USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1286 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 70 THR OG1 : rot 106:sc= 0.4 USER MOD Set 1.2: A 100 GLN : amide:sc= 0.179 K(o=0.58,f=0.018) USER MOD Set 2.1: A 60 HIS : no HD1:sc= -0.108 K(o=-1.8,f=-2.5) USER MOD Set 2.2: A 80 HIS : no HE2:sc= -0.24! K(o=-1.8!,f=-7.9) USER MOD Set 2.3: A 83 THR OG1 : rot -85:sc= 0.464 USER MOD Set 2.4: A 96 HIS : no HE2:sc= -1.87! C(o=-1.8!,f=-13!) USER MOD Set 3.1: A 58 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 85 SER OG : rot -55:sc= 0.521 USER MOD Single : A 5 THR OG1 : rot 38:sc= 0.139 USER MOD Single : A 10 THR OG1 : rot 51:sc= 1.19 USER MOD Single : A 11 GLN : amide:sc= -0.0167 K(o=-0.017,f=-0.59) USER MOD Single : A 13 GLN : amide:sc= -0.173 X(o=-0.17,f=0) USER MOD Single : A 15 ASN : amide:sc= -0.0034 K(o=-0.0034,f=-0.54) USER MOD Single : A 19 LYS NZ :NH3+ -151:sc= 1.18 (180deg=0.475) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 HIS : no HD1:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 28 GLN : amide:sc= -0.0386 X(o=-0.039,f=-0.039) USER MOD Single : A 29 SER OG : rot 35:sc= 0.0631 USER MOD Single : A 43 SER OG : rot 61:sc= 0.155 USER MOD Single : A 44 TYR OH : rot 180:sc= -0.405 USER MOD Single : A 51 TYR OH : rot 180:sc= -0.372 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 42:sc= 0.424 USER MOD Single : A 65 SER OG : rot 32:sc= 0.119 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot -121:sc= 0.156 USER MOD Single : A 78 TYR OH : rot 63:sc= 0.255 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot -41:sc= 0.476 USER MOD Single : A 107 THR OG1 : rot -46:sc= 0.354 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot -41:sc= 0.637 USER MOD Single : A 117 THR OG1 : rot -50:sc= -0.373 USER MOD Single : A 119 GLN : amide:sc= 0.225 X(o=0.22,f=-0.00053) USER MOD Single : A 120 GLN : amide:sc= -1.29 K(o=-1.3,f=-6.2!) USER MOD Single : A 121 SER OG : rot 180:sc= -0.0156 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 TYR OH : rot -76:sc= 0.577 USER MOD Single : A 128 MET CE :methyl -171:sc= 0 (180deg=-0.0576) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 ASN : amide:sc= -2.82! C(o=-2.8!,f=-5.7!) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 44:sc= 0.101 USER MOD Single : A 154 CYS SG : rot 73:sc= 0.931 USER MOD Single : A 156 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 SER OG : rot 170:sc= -1.14 USER MOD Single : A 159 THR OG1 : rot -22:sc= 0.0611 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 162 CYS SG : rot 180:sc= -0.485 USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 169 ASN : amide:sc= -1.33 K(o=-1.3,f=-2.4) USER MOD Single : A 173 THR OG1 : rot 180:sc=-0.00265 USER MOD Single : A 176 THR OG1 : rot 44:sc= 0.17 USER MOD ----------------------------------------------------------------- ATOM 59 N THR A 5 -13.802 1.216 -15.590 1.00 12.52 N ATOM 60 CA THR A 5 -12.989 0.156 -14.978 1.00 22.40 C ATOM 61 C THR A 5 -11.681 -0.081 -15.771 1.00 4.02 C ATOM 62 O THR A 5 -10.663 -0.503 -15.196 1.00 74.24 O ATOM 63 CB THR A 5 -13.831 -1.155 -14.864 1.00 32.34 C ATOM 64 OG1 THR A 5 -15.023 -0.872 -14.113 1.00 25.10 O ATOM 65 CG2 THR A 5 -13.080 -2.310 -14.172 1.00 41.02 C ATOM 0 HA THR A 5 -12.700 0.473 -13.976 1.00 22.40 H new ATOM 0 HB THR A 5 -14.053 -1.480 -15.880 1.00 32.34 H new ATOM 0 HG1 THR A 5 -15.353 0.021 -14.347 1.00 25.10 H new ATOM 0 HG21 THR A 5 -13.724 -3.188 -14.128 1.00 41.02 H new ATOM 0 HG22 THR A 5 -12.179 -2.549 -14.738 1.00 41.02 H new ATOM 0 HG23 THR A 5 -12.804 -2.011 -13.161 1.00 41.02 H new ATOM 73 N GLU A 6 -11.705 0.220 -17.086 1.00 74.44 N ATOM 74 CA GLU A 6 -10.505 0.143 -17.925 1.00 12.32 C ATOM 75 C GLU A 6 -9.473 1.187 -17.478 1.00 15.44 C ATOM 76 O GLU A 6 -8.315 0.843 -17.334 1.00 41.11 O ATOM 77 CB GLU A 6 -10.832 0.284 -19.433 1.00 33.02 C ATOM 78 CG GLU A 6 -11.476 1.616 -19.853 1.00 64.24 C ATOM 79 CD GLU A 6 -11.780 1.688 -21.357 1.00 44.42 C ATOM 80 OE1 GLU A 6 -12.758 1.053 -21.799 1.00 74.20 O ATOM 81 OE2 GLU A 6 -11.041 2.367 -22.099 1.00 34.03 O ATOM 0 H GLU A 6 -12.544 0.518 -17.583 1.00 74.44 H new ATOM 0 HA GLU A 6 -10.075 -0.850 -17.793 1.00 12.32 H new ATOM 0 HB2 GLU A 6 -9.910 0.152 -20.000 1.00 33.02 H new ATOM 0 HB3 GLU A 6 -11.501 -0.528 -19.719 1.00 33.02 H new ATOM 0 HG2 GLU A 6 -12.401 1.758 -19.294 1.00 64.24 H new ATOM 0 HG3 GLU A 6 -10.811 2.436 -19.583 1.00 64.24 H new ATOM 88 N ASP A 7 -9.929 2.436 -17.204 1.00 63.14 N ATOM 89 CA ASP A 7 -9.064 3.538 -16.704 1.00 25.13 C ATOM 90 C ASP A 7 -8.429 3.193 -15.344 1.00 22.30 C ATOM 91 O ASP A 7 -7.225 3.442 -15.134 1.00 45.33 O ATOM 92 CB ASP A 7 -9.873 4.857 -16.584 1.00 1.34 C ATOM 93 CG ASP A 7 -10.220 5.474 -17.945 1.00 30.34 C ATOM 94 OD1 ASP A 7 -11.062 4.915 -18.663 1.00 15.52 O ATOM 95 OD2 ASP A 7 -9.638 6.518 -18.305 1.00 41.12 O ATOM 0 H ASP A 7 -10.905 2.708 -17.323 1.00 63.14 H new ATOM 0 HA ASP A 7 -8.262 3.672 -17.429 1.00 25.13 H new ATOM 0 HB2 ASP A 7 -10.794 4.663 -16.034 1.00 1.34 H new ATOM 0 HB3 ASP A 7 -9.299 5.577 -16.001 1.00 1.34 H new ATOM 100 N TRP A 8 -9.268 2.657 -14.428 1.00 33.54 N ATOM 101 CA TRP A 8 -8.819 2.031 -13.166 1.00 43.51 C ATOM 102 C TRP A 8 -7.621 1.087 -13.408 1.00 12.21 C ATOM 103 O TRP A 8 -6.586 1.203 -12.739 1.00 3.15 O ATOM 104 CB TRP A 8 -9.999 1.265 -12.488 1.00 25.12 C ATOM 105 CG TRP A 8 -9.597 0.319 -11.369 1.00 12.44 C ATOM 106 CD1 TRP A 8 -9.111 0.652 -10.139 1.00 24.33 C ATOM 107 CD2 TRP A 8 -9.638 -1.117 -11.402 1.00 61.12 C ATOM 108 NE1 TRP A 8 -8.855 -0.486 -9.417 1.00 65.21 N ATOM 109 CE2 TRP A 8 -9.172 -1.579 -10.168 1.00 13.33 C ATOM 110 CE3 TRP A 8 -10.024 -2.054 -12.369 1.00 34.42 C ATOM 111 CZ2 TRP A 8 -9.094 -2.932 -9.864 1.00 11.00 C ATOM 112 CZ3 TRP A 8 -9.951 -3.399 -12.069 1.00 74.44 C ATOM 113 CH2 TRP A 8 -9.480 -3.827 -10.825 1.00 14.22 C ATOM 0 H TRP A 8 -10.281 2.647 -14.546 1.00 33.54 H new ATOM 0 HA TRP A 8 -8.488 2.823 -12.494 1.00 43.51 H new ATOM 0 HB2 TRP A 8 -10.704 1.995 -12.090 1.00 25.12 H new ATOM 0 HB3 TRP A 8 -10.528 0.695 -13.252 1.00 25.12 H new ATOM 0 HD1 TRP A 8 -8.952 1.660 -9.786 1.00 24.33 H new ATOM 0 HE1 TRP A 8 -8.485 -0.511 -8.467 1.00 65.21 H new ATOM 0 HE3 TRP A 8 -10.374 -1.728 -13.337 1.00 34.42 H new ATOM 0 HZ2 TRP A 8 -8.740 -3.267 -8.900 1.00 11.00 H new ATOM 0 HZ3 TRP A 8 -10.261 -4.128 -12.803 1.00 74.44 H new ATOM 0 HH2 TRP A 8 -9.419 -4.885 -10.618 1.00 14.22 H new ATOM 124 N GLU A 9 -7.762 0.179 -14.393 1.00 5.45 N ATOM 125 CA GLU A 9 -6.721 -0.803 -14.703 1.00 51.14 C ATOM 126 C GLU A 9 -5.635 -0.225 -15.650 1.00 3.21 C ATOM 127 O GLU A 9 -4.566 -0.802 -15.760 1.00 11.42 O ATOM 128 CB GLU A 9 -7.333 -2.116 -15.261 1.00 73.02 C ATOM 129 CG GLU A 9 -6.298 -3.253 -15.451 1.00 12.34 C ATOM 130 CD GLU A 9 -6.898 -4.578 -15.915 1.00 42.22 C ATOM 131 OE1 GLU A 9 -7.577 -4.600 -16.959 1.00 35.34 O ATOM 132 OE2 GLU A 9 -6.692 -5.610 -15.248 1.00 12.14 O ATOM 0 H GLU A 9 -8.590 0.110 -14.985 1.00 5.45 H new ATOM 0 HA GLU A 9 -6.220 -1.047 -13.766 1.00 51.14 H new ATOM 0 HB2 GLU A 9 -8.116 -2.458 -14.584 1.00 73.02 H new ATOM 0 HB3 GLU A 9 -7.809 -1.906 -16.219 1.00 73.02 H new ATOM 0 HG2 GLU A 9 -5.552 -2.931 -16.177 1.00 12.34 H new ATOM 0 HG3 GLU A 9 -5.776 -3.414 -14.508 1.00 12.34 H new ATOM 139 N THR A 10 -5.886 0.932 -16.298 1.00 65.52 N ATOM 140 CA THR A 10 -4.904 1.559 -17.208 1.00 44.31 C ATOM 141 C THR A 10 -3.719 2.090 -16.380 1.00 2.33 C ATOM 142 O THR A 10 -2.555 1.764 -16.661 1.00 61.45 O ATOM 143 CB THR A 10 -5.546 2.706 -18.076 1.00 61.13 C ATOM 144 OG1 THR A 10 -6.612 2.177 -18.880 1.00 21.44 O ATOM 145 CG2 THR A 10 -4.531 3.384 -19.005 1.00 13.03 C ATOM 0 H THR A 10 -6.760 1.451 -16.208 1.00 65.52 H new ATOM 0 HA THR A 10 -4.552 0.803 -17.910 1.00 44.31 H new ATOM 0 HB THR A 10 -5.919 3.453 -17.375 1.00 61.13 H new ATOM 0 HG1 THR A 10 -7.230 1.671 -18.312 1.00 21.44 H new ATOM 0 HG21 THR A 10 -5.029 4.166 -19.579 1.00 13.03 H new ATOM 0 HG22 THR A 10 -3.731 3.824 -18.410 1.00 13.03 H new ATOM 0 HG23 THR A 10 -4.112 2.645 -19.687 1.00 13.03 H new ATOM 153 N GLN A 11 -4.034 2.889 -15.337 1.00 75.21 N ATOM 154 CA GLN A 11 -3.032 3.327 -14.352 1.00 14.23 C ATOM 155 C GLN A 11 -2.439 2.132 -13.588 1.00 5.44 C ATOM 156 O GLN A 11 -1.227 2.061 -13.418 1.00 25.24 O ATOM 157 CB GLN A 11 -3.619 4.377 -13.367 1.00 61.11 C ATOM 158 CG GLN A 11 -4.836 3.913 -12.538 1.00 60.32 C ATOM 159 CD GLN A 11 -5.293 4.937 -11.494 1.00 21.35 C ATOM 160 OE1 GLN A 11 -4.491 5.699 -10.954 1.00 21.45 O ATOM 161 NE2 GLN A 11 -6.582 4.950 -11.188 1.00 41.22 N ATOM 0 H GLN A 11 -4.975 3.241 -15.159 1.00 75.21 H new ATOM 0 HA GLN A 11 -2.225 3.807 -14.906 1.00 14.23 H new ATOM 0 HB2 GLN A 11 -2.830 4.683 -12.680 1.00 61.11 H new ATOM 0 HB3 GLN A 11 -3.907 5.261 -13.936 1.00 61.11 H new ATOM 0 HG2 GLN A 11 -5.665 3.700 -13.213 1.00 60.32 H new ATOM 0 HG3 GLN A 11 -4.587 2.979 -12.034 1.00 60.32 H new ATOM 0 HE21 GLN A 11 -7.223 4.307 -11.652 1.00 41.22 H new ATOM 0 HE22 GLN A 11 -6.933 5.604 -10.488 1.00 41.22 H new ATOM 170 N LEU A 12 -3.307 1.177 -13.179 1.00 50.34 N ATOM 171 CA LEU A 12 -2.923 0.026 -12.341 1.00 64.22 C ATOM 172 C LEU A 12 -1.868 -0.855 -13.018 1.00 35.12 C ATOM 173 O LEU A 12 -0.813 -1.110 -12.423 1.00 15.14 O ATOM 174 CB LEU A 12 -4.173 -0.817 -11.984 1.00 32.24 C ATOM 175 CG LEU A 12 -3.931 -2.188 -11.263 1.00 43.01 C ATOM 176 CD1 LEU A 12 -3.116 -2.020 -9.963 1.00 51.42 C ATOM 177 CD2 LEU A 12 -5.271 -2.920 -11.010 1.00 74.11 C ATOM 0 H LEU A 12 -4.297 1.187 -13.424 1.00 50.34 H new ATOM 0 HA LEU A 12 -2.480 0.423 -11.428 1.00 64.22 H new ATOM 0 HB2 LEU A 12 -4.819 -0.211 -11.349 1.00 32.24 H new ATOM 0 HB3 LEU A 12 -4.723 -1.012 -12.905 1.00 32.24 H new ATOM 0 HG LEU A 12 -3.331 -2.810 -11.928 1.00 43.01 H new ATOM 0 HD11 LEU A 12 -2.971 -2.994 -9.496 1.00 51.42 H new ATOM 0 HD12 LEU A 12 -2.146 -1.582 -10.196 1.00 51.42 H new ATOM 0 HD13 LEU A 12 -3.655 -1.365 -9.278 1.00 51.42 H new ATOM 0 HD21 LEU A 12 -5.078 -3.869 -10.509 1.00 74.11 H new ATOM 0 HD22 LEU A 12 -5.911 -2.301 -10.381 1.00 74.11 H new ATOM 0 HD23 LEU A 12 -5.769 -3.107 -11.962 1.00 74.11 H new ATOM 189 N GLN A 13 -2.161 -1.298 -14.259 1.00 33.12 N ATOM 190 CA GLN A 13 -1.303 -2.232 -15.012 1.00 24.52 C ATOM 191 C GLN A 13 0.123 -1.683 -15.141 1.00 12.00 C ATOM 192 O GLN A 13 1.074 -2.428 -15.001 1.00 13.14 O ATOM 193 CB GLN A 13 -1.902 -2.556 -16.411 1.00 32.34 C ATOM 194 CG GLN A 13 -1.977 -1.366 -17.390 1.00 22.30 C ATOM 195 CD GLN A 13 -2.657 -1.712 -18.713 1.00 20.11 C ATOM 196 OE1 GLN A 13 -2.004 -2.125 -19.670 1.00 35.23 O ATOM 197 NE2 GLN A 13 -3.970 -1.575 -18.773 1.00 0.31 N ATOM 0 H GLN A 13 -3.000 -1.017 -14.766 1.00 33.12 H new