931 -9.601 1.00 5.81 H new ATOM 0 HZ2 LYS A 131 -7.297 -9.597 -8.106 1.00 5.81 H new ATOM 0 HZ3 LYS A 131 -8.933 -9.286 -8.437 1.00 5.81 H new ATOM 1977 N VAL A 132 -7.454 -7.221 -1.461 1.00 0.47 N ATOM 1978 CA VAL A 132 -7.619 -7.370 -0.025 1.00 0.44 C ATOM 1979 C VAL A 132 -8.681 -8.435 0.255 1.00 0.56 C ATOM 1980 O VAL A 132 -9.875 -8.142 0.255 1.00 1.07 O ATOM 1981 CB VAL A 132 -7.951 -6.016 0.606 1.00 0.62 C ATOM 1982 CG1 VAL A 132 -7.880 -6.091 2.133 1.00 0.90 C ATOM 1983 CG2 VAL A 132 -7.030 -4.919 0.067 1.00 0.89 C ATOM 0 H VAL A 132 -8.139 -6.612 -1.908 1.00 0.47 H new ATOM 0 HA VAL A 132 -6.690 -7.709 0.433 1.00 0.44 H new ATOM 0 HB VAL A 132 -8.974 -5.759 0.330 1.00 0.62 H new ATOM 0 HG11 VAL A 132 -8.120 -5.116 2.557 1.00 0.90 H new ATOM 0 HG12 VAL A 132 -8.595 -6.830 2.495 1.00 0.90 H new ATOM 0 HG13 VAL A 132 -6.874 -6.381 2.437 1.00 0.90 H new ATOM 0 HG21 VAL A 132 -7.287 -3.967 0.532 1.00 0.89 H new ATOM 0 HG22 VAL A 132 -5.994 -5.167 0.298 1.00 0.89 H new ATOM 0 HG23 VAL A 132 -7.152 -4.840 -1.013 1.00 0.89 H new ATOM 1993 N LYS A 133 -8.206 -9.651 0.486 1.00 0.77 N ATOM 1994 CA LYS A 133 -9.102 -10.774 0.707 1.00 0.91 C ATOM 1995 C LYS A 133 -9.788 -10.614 2.065 1.00 0.86 C ATOM 1996 O LYS A 133 -11.013 -10.664 2.155 1.00 1.86 O ATOM 1997 CB LYS A 133 -8.350 -12.097 0.550 1.00 1.20 C ATOM 1998 CG LYS A 133 -9.325 -13.272 0.449 1.00 1.81 C ATOM 1999 CD LYS A 133 -9.657 -13.586 -1.011 1.00 3.29 C ATOM 2000 CE LYS A 133 -8.535 -14.392 -1.668 1.00 3.60 C ATOM 2001 NZ LYS A 133 -8.610 -14.281 -3.142 1.00 5.39 N ATOM 0 H LYS A 133 -7.213 -9.883 0.525 1.00 0.77 H new ATOM 0 HA LYS A 133 -9.888 -10.789 -0.048 1.00 0.91 H new ATOM 0 HB2 LYS A 133 -7.725 -12.061 -0.342 1.00 1.20 H new ATOM 0 HB3 LYS A 133 -7.684 -12.244 1.400 1.00 1.20 H new ATOM 0 HG2 LYS A 133 -8.890 -14.152 0.924 1.00 1.81 H new ATOM 0 HG3 LYS A 133 -10.241 -13.037 0.991 1.00 1.81 H new ATOM 0 HD2 LYS A 133 -10.590 -14.146 -1.063 1.00 3.29 H new ATOM 0 HD3 LYS A 133 -9.812 -12.657 -1.560 1.00 3.29 H new ATOM 0 HE2 LYS A 133 -7.568 -14.031 -1.319 1.00 3.60 H new ATOM 0 HE3 LYS A 133 -8.610 -15.438 -1.372 1.00 3.60 H new ATOM 0 HZ1 LYS A 133 -7.711 -14.595 -3.560 1.00 5.39 H new ATOM 0 HZ2 LYS A 133 -9.384 -14.879 -3.496 1.00 5.39 H new ATOM 0 HZ3 LYS A 133 -8.788 -13.291 -3.407 1.00 5.39 H new ATOM 2015 N GLU A 134 -8.967 -10.425 3.088 1.00 0.90 N ATOM 2016 CA GLU A 134 -9.471 -10.354 4.449 1.00 0.95 C ATOM 2017 C GLU A 134 -8.681 -9.321 5.255 1.00 1.09 C ATOM 2018 O GLU A 134 -7.459 -9.244 5.144 1.00 1.85 O ATOM 2019 CB GLU A 134 -9.423 -11.728 5.122 1.00 1.19 C ATOM 2020 CG GLU A 134 -9.557 -11.598 6.640 1.00 2.68 C ATOM 2021 CD GLU A 134 -9.857 -12.954 7.282 1.00 2.67 C ATOM 2022 OE1 GLU A 134 -8.879 -13.681 7.559 1.00 3.54 O ATOM 2023 OE2 GLU A 134 -11.059 -13.235 7.481 1.00 2.49 O ATOM 0 H GLU A 134 -7.956 -10.319 3.001 1.00 0.90 H new ATOM 0 HA GLU A 134 -10.514 -10.038 4.414 1.00 0.95 H new ATOM 0 HB2 GLU A 134 -10.226 -12.355 4.735 1.00 1.19 H new ATOM 0 HB3 GLU A 134 -8.484 -12.225 4.877 1.00 1.19 H new ATOM 0 HG2 GLU A 134 -8.636 -11.190 7.056 1.00 2.68 H new ATOM 0 HG3 GLU A 134 -10.354 -10.894 6.879 1.00 2.68 H new ATOM 2030 N GLY A 135 -9.413 -8.552 6.048 1.00 0.74 N ATOM 2031 CA GLY A 135 -8.795 -7.536 6.883 1.00 0.77 C ATOM 2032 C GLY A 135 -9.276 -6.138 6.491 1.00 0.69 C ATOM 2033 O GLY A 135 -8.802 -5.140 7.032 1.00 0.72 O ATOM 0 H GLY A 135 -10.428 -8.612 6.130 1.00 0.74 H new ATOM 0 HA2 GLY A 135 -9.033 -7.726 7.930 1.00 0.77 H new ATOM 0 HA3 GLY A 135 -7.711 -7.592 6.787 1.00 0.77 H new ATOM 2037 N MET A 136 -10.211 -6.110 5.553 1.00 0.72 N ATOM 2038 CA MET A 136 -10.803 -4.854 5.124 1.00 0.76 C ATOM 2039 C MET A 136 -11.344 -4.066 6.319 1.00 0.72 C ATOM 2040 O MET A 136 -11.290 -2.837 6.332 1.00 0.75 O ATOM 2041 CB MET A 136 -11.942 -5.135 4.140 1.00 0.89 C ATOM 2042 CG MET A 136 -11.409 -5.293 2.716 1.00 1.38 C ATOM 2043 SD MET A 136 -12.345 -4.264 1.596 1.00 1.58 S ATOM 2044 CE MET A 136 -11.595 -2.679 1.930 1.00 1.25 C ATOM 0 H MET A 136 -10.573 -6.937 5.078 1.00 0.72 H new ATOM 0 HA MET A 136 -10.030 -4.258 4.639 1.00 0.76 H new ATOM 0 HB2 MET A 136 -12.469 -6.042 4.438 1.00 0.89 H new ATOM 0 HB3 MET A 136 -12.665 -4.320 4.173 1.00 0.89 H new ATOM 0 HG2 MET A 136 -10.355 -5.018 2.681 1.00 1.38 H new ATOM 0 HG3 MET A 136 -11.477 -6.336 2.407 1.00 1.38 H new ATOM 0 HE1 MET A 136 -12.065 -1.916 1.310 1.00 1.25 H new ATOM 0 HE2 MET A 136 -11.731 -2.426 2.982 1.00 1.25 H new ATOM 0 HE3 MET A 136 -10.530 -2.725 1.703 1.00 1.25 H new ATOM 2054 N ASN A 137 -11.851 -4.806 7.294 1.00 0.68 N ATOM 2055 CA ASN A 137 -12.478 -4.190 8.451 1.00 0.68 C ATOM 2056 C ASN A 137 -11.405 -3.515 9.309 1.00 0.62 C ATOM 2057 O ASN A 137 -11.692 -2.561 10.030 1.00 0.64 O ATOM 2058 CB ASN A 137 -13.184 -5.236 9.316 1.00 0.71 C ATOM 2059 CG ASN A 137 -12.203 -6.308 9.793 1.00 2.04 C ATOM 2060 OD1 ASN A 137 -11.556 -6.181 10.820 1.00 3.15 O ATOM 2061 ND2 ASN A 137 -12.127 -7.367 8.993 1.00 3.34 N ATOM 0 H ASN A 137 -11.840 -5.826 7.307 1.00 0.68 H new ATOM 0 HA ASN A 137 -13.208 -3.465 8.092 1.00 0.68 H new ATOM 0 HB2 ASN A 137 -13.644 -4.750 10.177 1.00 0.71 H new ATOM 0 HB3 ASN A 137 -13.988 -5.702 8.746 1.00 0.71 H new ATOM 0 HD21 ASN A 137 -11.499 -8.137 9.224 1.00 3.34 H new ATOM 0 HD22 ASN A 137 -12.697 -7.410 8.148 1.00 3.34 H new ATOM 2068 N ILE A 138 -10.192 -4.036 9.201 1.00 0.62 N ATOM 2069 CA ILE A 138 -9.062 -3.455 9.906 1.00 0.63 C ATOM 2070 C ILE A 138 -8.657 -2.150 9.220 1.00 0.62 C ATOM 2071 O ILE A 138 -8.305 -1.177 9.886 1.00 0.64 O ATOM 2072 CB ILE A 138 -7.923 -4.470 10.021 1.00 0.68 C ATOM 2073 CG1 ILE A 138 -8.391 -5.741 10.732 1.00 0.90 C ATOM 2074 CG2 ILE A 138 -6.702 -3.849 10.702 1.00 0.65 C ATOM 2075 CD1 ILE A 138 -8.840 -5.436 12.161 1.00 1.12 C ATOM 0 H ILE A 138 -9.967 -4.855 8.636 1.00 0.62 H new ATOM 0 HA ILE A 138 -9.338 -3.205 10.930 1.00 0.63 H new ATOM 0 HB ILE A 138 -7.619 -4.758 9.015 1.00 0.68 H new ATOM 0 HG12 ILE A 138 -9.214 -6.190 10.177 1.00 0.90 H new ATOM 0 HG13 ILE A 138 -7.582 -6.471 10.749 1.00 0.90 H new ATOM 0 HG21 ILE A 138 -5.907 -4.592 10.771 1.00 0.65 H new ATOM 0 HG22 ILE A 138 -6.353 -2.997 10.118 1.00 0.65 H new ATOM 0 HG23 ILE A 138 -6.974 -3.515 11.703 1.00 0.65 H new ATOM 0 HD11 ILE A 138 -9.168 -6.357 12.644 1.00 1.12 H new ATOM 0 HD12 ILE A 138 -8.008 -5.009 12.721 1.00 1.12 H new ATOM 0 HD13 ILE A 138 -9.665 -4.724 12.139 1.00 1.12 H new ATOM 2087 N VAL A 139 -8.718 -2.169 7.896 1.00 0.62 N ATOM 2088 CA VAL A 139 -8.411 -0.984 7.115 1.00 0.65 C ATOM 2089 C VAL A 139 -9.477 0.083 7.372 1.00 0.66 C ATOM 2090 O VAL A 139 -9.169 1.272 7.436 1.00 0.71 O ATOM 2091 CB VAL A 139 -8.276 -1.352 5.636 1.00 0.71 C ATOM 2092 CG1 VAL A 139 -8.130 -0.099 4.770 1.00 0.82 C ATOM 2093 CG2 VAL A 139 -7.105 -2.312 5.414 1.00 0.73 C ATOM 0 H VAL A 139 -8.976 -2.988 7.345 1.00 0.62 H new ATOM 0 HA VAL A 139 -7.452 -0.564 7.420 1.00 0.65 H new ATOM 0 HB VAL A 139 -9.190 -1.863 5.334 1.00 0.71 H new ATOM 0 HG11 VAL A 139 -8.036 -0.389 3.724 1.00 0.82 H new ATOM 0 HG12 VAL A 139 -9.009 0.533 4.894 1.00 0.82 H new ATOM 0 HG13 VAL A 139 -7.241 0.453 5.075 1.00 0.82 H new ATOM 0 HG21 VAL A 139 -7.032 -2.557 4.355 1.00 0.73 H new ATOM 0 HG22 VAL A 139 -6.179 -1.839 5.742 1.00 0.73 H new ATOM 0 HG23 VAL A 139 -7.269 -3.224 5.987 1.00 0.73 H new ATOM 2103 N GLU A 140 -10.711 -0.381 7.509 1.00 0.66 N ATOM 2104 CA GLU A 140 -11.827 0.520 