ATOM 0 HA GLN A 13 -1.259 -3.164 -14.449 1.00 24.52 H new ATOM 0 HB2 GLN A 13 -1.305 -3.345 -16.869 1.00 32.34 H new ATOM 0 HB3 GLN A 13 -2.907 -2.956 -16.274 1.00 32.34 H new ATOM 0 HG2 GLN A 13 -2.518 -0.548 -16.915 1.00 22.30 H new ATOM 0 HG3 GLN A 13 -0.968 -1.007 -17.592 1.00 22.30 H new ATOM 0 HE21 GLN A 13 -4.484 -1.230 -17.963 1.00 0.31 H new ATOM 0 HE22 GLN A 13 -4.469 -1.814 -19.630 1.00 0.31 H new ATOM 206 N ALA A 14 0.239 -0.357 -15.340 1.00 13.35 N ATOM 207 CA ALA A 14 1.525 0.334 -15.440 1.00 5.53 C ATOM 208 C ALA A 14 2.217 0.414 -14.063 1.00 24.41 C ATOM 209 O ALA A 14 3.391 0.039 -13.925 1.00 22.30 O ATOM 210 CB ALA A 14 1.302 1.731 -16.033 1.00 35.01 C ATOM 0 H ALA A 14 -0.565 0.263 -15.436 1.00 13.35 H new ATOM 0 HA ALA A 14 2.186 -0.229 -16.099 1.00 5.53 H new ATOM 0 HB1 ALA A 14 2.257 2.250 -16.110 1.00 35.01 H new ATOM 0 HB2 ALA A 14 0.858 1.639 -17.024 1.00 35.01 H new ATOM 0 HB3 ALA A 14 0.632 2.298 -15.387 1.00 35.01 H new ATOM 216 N ASN A 15 1.445 0.869 -13.048 1.00 32.02 N ATOM 217 CA ASN A 15 1.930 1.097 -11.662 1.00 33.30 C ATOM 218 C ASN A 15 2.417 -0.194 -10.985 1.00 43.42 C ATOM 219 O ASN A 15 3.233 -0.123 -10.071 1.00 60.14 O ATOM 220 CB ASN A 15 0.822 1.750 -10.766 1.00 53.32 C ATOM 221 CG ASN A 15 0.490 3.206 -11.123 1.00 61.25 C ATOM 222 OD1 ASN A 15 1.337 3.956 -11.601 1.00 61.41 O ATOM 223 ND2 ASN A 15 -0.748 3.617 -10.877 1.00 72.13 N ATOM 0 H ASN A 15 0.457 1.091 -13.168 1.00 32.02 H new ATOM 0 HA ASN A 15 2.776 1.778 -11.756 1.00 33.30 H new ATOM 0 HB2 ASN A 15 -0.087 1.154 -10.843 1.00 53.32 H new ATOM 0 HB3 ASN A 15 1.143 1.709 -9.725 1.00 53.32 H new ATOM 0 HD21 ASN A 15 -1.017 4.579 -11.086 1.00 72.13 H new ATOM 0 HD22 ASN A 15 -1.430 2.971 -10.480 1.00 72.13 H new ATOM 230 N ARG A 16 1.902 -1.364 -11.413 1.00 42.43 N ATOM 231 CA ARG A 16 2.251 -2.665 -10.787 1.00 33.35 C ATOM 232 C ARG A 16 3.237 -3.475 -11.651 1.00 14.21 C ATOM 233 O ARG A 16 3.951 -4.319 -11.115 1.00 41.54 O ATOM 234 CB ARG A 16 0.979 -3.504 -10.503 1.00 73.40 C ATOM 235 CG ARG A 16 0.274 -4.054 -11.759 1.00 51.55 C ATOM 236 CD ARG A 16 -0.974 -4.880 -11.433 1.00 33.53 C ATOM 237 NE ARG A 16 -1.565 -5.465 -12.646 1.00 31.22 N ATOM 238 CZ ARG A 16 -2.287 -6.593 -12.685 1.00 34.13 C ATOM 239 NH1 ARG A 16 -2.522 -7.294 -11.582 1.00 73.01 N ATOM 240 NH2 ARG A 16 -2.718 -7.045 -13.847 1.00 22.41 N ATOM 0 H ARG A 16 1.243 -1.440 -12.188 1.00 42.43 H new ATOM 0 HA ARG A 16 2.743 -2.439 -9.841 1.00 33.35 H new ATOM 0 HB2 ARG A 16 1.249 -4.341 -9.859 1.00 73.40 H new ATOM 0 HB3 ARG A 16 0.272 -2.889 -9.946 1.00 73.40 H new ATOM 0 HG2 ARG A 16 -0.007 -3.222 -12.405 1.00 51.55 H new ATOM 0 HG3 ARG A 16 0.975 -4.671 -12.321 1.00 51.55 H new ATOM 0 HD2 ARG A 16 -0.713 -5.675 -10.734 1.00 33.53 H new ATOM 0 HD3 ARG A 16 -1.710 -4.248 -10.937 1.00 33.53 H new ATOM 0 HE ARG A 16 -1.413 -4.973 -13.527 1.00 31.22 H new ATOM 0 HH11 ARG A 16 -2.151 -6.976 -10.687 1.00 73.01 H new ATOM 0 HH12 ARG A 16 -3.074 -8.151 -11.630 1.00 73.01 H new ATOM 0 HH21 ARG A 16 -2.501 -6.537 -14.704 1.00 22.41 H new ATOM 0 HH22 ARG A 16 -3.268 -7.903 -13.888 1.00 22.41 H new ATOM 254 N ASP A 17 3.260 -3.220 -12.981 1.00 52.01 N ATOM 255 CA ASP A 17 4.164 -3.922 -13.936 1.00 0.24 C ATOM 256 C ASP A 17 5.623 -3.542 -13.666 1.00 53.51 C ATOM 257 O ASP A 17 6.531 -4.388 -13.703 1.00 53.54 O ATOM 258 CB ASP A 17 3.774 -3.564 -15.395 1.00 3.44 C ATOM 259 CG ASP A 17 4.673 -4.183 -16.474 1.00 11.14 C ATOM 260 OD1 ASP A 17 4.880 -5.411 -16.453 1.00 70.15 O ATOM 261 OD2 ASP A 17 5.145 -3.453 -17.372 1.00 2.51 O ATOM 0 H ASP A 17 2.658 -2.527 -13.425 1.00 52.01 H new ATOM 0 HA ASP A 17 4.057 -4.998 -13.797 1.00 0.24 H new ATOM 0 HB2 ASP A 17 2.747 -3.885 -15.570 1.00 3.44 H new ATOM 0 HB3 ASP A 17 3.793 -2.480 -15.505 1.00 3.44 H new ATOM 266 N GLU A 18 5.817 -2.243 -13.390 1.00 63.42 N ATOM 267 CA GLU A 18 7.104 -1.710 -12.946 1.00 71.23 C ATOM 268 C GLU A 18 7.519 -2.340 -11.601 1.00 52.14 C ATOM 269 O GLU A 18 8.689 -2.635 -11.414 1.00 74.35 O ATOM 270 CB GLU A 18 7.054 -0.167 -12.835 1.00 54.34 C ATOM 271 CG GLU A 18 5.978 0.373 -11.869 1.00 40.54 C ATOM 272 CD GLU A 18 5.957 1.901 -11.771 1.00 45.54 C ATOM 273 OE1 GLU A 18 5.455 2.553 -12.703 1.00 12.01 O ATOM 274 OE2 GLU A 18 6.466 2.459 -10.778 1.00 52.42 O ATOM 0 H GLU A 18 5.084 -1.538 -13.470 1.00 63.42 H new ATOM 0 HA GLU A 18 7.854 -1.971 -13.692 1.00 71.23 H new ATOM 0 HB2 GLU A 18 8.030 0.193 -12.509 1.00 54.34 H new ATOM 0 HB3 GLU A 18 6.876 0.250 -13.826 1.00 54.34 H new ATOM 0 HG2 GLU A 18 4.999 0.024 -12.197 1.00 40.54 H new ATOM 0 HG3 GLU A 18 6.149 -0.045 -10.877 1.00 40.54 H new ATOM 281 N LYS A 19 6.529 -2.578 -10.698 1.00 70.10 N ATOM 282 CA LYS A 19 6.771 -3.156 -9.349 1.00 73.12 C ATOM 283 C LYS A 19 7.032 -4.671 -9.420 1.00 2.23 C ATOM 284 O LYS A 19 7.732 -5.234 -8.564 1.00 61.12 O ATOM 285 CB LYS A 19 5.587 -2.856 -8.396 1.00 74.44 C ATOM 286 CG LYS A 19 5.286 -1.356 -8.231 1.00 15.12 C ATOM 287 CD LYS A 19 6.436 -0.545 -7.586 1.00 60.03 C ATOM 288 CE LYS A 19 6.205 0.969 -7.725 1.00 10.43 C ATOM 289 NZ LYS A 19 4.857 1.390 -7.249 1.00 43.44 N ATOM 0 H LYS A 19 5.547 -2.376 -10.884 1.00 70.10 H new ATOM 0 HA LYS A 19 7.667 -2.680 -8.949 1.00 73.12 H new ATOM 0 HB2 LYS A 19 4.695 -3.357 -8.772 1.00 74.44 H new ATOM 0 HB3 LYS A 19 5.804 -3.283 -7.417 1.00 74.44 H new ATOM 0 HG2 LYS A 19 5.062 -0.932 -9.210 1.00 15.12 H new ATOM 0 HG3 LYS A 19 4.390 -1.242 -7.622 1.00 15.12 H new ATOM 0 HD2 LYS A 19 6.519 -0.806 -6.531 1.00 60.03 H new ATOM 0 HD3 LYS A 19 7.381 -0.815 -8.057 1.00 60.03 H new ATOM 0 HE2 LYS A 19 6.969 1.503 -7.159 1.00 10.43 H new ATOM 0 HE3 LYS A 19 6.323 1.256 -8.770 1.00 10.43 H new ATOM 0 HZ1 LYS A 19 4.552 2.235 -7.773 1.00 43.44 H new ATOM 0 HZ2 LYS A 19 4.177 0.620 -7.408 1.00 43.44 H new ATOM 0 HZ3 LYS A 19 4.900 1.610 -6.233 1.00 43.44 H new ATOM 303 N ASP A 20 6.479 -5.303 -10.464 1.00 72.03 N ATOM 304 CA ASP A 20 6.630 -6.742 -10.733 1.00 53.53 C ATOM 305 C ASP A 20 8.101 -7.070 -11.045 1.00 72.42 C ATOM 306 O ASP A 20 8.661 -8.045 -10.536 1.00 54.14 O ATOM 307 CB ASP A 20 5.696 -7.144 -11.910 1.00 33.23 C ATOM 308 CG ASP A 20 5.891 -8.592 -12.387 1.00 32.45 C ATOM 309 OD1 ASP A 20 5.284 -9.511 -11.813 1.00 32.40 O ATOM 310 OD2 ASP A 20 6.662 -8.817 -13.339 1.00 1.24 O ATOM 0 H ASP A 20 5.905 -4.823 -11.157 1.00 72.03 H new ATOM 0 HA ASP A 20 6.343 -7.316 -9.852 1.00 53.53 H new ATOM 0 HB2 ASP A 20 4.659 -7.009 -11.602 1.00 33.23 H new ATOM 0 HB3 ASP A 20 5.870 -6.468 -12.747 1.00 33.23 H new ATOM 315 N ARG A 21 8.721 -6.216 -11.870 1.00 62.02 N ATOM 316 CA ARG A 21 10.139 -6.357 -12.240 1.00 2.40 C ATOM 317 C ARG A 21 11.043 -5.540 -11.303 1.00 35.53 C ATOM 318 O ARG A 21 12.248 -5.740 -11.297 1.00 3.52 O ATOM 319 CB ARG A 21 10.365 -5.964 -13.720 1.00 42.21 C ATOM 320 CG ARG A 21 10.014 -4.506 -14.076 1.00 61.11 C ATOM 321 CD ARG A 21 10.291 -4.186 -15.554 1.00 43.21 C ATOM 322 NE ARG A 21 9.516 -5.055 -16.460 1.00 41.51 N ATOM 323 CZ ARG A 21 8.454 -4.670 -17.183 1.00 73.35 C ATOM 324 NH1 ARG A 21 8.013 -3.416 -17.132 1.00 70.24 N ATOM 325 NH2 ARG A 21 7.830 -5.550 -17.948 1.00 41.22 N ATOM 0 H ARG A 21 8.260 -5.413 -12.298 1.00 62.02 H new ATOM 0 HA ARG A 21 10.412 -7.406 -12.127 1.00 2.40 H new ATOM 0 HB2 ARG A 21 11.411 -6.140 -13.970 1.00 42.21 H new ATOM 0 HB3 ARG A 21 9.772 -6.627 -14.349 1.00 42.21 H new ATOM 0 HG2 ARG A 21 8.962 -4.324 -13.858 1.00 61.11 H new ATOM 0 HG3 ARG A 21 10.592 -3.831 -13.445 1.00 61.11 H new ATOM 0 HD2 ARG A 21 10.044 -3.143 -15.752 1.00 43.21 H new ATOM 0 HD3 ARG A 21 11.355 -4.306 -15.758 1.00 43.21 H new ATOM 0 HE ARG A 21 9.812 -6.028 -16.543 1.00 41.51 H new ATOM 0 HH11 ARG A 21 8.484 -2.734 -16.538 1.00 70.24 H new ATOM 0 HH12 ARG A 21 7.204 -3.137 -17.687 1.00 70.24 H new ATOM 0 HH21 ARG A 21 8.157 -6.515 -17.986 1.00 41.22 H new ATOM 0 HH22 ARG A 21 7.022 -5.263 -18.500 1.00 41.22 H new ATOM 339 N PHE A 22 10.449 -4.632 -10.499 1.00 1.20 N ATOM 340 CA PHE A 22 11.177 -3.840 -9.470 1.00 11.40 C ATOM 341 C PHE A 22 11.886 -4.776 -8.484 1.00 2.33 C ATOM 342 O PHE A 22 13.011 -4.538 -8.113 1.00 40.24 O ATOM 343 CB PHE A 22 10.168 -2.925 -8.731 1.00 21.33 C ATOM 344 CG PHE A 22 10.713 -1.860 -7.785 1.00 55.22 C ATOM 345 CD1 PHE A 22 10.957 -2.150 -6.447 1.00 54.43 C ATOM 346 CD2 PHE A 22 10.914 -0.547 -8.217 1.00 25.31 C ATOM 347 CE1 PHE A 22 11.394 -1.178 -5.575 1.00 4.41 C ATOM 348 CE2 PHE A 22 11.344 0.431 -7.340 1.00 54.45 C ATOM 349 CZ PHE A 22 11.584 0.116 -6.018 1.00 44.44 C ATOM 0 H PHE A 22 9.451 -4.423 -10.541 1.00 1.20 H new ATOM 0 HA PHE A 22 11.936 -3.222 -9.950 1.00 11.40 H new ATOM 0 HB2 PHE A 22 9.563 -2.421 -9.485 1.00 21.33 H new ATOM 0 HB3 PHE A 22 9.497 -3.565 -8.159 1.00 21.33 H new ATOM 0 HD1 PHE A 22 10.801 -3.156 -6.085 1.00 54.43 H new ATOM 0 HD2 PHE A 22 10.731 -0.292 -9.250 1.00 25.31 H new ATOM 0 HE1 PHE A 22 11.589 -1.428 -4.543 1.00 4.41 H new ATOM 0 HE2 PHE A 22 11.492 1.442 -7.689 1.00 54.45 H new ATOM 0 HZ PHE A 22 11.920 0.879 -5.332 1.00 44.44 H new ATOM 359 N PHE A 23 11.205 -5.859 -8.097 1.00 54.11 N ATOM 360 CA PHE A 23 11.758 -6.871 -7.170 1.00 4.35 C ATOM 361 C PHE A 23 12.733 -7.833 -7.887 1.00 50.22 C ATOM 362 O PHE A 23 13.580 -8.454 -7.240 1.00 2.52 O ATOM 363 CB PHE A 23 10.596 -7.672 -6.507 1.00 52.41 C ATOM 364 CG PHE A 23 9.784 -6.899 -5.453 1.00 33.35 C ATOM 365 CD1 PHE A 23 9.509 -5.530 -5.589 1.00 22.41 C ATOM 366 CD2 PHE A 23 9.318 -7.545 -4.308 1.00 45.35 C ATOM 367 CE1 PHE A 23 8.801 -4.849 -4.622 1.00 1.04 C ATOM 368 CE2 PHE A 23 8.618 -6.856 -3.342 1.00 11.11 C ATOM 369 CZ PHE A 23 8.362 -5.512 -3.501 1.00 14.51 C ATOM 0 H PHE A 23 10.257 -6.065 -8.412 1.00 54.11 H new ATOM 0 HA PHE A 23 12.324 -6.347 -6.399 1.00 4.35 H new ATOM 0 HB2 PHE A 23 9.917 -8.010 -7.289 1.00 52.41 H new ATOM 0 HB3 PHE A 23 11.012 -8.564 -6.039 1.00 52.41 H new ATOM 0 HD1 PHE A 23 9.857 -5.002 -6.464 1.00 22.41 H new ATOM 0 HD2 PHE A 23 9.509 -8.600 -4.177 1.00 45.35 H new ATOM 0 HE1 PHE A 23 8.592 -3.797 -4.745 1.00 1.04 H new ATOM 0 HE2 PHE A 23 8.269 -7.370 -2.459 1.00 11.11 H new ATOM 0 HZ PHE A 23 7.813 -4.976 -2.741 1.00 14.51 H new ATOM 379 N SER A 24 12.614 -7.932 -9.220 1.00 54.21 N ATOM 380 CA SER A 24 13.335 -8.938 -10.020 1.00 63.42 C ATOM 381 C SER A 24 14.706 -8.413 -10.519 1.00 41.22 C ATOM 382 O SER A 24 15.709 -9.133 -10.453 1.00 22.44 O ATOM 383 CB SER A 24 12.443 -9.380 -11.207 1.00 14.13 C ATOM 384 OG SER A 24 12.974 -10.520 -11.862 1.00 25.43 O ATOM 0 H SER A 24 12.017 -7.319 -9.774 1.00 54.21 H new ATOM 0 HA SER A 24 13.546 -9.797 -9.383 1.00 63.42 H new ATOM 0 HB2 SER A 24 11.439 -9.602 -10.846 1.00 14.13 H new ATOM 0 HB3 SER A 24 12.351 -8.560 -11.919 1.00 14.13 H new ATOM 0 HG SER A 24 12.387 -10.774 -12.605 1.00 25.43 H new ATOM 390 N GLU A 25 14.744 -7.152 -11.002 1.00 33.43 N ATOM 391 CA GLU A 25 15.935 -6.582 -11.691 1.00 72.44 C ATOM 392 C GLU A 25 16.426 -5.274 -11.029 1.00 3.33 C ATOM 393 O GLU A 25 17.625 -5.121 -10.769 1.00 41.41 O ATOM 394 CB GLU A 25 15.618 -6.337 -13.202 1.00 44.30 C ATOM 395 CG GLU A 25 14.396 -5.424 -13.467 1.00 70.41 C ATOM 396 CD GLU A 25 14.248 -4.980 -14.925 1.00 14.31 C ATOM 397 OE1 GLU A 25 14.867 -3.970 -15.307 1.00 63.13 O ATOM 398 OE2 GLU A 25 13.500 -5.619 -15.683 1.00 13.54 O ATOM 0 H GLU A 25 13.961 -6.502 -10.929 1.00 33.43 H new ATOM 0 HA GLU A 25 16.740 -7.311 -11.602 1.00 72.44 H new ATOM 0 HB2 GLU A 25 16.494 -5.895 -13.676 1.00 44.30 H new ATOM 0 HB3 GLU A 25 15.447 -7.300 -13.684 1.00 44.30 H new ATOM 0 HG2 GLU A 25 13.491 -5.951 -13.166 1.00 70.41 H new ATOM 0 HG3 GLU A 25 14.474 -4.539 -12.836 1.00 70.41 H new ATOM 405 N HIS A 26 15.487 -4.348 -10.747 1.00 60.22 N ATOM 406 CA HIS A 26 15.809 -2.975 -10.294 1.00 0.25 C ATOM 407 C HIS A 26 16.374 -2.991 -8.872 1.00 12.24 C ATOM 408 O HIS A 26 17.431 -2.425 -8.575 1.00 34.04 O ATOM 409 CB HIS A 26 14.535 -2.085 -10.347 1.00 41.32 C ATOM 410 CG HIS A 26 14.733 -0.704 -9.764 1.00 1.22 C ATOM 411 ND1 HIS A 26 14.437 -0.440 -8.447 1.00 54.31 N ATOM 412 CD2 HIS A 26 15.216 0.429 -10.338 1.00 73.11 C ATOM 413 CE1 HIS A 26 14.748 0.822 -8.246 1.00 24.21 C ATOM 414 NE2 HIS A 26 15.222 1.393 -9.361 1.00 51.41 N ATOM 0 H HIS A 26 14.486 -4.528 -10.826 1.00 60.22 H new ATOM 0 HA HIS A 26 16.565 -2.562 -10.962 1.00 0.25 H new ATOM 0 HB2 HIS A 26 14.213 -1.989 -11.384 1.00 41.32 H new ATOM 0 HB3 HIS A 26 13.730 -2.585 -9.808 1.00 41.32 H new ATOM 0 HD2 HIS A 26 15.533 0.548 -11.363 1.00 73.11 H new ATOM 0 HE1 HIS A 26 14.635 1.333 -7.301 1.00 24.21 H new ATOM 0 HE2 HIS A 26 15.529 2.360 -9.464 1.00 51.41 H new ATOM 422 N ARG A 27 15.623 -3.654 -8.026 1.00 44.21 N ATOM 423 CA ARG A 27 15.868 -3.783 -6.598 1.00 33.04 C ATOM 424 C ARG A 27 16.061 -5.259 -6.280 1.00 40.23 C ATOM 425 O ARG A 27 15.542 -6.133 -6.990 1.00 70.25 O ATOM 426 CB ARG A 27 14.669 -3.192 -5.770 1.00 31.24 C ATOM 427 CG ARG A 27 14.945 -1.838 -5.088 1.00 74.41 C ATOM 428 CD ARG A 27 16.130 -1.924 -4.120 1.00 14.41 C ATOM 429 NE ARG A 27 16.055 -3.118 -3.245 1.00 45.20 N ATOM 430 CZ ARG A 27 16.901 -3.401 -2.251 1.00 53.03 C ATOM 431 NH1 ARG A 27 17.895 -2.574 -1.945 1.00 0.34 N ATOM 432 NH2 ARG A 27 16.768 -4.535 -1.588 1.00 65.15 N ATOM 0 H ARG A 27 14.780 -4.145 -8.324 1.00 44.21 H new ATOM 0 HA ARG A 27 16.761 -3.222 -6.324 1.00 33.04 H new ATOM 0 HB2 ARG A 27 13.812 -3.078 -6.434 1.00 31.24 H new ATOM 0 HB3 ARG A 27 14.386 -3.915 -5.005 1.00 31.24 H new ATOM 0 HG2 ARG A 27 15.149 -1.083 -5.847 1.00 74.41 H new ATOM 0 HG3 ARG A 27 14.056 -1.515 -4.547 1.00 74.41 H new ATOM 0 HD2 ARG A 27 17.060 -1.951 -4.688 1.00 14.41 H new ATOM 0 HD3 ARG A 27 16.159 -1.026 -3.504 1.00 14.41 H new ATOM 0 HE ARG A 27 15.296 -3.777 -3.416 1.00 45.20 H new ATOM 0 HH11 ARG A 27 18.020 -1.710 -2.472 1.00 0.34 H new ATOM 0 HH12 ARG A 27 18.533 -2.804 -1.183 1.00 0.34 H new ATOM 0 HH21 ARG A 27 16.024 -5.187 -1.836 1.00 65.15 H new ATOM 0 HH22 ARG A 27 17.410 -4.759 -0.827 1.00 65.15 H new ATOM 446 N GLN A 28 16.826 -5.522 -5.226 1.00 42.13 N ATOM 447 CA GLN A 28 16.975 -6.864 -4.681 1.00 12.31 C ATOM 448 C GLN A 28 15.682 -7.248 -3.935 1.00 24.23 C ATOM 449 O GLN A 28 15.212 -6.486 -3.073 1.00 1.22 O ATOM 450 CB GLN A 28 18.221 -6.920 -3.766 1.00 65.43 C ATOM 451 CG GLN A 28 19.539 -6.553 -4.478 1.00 10.13 C ATOM 452 CD GLN A 28 19.867 -7.470 -5.666 1.00 40.42 C ATOM 453 OE1 GLN A 28 20.518 -8.505 -5.513 1.00 73.13 O ATOM 454 NE2 GLN A 28 19.425 -7.098 -6.855 1.00 42.43 N ATOM 0 H GLN A 28 17.359 -4.810 -4.727 1.00 42.13 H new ATOM 0 HA GLN A 28 17.130 -7.589 -5.480 1.00 12.31 H new ATOM 0 HB2 GLN A 28 18.073 -6.242 -2.926 1.00 65.43 H new ATOM 0 HB3 GLN A 28 18.311 -7.925 -3.353 1.00 65.43 H new ATOM 0 HG2 GLN A 28 19.479 -5.523 -4.830 1.00 10.13 H new ATOM 0 HG3 GLN A 28 20.356 -6.597 -3.758 1.00 10.13 H new ATOM 0 HE21 GLN A 28 18.888 -6.236 -6.953 1.00 42.43 H new ATOM 0 HE22 GLN A 28 19.621 -7.673 -7.675 1.00 42.43 H new ATOM 463 N SER A 29 15.088 -8.379 -4.354 1.00 4.00 N ATOM 464 CA SER A 29 13.832 -8.914 -3.810 1.00 24.45 C ATOM 465 C SER A 29 13.869 -9.080 -2.267 1.00 14.35 C ATOM 466 O SER A 29 14.814 -9.659 -1.738 1.00 15.22 O ATOM 467 CB SER A 29 13.525 -10.277 -4.473 1.00 61.32 C ATOM 468 OG SER A 29 14.579 -11.199 -4.259 1.00 41.30 O ATOM 0 H SER A 29 15.478 -8.958 -5.097 1.00 4.00 H new ATOM 0 HA SER A 29 13.046 -8.193 -4.035 1.00 24.45 H new ATOM 0 HB2 SER A 29 12.597 -10.681 -4.068 1.00 61.32 H new ATOM 0 HB3 SER A 29 13.372 -10.138 -5.543 1.00 61.32 H new ATOM 0 HG SER A 29 14.971 -11.048 -3.374 1.00 41.30 H new ATOM 474 N PRO A 30 12.858 -8.520 -1.531 1.00 63.35 N ATOM 475 CA PRO A 30 12.613 -8.848 -0.103 1.00 21.31 C ATOM 476 C PRO A 30 12.256 -10.329 0.118 1.00 33.24 C ATOM 477 O PRO A 30 12.431 -10.857 1.213 1.00 63.12 O ATOM 478 CB PRO A 30 11.417 -7.941 0.280 1.00 44.12 C ATOM 479 CG PRO A 30 11.407 -6.848 -0.745 1.00 14.01 C ATOM 480 CD PRO A 30 11.925 -7.478 -2.011 1.00 35.51 C ATOM 0 HA PRO A 30 13.504 -8.683 0.503 1.00 21.31 H new ATOM 0 HB2 PRO A 30 10.481 -8.499 0.269 1.00 44.12 H new ATOM 0 HB3 PRO A 30 11.536 -7.537 1.285 1.00 44.12 H new ATOM 0 HG2 PRO A 30 10.401 -6.452 -0.887 1.00 14.01 H new ATOM 0 HG3 PRO A 30 12.037 -6.014 -0.435 1.00 14.01 H new ATOM 0 HD2 PRO A 30 11.117 -7.907 -2.604 1.00 35.51 H new ATOM 0 HD3 PRO A 30 12.431 -6.748 -2.643 1.00 35.51 H new ATOM 488 N ILE A 31 11.701 -10.981 -0.922 1.00 45.32 N ATOM 489 CA ILE A 31 11.407 -12.421 -0.879 1.00 34.12 C ATOM 490 C ILE A 31 12.754 -13.178 -0.770 1.00 23.22 C ATOM 491 O ILE A 31 13.535 -13.161 -1.732 1.00 13.13 O ATOM 492 CB ILE A 31 10.590 -12.900 -2.144 1.00 5.30 C ATOM 493 CG1 ILE A 31 9.375 -11.947 -2.423 1.00 22.25 C ATOM 494 CG2 ILE A 31 10.119 -14.371 -1.981 1.00 43.15 C ATOM 495 CD1 ILE A 31 8.409 -11.747 -1.257 1.00 75.25 C ATOM 0 H ILE A 31 11.448 -10.530 -1.801 1.00 45.32 H new ATOM 0 HA ILE A 31 10.778 -12.634 -0.015 1.00 34.12 H new ATOM 0 HB ILE A 31 11.255 -12.857 -3.007 1.00 5.30 H new ATOM 0 HG12 ILE A 31 9.762 -10.973 -2.721 1.00 22.25 H new ATOM 0 HG13 ILE A 31 8.815 -12.341 -3.271 1.00 22.25 H new ATOM 0 HG21 ILE A 31 9.559 -14.674 -2.866 1.00 43.15 H new ATOM 0 HG22 ILE A 31 10.987 -15.020 -1.861 1.00 43.15 H new ATOM 0 HG23 ILE A 31 9.480 -14.453 -1.102 1.00 43.15 H new ATOM 0 HD11 ILE A 31 7.609 -11.072 -1.559 1.00 75.25 H new ATOM 0 HD12 ILE A 31 7.983 -12.708 -0.968 1.00 75.25 H new ATOM 0 HD13 ILE A 31 8.945 -11.318 -0.410 1.00 75.25 H new ATOM 507 N PRO A 32 13.061 -13.811 0.419 1.00 14.02 N ATOM 508 CA PRO A 32 14.425 -14.293 0.746 1.00 33.30 C ATOM 509 C PRO A 32 14.941 -15.348 -0.252 1.00 71.23 C ATOM 510 O PRO A 32 14.133 -16.077 -0.825 1.00 65.14 O ATOM 511 CB PRO A 32 14.293 -14.858 2.184 1.00 51.34 C ATOM 512 CG PRO A 32 12.836 -15.123 2.376 1.00 42.03 C ATOM 513 CD PRO A 32 12.106 -14.114 1.518 1.00 40.15 C ATOM 0 HA PRO A 32 15.164 -13.494 0.681 1.00 33.30 H new ATOM 0 HB2 PRO A 32 14.877 -15.771 2.302 1.00 51.34 H new ATOM 0 HB3 PRO A 32 14.663 -14.145 2.921 1.00 51.34 H new ATOM 0 HG2 PRO A 32 12.583 -16.141 2.080 1.00 42.03 H new ATOM 0 HG3 PRO A 32 12.556 -15.017 3.424 1.00 42.03 H new ATOM 0 HD2 PRO A 32 11.171 -14.521 1.132 1.00 40.15 H new ATOM 0 HD3 PRO A 32 11.854 -13.218 2.085 1.00 40.15 H new ATOM 521 N PRO A 33 16.298 -15.429 -0.476 1.00 53.12 N ATOM 522 CA PRO A 33 16.912 -16.332 -1.487 1.00 52.04 C ATOM 523 C PRO A 33 16.456 -17.801 -1.345 1.00 50.22 C ATOM 524 O PRO A 33 16.284 -18.503 -2.346 1.00 4.03 O ATOM 525 CB PRO A 33 18.445 -16.160 -1.268 1.00 42.32 C ATOM 526 CG PRO A 33 18.594 -15.448 0.049 1.00 54.13 C ATOM 527 CD PRO A 33 17.341 -14.626 0.224 1.00 2.44 C ATOM 0 HA PRO A 33 16.605 -16.072 -2.500 1.00 52.04 H new ATOM 0 HB2 PRO A 33 18.948 -17.127 -1.249 1.00 42.32 H new ATOM 0 HB3 PRO A 33 18.893 -15.583 -2.077 1.00 42.32 H new ATOM 0 HG2 PRO A 33 18.710 -16.160 0.866 1.00 54.13 H new ATOM 0 HG3 PRO A 33 19.480 -14.813 0.051 1.00 54.13 H new ATOM 0 HD2 PRO A 33 17.098 -14.483 1.277 1.00 2.44 H new ATOM 0 HD3 PRO A 33 17.447 -13.634 -0.216 1.00 2.44 H new ATOM 535 N GLU A 34 16.223 -18.225 -0.092 1.00 24.15 N ATOM 536 CA GLU A 34 15.699 -19.564 0.233 1.00 40.22 C ATOM 537 C GLU A 34 14.253 -19.763 -0.296 1.00 4.04 C ATOM 538 O GLU A 34 13.930 -20.819 -0.847 1.00 72.45 O ATOM 539 CB GLU A 34 15.770 -19.791 1.771 1.00 74.31 C ATOM 540 CG GLU A 34 14.985 -18.756 2.616 1.00 72.14 C ATOM 541 CD GLU A 34 15.270 -18.848 4.124 1.00 41.51 C ATOM 542 OE1 GLU A 34 14.876 -19.850 4.751 1.00 45.45 O ATOM 543 OE2 GLU A 34 15.887 -17.917 4.685 1.00 53.23 O ATOM 0 H GLU A 34 16.394 -17.645 0.730 1.00 24.15 H new ATOM 0 HA GLU A 34 16.320 -20.307 -0.267 1.00 40.22 H new ATOM 0 HB2 GLU A 34 15.388 -20.787 1.995 1.00 74.31 H new ATOM 0 HB3 GLU A 34 16.815 -19.773 2.079 1.00 74.31 H new ATOM 0 HG2 GLU A 34 15.233 -17.753 2.269 1.00 72.14 H new ATOM 0 HG3 GLU A 34 13.917 -18.897 2.447 1.00 72.14 H new ATOM 550 N GLU A 35 13.393 -18.737 -0.147 1.00 1.12 N ATOM 551 CA GLU A 35 11.976 -18.820 -0.544 1.00 31.42 C ATOM 552 C GLU A 35 11.777 -18.590 -2.049 1.00 51.52 C ATOM 553 O GLU A 35 11.065 -19.360 -2.674 1.00 52.41 O ATOM 554 CB GLU A 35 11.117 -17.825 0.277 1.00 32.23 C ATOM 555 CG GLU A 35 11.028 -18.155 1.784 1.00 21.01 C ATOM 556 CD GLU A 35 10.223 -19.432 2.093 1.00 62.10 C ATOM 557 OE1 GLU A 35 10.795 -20.542 2.041 1.00 13.23 O ATOM 558 OE2 GLU A 35 9.015 -19.327 2.396 1.00 34.32 O ATOM 0 H GLU A 35 13.659 -17.835 0.249 1.00 1.12 H new ATOM 0 HA GLU A 35 11.644 -19.835 -0.327 1.00 31.42 H new ATOM 0 HB2 GLU A 35 11.531 -16.823 0.160 1.00 32.23 H new ATOM 0 HB3 GLU A 35 10.110 -17.804 -0.139 1.00 32.23 H new ATOM 0 HG2 GLU A 35 12.036 -18.267 2.182 1.00 21.01 H new ATOM 0 HG3 GLU A 35 10.571 -17.313 2.305 1.00 21.01 H new ATOM 565 N ARG A 36 12.456 -17.582 -2.647 1.00 61.41 N ATOM 566 CA ARG A 36 12.179 -17.120 -4.043 1.00 11.32 C ATOM 567 C ARG A 36 12.561 -18.179 -5.107 1.00 24.53 C ATOM 568 O ARG A 36 12.284 -18.002 -6.295 1.00 44.25 O ATOM 569 CB ARG A 36 12.936 -15.790 -4.319 1.00 73.44 C ATOM 570 CG ARG A 36 14.473 -15.917 -4.283 1.00 13.25 C ATOM 571 CD ARG A 36 15.203 -14.561 -4.351 1.00 21.43 C ATOM 572 NE ARG A 36 15.048 -13.860 -5.646 1.00 31.23 N ATOM 573 CZ ARG A 36 15.983 -13.063 -6.204 1.00 23.54 C ATOM 574 NH1 ARG A 36 17.159 -12.874 -5.608 1.00 65.54 N ATOM 575 NH2 ARG A 36 15.715 -12.420 -7.335 1.00 5.11 N ATOM 0 H ARG A 36 13.206 -17.066 -2.187 1.00 61.41 