7.744 1.00 0.71 C ATOM 2105 C GLU A 140 -11.703 1.170 9.123 1.00 0.72 C ATOM 2106 O GLU A 140 -12.101 2.318 9.308 1.00 0.78 O ATOM 2107 CB GLU A 140 -13.162 -0.214 7.601 1.00 0.76 C ATOM 2108 CG GLU A 140 -14.262 0.736 7.123 1.00 0.86 C ATOM 2109 CD GLU A 140 -15.622 0.331 7.693 1.00 2.05 C ATOM 2110 OE1 GLU A 140 -15.877 0.691 8.863 1.00 3.10 O ATOM 2111 OE2 GLU A 140 -16.377 -0.327 6.947 1.00 3.16 O ATOM 0 H GLU A 140 -10.962 -1.368 7.462 1.00 0.66 H new ATOM 0 HA GLU A 140 -11.800 1.307 6.990 1.00 0.71 H new ATOM 0 HB2 GLU A 140 -13.055 -1.037 6.894 1.00 0.76 H new ATOM 0 HB3 GLU A 140 -13.445 -0.651 8.559 1.00 0.76 H new ATOM 0 HG2 GLU A 140 -14.025 1.755 7.428 1.00 0.86 H new ATOM 0 HG3 GLU A 140 -14.304 0.731 6.034 1.00 0.86 H new ATOM 2118 N ALA A 141 -11.149 0.408 10.054 1.00 0.74 N ATOM 2119 CA ALA A 141 -11.010 0.879 11.421 1.00 0.77 C ATOM 2120 C ALA A 141 -10.017 2.042 11.456 1.00 0.74 C ATOM 2121 O ALA A 141 -10.364 3.146 11.870 1.00 0.83 O ATOM 2122 CB ALA A 141 -10.580 -0.282 12.320 1.00 0.85 C ATOM 0 H ALA A 141 -10.791 -0.533 9.888 1.00 0.74 H new ATOM 0 HA ALA A 141 -11.964 1.248 11.799 1.00 0.77 H new ATOM 0 HB1 ALA A 141 -10.476 0.071 13.346 1.00 0.85 H new ATOM 0 HB2 ALA A 141 -11.333 -1.069 12.282 1.00 0.85 H new ATOM 0 HB3 ALA A 141 -9.625 -0.676 11.973 1.00 0.85 H new ATOM 2128 N MET A 142 -8.801 1.753 11.017 1.00 0.83 N ATOM 2129 CA MET A 142 -7.737 2.744 11.050 1.00 0.88 C ATOM 2130 C MET A 142 -8.062 3.927 10.136 1.00 0.79 C ATOM 2131 O MET A 142 -7.522 5.018 10.311 1.00 0.84 O ATOM 2132 CB MET A 142 -6.424 2.099 10.604 1.00 1.18 C ATOM 2133 CG MET A 142 -6.457 1.764 9.112 1.00 1.30 C ATOM 2134 SD MET A 142 -5.072 0.721 8.689 1.00 1.40 S ATOM 2135 CE MET A 142 -3.725 1.844 9.021 1.00 1.94 C ATOM 0 H MET A 142 -8.528 0.847 10.636 1.00 0.83 H new ATOM 0 HA MET A 142 -7.641 3.113 12.071 1.00 0.88 H new ATOM 0 HB2 MET A 142 -5.594 2.775 10.810 1.00 1.18 H new ATOM 0 HB3 MET A 142 -6.246 1.191 11.180 1.00 1.18 H new ATOM 0 HG2 MET A 142 -7.391 1.260 8.865 1.00 1.30 H new ATOM 0 HG3 MET A 142 -6.425 2.681 8.524 1.00 1.30 H new ATOM 0 HE1 MET A 142 -2.819 1.479 8.536 1.00 1.94 H new ATOM 0 HE2 MET A 142 -3.971 2.832 8.633 1.00 1.94 H new ATOM 0 HE3 MET A 142 -3.561 1.907 10.097 1.00 1.94 H new ATOM 2145 N GLU A 143 -8.945 3.671 9.181 1.00 0.80 N ATOM 2146 CA GLU A 143 -9.389 4.715 8.274 1.00 0.82 C ATOM 2147 C GLU A 143 -10.023 5.865 9.058 1.00 0.89 C ATOM 2148 O GLU A 143 -9.784 7.034 8.757 1.00 1.08 O ATOM 2149 CB GLU A 143 -10.363 4.160 7.233 1.00 0.92 C ATOM 2150 CG GLU A 143 -9.739 4.173 5.836 1.00 1.65 C ATOM 2151 CD GLU A 143 -10.783 3.847 4.766 1.00 1.65 C ATOM 2152 OE1 GLU A 143 -11.582 2.920 5.016 1.00 2.52 O ATOM 2153 OE2 GLU A 143 -10.757 4.534 3.721 1.00 2.27 O ATOM 0 H GLU A 143 -9.364 2.756 9.016 1.00 0.80 H new ATOM 0 HA GLU A 143 -8.519 5.100 7.741 1.00 0.82 H new ATOM 0 HB2 GLU A 143 -10.645 3.141 7.500 1.00 0.92 H new ATOM 0 HB3 GLU A 143 -11.277 4.754 7.232 1.00 0.92 H new ATOM 0 HG2 GLU A 143 -9.303 5.152 5.638 1.00 1.65 H new ATOM 0 HG3 GLU A 143 -8.927 3.447 5.790 1.00 1.65 H new ATOM 2160 N ARG A 144 -10.821 5.494 10.049 1.00 0.91 N ATOM 2161 CA ARG A 144 -11.586 6.474 10.801 1.00 1.13 C ATOM 2162 C ARG A 144 -10.870 6.817 12.110 1.00 1.02 C ATOM 2163 O ARG A 144 -11.506 7.225 13.081 1.00 1.42 O ATOM 2164 CB ARG A 144 -12.990 5.953 11.117 1.00 1.51 C ATOM 2165 CG ARG A 144 -12.923 4.641 11.901 1.00 1.82 C ATOM 2166 CD ARG A 144 -14.281 4.304 12.521 1.00 2.29 C ATOM 2167 NE ARG A 144 -14.514 2.844 12.466 1.00 3.30 N ATOM 2168 CZ ARG A 144 -14.871 2.181 11.357 1.00 4.28 C ATOM 2169 NH1 ARG A 144 -15.005 2.839 10.198 1.00 4.62 N ATOM 2170 NH2 ARG A 144 -15.094 0.861 11.407 1.00 5.69 