H new ATOM 0 HA ARG A 36 11.104 -16.960 -4.123 1.00 11.32 H new ATOM 0 HB2 ARG A 36 12.637 -15.411 -5.296 1.00 73.44 H new ATOM 0 HB3 ARG A 36 12.627 -15.049 -3.582 1.00 73.44 H new ATOM 0 HG2 ARG A 36 14.766 -16.433 -3.369 1.00 13.25 H new ATOM 0 HG3 ARG A 36 14.798 -16.538 -5.118 1.00 13.25 H new ATOM 0 HD2 ARG A 36 14.829 -13.918 -3.554 1.00 21.43 H new ATOM 0 HD3 ARG A 36 16.264 -14.721 -4.160 1.00 21.43 H new ATOM 0 HE ARG A 36 14.172 -13.989 -6.152 1.00 31.23 H new ATOM 0 HH11 ARG A 36 17.361 -13.334 -4.720 1.00 65.54 H new ATOM 0 HH12 ARG A 36 17.858 -12.269 -6.039 1.00 65.54 H new ATOM 0 HH21 ARG A 36 14.804 -12.529 -7.780 1.00 5.11 H new ATOM 0 HH22 ARG A 36 16.420 -11.817 -7.758 1.00 5.11 H new ATOM 589 N ASP A 37 13.232 -19.245 -4.657 1.00 22.14 N ATOM 590 CA ASP A 37 13.505 -20.446 -5.457 1.00 70.44 C ATOM 591 C ASP A 37 12.186 -21.175 -5.808 1.00 35.34 C ATOM 592 O ASP A 37 11.924 -21.499 -6.972 1.00 2.22 O ATOM 593 CB ASP A 37 14.452 -21.363 -4.640 1.00 44.33 C ATOM 594 CG ASP A 37 14.767 -22.704 -5.324 1.00 14.34 C ATOM 595 OD1 ASP A 37 15.663 -22.748 -6.188 1.00 2.33 O ATOM 596 OD2 ASP A 37 14.116 -23.721 -5.001 1.00 2.31 O ATOM 0 H ASP A 37 13.607 -19.299 -3.710 1.00 22.14 H new ATOM 0 HA ASP A 37 13.982 -20.173 -6.399 1.00 70.44 H new ATOM 0 HB2 ASP A 37 15.386 -20.832 -4.456 1.00 44.33 H new ATOM 0 HB3 ASP A 37 14.001 -21.560 -3.667 1.00 44.33 H new ATOM 601 N ASP A 38 11.369 -21.421 -4.767 1.00 1.11 N ATOM 602 CA ASP A 38 10.064 -22.110 -4.879 1.00 21.35 C ATOM 603 C ASP A 38 8.925 -21.111 -5.166 1.00 0.55 C ATOM 604 O ASP A 38 7.977 -21.410 -5.902 1.00 71.51 O ATOM 605 CB ASP A 38 9.795 -22.867 -3.549 1.00 53.53 C ATOM 606 CG ASP A 38 8.472 -23.654 -3.541 1.00 31.41 C ATOM 607 OD1 ASP A 38 8.465 -24.834 -3.955 1.00 11.53 O ATOM 608 OD2 ASP A 38 7.433 -23.102 -3.119 1.00 23.04 O ATOM 0 H ASP A 38 11.597 -21.145 -3.812 1.00 1.11 H new ATOM 0 HA ASP A 38 10.098 -22.811 -5.713 1.00 21.35 H new ATOM 0 HB2 ASP A 38 10.618 -23.556 -3.361 1.00 53.53 H new ATOM 0 HB3 ASP A 38 9.786 -22.150 -2.728 1.00 53.53 H new ATOM 613 N PHE A 39 9.059 -19.921 -4.582 1.00 4.25 N ATOM 614 CA PHE A 39 8.048 -18.856 -4.609 1.00 63.25 C ATOM 615 C PHE A 39 8.345 -17.875 -5.749 1.00 71.13 C ATOM 616 O PHE A 39 9.474 -17.786 -6.238 1.00 53.31 O ATOM 617 CB PHE A 39 7.995 -18.119 -3.235 1.00 34.15 C ATOM 618 CG PHE A 39 7.421 -18.973 -2.093 1.00 4.35 C ATOM 619 CD1 PHE A 39 8.203 -19.923 -1.431 1.00 41.04 C ATOM 620 CD2 PHE A 39 6.092 -18.823 -1.681 1.00 0.41 C ATOM 621 CE1 PHE A 39 7.680 -20.690 -0.407 1.00 42.14 C ATOM 622 CE2 PHE A 39 5.573 -19.592 -0.656 1.00 4.43 C ATOM 623 CZ PHE A 39 6.369 -20.521 -0.019 1.00 13.23 C ATOM 0 H PHE A 39 9.896 -19.660 -4.061 1.00 4.25 H new ATOM 0 HA PHE A 39 7.070 -19.303 -4.788 1.00 63.25 H new ATOM 0 HB2 PHE A 39 9.002 -17.799 -2.966 1.00 34.15 H new ATOM 0 HB3 PHE A 39 7.392 -17.217 -3.340 1.00 34.15 H new ATOM 0 HD1 PHE A 39 9.233 -20.060 -1.724 1.00 41.04 H new ATOM 0 HD2 PHE A 39 5.462 -18.095 -2.171 1.00 0.41 H new ATOM 0 HE1 PHE A 39 8.300 -21.422 0.089 1.00 42.14 H new ATOM 0 HE2 PHE A 39 4.544 -19.465 -0.354 1.00 4.43 H new ATOM 0 HZ PHE A 39 5.964 -21.117 0.785 1.00 13.23 H new ATOM 633 N ASP A 40 7.309 -17.148 -6.152 1.00 20.25 N ATOM 634 CA ASP A 40 7.338 -16.168 -7.255 1.00 24.04 C ATOM 635 C ASP A 40 7.438 -14.754 -6.669 1.00 23.25 C ATOM 636 O ASP A 40 7.467 -14.599 -5.440 1.00 71.21 O ATOM 637 CB ASP A 40 6.086 -16.314 -8.165 1.00 2.54 C ATOM 638 CG ASP A 40 6.142 -17.575 -9.045 1.00 30.33 C ATOM 639 OD1 ASP A 40 5.765 -18.667 -8.576 1.00 31.15 O ATOM 640 OD2 ASP A 40 6.577 -17.478 -10.211 1.00 14.30 O ATOM 0 H ASP A 40 6.392 -17.220 -5.712 1.00 20.25 H new ATOM 0 HA ASP A 40 8.211 -16.356 -7.880 1.00 24.04 H new ATOM 0 HB2 ASP A 40 5.191 -16.348 -7.544 1.00 2.54 H new ATOM 0 HB3 ASP A 40 5.999 -15.434 -8.802 1.00 2.54 H new ATOM 645 N GLY A 41 7.632 -13.765 -7.571 1.00 11.44 N ATOM 646 CA GLY A 41 7.550 -12.311 -7.281 1.00 22.12 C ATOM 647 C GLY A 41 6.327 -11.861 -6.451 1.00 62.02 C ATOM 648 O GLY A 41 5.861 -12.575 -5.558 1.00 4.22 O ATOM 0 H GLY A 41 7.856 -13.959 -8.547 1.00 11.44 H new ATOM 0 HA2 GLY A 41 8.455 -12.013 -6.751 1.00 22.12 H new ATOM 0 HA3 GLY A 41 7.542 -11.770 -8.227 1.00 22.12 H new ATOM 652 N LEU A 42 5.841 -10.628 -6.707 1.00 53.45 N ATOM 653 CA LEU A 42 4.750 -10.013 -5.926 1.00 41.25 C ATOM 654 C LEU A 42 3.480 -10.879 -5.993 1.00 64.34 C ATOM 655 O LEU A 42 2.736 -10.828 -6.970 1.00 61.05 O ATOM 656 CB LEU A 42 4.461 -8.556 -6.413 1.00 43.00 C ATOM 657 CG LEU A 42 5.419 -7.465 -5.848 1.00 41.51 C ATOM 658 CD1 LEU A 42 5.150 -6.085 -6.480 1.00 45.40 C ATOM 659 CD2 LEU A 42 5.311 -7.409 -4.310 1.00 72.35 C ATOM 0 H LEU A 42 6.193 -10.034 -7.458 1.00 53.45 H new ATOM 0 HA LEU A 42 5.069 -9.957 -4.885 1.00 41.25 H new ATOM 0 HB2 LEU A 42 4.516 -8.536 -7.501 1.00 43.00 H new ATOM 0 HB3 LEU A 42 3.438 -8.295 -6.141 1.00 43.00 H new ATOM 0 HG LEU A 42 6.440 -7.740 -6.114 1.00 41.51 H new ATOM 0 HD11 LEU A 42 5.838 -5.352 -6.060 1.00 45.40 H new ATOM 0 HD12 LEU A 42 5.297 -6.144 -7.558 1.00 45.40 H new ATOM 0 HD13 LEU A 42 4.124 -5.782 -6.269 1.00 45.40 H new ATOM 0 HD21 LEU A 42 5.985 -6.643 -3.926 1.00 72.35 H new ATOM 0 HD22 LEU A 42 4.287 -7.167 -4.026 1.00 72.35 H new ATOM 0 HD23 LEU A 42 5.585 -8.377 -3.891 1.00 72.35 H new ATOM 671 N SER A 43 3.310 -11.737 -4.978 1.00 4.24 N ATOM 672 CA SER A 43 2.123 -12.579 -4.814 1.00 1.53 C ATOM 673 C SER A 43 1.108 -11.837 -3.932 1.00 23.42 C ATOM 674 O SER A 43 1.436 -11.443 -2.801 1.00 31.31 O ATOM 675 CB SER A 43 2.534 -13.936 -4.197 1.00 30.33 C ATOM 676 OG SER A 43 3.523 -14.576 -4.999 1.00 3.34 O ATOM 0 H SER A 43 4.003 -11.865 -4.240 1.00 4.24 H new ATOM 0 HA SER A 43 1.658 -12.781 -5.779 1.00 1.53 H new ATOM 0 HB2 SER A 43 2.920 -13.781 -3.190 1.00 30.33 H new ATOM 0 HB3 SER A 43 1.659 -14.580 -4.107 1.00 30.33 H new ATOM 0 HG SER A 43 4.323 -14.012 -5.044 1.00 3.34 H new ATOM 682 N TYR A 44 -0.108 -11.636 -4.464 1.00 65.14 N ATOM 683 CA TYR A 44 -1.137 -10.812 -3.815 1.00 64.15 C ATOM 684 C TYR A 44 -2.555 -11.248 -4.220 1.00 71.42 C ATOM 685 O TYR A 44 -2.739 -12.287 -4.866 1.00 52.54 O ATOM 686 CB TYR A 44 -0.874 -9.297 -4.106 1.00 1.35 C ATOM 687 CG TYR A 44 -0.800 -8.868 -5.590 1.00 13.21 C ATOM 688 CD1 TYR A 44 -1.947 -8.506 -6.303 1.00 45.40 C ATOM 689 CD2 TYR A 44 0.422 -8.786 -6.264 1.00 51.30 C ATOM 690 CE1 TYR A 44 -1.883 -8.098 -7.619 1.00 44.43 C ATOM 691 CE2 TYR A 44 0.487 -8.379 -7.586 1.00 10.15 C ATOM 692 CZ TYR A 44 -0.668 -8.033 -8.253 1.00 65.41 C ATOM 693 OH TYR A 44 -0.609 -7.619 -9.565 1.00 65.01 O ATOM 0 H TYR A 44 -0.404 -12.039 -5.353 1.00 65.14 H new ATOM 0 HA TYR A 44 -1.072 -10.962 -2.737 1.00 64.15 H new ATOM 0 HB2 TYR A 44 -1.663 -8.718 -3.625 1.00 1.35 H new ATOM 0 HB3 TYR A 44 0.064 -9.018 -3.626 1.00 1.35 H new ATOM 0 HD1 TYR A 44 -2.907 -8.547 -5.811 1.00 45.40 H new ATOM 0 HD2 TYR A 44 1.332 -9.045 -5.744 1.00 51.30 H new ATOM 0 HE1 TYR A 44 -2.786 -7.831 -8.148 1.00 44.43 H new ATOM 0 HE2 TYR A 44 1.440 -8.333 -8.093 1.00 10.15 H new ATOM 0 HH TYR A 44 0.323 -7.626 -9.869 1.00 65.01 H new ATOM 703 N PHE A 45 -3.544 -10.430 -3.825 1.00 31.11 N ATOM 704 CA PHE A 45 -4.963 -10.700 -4.072 1.00 73.44 C ATOM 705 C PHE A 45 -5.314 -10.182 -5.476 1.00 12.11 C ATOM 706 O PHE A 45 -4.939 -9.064 -5.828 1.00 5.31 O ATOM 707 CB PHE A 45 -5.838 -10.025 -2.987 1.00 45.34 C ATOM 708 CG PHE A 45 -5.475 -10.401 -1.547 1.00 53.01 C ATOM 709 CD1 PHE A 45 -5.878 -11.622 -1.000 1.00 44.52 C ATOM 710 CD2 PHE A 45 -4.731 -9.531 -0.741 1.00 74.34 C ATOM 711 CE1 PHE A 45 -5.550 -11.961 0.300 1.00 51.20 C ATOM 712 CE2 PHE A 45 -4.405 -9.871 0.559 1.00 12.03 C ATOM 713 CZ PHE A 45 -4.814 -11.086 1.079 1.00 24.35 C ATOM 0 H PHE A 45 -3.377 -9.558 -3.322 1.00 31.11 H new ATOM 0 HA PHE A 45 -5.159 -11.771 -4.022 1.00 73.44 H new ATOM 0 HB2 PHE A 45 -5.759 -8.943 -3.097 1.00 45.34 H new ATOM 0 HB3 PHE A 45 -6.881 -10.288 -3.165 1.00 45.34 H new ATOM 0 HD1 PHE A 45 -6.454 -12.311 -1.601 1.00 44.52 H new ATOM 0 HD2 PHE A 45 -4.407 -8.581 -1.140 1.00 74.34 H new ATOM 0 HE1 PHE A 45 -5.869 -12.909 0.707 1.00 51.20 H new ATOM 0 HE2 PHE A 45 -3.831 -9.188 1.168 1.00 12.03 H new ATOM 0 HZ PHE A 45 -4.558 -11.352 2.094 1.00 24.35 H new ATOM 723 N ASP A 46 -6.047 -10.979 -6.271 1.00 23.20 N ATOM 724 CA ASP A 46 -6.266 -10.668 -7.706 1.00 21.54 C ATOM 725 C ASP A 46 -7.267 -9.491 -7.838 1.00 1.13 C ATOM 726 O ASP A 46 -8.406 -9.636 -7.395 1.00 4.41 O ATOM 727 CB ASP A 46 -6.769 -11.917 -8.471 1.00 55.13 C ATOM 728 CG ASP A 46 -6.875 -11.700 -9.993 1.00 20.30 C ATOM 729 OD1 ASP A 46 -5.833 -11.669 -10.667 1.00 34.25 O ATOM 730 OD2 ASP A 46 -7.993 -11.559 -10.525 1.00 54.12 O ATOM 0 H ASP A 46 -6.497 -11.838 -5.954 1.00 23.20 H new ATOM 0 HA ASP A 46 -5.317 -10.372 -8.153 1.00 21.54 H new ATOM 0 HB2 ASP A 46 -6.093 -12.750 -8.276 1.00 55.13 H new ATOM 0 HB3 ASP A 46 -7.747 -12.202 -8.083 1.00 55.13 H new ATOM 735 N PRO A 47 -6.834 -8.317 -8.434 1.00 52.11 N ATOM 736 CA PRO A 47 -7.621 -7.042 -8.483 1.00 13.35 C ATOM 737 C PRO A 47 -9.130 -7.212 -8.799 1.00 53.22 C ATOM 738 O PRO A 47 -9.495 -7.640 -9.899 1.00 42.22 O ATOM 739 CB PRO A 47 -6.908 -6.240 -9.603 1.00 10.30 C ATOM 740 CG PRO A 47 -5.477 -6.693 -9.550 1.00 52.51 C ATOM 741 CD PRO A 47 -5.509 -8.146 -9.108 1.00 20.25 C ATOM 0 HA PRO A 47 -7.634 -6.558 -7.507 1.00 13.35 H new ATOM 0 HB2 PRO A 47 -7.351 -6.443 -10.578 1.00 10.30 H new ATOM 0 HB3 PRO A 47 -6.989 -5.166 -9.433 1.00 10.30 H new ATOM 0 HG2 PRO A 47 -5.001 -6.593 -10.525 1.00 52.51 H new ATOM 0 HG3 PRO A 47 -4.902 -6.086 -8.851 1.00 52.51 H new ATOM 0 HD2 PRO A 47 -5.409 -8.820 -9.959 1.00 20.25 H new ATOM 0 HD3 PRO A 47 -4.688 -8.369 -8.427 1.00 20.25 H new ATOM 749 N ASP A 48 -9.981 -6.885 -7.806 1.00 34.03 N ATOM 750 CA ASP A 48 -11.457 -6.928 -7.929 1.00 10.43 C ATOM 751 C ASP A 48 -11.991 -5.493 -8.030 1.00 32.21 C ATOM 752 O ASP A 48 -11.788 -4.710 -7.096 1.00 44.44 O ATOM 753 CB ASP A 48 -12.146 -7.614 -6.712 1.00 61.05 C ATOM 754 CG ASP A 48 -11.932 -9.129 -6.639 1.00 53.01 C ATOM 755 OD1 ASP A 48 -12.601 -9.866 -7.379 1.00 54.14 O ATOM 756 OD2 ASP A 48 -11.115 -9.596 -5.828 1.00 40.32 O ATOM 0 H ASP A 48 -9.663 -6.580 -6.886 1.00 34.03 H new ATOM 0 HA ASP A 48 -11.687 -7.512 -8.820 1.00 10.43 H new ATOM 0 HB2 ASP A 48 -11.771 -7.161 -5.794 1.00 61.05 H new ATOM 0 HB3 ASP A 48 -13.216 -7.411 -6.753 1.00 61.05 H new ATOM 761 N PRO A 49 -12.732 -5.136 -9.124 1.00 10.31 N ATOM 762 CA PRO A 49 -13.355 -3.790 -9.271 1.00 54.35 C ATOM 763 C PRO A 49 -14.528 -3.563 -8.283 1.00 55.13 C ATOM 764 O PRO A 49 -14.964 -2.427 -8.082 1.00 3.54 O ATOM 765 CB PRO A 49 -13.849 -3.802 -10.739 1.00 41.22 C ATOM 766 CG PRO A 49 -14.124 -5.248 -11.021 1.00 40.45 C ATOM 767 CD PRO A 49 -13.021 -6.000 -10.310 1.00 15.21 C ATOM 0 HA PRO A 49 -12.659 -2.981 -9.047 1.00 54.35 H new ATOM 0 HB2 PRO A 49 -14.745 -3.194 -10.863 1.00 41.22 H new ATOM 0 HB3 PRO A 49 -13.095 -3.400 -11.416 1.00 41.22 H new ATOM 0 HG2 PRO A 49 -15.106 -5.543 -10.650 1.00 40.45 H new ATOM 0 HG3 PRO A 49 -14.113 -5.451 -12.092 1.00 40.45 H new ATOM 0 HD2 PRO A 49 -13.341 -6.999 -10.013 1.00 15.21 H new ATOM 0 HD3 PRO A 49 -12.143 -6.122 -10.944 1.00 15.21 H new ATOM 775 N ASP A 50 -15.047 -4.662 -7.713 1.00 35.10 N ATOM 776 CA ASP A 50 -16.132 -4.640 -6.705 1.00 23.24 C ATOM 777 C ASP A 50 -15.580 -4.546 -5.273 1.00 23.30 C ATOM 778 O ASP A 50 -16.320 -4.202 -4.348 1.00 34.42 O ATOM 779 CB ASP A 50 -17.014 -5.905 -6.862 1.00 62.02 C ATOM 780 CG ASP A 50 -16.219 -7.214 -6.695 1.00 73.15 C ATOM 781 OD1 ASP A 50 -15.597 -7.668 -7.683 1.00 41.33 O ATOM 782 OD2 ASP A 50 -16.203 -7.789 -5.583 1.00 42.41 O ATOM 0 H ASP A 50 -14.725 -5.603 -7.938 1.00 35.10 H new ATOM 0 HA ASP A 50 -16.736 -3.750 -6.878 1.00 23.24 H new ATOM 0 HB2 ASP A 50 -17.816 -5.876 -6.125 1.00 62.02 H new ATOM 0 HB3 ASP A 50 -17.484 -5.894 -7.845 1.00 62.02 H new ATOM 787 N TYR A 51 -14.287 -4.872 -5.090 1.00 3.14 N ATOM 788 CA TYR A 51 -13.609 -4.717 -3.780 1.00 20.12 C ATOM 789 C TYR A 51 -12.979 -3.308 -3.694 1.00 74.33 C ATOM 790 O TYR A 51 -12.452 -2.909 -2.647 1.00 13.11 O ATOM 791 CB TYR A 51 -12.535 -5.834 -3.569 1.00 42.04 C ATOM 792 CG TYR A 51 -12.482 -6.390 -2.128 1.00 1.33 C ATOM 793 CD1 TYR A 51 -11.793 -5.729 -1.104 1.00 41.11 C ATOM 794 CD2 TYR A 51 -13.144 -7.575 -1.795 1.00 62.30 C ATOM 795 CE1 TYR A 51 -11.768 -6.236 0.186 1.00 54.42 C ATOM 796 CE2 TYR A 51 -13.122 -8.081 -0.511 1.00 72.10 C ATOM 797 CZ TYR A 51 -12.436 -7.413 0.476 1.00 41.52 C ATOM 798 OH TYR A 51 -12.424 -7.922 1.761 1.00 1.31 O ATOM 0 H TYR A 51 -13.688 -5.244 -5.828 1.00 3.14 H new ATOM 0 HA TYR A 51 -14.343 -4.824 -2.982 1.00 20.12 H new ATOM 0 HB2 TYR A 51 -12.739 -6.655 -4.257 1.00 42.04 H new ATOM 0 HB3 TYR A 51 -11.555 -5.435 -3.830 1.00 42.04 H new ATOM 0 HD1 TYR A 51 -11.272 -4.809 -1.323 1.00 41.11 H new ATOM 0 HD2 TYR A 51 -13.686 -8.108 -2.562 1.00 62.30 H new ATOM 0 HE1 TYR A 51 -11.229 -5.714 0.963 1.00 54.42 H new ATOM 0 HE2 TYR A 51 -13.642 -8.999 -0.282 1.00 72.10 H new ATOM 0 HH TYR A 51 -12.943 -8.753 1.789 1.00 1.31 H new ATOM 808 N ARG A 52 -13.028 -2.591 -4.832 1.00 21.01 N ATOM 809 CA ARG A 52 -12.617 -1.193 -4.954 1.00 3.24 C ATOM 810 C ARG A 52 -13.482 -0.287 -4.060 1.00 73.43 C ATOM 811 O ARG A 52 -14.718 -0.345 -4.119 1.00 40.43 O ATOM 812 CB ARG A 52 -12.754 -0.757 -6.441 1.00 54.34 C ATOM 813 CG ARG A 52 -12.190 0.638 -6.770 1.00 3.31 C ATOM 814 CD ARG A 52 -12.249 0.967 -8.279 1.00 71.14 C ATOM 815 NE ARG A 52 -13.598 1.373 -8.732 1.00 1.12 N ATOM 816 CZ ARG A 52 -14.288 0.825 -9.749 1.00 4.22 C ATOM 817 NH1 ARG A 52 -13.778 -0.186 -10.452 1.00 32.21 N ATOM 818 NH2 ARG A 52 -15.474 1.324 -10.073 1.00 13.53 N ATOM 0 H ARG A 52 -13.364 -2.985 -5.711 1.00 21.01 H new ATOM 0 HA ARG A 52 -11.581 -1.096 -4.630 1.00 3.24 H new ATOM 0 HB2 ARG A 52 -12.248 -1.493 -7.067 1.00 54.34 H new ATOM 0 HB3 ARG A 52 -13.809 -0.778 -6.713 1.00 54.34 H new ATOM 0 HG2 ARG A 52 -12.750 1.391 -6.216 1.00 3.31 H new ATOM 0 HG3 ARG A 52 -11.156 0.696 -6.430 1.00 3.31 H new ATOM 0 HD2 ARG A 52 -11.542 1.767 -8.498 1.00 71.14 H new ATOM 0 HD3 ARG A 52 -11.929 0.094 -8.848 1.00 71.14 H new ATOM 0 HE ARG A 52 -14.046 2.138 -8.227 1.00 1.12 H new ATOM 0 HH11 ARG A 52 -12.855 -0.553 -10.221 1.00 32.21 H new ATOM 0 HH12 ARG A 52 -14.311 -0.593 -11.221 1.00 32.21 H new ATOM 0 HH21 ARG A 52 -15.854 2.115 -9.553 1.00 13.53 H new ATOM 0 HH22 ARG A 52 -16.006 0.917 -10.842 1.00 13.53 H new ATOM 832 N VAL A 53 -12.825 0.533 -3.229 1.00 30.35 N ATOM 833 CA VAL A 53 -13.479 1.582 -2.431 1.00 32.23 C ATOM 834 C VAL A 53 -12.678 2.875 -2.619 1.00 33.23 C ATOM 835 O VAL A 53 -11.459 2.829 -2.770 1.00 55.23 O ATOM 836 CB VAL A 53 -13.587 1.225 -0.888 1.00 12.55 C ATOM 837 CG1 VAL A 53 -14.386 -0.082 -0.651 1.00 72.21 C ATOM 838 CG2 VAL A 53 -12.201 1.155 -0.205 1.00 11.21 C ATOM 0 H VAL A 53 -11.816 0.488 -3.090 1.00 30.35 H new ATOM 0 HA VAL A 53 -14.506 1.689 -2.781 1.00 32.23 H new ATOM 0 HB VAL A 53 -14.139 2.042 -0.423 1.00 12.55 H new ATOM 0 HG11 VAL A 53 -14.436 -0.289 0.418 1.00 72.21 H new ATOM 0 HG12 VAL A 53 -15.396 0.032 -1.046 1.00 72.21 H new ATOM 0 HG13 VAL A 53 -13.889 -0.909 -1.158 1.00 72.21 H new ATOM 0 HG21 VAL A 53 -12.327 0.908 0.849 1.00 11.21 H new ATOM 0 HG22 VAL A 53 -11.596 0.388 -0.688 1.00 11.21 H new ATOM 0 HG23 VAL A 53 -11.702 2.120 -0.294 1.00 11.21 H new ATOM 848 N GLU A 54 -13.354 4.016 -2.649 1.00 73.55 N ATOM 849 CA GLU A 54 -12.686 5.328 -2.733 1.00 71.11 C ATOM 850 C GLU A 54 -12.788 6.041 -1.377 1.00 14.21 C ATOM 851 O GLU A 54 -13.807 5.924 -0.681 1.00 40.24 O ATOM 852 CB GLU A 54 -13.269 6.179 -3.888 1.00 72.02 C ATOM 853 CG GLU A 54 -14.797 6.354 -3.863 1.00 61.22 C ATOM 854 CD GLU A 54 -15.321 7.084 -5.104 1.00 75.32 C ATOM 855 OE1 GLU A 54 -15.481 6.436 -6.155 1.00 30.15 O ATOM 856 OE2 GLU A 54 -15.562 8.302 -5.044 1.00 41.15 O ATOM 0 H GLU A 54 -14.372 4.069 -2.617 1.00 73.55 H new ATOM 0 HA GLU A 54 -11.630 5.182 -2.962 1.00 71.11 H new ATOM 0 HB2 GLU A 54 -12.806 7.165 -3.862 1.00 72.02 H new ATOM 0 HB3 GLU A 54 -12.987 5.719 -4.835 1.00 72.02 H new ATOM 0 HG2 GLU A 54 -15.271 5.375 -3.793 1.00 61.22 H new ATOM 0 HG3 GLU A 54 -15.082 6.910 -2.970 1.00 61.22 H new ATOM 863 N ALA A 55 -11.727 6.777 -1.010 1.00 25.02 N ATOM 864 CA ALA A 55 -11.578 7.379 0.325 1.00 3.31 C ATOM 865 C ALA A 55 -11.260 8.872 0.214 1.00 55.20 C ATOM 866 O ALA A 55 -10.512 9.280 -0.676 1.00 43.53 O ATOM 867 CB ALA A 55 -10.482 6.642 1.098 1.00 54.21 C ATOM 0 H ALA A 55 -10.944 6.972 -1.634 1.00 25.02 H new ATOM 0 HA ALA A 55 -12.519 7.282 0.867 1.00 3.31 H new ATOM 0 HB1 ALA A 55 -10.372 7.088 2.087 1.00 54.21 H new ATOM 0 HB2 ALA A 55 -10.754 5.591 1.202 1.00 54.21 H new ATOM 0 HB3 ALA A 55 -9.539 6.721 0.557 1.00 54.21 H new ATOM 873 N THR A 56 -11.813 9.670 1.142 1.00 34.43 N ATOM 874 CA THR A 56 -11.649 11.125 1.170 1.00 33.22 C ATOM 875 C THR A 56 -10.288 11.489 1.789 1.00 31.31 C ATOM 876 O THR A 56 -10.012 11.155 2.948 1.00 4.12 O ATOM 877 CB THR A 56 -12.805 11.787 1.993 1.00 25.53 C ATOM 878 OG1 THR A 56 -14.076 11.346 1.483 1.00 53.33 O ATOM 879 CG2 THR A 56 -12.741 13.329 1.950 1.00 72.14 C ATOM 0 H THR A 56 -12.393 9.314 1.902 1.00 34.43 H new ATOM 0 HA THR A 56 -11.687 11.501 0.148 1.00 33.22 H new ATOM 0 HB THR A 56 -12.686 11.479 3.032 1.00 25.53 H new ATOM 0 HG1 THR A 56 -14.798 11.760 2.001 1.00 53.33 H new ATOM 0 HG21 THR A 56 -13.562 13.744 2.535 1.00 72.14 H new ATOM 0 HG22 THR A 56 -11.792 13.666 2.368 1.00 72.14 H new ATOM 0 HG23 THR A 56 -12.823 13.668 0.917 1.00 72.14 H new ATOM 887 N VAL A 57 -9.462 12.181 1.002 1.00 13.23 N ATOM 888 CA VAL A 57 -8.110 12.595 1.386 1.00 14.00 C ATOM 889 C VAL A 57 -8.180 13.766 2.374 1.00 43.14 C ATOM 890 O VAL A 57 -8.812 14.784 2.084 1.00 51.32 O ATOM 891 CB VAL A 57 -7.282 13.030 0.120 1.00 62.43 C ATOM 892 CG1 VAL A 57 -5.828 13.394 0.502 1.00 75.33 C ATOM 893 CG2 VAL A 57 -7.328 11.935 -0.973 1.00 63.13 C ATOM 0 H VAL A 57 -9.719 12.476 0.060 1.00 13.23 H new ATOM 0 HA VAL A 57 -7.615 11.747 1.859 1.00 14.00 H new ATOM 0 HB VAL A 57 -7.743 13.927 -0.294 1.00 62.43 H new ATOM 0 HG11 VAL A 57 -5.280 13.691 -0.392 1.00 75.33 H new ATOM 0 HG12 VAL A 57 -5.835 14.219 1.214 1.00 75.33 H new ATOM 0 HG13 VAL A 57 -5.343 12.529 0.954 1.00 75.33 H new ATOM 0 HG21 VAL A 57 -6.749 12.259 -1.837 1.00 63.13 H new ATOM 0 HG22 VAL A 57 -6.906 11.010 -0.580 1.00 63.13 H new ATOM 0 HG23 VAL A 57 -8.362 11.763 -1.273 1.00 63.13 H new ATOM 903 N THR A 58 -7.524 13.602 3.529 1.00 54.11 N ATOM 904 CA THR A 58 -7.476 14.603 4.598 1.00 0.45 C ATOM 905 C THR A 58 -6.002 14.946 4.860 1.00 40.05 C ATOM 906 O THR A 58 -5.294 14.201 5.551 1.00 54.44 O ATOM 907 CB THR A 58 -8.169 14.056 5.892 1.00 52.23 C ATOM 908 OG1 THR A 58 -9.470 13.535 5.553 1.00 73.22 O ATOM 909 CG2 THR A 58 -8.316 15.137 6.980 1.00 31.44 C ATOM 0 H THR A 58 -7.002 12.754 3.750 1.00 54.11 H new ATOM 0 HA THR A 58 -8.015 15.503 4.301 1.00 0.45 H new ATOM 0 HB THR A 58 -7.534 13.268 6.298 1.00 52.23 H new ATOM 0 HG1 THR A 58 -9.905 13.190 6.361 1.00 73.22 H new ATOM 0 HG21 THR A 58 -8.802 14.708 7.856 1.00 31.44 H new ATOM 0 HG22 THR A 58 -7.330 15.510 7.258 1.00 31.44 H new ATOM 0 HG23 THR A 58 -8.920 15.959 6.597 1.00 31.44 H new ATOM 917 N VAL A 59 -5.536 16.065 4.289 1.00 52.14 N ATOM 918 CA VAL A 59 -4.106 16.409 4.264 1.00 21.42 C ATOM 919 C VAL A 59 -3.706 17.090 5.575 1.00 21.01 C ATOM 920 O VAL A 59 -4.423 17.957 6.080 1.00 30.40 O ATOM 921 CB VAL A 59 -3.746 17.315 3.028 1.00 61.42 C ATOM 922 CG1 VAL A 59 -2.260 17.772 3.042 1.00 55.20 C ATOM 923 CG2 VAL A 59 -4.073 16.574 1.718 1.00 75.11 C ATOM 0 H VAL A 59 -6.135 16.754 3.834 1.00 52.14 H new ATOM 0 HA VAL A 59 -3.539 15.484 4.160 1.00 21.42 H new ATOM 0 HB VAL A 59 -4.355 18.217 3.095 1.00 61.42 H new ATOM 0 HG11 VAL A 59 -2.062 18.394 2.169 1.00 55.20 H new ATOM 0 HG12 VAL A 59 -2.064 18.345 3.948 1.00 55.20 H new ATOM 0 HG13 VAL A 59 -1.610 16.897 3.019 1.00 55.20 H new ATOM 0 HG21 VAL A 59 -3.821 17.208 0.868 1.00 75.11 H new ATOM 0 HG22 VAL A 59 -3.494 15.652 1.667 1.00 75.11 H new ATOM 0 HG23 VAL A 59 -5.136 16.336 1.690 1.00 75.11 H new ATOM 933 N HIS A 60 -2.570 16.658 6.131 1.00 63.23 N ATOM 934 CA HIS A 60 -2.023 17.207 7.372 1.00 32.52 C ATOM 935 C HIS A 60 -1.107 18.390 7.048 1.00 31.43 C ATOM 936 O HIS A 60 -0.011 18.205 6.507 1.00 62.14 O ATOM 937 CB HIS A 60 -1.285 16.091 8.160 1.00 13.22 C ATOM 938 CG HIS A 60 -2.242 15.105 8.792 1.00 0.30 C ATOM 939 ND1 HIS A 60 -3.285 14.515 8.098 1.00 11.13 N ATOM 940 CD2 HIS A 60 -2.368 14.673 10.072 1.00 11.21 C ATOM 941 CE1 HIS A 60 -4.007 13.790 8.923 1.00 14.54 C ATOM 942 NE2 HIS A 60 -3.472 13.864 10.122 1.00 35.21 N ATOM 0 H HIS A 60 -2.002 15.913 5.729 1.00 63.23 H new ATOM 0 HA HIS A 60 -2.828 17.576 8.007 1.00 32.52 H new ATOM 0 HB2 HIS A 60 -0.611 15.560 7.488 1.00 13.22 H new ATOM 0 HB3 HIS A 60 -0.669 16.544 8.936 1.00 13.22 H new ATOM 0 HD2 HIS A 60 -1.718 14.921 10.898 1.00 11.21 H new ATOM 0 HE1 HIS A 60 -4.891 13.228 8.660 1.00 14.54 H new ATOM 0 HE2 HIS A 60 -3.823 13.394 10.956 1.00 35.21 H new ATOM 951 N GLU A 61 -1.615 19.601 7.359 1.00 21.13 N ATOM 952 CA GLU A 61 -0.896 20.894 7.226 1.00 12.20 C ATOM 953 C GLU A 61 0.508 20.851 7.869 1.00 53.04 C ATOM 954 O GLU A 61 1.431 21.530 7.419 1.00 14.03 O ATOM 955 CB GLU A 61 -1.739 22.020 7.893 1.00 45.32 C ATOM 956 CG GLU A 61 -2.099 21.736 9.373 1.00 21.03 C ATOM 957 CD GLU A 61 -2.790 22.907 10.077 1.00 63.31 C ATOM 958 OE1 GLU A 61 -3.985 23.146 9.817 1.00 42.20 O ATOM 959 OE2 GLU A 61 -2.142 23.592 10.896 1.00 11.12 O ATOM 0 H GLU A 61 -2.562 19.714 7.720 1.00 21.13 H new ATOM 0 HA GLU A 61 -0.763 21.093 6.163 1.00 12.20 H new ATOM 0 HB2 GLU A 61 -1.186 22.958 7.836 1.00 45.32 H new ATOM 0 HB3 GLU A 61 -2.659 22.158 7.325 1.00 45.32 H new ATOM 0 HG2 GLU A 61 -2.749 20.863 9.418 1.00 21.03 H new ATOM 0 HG3 GLU A 61 -1.189 21.484 9.917 1.00 21.03 H new ATOM 966 N THR A 62 0.633 20.056 8.942 1.00 41.31 N ATOM 967 CA THR A 62 1.886 19.844 9.669 1.00 43.44 C ATOM 968 C THR A 62 2.212 18.330 9.671 1.00 21.00 C ATOM 969 O THR A 62 1.722 17.591 10.530 1.00 12.13 O ATOM 970 CB THR A 62 1.769 20.426 11.122 1.00 50.42 C ATOM 971 OG1 THR A 62 0.624 19.864 11.788 1.00 54.01 O ATOM 972 CG2 THR A 62 1.636 21.966 11.119 1.00 5.24 C ATOM 0 H THR A 62 -0.151 19.534 9.333 1.00 41.31 H new ATOM 0 HA THR A 62 2.705 20.370 9.179 1.00 43.44 H new ATOM 0 HB THR A 62 2.685 20.159 11.649 1.00 50.42 H new ATOM 0 HG1 THR A 62 0.570 18.905 11.592 1.00 54.01 H new ATOM 0 HG21 THR A 62 1.558 22.326 12.145 1.00 5.24 H new ATOM 0 HG22 THR A 62 2.514 22.406 10.646 1.00 5.24 H new ATOM 0 HG23 THR A 62 0.743 22.253 10.564 1.00 5.24 H new ATOM 980 N PRO A 63 3.001 17.827 8.661 1.00 13.52 N ATOM 981 CA PRO A 63 3.278 16.375 8.513 1.00 2.32 C ATOM 982 C PRO A 63 4.159 15.832 9.662 1.00 43.15 C ATOM 983 O PRO A 63 5.271 16.330 9.902 1.00 11.34 O ATOM 984 CB PRO A 63 3.999 16.293 7.141 1.00 20.03 C ATOM 985 CG PRO A 63 4.633 17.639 6.960 1.00 72.41 C ATOM 986 CD PRO A 63 3.679 18.628 7.599 1.00 24.23 C ATOM 0 HA PRO A 63 2.376 15.765 8.557 1.00 2.32 H new ATOM 0 HB2 PRO A 63 4.746 15.500 7.134 1.00 20.03 H new ATOM 0 HB3 PRO A 63 3.296 16.076 6.337 1.00 20.03 H new ATOM 0 HG2 PRO A 63 5.613 17.677 7.435 1.00 72.41 H new ATOM 0 HG3 PRO A 63 4.781 17.864 5.904 1.00 72.41 H new ATOM 0 HD2 PRO A 63 4.210 19.483 8.019 1.00 24.23 H new ATOM 0 HD3 PRO A 63 2.965 19.020 6.875 1.00 24.23 H new ATOM 994 N GLU A 64 3.654 14.804 10.358 1.00 51.21 N ATOM 995 CA GLU A 64 4.325 14.204 11.527 1.00 42.05 C ATOM 996 C GLU A 64 5.177 12.995 11.091 1.00 44.40 C ATOM 997 O GLU A 64 4.823 12.282 10.147 1.00 63.31 O ATOM 998 CB GLU A 64 3.258 13.809 12.596 1.00 53.52 C ATOM 999 CG GLU A 64 2.143 12.872 12.076 1.00 44.05 C ATOM 1000 CD GLU A 64 0.951 12.728 13.033 1.00 24.23 C ATOM 1001 OE1 GLU A 64 0.001 13.536 12.941 1.00 10.44 O ATOM 1002 OE2 GLU A 64 0.959 11.814 13.882 1.00 2.33 O ATOM 0 H GLU A 64 2.765 14.361 10.127 1.00 51.21 H new ATOM 0 HA GLU A 64 5.001 14.931 11.977 1.00 42.05 H new ATOM 0 HB2 GLU A 64 3.762 13.324 13.432 1.00 53.52 H new ATOM 0 HB3 GLU A 64 2.799 14.718 12.985 1.00 53.52 H new ATOM 0 HG2 GLU A 64 1.783 13.249 11.118 1.00 44.05 H new ATOM 0 HG3 GLU A 64 2.568 11.886 11.891 1.00 44.05 H new ATOM 1009 N SER A 65 6.311 12.795 11.776 1.00 1.21 N ATOM 1010 CA SER A 65 7.293 11.753 11.436 1.00 22.30 C ATOM 1011 C SER A 65 6.827 10.360 11.930 1.00 53.12 C ATOM 1012 O SER A 65 6.564 10.173 13.121 1.00 73.44 O ATOM 1013 CB SER A 65 8.653 12.137 12.051 1.00 13.20 C ATOM 1014 OG SER A 65 8.555 12.341 13.452 1.00 61.35 O ATOM 0 H SER A 65 6.576 13.354 12.587 1.00 1.21 H new ATOM 0 HA SER A 65 7.391 11.686 10.352 1.00 22.30 H new ATOM 0 HB2 SER A 65 9.380 11.351 11.847 1.00 13.20 H new ATOM 0 HB3 SER A 65 9.024 13.045 11.576 1.00 13.20 H new ATOM 0 HG SER A 65 7.868 11.748 13.822 1.00 61.35 H new ATOM 1020 N VAL A 66 6.703 9.402 10.996 1.00 31.11 N ATOM 1021 CA VAL A 66 6.254 8.020 11.262 1.00 62.01 C ATOM 1022 C VAL A 66 7.262 7.050 10.616 1.00 71.14 C ATOM 1023 O VAL A 66 7.437 7.076 9.396 1.00 64.33 O ATOM 1024 CB VAL A 66 4.815 7.753 10.657 1.00 5.41 C ATOM 1025 CG1 VAL A 66 4.242 6.397 11.132 1.00 4.03 C ATOM 1026 CG2 VAL A 66 3.839 8.919 10.964 1.00 43.31 C ATOM 0 H VAL A 66 6.916 9.568 10.012 1.00 31.11 H new ATOM 0 HA VAL A 66 6.200 7.869 12.340 1.00 62.01 H new ATOM 0 HB VAL A 66 4.926 7.700 9.574 1.00 5.41 H new ATOM 0 HG11 VAL A 66 3.254 6.247 10.697 1.00 4.03 H new ATOM 0 HG12 VAL A 66 4.904 5.591 10.815 1.00 4.03 H new ATOM 0 HG13 VAL A 66 4.164 6.396 12.219 1.00 4.03 H new ATOM 0 HG21 VAL A 66 2.862 8.699 10.533 1.00 43.31 H new ATOM 0 HG22 VAL A 66 3.741 9.037 12.043 1.00 43.31 H new ATOM 0 HG23 VAL A 66 4.227 9.842 10.532 1.00 43.31 H new ATOM 1036 N ASP A 67 7.906 6.190 11.425 1.00 13.55 N ATOM 1037 CA ASP A 67 8.989 5.304 10.949 1.00 3.34 C ATOM 1038 C ASP A 67 8.397 4.056 10.283 1.00 1.53 C ATOM 1039 O ASP A 67 7.792 3.208 10.949 1.00 23.23 O ATOM 1040 CB ASP A 67 9.936 4.897 12.107 1.00 71.15 C ATOM 1041 CG ASP A 67 10.683 6.099 12.696 1.00 55.52 C ATOM 1042 OD1 ASP A 67 11.591 6.627 12.027 1.00 1.11 O ATOM 1043 OD2 ASP A 67 10.352 6.545 13.815 1.00 31.40 O ATOM 0 H ASP A 67 7.695 6.088 12.418 1.00 13.55 H new ATOM 0 HA ASP A 67 9.576 5.856 10.215 1.00 3.34 H new ATOM 0 HB2 ASP A 67 9.358 4.411 12.893 1.00 71.15 H new ATOM 0 HB3 ASP A 67 10.658 4.166 11.743 1.00 71.15 H new ATOM 1048 N LEU A 68 8.556 3.972 8.956 1.00 41.42 N ATOM 1049 CA LEU A 68 8.071 2.849 8.133 1.00 23.03 C ATOM 1050 C LEU A 68 9.242 2.329 7.286 1.00 31.02 C ATOM 1051 O LEU A 68 10.226 3.042 7.083 1.00 11.31 O ATOM 1052 CB LEU A 68 6.908 3.310 7.208 1.00 54.54 C ATOM 1053 CG LEU A 68 5.775 4.155 7.874 1.00 33.11 C ATOM 1054 CD1 LEU A 68 4.819 4.700 6.815 1.00 10.11 C ATOM 1055 CD2 LEU A 68 4.996 3.363 8.946 1.00 14.34 C ATOM 0 H LEU A 68 9.032 4.692 8.413 1.00 41.42 H new ATOM 0 HA LEU A 68 7.693 2.057 8.780 1.00 23.03 H new ATOM 0 HB2 LEU A 68 7.333 3.894 6.392 1.00 54.54 H new ATOM 0 HB3 LEU A 68 6.455 2.424 6.763 1.00 54.54 H new ATOM 0 HG LEU A 68 6.260 4.988 8.382 1.00 33.11 H new ATOM 0 HD11 LEU A 68 4.037 5.286 7.298 1.00 10.11 H new ATOM 0 HD12 LEU A 68 5.369 5.333 6.119 1.00 10.11 H new ATOM 0 HD13 LEU A 68 4.367 3.870 6.271 1.00 10.11 H new ATOM 0 HD21 LEU A 68 4.221 3.998 9.376 1.00 14.34 H new ATOM 0 HD22 LEU A 68 4.535 2.488 8.488 1.00 14.34 H new ATOM 0 HD23 LEU A 68 5.681 3.044 9.732 1.00 14.34 H new ATOM 1067 N GLU A 69 9.132 1.102 6.781 1.00 62.20 N ATOM 1068 CA GLU A 69 10.158 0.513 5.899 1.00 51.13 C ATOM 1069 C GLU A 69 9.984 1.031 4.456 1.00 25.24 C ATOM 1070 O GLU A 69 8.860 1.335 4.022 1.00 74.31 O ATOM 1071 CB GLU A 69 10.057 -1.026 5.941 1.00 34.15 C ATOM 1072 CG GLU A 69 8.720 -1.578 5.408 1.00 21.52 C ATOM 1073 CD GLU A 69 8.571 -3.074 5.632 1.00 44.13 C ATOM 1074 OE1 GLU A 69 9.150 -3.853 4.876 1.00 24.21 O ATOM 1075 OE2 GLU A 69 7.867 -3.478 6.562 1.00 0.50 O ATOM 0 H GLU A 69 8.340 0.486 6.965 1.00 62.20 H new ATOM 0 HA GLU A 69 11.146 0.810 6.250 1.00 51.13 H new ATOM 0 HB2 GLU A 69 10.873 -1.450 5.356 1.00 34.15 H new ATOM 0 HB3 GLU A 69 10.194 -1.362 6.969 1.00 34.15 H new ATOM 0 HG2 GLU A 69 7.896 -1.058 5.897 1.00 21.52 H new ATOM 0 HG3 GLU A 69 8.643 -1.365 4.342 1.00 21.52 H new ATOM 1082 N THR A 70 11.108 1.166 3.738 1.00 40.14 N ATOM 1083 CA THR A 70 11.119 1.513 2.305 1.00 60.33 C ATOM 1084 C THR A 70 11.339 0.234 1.465 1.00 43.50 C ATOM 1085 O THR A 70 11.512 -0.851 2.022 1.00 54.23 O ATOM 1086 CB THR A 70 12.225 2.590 2.005 1.00 25.52 C ATOM 1087 OG1 THR A 70 12.151 3.023 0.640 1.00 3.45 O ATOM 1088 CG2 THR A 70 13.647 2.074 2.303 1.00 65.03 C ATOM 0 H THR A 70 12.039 1.038 4.134 1.00 40.14 H new ATOM 0 HA THR A 70 10.157 1.947 2.032 1.00 60.33 H new ATOM 0 HB THR A 70 12.029 3.431 2.670 1.00 25.52 H new ATOM 0 HG1 THR A 70 11.771 3.926 0.603 1.00 3.45 H new ATOM 0 HG21 THR A 70 14.372 2.856 2.079 1.00 65.03 H new ATOM 0 HG22 THR A 70 13.722 1.801 3.355 1.00 65.03 H new ATOM 0 HG23 THR A 70 13.854 1.200 1.686 1.00 65.03 H new ATOM 1096 N SER A 71 11.353 0.380 0.132 1.00 72.22 N ATOM 1097 CA SER A 71 11.517 -0.737 -0.823 1.00 2.35 C ATOM 1098 C SER A 71 13.011 -1.040 -1.117 1.00 13.24 C ATOM 1099 O SER A 71 13.329 -1.720 -2.102 1.00 20.32 O ATOM 1100 CB SER A 71 10.745 -0.395 -2.122 1.00 10.32 C ATOM 1101 OG SER A 71 9.364 -0.169 -1.858 1.00 22.22 O ATOM 0 H SER A 71 11.250 1.287 -0.324 1.00 72.22 H new ATOM 0 HA SER A 71 11.107 -1.644 -0.379 1.00 2.35 H new ATOM 0 HB2 SER A 71 11.179 0.492 -2.583 1.00 10.32 H new ATOM 0 HB3 SER A 71 10.852 -1.211 -2.837 1.00 10.32 H new ATOM 0 HG SER A 71 8.902 0.046 -2.695 1.00 22.22 H new ATOM 1107 N ASP A 72 13.916 -0.608 -0.213 1.00 53.23 N ATOM 1108 CA ASP A 72 15.371 -0.574 -0.479 1.00 21.52 C ATOM 1109 C ASP A 72 16.152 -1.103 0.749 1.00 43.10 C ATOM 1110 O ASP A 72 17.080 -0.456 1.241 1.00 44.20 O ATOM 1111 CB ASP A 72 15.780 0.885 -0.876 1.00 65.04 C ATOM 1112 CG ASP A 72 17.236 1.017 -1.386 1.00 62.24 C ATOM 1113 OD1 ASP A 72 17.590 0.375 -2.384 1.00 61.33 O ATOM 1114 OD2 ASP A 72 18.030 1.777 -0.806 1.00 44.33 O ATOM 0 H ASP A 72 13.661 -0.275 0.717 1.00 53.23 H new ATOM 0 HA ASP A 72 15.623 -1.230 -1.312 1.00 21.52 H new ATOM 0 HB2 ASP A 72 15.101 1.243 -1.650 1.00 65.04 H new ATOM 0 HB3 ASP A 72 15.649 1.536 -0.011 1.00 65.04 H new ATOM 1119 N ASP A 73 15.722 -2.290 1.256 1.00 53.13 N ATOM 1120 CA ASP A 73 16.287 -2.972 2.476 1.00 72.22 C ATOM 1121 C ASP A 73 16.024 -2.218 3.796 1.00 71.12 C ATOM 1122 O ASP A 73 15.948 -2.839 4.857 1.00 52.41 O ATOM 1123 CB ASP A 73 17.824 -3.254 2.372 1.00 21.44 C ATOM 1124 CG ASP A 73 18.201 -4.237 1.254 1.00 23.40 C ATOM 1125 OD1 ASP A 73 17.645 -5.357 1.225 1.00 53.53 O ATOM 1126 OD2 ASP A 73 19.042 -3.898 0.392 1.00 35.24 O ATOM 0 H ASP A 73 14.960 -2.817 0.829 1.00 53.13 H new ATOM 0 HA ASP A 73 15.745 -3.917 2.501 1.00 72.22 H new ATOM 0 HB2 ASP A 73 18.346 -2.312 2.205 1.00 21.44 H new ATOM 0 HB3 ASP A 73 18.176 -3.650 3.325 1.00 21.44 H new ATOM 1131 N ARG A 74 15.842 -0.902 3.719 1.00 42.32 N ATOM 1132 CA ARG A 74 16.067 0.016 4.833 1.00 34.01 C ATOM 1133 C ARG A 74 14.740 0.313 5.555 1.00 20.45 C ATOM 1134 O ARG A 74 13.667 -0.152 5.149 1.00 32.31 O ATOM 1135 CB ARG A 74 16.737 1.311 4.252 1.00 32.53 C ATOM 1136 CG ARG A 74 17.488 2.221 5.264 1.00 32.02 C ATOM 1137 CD ARG A 74 18.297 3.343 4.580 1.00 62.11 C ATOM 1138 NE ARG A 74 19.363 2.801 3.699 1.00 74.15 N ATOM 1139 CZ ARG A 74 19.296 2.699 2.361 1.00 61.11 C ATOM 1140 NH1 ARG A 74 18.214 3.101 1.706 1.00 1.32 N ATOM 1141 NH2 ARG A 74 20.303 2.160 1.688 1.00 1.12 N ATOM 0 H ARG A 74 15.529 -0.436 2.867 1.00 42.32 H new ATOM 0 HA ARG A 74 16.729 -0.422 5.579 1.00 34.01 H new ATOM 0 HB2 ARG A 74 17.441 1.011 3.476 1.00 32.53 H new ATOM 0 HB3 ARG A 74 15.963 1.907 3.767 1.00 32.53 H new ATOM 0 HG2 ARG A 74 16.766 2.666 5.949 1.00 32.02 H new ATOM 0 HG3 ARG A 74 18.161 1.609 5.864 1.00 32.02 H new ATOM 0 HD2 ARG A 74 17.625 3.969 3.993 1.00 62.11 H new ATOM 