N ATOM 0 H ARG A 144 -10.954 4.528 10.348 1.00 0.91 H new ATOM 0 HA ARG A 144 -11.673 7.369 10.185 1.00 1.13 H new ATOM 0 HB2 ARG A 144 -13.537 6.698 11.694 1.00 1.51 H new ATOM 0 HB3 ARG A 144 -13.542 5.799 10.190 1.00 1.51 H new ATOM 0 HG2 ARG A 144 -12.611 3.833 11.239 1.00 1.82 H new ATOM 0 HG3 ARG A 144 -12.170 4.720 12.685 1.00 1.82 H new ATOM 0 HD2 ARG A 144 -14.313 4.647 13.555 1.00 2.29 H new ATOM 0 HD3 ARG A 144 -15.074 4.828 11.987 1.00 2.29 H new ATOM 0 HE ARG A 144 -14.396 2.308 13.326 1.00 3.30 H new ATOM 0 HH11 ARG A 144 -14.835 3.844 10.160 1.00 4.62 H new ATOM 0 HH12 ARG A 144 -15.277 2.335 9.354 1.00 4.62 H new ATOM 0 HH21 ARG A 144 -14.992 0.360 12.289 1.00 5.69 H new ATOM 0 HH22 ARG A 144 -15.366 0.357 10.563 1.00 5.69 H new ATOM 2184 N PHE A 145 -9.558 6.637 12.093 1.00 1.01 N ATOM 2185 CA PHE A 145 -8.731 7.064 13.210 1.00 1.07 C ATOM 2186 C PHE A 145 -7.979 8.353 12.875 1.00 1.16 C ATOM 2187 O PHE A 145 -7.458 9.022 13.766 1.00 1.41 O ATOM 2188 CB PHE A 145 -7.716 5.947 13.466 1.00 1.19 C ATOM 2189 CG PHE A 145 -7.628 5.509 14.928 1.00 1.76 C ATOM 2190 CD1 PHE A 145 -7.085 6.343 15.856 1.00 3.05 C ATOM 2191 CD2 PHE A 145 -8.092 4.287 15.302 1.00 2.24 C ATOM 2192 CE1 PHE A 145 -7.004 5.936 17.214 1.00 3.82 C ATOM 2193 CE2 PHE A 145 -8.011 3.881 16.660 1.00 2.77 C ATOM 2194 CZ PHE A 145 -7.468 4.714 17.588 1.00 3.31 C ATOM 0 H PHE A 145 -9.047 6.202 11.325 1.00 1.01 H new ATOM 0 HA PHE A 145 -9.355 7.256 14.083 1.00 1.07 H new ATOM 0 HB2 PHE A 145 -7.979 5.084 12.854 1.00 1.19 H new ATOM 0 HB3 PHE A 145 -6.732 6.282 13.138 1.00 1.19 H new ATOM 0 HD1 PHE A 145 -6.716 7.314 15.560 1.00 3.05 H new ATOM 0 HD2 PHE A 145 -8.523 3.625 14.566 1.00 2.24 H new ATOM 0 HE1 PHE A 145 -6.573 6.598 17.951 1.00 3.82 H new ATOM 0 HE2 PHE A 145 -8.381 2.910 16.956 1.00 2.77 H new ATOM 0 HZ PHE A 145 -7.405 4.405 18.621 1.00 3.31 H new ATOM 2204 N GLY A 146 -7.946 8.663 11.587 1.00 1.23 N ATOM 2205 CA GLY A 146 -7.286 9.873 11.126 1.00 1.50 C ATOM 2206 C GLY A 146 -8.280 11.031 11.012 1.00 1.38 C ATOM 2207 O GLY A 146 -8.662 11.626 12.019 1.00 2.21 O ATOM 0 H GLY A 146 -8.365 8.098 10.849 1.00 1.23 H new ATOM 0 HA2 GLY A 146 -6.487 10.142 11.817 1.00 1.50 H new ATOM 0 HA3 GLY A 146 -6.821 9.691 10.157 1.00 1.50 H new ATOM 2211 N SER A 147 -8.670 11.315 9.779 1.00 0.89 N ATOM 2212 CA SER A 147 -9.665 12.342 9.526 1.00 1.11 C ATOM 2213 C SER A 147 -9.098 13.720 9.877 1.00 2.14 C ATOM 2214 O SER A 147 -7.960 13.829 10.332 1.00 3.52 O ATOM 2215 CB SER A 147 -10.944 12.077 10.323 1.00 2.83 C ATOM 2216 OG SER A 147 -11.246 10.686 10.399 1.00 4.37 O ATOM 0 H SER A 147 -8.314 10.851 8.943 1.00 0.89 H new ATOM 0 HA SER A 147 -9.917 12.319 8.466 1.00 1.11 H new ATOM 0 HB2 SER A 147 -10.834 12.480 11.330 1.00 2.83 H new ATOM 0 HB3 SER A 147 -11.777 12.604 9.858 1.00 2.83 H new ATOM 0 HG SER A 147 -12.068 10.558 10.917 1.00 4.37 H new ATOM 2222 N ARG A 148 -9.918 14.736 9.654 1.00 2.52 N ATOM 2223 CA ARG A 148 -9.533 16.095 9.996 1.00 4.02 C ATOM 2224 C ARG A 148 -8.324 16.530 9.165 1.00 3.55 C ATOM 2225 O ARG A 148 -8.468 17.264 8.189 1.00 4.03 O ATOM 2226 CB ARG A 148 -9.191 16.214 11.482 1.00 5.42 C ATOM 2227 CG ARG A 148 -8.797 17.648 11.841 1.00 6.03 C ATOM 2228 CD ARG A 148 -10.036 18.521 12.053 1.00 6.45 C ATOM 2229 NE ARG A 148 -10.732 18.118 13.295 1.00 7.54 N ATOM 2230 CZ ARG A 148 -12.030 17.792 13.357 1.00 8.10 C ATOM 2231 NH1 ARG A 148 -12.644 17.279 12.283 1.00 7.79 N ATOM 2232 NH2 ARG A 148 -12.715 17.981 14.494 1.00 9.41 N ATOM 0 H ARG A 148 -10.846 14.646 9.241 1.00 2.52 H new ATOM 0 HA ARG A 148 -10.381 16.744 9.777 1.00 4.02 H new ATOM 0 HB2 ARG A 148 -10.048 15.908 12.082 1.00 5.42 H new ATOM 0 HB3 ARG A 148 -8.373 15.536 11.726 1.00 5.42 H new ATOM 0 HG2 ARG A 148 -8.190 17.646 12.746 1.00 6.03 H new ATOM 0 HG3 ARG A 148 -8.182 18.070 11.046 1.00 6.03 H new ATOM 0 HD2 ARG A 148 -9.746 19.570 12.113 1.00 6.45 H new ATOM 0 HD3 ARG A 148 -10.709 18.424 11.201 1.00 6.45 H new ATOM 0 HE ARG A 148 -10.189 18.086 14.158 1.00 7.54 H new ATOM 0 HH11 ARG A 148 -12.123 17.136 11.418 1.00 7.79 H new ATOM 0 HH12 ARG A 148 -13.632 17.031 12.331 1.00 7.79 H new ATOM 0 HH21 ARG A 148 -12.248 18.373 15.312 1.00 9.41 H new ATOM 0 HH22 ARG A 148 -13.703 17.733 14.541 1.00 9.41 H new ATOM 2246 N ASN A 149 -7.159 16.058 9.583 1.00 2.94 N ATOM 2247 CA ASN A 149 -5.918 16.455 8.940 1.00 2.77 C ATOM 2248 C ASN A 149 -5.523 15.399 7.904 1.00 2.28 C ATOM 2249 O ASN A 149 -4.704 15.662 7.026 1.00 2.50 O ATOM 2250 CB ASN A 149 -4.781 16.564 9.958 1.00 3.13 C ATOM 2251 CG ASN A 149 -4.737 15.333 10.865 1.00 3.00 C ATOM 2252 OD1 ASN A 149 -4.081 14.343 10.583 1.00 3.45 O ATOM 2253 ND2 ASN A 149 -5.470 15.447 11.969 1.00 3.34 N ATOM 0 H ASN A 149 -7.048 15.405 10.359 1.00 2.94 H new ATOM 0 HA ASN A 149 -6.078 17.426 8.471 1.00 2.77 H new ATOM 0 HB2 ASN A 149 -3.830 16.670 9.436 1.00 3.13 H new ATOM 0 HB3 ASN A 149 -4.914 17.461 10.563 1.00 3.13 H new ATOM 0 HD21 ASN A 149 -5.506 14.679 12.639 1.00 3.34 H new ATOM 0 HD22 ASN A 149 -5.996 16.303 12.146 1.00 3.34 H new ATOM 2260 N GLY A 150 -6.127 14.227 8.043 1.00 2.08 N ATOM 2261 CA GLY A 150 -5.894 13.150 7.096 1.00 2.39 C ATOM 2262 C GLY A 150 -4.493 12.561 7.270 1.00 1.70 C ATOM 2263 O GLY A 150 -3.920 12.022 6.324 1.00 2.68 O ATOM 0 H GLY A 150 -6.776 14.000 8.796 1.00 2.08 H new ATOM 0 HA2 GLY A 150 -6.641 12.369 7.237 1.00 2.39 H new ATOM 0 HA3 GLY A 150 -6.012 13.523 6.079 1.00 2.39 H new ATOM 2267 N LYS A 151 -3.982 12.682 8.486 1.00 1.20 N ATOM 2268 CA LYS A 151 -2.648 12.192 8.790 1.00 1.59 C ATOM 2269 C LYS A 151 -2.633 11.606 10.203 1.00 1.79 C ATOM 2270 O LYS A 151 -1.936 12.111 11.081 1.00 3.12 O ATOM 2271 CB LYS A 151 -1.610 13.294 8.570 1.00 2.39 C ATOM 2272 CG LYS A 151 -0.192 12.720 8.570 1.00 2.79 C ATOM 2273 CD LYS A 151 0.842 13.810 8.859 1.00 3.38 C ATOM 2274 CE LYS A 151 0.899 14.828 7.719 1.00 4.33 C ATOM 2275 NZ LYS A 151 1.996 15.796 7.942 1.00 5.08 N ATOM 0 H LYS A 151 -4.468 13.112 9.273 1.00 1.20 H new ATOM 0 HA LYS A 151 -2.374 11.387 8.109 1.00 1.59 H new ATOM 0 HB2 LYS A 151 -1.803 13.796 7.622 1.00 2.39 H new ATOM 0 HB3 LYS A 151 -1.702 14.046 9.353 1.00 2.39 H new ATOM 0 HG2 LYS A 151 -0.115 11.933 9.320 1.00 2.79 H new ATOM 0 HG3 LYS A 151 0.018 12.262 7.604 1.00 2.79 H new ATOM 0 HD2 LYS A 151 0.591 14.316 9.791 1.00 3.38 H new ATOM 0 HD3 LYS A 151 1.824 13.357 8.996 1.00 3.38 H new ATOM 0 HE2 LYS A 151 1.049 14.312 6.770 1.00 4.33 H new ATOM 0 HE3 LYS A 151 -0.052 15.357 7.648 1.00 4.33 H new ATOM 0 HZ1 LYS A 151 2.020 16.480 7.159 1.00 5.08 H new ATOM 0 HZ2 LYS A 151 1.837 16.301 8.837 1.00 5.08 H new ATOM 0 HZ3 LYS A 151 2.903 15.289 7.987 1.00 5.08 H new ATOM 2289 N THR A 152 -3.412 10.548 10.378 1.00 1.38 N ATOM 2290 CA THR A 152 -3.556 9.934 11.687 1.00 1.55 C ATOM 2291 C THR A 152 -3.852 10.998 12.746 1.00 1.55 C ATOM 2292 O THR A 152 -4.058 12.165 12.417 1.00 2.11 O ATOM 2293 CB THR A 152 -2.288 9.128 11.974 1.00 2.25 C ATOM 2294 OG1 THR A 152 -1.441 10.045 12.662 1.00 3.11 O ATOM 2295 CG2 THR A 152 -1.511 8.787 10.701 1.00 2.46 C ATOM 0 H THR A 152 -3.950 10.101 9.635 1.00 1.38 H new ATOM 0 HA THR A 152 -4.405 9.251 11.711 1.00 1.55 H new ATOM 0 HB THR A 152 -2.553 8.208 12.495 1.00 2.25 H new ATOM 0 HG1 THR A 152 -1.233 10.802 12.075 1.00 3.11 H new ATOM 0 HG21 THR A 152 -0.620 8.215 10.961 1.00 2.46 H new ATOM 0 HG22 THR A 152 -2.142 8.196 10.037 1.00 2.46 H new ATOM 0 HG23 THR A 152 -1.217 9.707 10.197 1.00 2.46 H new ATOM 2303 N SER A 153 -3.863 10.558 13.995 1.00 1.86 N ATOM 2304 CA SER A 153 -4.000 11.476 15.111 1.00 2.16 C ATOM 2305 C SER A 153 -3.278 10.918 16.340 1.00 1.81 C ATOM 2306 O SER A 153 -3.557 11.325 17.466 1.00 2.20 O ATOM 2307 CB SER A 153 -5.473 11.737 15.434 1.00 2.76 C ATOM 2308 OG SER A 153 -6.121 10.574 15.940 1.00 3.20 O ATOM 0 H SER A 153 -3.779 9.576 14.259 1.00 1.86 H new ATOM 0 HA SER A 153 -3.545 12.425 14.829 1.00 2.16 H new ATOM 0 HB2 SER A 153 -5.547 12.541 16.166 1.00 2.76 H new ATOM 0 HB3 SER A 153 -5.987 12.076 14.535 1.00 2.76 H new ATOM 0 HG SER A 153 -6.549 10.091 15.202 1.00 3.20 H new ATOM 2314 N LYS A 154 -2.363 9.995 16.081 1.00 1.52 N ATOM 2315 CA LYS A 154 -1.659 9.317 17.156 1.00 1.40 C ATOM 2316 C LYS A 154 -0.297 8.841 16.646 1.00 1.50 C ATOM 2317 O LYS A 154 0.641 9.629 16.541 1.00 1.92 O ATOM 2318 CB LYS A 154 -2.522 8.198 17.742 1.00 1.38 C ATOM 2319 CG LYS A 154 -3.584 8.764 18.688 1.00 2.01 C ATOM 2320 CD LYS A 154 -4.145 7.670 19.599 1.00 2.28 C ATOM 2321 CE LYS A 154 -5.304 8.201 20.443 1.00 2.73 C ATOM 2322 NZ LYS A 154 -5.850 7.130 21.306 1.00 4.15 N ATOM 0 H LYS A 154 -2.093 9.701 15.142 1.00 1.52 H new ATOM 0 HA LYS A 154 -1.470 10.005 17.980 1.00 1.40 H new ATOM 0 HB2 LYS A 154 -3.005 7.646 16.936 1.00 1.38 H new ATOM 0 HB3 LYS A 154 -1.891 7.490 18.279 1.00 1.38 H new ATOM 0 HG2 LYS A 154 -3.150 9.560 19.294 1.00 2.01 H new ATOM 0 HG3 LYS A 154 -4.392 9.210 18.108 1.00 2.01 H new ATOM 0 HD2 LYS A 154 -4.485 6.829 18.996 1.00 2.28 H new ATOM 0 HD3 LYS A 154 -3.357 7.296 20.252 1.00 2.28 H new ATOM 0 HE2 LYS A 154 -4.962 9.033 21.058 1.00 2.73 H new ATOM 0 HE3 LYS A 154 -6.089 8.587 19.792 1.00 2.73 H new ATOM 0 HZ1 LYS A 154 -6.636 7.508 21.872 1.00 4.15 H new ATOM 0 HZ2 LYS A 154 -6.195 6.348 20.713 1.00 4.15 H new ATOM 0 HZ3 LYS A 154 -5.103 6.780 21.940 1.00 4.15 H new ATOM 2336 N LYS A 155 -0.233 7.553 16.342 1.00 1.29 N ATOM 2337 CA LYS A 155 1.023 6.940 15.941 1.00 1.40 C ATOM 2338 C LYS A 155 0.743 5.560 15.343 1.00 1.37 C ATOM 2339 O LYS A 155 0.533 4.593 16.073 1.00 1.63 O ATOM 2340 CB LYS A 155 2.004 6.914 17.114 1.00 1.47 C ATOM 2341 CG LYS A 155 3.399 6.487 16.653 1.00 2.65 C ATOM 2342 CD LYS A 155 4.441 6.746 17.743 1.00 2.90 C ATOM 2343 CE LYS A 155 4.136 5.926 18.998 1.00 3.86 C ATOM 2344 NZ LYS A 155 4.061 4.485 18.671 1.00 5.04 N ATOM 0 H LYS A 155 -1.030 6.917 16.365 1.00 1.29 H new ATOM 0 HA LYS A 155 1.506 7.533 15.164 1.00 1.40 H new ATOM 0 HB2 LYS A 155 2.055 7.902 17.572 1.00 1.47 H new ATOM 0 HB3 LYS A 155 1.644 6.226 17.879 1.00 1.47 H new ATOM 0 HG2 LYS A 155 3.392 5.428 16.396 1.00 2.65 H new ATOM 0 HG3 LYS A 155 3.670 7.033 15.749 1.00 2.65 H new ATOM 0 HD2 LYS A 155 5.433 6.492 17.370 1.00 2.90 H new ATOM 0 HD3 LYS A 155 4.456 7.807 17.992 1.00 2.90 H new ATOM 0 HE2 LYS A 155 4.910 6.095 19.747 1.00 3.86 H new ATOM 0 HE3 LYS A 155 3.193 6.255 19.434 1.00 3.86 H new ATOM 0 HZ1 LYS A 155 4.142 3.926 19.544 1.00 5.04 H new ATOM 0 HZ2 LYS A 155 3.150 4.280 18.212 1.00 5.04 H new ATOM 0 HZ3 LYS A 155 4.837 4.234 18.026 1.00 5.04 H new ATOM 2358 N ILE A 156 0.749 5.512 14.019 1.00 1.21 N ATOM 2359 CA ILE A 156 0.484 4.270 13.313 1.00 1.17 C ATOM 2360 C ILE A 156 1.812 3.580 12.989 1.00 1.20 C ATOM 2361 O ILE A 156 2.713 4.195 12.423 1.00 1.49 O ATOM 2362 CB ILE A 156 -0.390 4.527 12.085 1.00 1.32 C ATOM 2363 CG1 ILE A 156 -1.499 5.533 12.402 1.00 1.77 C ATOM 2364 CG2 ILE A 156 -0.947 3.217 11.525 1.00 1.28 C ATOM 2365 CD1 ILE A 156 -2.431 4.996 13.491 1.00 1.85 C ATOM 0 H ILE A 156 0.933 6.314 13.416 1.00 1.21 H new ATOM 0 HA ILE A 156 -0.086 3.588 13.944 1.00 1.17 H new ATOM 0 HB ILE A 156 0.234 4.970 