0 HD3 ARG A 74 18.745 3.982 5.341 1.00 62.11 H new ATOM 0 HE ARG A 74 20.220 2.478 4.149 1.00 74.15 H new ATOM 0 HH11 ARG A 74 17.423 3.492 2.218 1.00 1.32 H new ATOM 0 HH12 ARG A 74 18.173 3.019 0.690 1.00 1.32 H new ATOM 0 HH21 ARG A 74 21.127 1.823 2.186 1.00 1.12 H new ATOM 0 HH22 ARG A 74 20.254 2.082 0.672 1.00 1.12 H new ATOM 1155 N THR A 75 14.842 1.126 6.596 1.00 11.41 N ATOM 1156 CA THR A 75 13.730 1.609 7.386 1.00 42.42 C ATOM 1157 C THR A 75 14.004 3.091 7.605 1.00 51.22 C ATOM 1158 O THR A 75 15.103 3.469 8.029 1.00 72.22 O ATOM 1159 CB THR A 75 13.606 0.847 8.733 1.00 70.21 C ATOM 1160 OG1 THR A 75 13.478 -0.562 8.469 1.00 32.23 O ATOM 1161 CG2 THR A 75 12.395 1.333 9.547 1.00 44.43 C ATOM 0 H THR A 75 15.741 1.479 6.923 1.00 11.41 H new ATOM 0 HA THR A 75 12.780 1.447 6.877 1.00 42.42 H new ATOM 0 HB THR A 75 14.503 1.041 9.321 1.00 70.21 H new ATOM 0 HG1 THR A 75 12.635 -0.890 8.845 1.00 32.23 H new ATOM 0 HG21 THR A 75 12.339 0.778 10.483 1.00 44.43 H new ATOM 0 HG22 THR A 75 12.504 2.396 9.761 1.00 44.43 H new ATOM 0 HG23 THR A 75 11.482 1.170 8.974 1.00 44.43 H new ATOM 1169 N VAL A 76 13.016 3.921 7.308 1.00 1.31 N ATOM 1170 CA VAL A 76 13.202 5.371 7.155 1.00 63.30 C ATOM 1171 C VAL A 76 12.000 6.127 7.704 1.00 0.12 C ATOM 1172 O VAL A 76 10.913 5.571 7.891 1.00 12.23 O ATOM 1173 CB VAL A 76 13.476 5.805 5.652 1.00 50.42 C ATOM 1174 CG1 VAL A 76 14.899 5.415 5.198 1.00 34.12 C ATOM 1175 CG2 VAL A 76 12.420 5.224 4.691 1.00 52.22 C ATOM 0 H VAL A 76 12.054 3.614 7.164 1.00 1.31 H new ATOM 0 HA VAL A 76 14.091 5.630 7.731 1.00 63.30 H new ATOM 0 HB VAL A 76 13.399 6.892 5.617 1.00 50.42 H new ATOM 0 HG11 VAL A 76 15.050 5.728 4.165 1.00 34.12 H new ATOM 0 HG12 VAL A 76 15.632 5.907 5.837 1.00 34.12 H new ATOM 0 HG13 VAL A 76 15.021 4.334 5.271 1.00 34.12 H new ATOM 0 HG21 VAL A 76 12.641 5.543 3.672 1.00 52.22 H new ATOM 0 HG22 VAL A 76 12.440 4.135 4.743 1.00 52.22 H new ATOM 0 HG23 VAL A 76 11.431 5.583 4.977 1.00 52.22 H new ATOM 1185 N ARG A 77 12.241 7.403 7.974 1.00 11.33 N ATOM 1186 CA ARG A 77 11.228 8.352 8.404 1.00 64.24 C ATOM 1187 C ARG A 77 10.309 8.647 7.200 1.00 71.40 C ATOM 1188 O ARG A 77 10.794 8.912 6.100 1.00 60.52 O ATOM 1189 CB ARG A 77 11.980 9.620 8.935 1.00 33.21 C ATOM 1190 CG ARG A 77 11.133 10.790 9.513 1.00 43.12 C ATOM 1191 CD ARG A 77 10.422 11.643 8.439 1.00 62.31 C ATOM 1192 NE ARG A 77 11.286 11.920 7.272 1.00 13.43 N ATOM 1193 CZ ARG A 77 11.923 13.074 7.019 1.00 15.34 C ATOM 1194 NH1 ARG A 77 11.815 14.114 7.837 1.00 31.03 N ATOM 1195 NH2 ARG A 77 12.689 13.166 5.950 1.00 24.24 N ATOM 0 H ARG A 77 13.171 7.815 7.897 1.00 11.33 H new ATOM 0 HA ARG A 77 10.595 7.974 9.207 1.00 64.24 H new ATOM 0 HB2 ARG A 77 12.673 9.295 9.712 1.00 33.21 H new ATOM 0 HB3 ARG A 77 12.581 10.017 8.117 1.00 33.21 H new ATOM 0 HG2 ARG A 77 10.384 10.382 10.192 1.00 43.12 H new ATOM 0 HG3 ARG A 77 11.781 11.436 10.105 1.00 43.12 H new ATOM 0 HD2 ARG A 77 9.522 11.126 8.106 1.00 62.31 H new ATOM 0 HD3 ARG A 77 10.102 12.586 8.882 1.00 62.31 H new ATOM 0 HE ARG A 77 11.409 11.165 6.597 1.00 13.43 H new ATOM 0 HH11 ARG A 77 11.240 14.045 8.676 1.00 31.03 H new ATOM 0 HH12 ARG A 77 12.308 14.982 7.626 1.00 31.03 H new ATOM 0 HH21 ARG A 77 12.792 12.366 5.326 1.00 24.24 H new ATOM 0 HH22 ARG A 77 13.178 14.038 5.747 1.00 24.24 H new ATOM 1209 N TYR A 78 8.997 8.544 7.422 1.00 43.53 N ATOM 1210 CA TYR A 78 7.954 8.992 6.479 1.00 44.13 C ATOM 1211 C TYR A 78 7.225 10.193 7.085 1.00 3.32 C ATOM 1212 O TYR A 78 7.047 10.270 8.294 1.00 24.03 O ATOM 1213 CB TYR A 78 6.941 7.856 6.167 1.00 25.52 C ATOM 1214 CG TYR A 78 7.428 6.797 5.166 1.00 43.42 C ATOM 1215 CD1 TYR A 78 8.553 6.012 5.419 1.00 14.35 C ATOM 1216 CD2 TYR A 78 6.742 6.572 3.970 1.00 1.02 C ATOM 1217 CE1 TYR A 78 8.968 5.051 4.521 1.00 2.53 C ATOM 1218 CE2 TYR A 78 7.150 5.611 3.073 1.00 33.44 C ATOM 1219 CZ TYR A 78 8.264 4.853 3.350 1.00 70.25 C ATOM 1220 OH TYR A 78 8.672 3.889 2.452 1.00 5.54 O ATOM 0 H TYR A 78 8.616 8.140 8.277 1.00 43.53 H new ATOM 0 HA TYR A 78 8.429 9.273 5.539 1.00 44.13 H new ATOM 0 HB2 TYR A 78 6.681 7.357 7.101 1.00 25.52 H new ATOM 0 HB3 TYR A 78 6.026 8.304 5.780 1.00 25.52 H new ATOM 0 HD1 TYR A 78 9.108 6.159 6.333 1.00 14.35 H new ATOM 0 HD2 TYR A 78 5.870 7.167 3.744 1.00 1.02 H new ATOM 0 HE1 TYR A 78 9.843 4.454 4.734 1.00 2.53 H new ATOM 0 HE2 TYR A 78 6.599 5.453 2.158 1.00 33.44 H new ATOM 0 HH TYR A 78 8.615 3.005 2.872 1.00 5.54 H new ATOM 1230 N LEU A 79 6.829 11.138 6.241 1.00 32.00 N ATOM 1231 CA LEU A 79 6.014 12.284 6.651 1.00 32.21 C ATOM 1232 C LEU A 79 4.549 11.980 6.359 1.00 52.12 C ATOM 1233 O LEU A 79 4.194 11.629 5.220 1.00 11.13 O ATOM 1234 CB LEU A 79 6.493 13.582 5.949 1.00 12.14 C ATOM 1235 CG LEU A 79 7.909 14.085 6.388 1.00 12.44 C ATOM 1236 CD1 LEU A 79 8.298 15.398 5.676 1.00 63.44 C ATOM 1237 CD2 LEU A 79 7.987 14.244 7.923 1.00 5.03 C ATOM 0 H LEU A 79 7.063 11.135 5.248 1.00 32.00 H new ATOM 0 HA LEU A 79 6.125 12.452 7.722 1.00 32.21 H new ATOM 0 HB2 LEU A 79 6.501 13.413 4.872 1.00 12.14 H new ATOM 0 HB3 LEU A 79 5.767 14.372 6.143 1.00 12.14 H new ATOM 0 HG LEU A 79 8.631 13.326 6.086 1.00 12.44 H new ATOM 0 HD11 LEU A 79 9.287 15.713 6.008 1.00 63.44 H new ATOM 0 HD12 LEU A 79 8.312 15.237 4.598 1.00 63.44 H new ATOM 0 HD13 LEU A 79 7.570 16.173 5.918 1.00 63.44 H new ATOM 0 HD21 LEU A 79 8.981 14.594 8.202 1.00 5.03 H new ATOM 0 HD22 LEU A 79 7.241 14.967 8.252 1.00 5.03 H new ATOM 0 HD23 LEU A 79 7.794 13.282 8.399 1.00 5.03 H new ATOM 1249 N HIS A 80 3.714 12.075 7.412 1.00 3.33 N ATOM 1250 CA HIS A 80 2.280 11.809 7.322 1.00 72.24 C ATOM 1251 C HIS A 80 1.596 12.999 6.640 1.00 1.23 C ATOM 1252 O HIS A 80 1.350 14.042 7.260 1.00 63.30 O ATOM 1253 CB HIS A 80 1.710 11.557 8.740 1.00 25.42 C ATOM 1254 CG HIS A 80 0.241 11.238 8.793 1.00 43.34 C ATOM 1255 ND1 HIS A 80 -0.530 11.615 9.860 1.00 62.44 N ATOM 1256 CD2 HIS A 80 -0.531 10.550 7.914 1.00 1.52 C ATOM 1257 CE1 HIS A 80 -1.734 11.156 9.610 1.00 64.10 C ATOM 1258 NE2 HIS A 80 -1.783 10.504 8.445 1.00 71.31 N ATOM 0 H HIS A 80 4.024 12.339 8.347 1.00 3.33 H new ATOM 0 HA HIS A 80 2.093 10.916 6.725 1.00 72.24 H new ATOM 0 HB2 HIS A 80 2.261 10.733 9.194 1.00 25.42 H new ATOM 0 HB3 HIS A 80 1.896 12.440 9.351 1.00 25.42 H new ATOM 0 HD1 HIS A 80 -0.231 12.143 10.680 1.00 62.44 H new ATOM 0 HD2 HIS A 80 -0.213 10.122 6.975 1.00 1.52 H new ATOM 0 HE1 HIS A 80 -2.582 11.289 10.266 1.00 64.10 H new ATOM 1266 N VAL A 81 1.322 12.826 5.348 1.00 2.25 N ATOM 1267 CA VAL A 81 0.793 13.894 4.488 1.00 70.23 C ATOM 1268 C VAL A 81 -0.728 13.827 4.338 1.00 12.33 C ATOM 1269 O VAL A 81 -1.355 14.856 4.115 1.00 52.40 O ATOM 1270 CB VAL A 81 1.489 13.875 3.079 1.00 53.54 C ATOM 1271 CG1 VAL A 81 3.008 14.156 3.223 1.00 33.45 C ATOM 1272 CG2 VAL A 81 1.230 12.538 2.336 1.00 15.43 C ATOM 0 H VAL A 81 1.460 11.940 4.862 1.00 2.25 H new ATOM 0 HA VAL A 81 1.024 14.838 4.982 1.00 70.23 H new ATOM 0 HB VAL A 81 1.051 14.668 2.473 1.00 53.54 H new ATOM 0 HG11 VAL A 81 3.476 14.140 2.239 1.00 33.45 H new ATOM 0 HG12 VAL A 81 3.155 15.135 3.678 1.00 33.45 H new ATOM 0 HG13 VAL A 81 3.461 13.391 3.853 1.00 33.45 H new ATOM 0 HG21 VAL A 81 1.726 12.559 1.365 1.00 15.43 H new ATOM 0 HG22 VAL A 81 1.624 11.711 2.927 1.00 15.43 H new ATOM 0 HG23 VAL A 81 0.158 12.403 2.193 1.00 15.43 H new ATOM 1282 N ALA A 82 -1.326 12.630 4.463 1.00 15.11 N ATOM 1283 CA ALA A 82 -2.779 12.459 4.249 1.00 54.10 C ATOM 1284 C ALA A 82 -3.357 11.324 5.098 1.00 21.34 C ATOM 1285 O ALA A 82 -2.633 10.446 5.555 1.00 21.21 O ATOM 1286 CB ALA A 82 -3.068 12.218 2.751 1.00 3.40 C ATOM 0 H ALA A 82 -0.833 11.771 4.709 1.00 15.11 H new ATOM 0 HA ALA A 82 -3.271 13.378 4.567 1.00 54.10 H new ATOM 0 HB1 ALA A 82 -4.141 12.093 2.603 1.00 3.40 H new ATOM 0 HB2 ALA A 82 -2.719 13.072 2.171 1.00 3.40 H new ATOM 0 HB3 ALA A 82 -2.549 11.318 2.420 1.00 3.40 H new ATOM 1292 N THR A 83 -4.677 11.387 5.312 1.00 54.43 N ATOM 1293 CA THR A 83 -5.472 10.317 5.917 1.00 71.14 C ATOM 1294 C THR A 83 -6.710 10.096 5.034 1.00 14.32 C ATOM 1295 O THR A 83 -7.449 11.038 4.738 1.00 34.41 O ATOM 1296 CB THR A 83 -5.898 10.663 7.382 1.00 60.24 C ATOM 1297 OG1 THR A 83 -4.723 10.832 8.192 1.00 72.32 O ATOM 1298 CG2 THR A 83 -6.799 9.576 8.005 1.00 31.42 C ATOM 0 H THR A 83 -5.233 12.205 5.062 1.00 54.43 H new ATOM 0 HA THR A 83 -4.871 9.409 5.975 1.00 71.14 H new ATOM 0 HB THR A 83 -6.476 11.586 7.347 1.00 60.24 H new ATOM 0 HG1 THR A 83 -4.424 9.959 8.521 1.00 72.32 H new ATOM 0 HG21 THR A 83 -7.067 9.864 9.022 1.00 31.42 H new ATOM 0 HG22 THR A 83 -7.705 9.468 7.408 1.00 31.42 H new ATOM 0 HG23 THR A 83 -6.263 8.627 8.026 1.00 31.42 H new ATOM 1306 N LEU A 84 -6.918 8.851 4.622 1.00 44.02 N ATOM 1307 CA LEU A 84 -7.928 8.478 3.626 1.00 33.24 C ATOM 1308 C LEU A 84 -9.124 7.855 4.365 1.00 61.13 C ATOM 1309 O LEU A 84 -9.043 6.718 4.835 1.00 10.43 O ATOM 1310 CB LEU A 84 -7.304 7.497 2.585 1.00 23.41 C ATOM 1311 CG LEU A 84 -5.898 7.902 2.016 1.00 43.40 C ATOM 1312 CD1 LEU A 84 -5.404 6.882 0.973 1.00 0.21 C ATOM 1313 CD2 LEU A 84 -5.883 9.343 1.450 1.00 73.15 C ATOM 0 H LEU A 84 -6.384 8.056 4.973 1.00 44.02 H new ATOM 0 HA LEU A 84 -8.276 9.351 3.074 1.00 33.24 H new ATOM 0 HB2 LEU A 84 -7.217 6.514 3.048 1.00 23.41 H new ATOM 0 HB3 LEU A 84 -7.997 7.396 1.750 1.00 23.41 H new ATOM 0 HG LEU A 84 -5.202 7.889 2.854 1.00 43.40 H new ATOM 0 HD11 LEU A 84 -4.428 7.189 0.597 1.00 0.21 H new ATOM 0 HD12 LEU A 84 -5.321 5.899 1.436 1.00 0.21 H new ATOM 0 HD13 LEU A 84 -6.113 6.835 0.146 1.00 0.21 H new ATOM 0 HD21 LEU A 84 -4.888 9.574 1.069 1.00 73.15 H new ATOM 0 HD22 LEU A 84 -6.609 9.424 0.641 1.00 73.15 H new ATOM 0 HD23 LEU A 84 -6.141 10.047 2.241 1.00 73.15 H new ATOM 1325 N SER A 85 -10.204 8.629 4.497 1.00 14.12 N ATOM 1326 CA SER A 85 -11.382 8.265 5.301 1.00 52.52 C ATOM 1327 C SER A 85 -12.468 7.618 4.423 1.00 12.05 C ATOM 1328 O SER A 85 -12.893 8.207 3.427 1.00 13.25 O ATOM 1329 CB SER A 85 -11.926 9.535 5.986 1.00 21.23 C ATOM 1330 OG SER A 85 -10.906 10.165 6.747 1.00 64.11 O ATOM 0 H SER A 85 -10.290 9.539 4.044 1.00 14.12 H new ATOM 0 HA SER A 85 -11.092 7.534 6.056 1.00 52.52 H new ATOM 0 HB2 SER A 85 -12.307 10.226 5.234 1.00 21.23 H new ATOM 0 HB3 SER A 85 -12.764 9.276 6.634 1.00 21.23 H new ATOM 0 HG SER A 85 -10.528 9.522 7.382 1.00 64.11 H new ATOM 1336 N PHE A 86 -12.928 6.421 4.817 1.00 53.14 N ATOM 1337 CA PHE A 86 -13.920 5.632 4.059 1.00 74.53 C ATOM 1338 C PHE A 86 -14.707 4.718 5.016 1.00 61.12 C ATOM 1339 O PHE A 86 -14.606 4.844 6.242 1.00 23.33 O ATOM 1340 CB PHE A 86 -13.221 4.810 2.923 1.00 45.13 C ATOM 1341 CG PHE A 86 -12.153 3.806 3.382 1.00 42.10 C