11.308 1.00 1.32 H new ATOM 0 HG12 ILE A 156 -1.058 6.475 12.728 1.00 1.77 H new ATOM 0 HG13 ILE A 156 -2.072 5.744 11.499 1.00 1.77 H new ATOM 0 HG21 ILE A 156 -1.565 3.428 10.652 1.00 1.28 H new ATOM 0 HG22 ILE A 156 -0.123 2.565 11.237 1.00 1.28 H new ATOM 0 HG23 ILE A 156 -1.551 2.723 12.286 1.00 1.28 H new ATOM 0 HD11 ILE A 156 -3.210 5.730 13.698 1.00 1.85 H new ATOM 0 HD12 ILE A 156 -2.889 4.066 13.152 1.00 1.85 H new ATOM 0 HD13 ILE A 156 -1.859 4.809 14.400 1.00 1.85 H new ATOM 2377 N THR A 157 1.888 2.312 13.364 1.00 1.03 N ATOM 2378 CA THR A 157 3.108 1.546 13.166 1.00 1.11 C ATOM 2379 C THR A 157 2.776 0.114 12.740 1.00 0.94 C ATOM 2380 O THR A 157 1.865 -0.504 13.288 1.00 0.91 O ATOM 2381 CB THR A 157 3.927 1.622 14.456 1.00 1.27 C ATOM 2382 OG1 THR A 157 3.135 0.924 15.413 1.00 1.50 O ATOM 2383 CG2 THR A 157 4.014 3.045 15.012 1.00 1.45 C ATOM 0 H THR A 157 1.126 1.796 13.803 1.00 1.03 H new ATOM 0 HA THR A 157 3.709 1.961 12.357 1.00 1.11 H new ATOM 0 HB THR A 157 4.932 1.243 14.270 1.00 1.27 H new ATOM 0 HG1 THR A 157 2.186 1.087 15.233 1.00 1.50 H new ATOM 0 HG21 THR A 157 4.606 3.042 15.927 1.00 1.45 H new ATOM 0 HG22 THR A 157 4.487 3.695 14.276 1.00 1.45 H new ATOM 0 HG23 THR A 157 3.011 3.413 15.229 1.00 1.45 H new ATOM 2391 N ILE A 158 3.534 -0.370 11.767 1.00 0.92 N ATOM 2392 CA ILE A 158 3.463 -1.772 11.391 1.00 0.83 C ATOM 2393 C ILE A 158 4.166 -2.617 12.456 1.00 0.84 C ATOM 2394 O ILE A 158 5.322 -2.362 12.791 1.00 0.91 O ATOM 2395 CB ILE A 158 4.016 -1.977 9.980 1.00 0.90 C ATOM 2396 CG1 ILE A 158 3.148 -1.263 8.941 1.00 1.09 C ATOM 2397 CG2 ILE A 158 4.179 -3.464 9.665 1.00 0.91 C ATOM 2398 CD1 ILE A 158 2.022 -2.175 8.448 1.00 2.12 C ATOM 0 H ILE A 158 4.200 0.183 11.228 1.00 0.92 H new ATOM 0 HA ILE A 158 2.426 -2.104 11.353 1.00 0.83 H new ATOM 0 HB ILE A 158 5.008 -1.528 9.934 1.00 0.90 H new ATOM 0 HG12 ILE A 158 2.724 -0.358 9.376 1.00 1.09 H new ATOM 0 HG13 ILE A 158 3.765 -0.952 8.098 1.00 1.09 H new ATOM 0 HG21 ILE A 158 4.574 -3.581 8.656 1.00 0.91 H new ATOM 0 HG22 ILE A 158 4.869 -3.914 10.379 1.00 0.91 H new ATOM 0 HG23 ILE A 158 3.211 -3.959 9.735 1.00 0.91 H new ATOM 0 HD11 ILE A 158 1.420 -1.644 7.711 1.00 2.12 H new ATOM 0 HD12 ILE A 158 2.450 -3.068 7.992 1.00 2.12 H new ATOM 0 HD13 ILE A 158 1.393 -2.464 9.290 1.00 2.12 H new ATOM 2410 N ALA A 159 3.438 -3.604 12.957 1.00 0.88 N ATOM 2411 CA ALA A 159 3.970 -4.473 13.993 1.00 0.93 C ATOM 2412 C ALA A 159 4.979 -5.442 13.374 1.00 0.92 C ATOM 2413 O ALA A 159 6.151 -5.444 13.745 1.00 1.01 O ATOM 2414 CB ALA A 159 2.818 -5.198 14.691 1.00 0.98 C ATOM 0 H ALA A 159 2.485 -3.821 12.665 1.00 0.88 H new ATOM 0 HA ALA A 159 4.496 -3.890 14.749 1.00 0.93 H new ATOM 0 HB1 ALA A 159 3.216 -5.850 15.468 1.00 0.98 H new ATOM 0 HB2 ALA A 159 2.146 -4.466 15.140 1.00 0.98 H new ATOM 0 HB3 ALA A 159 2.269 -5.795 13.963 1.00 0.98 H new ATOM 2420 N ASP A 160 4.485 -6.242 12.439 1.00 0.85 N ATOM 2421 CA ASP A 160 5.301 -7.284 11.840 1.00 0.88 C ATOM 2422 C ASP A 160 4.663 -7.733 10.524 1.00 0.86 C ATOM 2423 O ASP A 160 3.474 -7.510 10.299 1.00 0.87 O ATOM 2424 CB ASP A 160 5.398 -8.504 12.759 1.00 0.90 C ATOM 2425 CG ASP A 160 6.143 -8.266 14.073 1.00 1.88 C ATOM 2426 OD1 ASP A 160 7.392 -8.321 14.037 1.00 3.24 O ATOM 2427 OD2 ASP A 160 5.448 -8.033 15.086 1.00 2.56 O ATOM 0 H ASP A 160 3.531 -6.189 12.082 1.00 0.85 H new ATOM 0 HA ASP A 160 6.298 -6.877 11.674 1.00 0.88 H new ATOM 0 HB2 ASP A 160 4.390 -8.849 12.988 1.00 0.90 H new ATOM 0 HB3 ASP A 160 5.895 -9.309 12.218 1.00 0.90 H new ATOM 2432 N CYS A 161 5.481 -8.356 9.688 1.00 0.90 N ATOM 2433 CA CYS A 161 5.012 -8.831 8.398 1.00 0.91 C ATOM 2434 C CYS A 161 5.524 -10.259 8.197 1.00 0.94 C ATOM 2435 O CYS A 161 6.435 -10.700 8.895 1.00 1.10 O ATOM 2436 CB CYS A 161 5.448 -7.903 7.262 1.00 1.20 C ATOM 2437 SG CYS A 161 4.917 -6.188 7.615 1.00 1.71 S ATOM 0 H CYS A 161 6.465 -8.543 9.879 1.00 0.90 H new ATOM 0 HA CYS A 161 3.922 -8.831 8.381 1.00 0.91 H new ATOM 0 HB2 CYS A 161 6.531 -7.940 7.146 1.00 1.20 H new ATOM 0 HB3 CYS A 161 5.015 -8.240 6.320 1.00 1.20 H new ATOM 0 HG CYS A 161 5.961 -5.452 7.859 1.00 1.71 H new ATOM 2443 N GLY A 162 4.915 -10.942 7.239 1.00 0.95 N ATOM 2444 CA GLY A 162 5.347 -12.284 6.886 1.00 1.21 C ATOM 2445 C GLY A 162 4.506 -12.847 5.738 1.00 1.05 C ATOM 2446 O GLY A 162 3.593 -12.182 5.249 1.00 1.38 O ATOM 0 H GLY A 162 4.126 -10.591 6.696 1.00 0.95 H new ATOM 0 HA2 GLY A 162 6.398 -12.267 6.597 1.00 1.21 H new ATOM 0 HA3 GLY A 162 5.265 -12.937 7.755 1.00 1.21 H new ATOM 2450 N GLN A 163 4.842 -14.066 5.343 1.00 1.22 N ATOM 2451 CA GLN A 163 4.142 -14.717 4.249 1.00 1.20 C ATOM 2452 C GLN A 163 3.506 -16.023 4.730 1.00 1.25 C ATOM 2453 O GLN A 163 4.111 -16.767 5.501 1.00 1.35 O ATOM 2454 CB GLN A 163 5.083 -14.968 3.069 1.00 1.42 C ATOM 2455 CG GLN A 163 4.383 -15.774 1.972 1.00 1.94 C ATOM 2456 CD GLN A 163 5.238 -15.832 0.705 1.00 2.21 C ATOM 2457 OE1 GLN A 163 4.957 -15.190 -0.294 1.00 2.97 O ATOM 2458 NE2 GLN A 163 6.294 -16.634 0.801 1.00 2.62 N ATOM 0 H GLN A 163 5.590 -14.620 5.761 1.00 1.22 H new ATOM 0 HA GLN A 163 3.349 -14.054 3.904 1.00 1.20 H new ATOM 0 HB2 GLN A 163 5.426 -14.016 2.663 1.00 1.42 H new ATOM 0 HB3 GLN A 163 5.967 -15.505 3.412 1.00 1.42 H new ATOM 0 HG2 GLN A 163 4.185 -16.785 2.328 1.00 1.94 H new ATOM 0 HG3 GLN A 163 3.418 -15.322 1.743 1.00 1.94 H new ATOM 0 HE21 GLN A 163 6.471 -17.143 1.667 1.00 2.62 H new ATOM 0 HE22 GLN A 163 6.927 -16.741 0.008 1.00 2.62 H new ATOM 2467 N LEU A 164 2.292 -16.262 4.255 1.00 1.29 N ATOM 2468 CA LEU A 164 1.584 -17.486 4.592 1.00 1.43 C ATOM 2469 C LEU A 164 1.917 -18.563 3.557 1.00 1.68 C ATOM 2470 O LEU A 164 1.133 -18.816 2.645 1.00 2.02 O ATOM 2471 CB LEU A 164 0.086 -17.214 4.738 1.00 1.32 C ATOM 2472 CG LEU A 164 -0.302 -16.074 5.681 1.00 1.09 C ATOM 2473 CD1 LEU A 164 -1.799 -15.773 5.592 1.00 1.25 C ATOM 2474 CD2 LEU A 164 0.138 -16.376 7.115 1.00 1.10 C ATOM 0 H LEU A 164 1.781 -15.629 3.640 1.00 1.29 H new ATOM 0 HA LEU A 164 1.912 -17.863 5.561 1.00 1.43 H new ATOM 0 HB2 LEU A 164 -0.321 -16.996 3.751 1.00 1.32 H new ATOM 0 HB3 LEU A 164 -0.396 -18.127 5.087 1.00 1.32 H new ATOM 0 HG LEU A 164 0.226 -15.174 5.364 1.00 1.09 H new ATOM 0 HD11 LEU A 164 -2.047 -14.959 6.273 1.00 1.25 H new ATOM 0 HD12 LEU A 164 -2.052 -15.483 4.572 1.00 1.25 H new ATOM 0 HD13 LEU A 164 -2.366 -16.662 5.868 1.00 1.25 H new ATOM 0 HD21 LEU A 164 -0.150 -15.550 7.765 1.00 1.10 H new ATOM 0 HD22 LEU A 164 -0.343 -17.292 7.458 1.00 1.10 H new ATOM 0 HD23 LEU A 164 1.220 -16.501 7.145 1.00 1.10 H new ATOM 2486 N GLU A 165 3.082 -19.169 3.735 1.00 1.87 N ATOM 2487 CA GLU A 165 3.534 -20.205 2.822 1.00 2.22 C ATOM 2488 C GLU A 165 4.401 -21.224 3.562 1.00 3.28 C ATOM 2489 O GLU A 165 4.210 -22.430 3.415 1.00 3.87 O ATOM 2490 CB GLU A 165 4.290 -19.599 1.637 1.00 2.50 C ATOM 2491 CG GLU A 165 4.631 -20.670 0.600 1.00 3.77 C ATOM 2492 CD GLU A 165 5.251 -20.044 -0.652 1.00 4.87 C ATOM 2493 OE1 GLU A 165 4.463 -19.643 -1.535 1.00 5.95 O ATOM 2494 OE2 GLU A 165 6.498 -19.981 -0.696 1.00 5.36 O ATOM 0 H GLU A 165 3.726 -18.962 4.498 1.00 1.87 H new ATOM 0 HA GLU A 165 2.659 -20.721 2.427 1.00 2.22 H new ATOM 0 HB2 GLU A 165 3.684 -18.820 1.175 1.00 2.50 H new ATOM 0 HB3 GLU A 165 5.206 -19.124 1.989 1.00 2.50 H new ATOM 0 HG2 GLU A 165 5.325 -21.391 1.032 1.00 3.77 H new ATOM 0 HG3 GLU A 165 3.729 -21.218 0.328 1.00 3.77 H new