ATOM 1342 CD1 PHE A 86 -10.866 4.229 3.711 1.00 32.01 C ATOM 1343 CD2 PHE A 86 -12.431 2.440 3.462 1.00 45.42 C ATOM 1344 CE1 PHE A 86 -9.899 3.327 4.104 1.00 41.42 C ATOM 1345 CE2 PHE A 86 -11.463 1.541 3.858 1.00 22.50 C ATOM 1346 CZ PHE A 86 -10.196 1.984 4.179 1.00 51.14 C ATOM 0 H PHE A 86 -12.622 5.967 5.677 1.00 53.14 H new ATOM 0 HA PHE A 86 -14.626 6.312 3.582 1.00 74.53 H new ATOM 0 HB2 PHE A 86 -13.987 4.268 2.369 1.00 45.13 H new ATOM 0 HB3 PHE A 86 -12.759 5.510 2.226 1.00 45.13 H new ATOM 0 HD1 PHE A 86 -10.622 5.280 3.657 1.00 32.01 H new ATOM 0 HD2 PHE A 86 -13.418 2.082 3.210 1.00 45.42 H new ATOM 0 HE1 PHE A 86 -8.907 3.674 4.353 1.00 41.42 H new ATOM 0 HE2 PHE A 86 -11.697 0.488 3.917 1.00 22.50 H new ATOM 0 HZ PHE A 86 -9.439 1.279 4.488 1.00 51.14 H new ATOM 1356 N ASP A 87 -15.529 3.842 4.437 1.00 22.54 N ATOM 1357 CA ASP A 87 -16.220 2.760 5.162 1.00 63.21 C ATOM 1358 C ASP A 87 -15.828 1.420 4.529 1.00 70.23 C ATOM 1359 O ASP A 87 -15.533 1.367 3.328 1.00 12.42 O ATOM 1360 CB ASP A 87 -17.764 2.963 5.129 1.00 63.33 C ATOM 1361 CG ASP A 87 -18.378 2.930 3.706 1.00 43.42 C ATOM 1362 OD1 ASP A 87 -18.434 3.988 3.045 1.00 73.42 O ATOM 1363 OD2 ASP A 87 -18.812 1.844 3.244 1.00 32.34 O ATOM 0 H ASP A 87 -15.740 3.859 3.439 1.00 22.54 H new ATOM 0 HA ASP A 87 -15.918 2.771 6.209 1.00 63.21 H new ATOM 0 HB2 ASP A 87 -18.234 2.188 5.734 1.00 63.33 H new ATOM 0 HB3 ASP A 87 -18.004 3.919 5.594 1.00 63.33 H new ATOM 1368 N LEU A 88 -15.807 0.352 5.337 1.00 53.24 N ATOM 1369 CA LEU A 88 -15.500 -1.011 4.860 1.00 42.43 C ATOM 1370 C LEU A 88 -16.090 -2.058 5.814 1.00 12.24 C ATOM 1371 O LEU A 88 -16.062 -1.864 7.037 1.00 1.20 O ATOM 1372 CB LEU A 88 -13.967 -1.227 4.725 1.00 60.33 C ATOM 1373 CG LEU A 88 -13.516 -2.621 4.170 1.00 73.53 C ATOM 1374 CD1 LEU A 88 -13.954 -2.813 2.697 1.00 50.14 C ATOM 1375 CD2 LEU A 88 -12.000 -2.824 4.347 1.00 11.51 C ATOM 0 H LEU A 88 -16.001 0.403 6.337 1.00 53.24 H new ATOM 0 HA LEU A 88 -15.952 -1.128 3.875 1.00 42.43 H new ATOM 0 HB2 LEU A 88 -13.567 -0.451 4.072 1.00 60.33 H new ATOM 0 HB3 LEU A 88 -13.512 -1.084 5.705 1.00 60.33 H new ATOM 0 HG LEU A 88 -14.019 -3.391 4.755 1.00 73.53 H new ATOM 0 HD11 LEU A 88 -13.625 -3.790 2.344 1.00 50.14 H new ATOM 0 HD12 LEU A 88 -15.040 -2.750 2.629 1.00 50.14 H new ATOM 0 HD13 LEU A 88 -13.506 -2.034 2.080 1.00 50.14 H new ATOM 0 HD21 LEU A 88 -11.715 -3.800 3.953 1.00 11.51 H new ATOM 0 HD22 LEU A 88 -11.463 -2.044 3.807 1.00 11.51 H new ATOM 0 HD23 LEU A 88 -11.747 -2.772 5.406 1.00 11.51 H new ATOM 1387 N ASP A 89 -16.621 -3.158 5.217 1.00 53.43 N ATOM 1388 CA ASP A 89 -17.118 -4.360 5.922 1.00 2.11 C ATOM 1389 C ASP A 89 -18.415 -4.064 6.712 1.00 23.22 C ATOM 1390 O ASP A 89 -19.517 -4.420 6.272 1.00 14.14 O ATOM 1391 CB ASP A 89 -16.007 -4.973 6.823 1.00 13.44 C ATOM 1392 CG ASP A 89 -16.453 -6.244 7.564 1.00 72.15 C ATOM 1393 OD1 ASP A 89 -16.548 -7.315 6.924 1.00 63.20 O ATOM 1394 OD2 ASP A 89 -16.688 -6.186 8.787 1.00 14.13 O ATOM 0 H ASP A 89 -16.716 -3.230 4.204 1.00 53.43 H new ATOM 0 HA ASP A 89 -17.377 -5.107 5.171 1.00 2.11 H new ATOM 0 HB2 ASP A 89 -15.138 -5.206 6.207 1.00 13.44 H new ATOM 0 HB3 ASP A 89 -15.690 -4.228 7.553 1.00 13.44 H new ATOM 1399 N GLY A 90 -18.271 -3.394 7.862 1.00 5.25 N ATOM 1400 CA GLY A 90 -19.404 -3.010 8.708 1.00 54.14 C ATOM 1401 C GLY A 90 -19.060 -1.874 9.659 1.00 1.43 C ATOM 1402 O GLY A 90 -19.808 -1.615 10.605 1.00 32.31 O ATOM 0 H GLY A 90 -17.365 -3.104 8.231 1.00 5.25 H new ATOM 0 HA2 GLY A 90 -20.240 -2.710 8.076 1.00 54.14 H new ATOM 0 HA3 GLY A 90 -19.733 -3.875 9.284 1.00 54.14 H new ATOM 1406 N GLU A 91 -17.924 -1.197 9.412 1.00 43.51 N ATOM 1407 CA GLU A 91 -17.444 -0.081 10.245 1.00 54.23 C ATOM 1408 C GLU A 91 -16.797 1.013 9.376 1.00 32.34 C ATOM 1409 O GLU A 91 -16.464 0.781 8.212 1.00 42.54 O ATOM 1410 CB GLU A 91 -16.418 -0.602 11.284 1.00 55.33 C ATOM 1411 CG GLU A 91 -15.183 -1.310 10.665 1.00 71.23 C ATOM 1412 CD GLU A 91 -14.030 -1.530 11.655 1.00 73.32 C ATOM 1413 OE1 GLU A 91 -13.809 -0.653 12.515 1.00 64.15 O ATOM 1414 OE2 GLU A 91 -13.290 -2.530 11.528 1.00 61.14 O ATOM 0 H GLU A 91 -17.311 -1.410 8.625 1.00 43.51 H new ATOM 0 HA GLU A 91 -18.299 0.352 10.765 1.00 54.23 H new ATOM 0 HB2 GLU A 91 -16.075 0.237 11.890 1.00 55.33 H new ATOM 0 HB3 GLU A 91 -16.921 -1.297 11.957 1.00 55.33 H new ATOM 0 HG2 GLU A 91 -15.493 -2.275 10.264 1.00 71.23 H new ATOM 0 HG3 GLU A 91 -14.820 -0.717 9.825 1.00 71.23 H new ATOM 1421 N SER A 92 -16.638 2.206 9.964 1.00 20.22 N ATOM 1422 CA SER A 92 -15.865 3.301 9.362 1.00 0.11 C ATOM 1423 C SER A 92 -14.364 2.975 9.477 1.00 55.20 C ATOM 1424 O SER A 92 -13.887 2.639 10.570 1.00 61.02 O ATOM 1425 CB SER A 92 -16.181 4.636 10.071 1.00 2.11 C ATOM 1426 OG SER A 92 -15.410 5.703 9.536 1.00 24.35 O ATOM 0 H SER A 92 -17.042 2.440 10.871 1.00 20.22 H new ATOM 0 HA SER A 92 -16.136 3.404 8.311 1.00 0.11 H new ATOM 0 HB2 SER A 92 -17.242 4.863 9.966 1.00 2.11 H new ATOM 0 HB3 SER A 92 -15.980 4.539 11.138 1.00 2.11 H new ATOM 0 HG SER A 92 -15.633 6.535 10.004 1.00 24.35 H new ATOM 1432 N ARG A 93 -13.636 3.055 8.349 1.00 51.14 N ATOM 1433 CA ARG A 93 -12.210 2.702 8.273 1.00 2.20 C ATOM 1434 C ARG A 93 -11.383 3.845 7.688 1.00 54.03 C ATOM 1435 O ARG A 93 -11.855 4.592 6.836 1.00 53.44 O ATOM 1436 CB ARG A 93 -12.022 1.414 7.419 1.00 4.02 C ATOM 1437 CG ARG A 93 -12.524 0.104 8.065 1.00 54.52 C ATOM 1438 CD ARG A 93 -11.684 -0.341 9.284 1.00 4.32 C ATOM 1439 NE ARG A 93 -11.903 0.493 10.479 1.00 41.43 N ATOM 1440 CZ ARG A 93 -10.966 1.194 11.139 1.00 1.44 C ATOM 1441 NH1 ARG A 93 -9.699 1.205 10.738 1.00 4.03 N ATOM 1442 NH2 ARG A 93 -11.325 1.899 12.191 1.00 43.54 N ATOM 0 H ARG A 93 -14.025 3.369 7.460 1.00 51.14 H new ATOM 0 HA ARG A 93 -11.856 2.516 9.287 1.00 2.20 H new ATOM 0 HB2 ARG A 93 -12.539 1.551 6.469 1.00 4.02 H new ATOM 0 HB3 ARG A 93 -10.962 1.302 7.191 1.00 4.02 H new ATOM 0 HG2 ARG A 93 -13.561 0.235 8.376 1.00 54.52 H new ATOM 0 HG3 ARG A 93 -12.513 -0.689 7.317 1.00 54.52 H new ATOM 0 HD2 ARG A 93 -11.924 -1.377 9.523 1.00 4.32 H new ATOM 0 HD3 ARG A 93 -10.627 -0.312 9.018 1.00 4.32 H new ATOM 0 HE ARG A 93 -12.856 0.543 10.839 1.00 41.43 H new ATOM 0 HH11 ARG A 93 -9.421 0.674 9.913 1.00 4.03 H new ATOM 0 HH12 ARG A 93 -9.005 1.745 11.255 1.00 4.03 H new ATOM 0 HH21 ARG A 93 -12.300 1.906 12.492 1.00 43.54 H new ATOM 0 HH22 ARG A 93 -10.629 2.438 12.706 1.00 43.54 H new ATOM 1456 N ASP A 94 -10.141 3.960 8.166 1.00 40.13 N ATOM 1457 CA ASP A 94 -9.145 4.917 7.644 1.00 25.30 C ATOM 1458 C ASP A 94 -7.902 4.165 7.175 1.00 41.40 C ATOM 1459 O ASP A 94 -7.621 3.079 7.678 1.00 64.24 O ATOM 1460 CB ASP A 94 -8.741 5.945 8.738 1.00 5.54 C ATOM 1461 CG ASP A 94 -9.884 6.891 9.120 1.00 34.02 C ATOM 1462 OD1 ASP A 94 -10.690 6.544 10.010 1.00 62.33 O ATOM 1463 OD2 ASP A 94 -9.974 7.990 8.543 1.00 25.30 O ATOM 0 H ASP A 94 -9.789 3.388 8.934 1.00 40.13 H new ATOM 0 HA ASP A 94 -9.591 5.453 6.806 1.00 25.30 H new ATOM 0 HB2 ASP A 94 -8.407 5.409 9.627 1.00 5.54 H new ATOM 0 HB3 ASP A 94 -7.894 6.532 8.383 1.00 5.54 H new ATOM 1468 N LEU A 95 -7.193 4.746 6.184 1.00 45.41 N ATOM 1469 CA LEU A 95 -5.819 4.358 5.797 1.00 51.11 C ATOM 1470 C LEU A 95 -4.990 5.628 5.659 1.00 64.15 C ATOM 1471 O LEU A 95 -5.370 6.522 4.923 1.00 35.43 O ATOM 1472 CB LEU A 95 -5.771 3.566 4.457 1.00 55.33 C ATOM 1473 CG LEU A 95 -6.388 2.141 4.481 1.00 44.12 C ATOM 1474 CD1 LEU A 95 -6.096 1.395 3.173 1.00 22.35 C ATOM 1475 CD2 LEU A 95 -5.899 1.337 5.694 1.00 5.23 C ATOM 0 H LEU A 95 -7.565 5.511 5.621 1.00 45.41 H new ATOM 0 HA LEU A 95 -5.423 3.699 6.570 1.00 51.11 H new ATOM 0 HB2 LEU A 95 -6.287 4.150 3.695 1.00 55.33 H new ATOM 0 HB3 LEU A 95 -4.730 3.484 4.145 1.00 55.33 H new ATOM 0 HG LEU A 95 -7.468 2.251 4.574 1.00 44.12 H new ATOM 0 HD11 LEU A 95 -6.539 0.400 3.215 1.00 22.35 H new ATOM 0 HD12 LEU A 95 -6.523 1.947 2.336 1.00 22.35 H new ATOM 0 HD13 LEU A 95 -5.018 1.307 3.037 1.00 22.35 H new ATOM 0 HD21 LEU A 95 -6.351 0.345 5.679 1.00 5.23 H new ATOM 0 HD22 LEU A 95 -4.814 1.242 5.654 1.00 5.23 H new ATOM 0 HD23 LEU A 95 -6.185 1.852 6.611 1.00 5.23 H new ATOM 1487 N HIS A 96 -3.858 5.704 6.348 1.00 71.33 N ATOM 1488 CA HIS A 96 -3.026 6.908 6.351 1.00 30.12 C ATOM 1489 C HIS A 96 -1.998 6.815 5.210 1.00 44.02 C ATOM 1490 O HIS A 96 -1.377 5.766 5.017 1.00 42.40 O ATOM 1491 CB HIS A 96 -2.342 7.067 7.729 1.00 24.14 C ATOM 1492 CG HIS A 96 -3.305 7.248 8.884 1.00 13.21 C ATOM 1493 ND1 HIS A 96 -3.340 8.405 9.611 1.00 42.00 N ATOM 1494 CD2 HIS A 96 -4.220 6.386 9.405 1.00 61.20 C ATOM 1495 CE1 HIS A 96 -4.256 8.233 10.540 1.00 71.01 C ATOM 1496 NE2 HIS A 96 -4.820 7.025 10.456 1.00 53.44 N ATOM 0 H HIS A 96 -3.490 4.941 6.917 1.00 71.33 H new ATOM 0 HA HIS A 96 -3.640 7.793 6.184 1.00 30.12 H new ATOM 0 HB2 HIS A 96 -1.725 6.189 7.919 1.00 24.14 H new ATOM 0 HB3 HIS A 96 -1.671 7.925 7.692 1.00 24.14 H new ATOM 0 HD1 HIS A 96 -2.769 9.237 9.463 1.00 42.00 H new ATOM 0 HD2 HIS A 96 -4.433 5.387 9.055 1.00 61.20 H new ATOM 0 HE1 HIS A 96 -4.519 8.976 11.278 1.00 71.01 H new ATOM 1504 N ALA A 97 -1.857 7.913 4.449 1.00 33.44 N ATOM 1505 CA ALA A 97 -0.936 8.015 3.307 1.00 12.11 C ATOM 1506 C ALA A 97 0.299 8.819 3.714 1.00 20.13 C ATOM 1507 O ALA A 97 0.177 9.919 4.277 1.00 4.23 O ATOM 1508 CB ALA A 97 -1.643 8.676 2.108 1.00 22.23 C ATOM 0 H ALA A 97 -2.389 8.768 4.613 1.00 33.44 H new ATOM 0 HA ALA A 97 -0.623 7.015 3.008 1.00 12.11 H new ATOM 0 HB1 ALA A 97 -0.950 8.745 1.270 1.00 22.23 H new ATOM 0 HB2 ALA A 97 -2.505 8.075 1.817 1.00 22.23 H new ATOM 0 HB3 ALA A 97 -1.975 9.676 2.387 1.00 22.23 H new ATOM 1514 N PHE A 98 1.486 8.262 3.434 1.00 10.45 N ATOM 1515 CA PHE A 98 2.780 8.868 3.793 1.00 30.22 C ATOM 1516 C PHE A 98 3.696 8.903 2.558 1.00 73.23 C ATOM 1517 O PHE A 98 3.358 8.366 1.500 1.00 73.35 O ATOM 1518 CB PHE A 98 3.491 8.044 4.912 1.00 73.24 C ATOM 1519 CG PHE A 98 2.616 7.534 6.054 1.00 44.13 C ATOM 1520 CD1 PHE A 98 1.927 6.328 5.937 1.00 53.01 C ATOM 1521 CD2 PHE A 98 2.508 8.229 7.251 1.00 41.22 C ATOM 1522 CE1 PHE A 98 1.162 5.840 6.974 1.00 3.24 C ATOM 1523 CE2 PHE A 98 1.742 7.736 8.288 1.00 50.01 C ATOM 1524 CZ PHE A 98 1.071 6.545 8.146 1.00 10.34 C ATOM 0 H PHE A 98 1.578 7.370 2.948 1.00 10.45 H new ATOM 0 HA PHE A 98 2.590 9.878 4.156 1.00 30.22 H new ATOM 0 HB2 PHE A 98 3.975 7.186 4.446 1.00 73.24 H new ATOM 0 HB3 PHE A 98 4.280 8.662 5.339 1.00 73.24 H new ATOM 0 HD1 PHE A 98 1.994 5.766 5.017 1.00 53.01 H new ATOM 0 HD2 PHE A 98 3.030 9.167 7.372 1.00 41.22 H new ATOM 0 HE1 PHE A 98 0.635 4.904 6.864 1.00 3.24 H new ATOM 0 HE2 PHE A 98 1.670 8.288 9.214 1.00 50.01 H new ATOM 0 HZ PHE A 98 0.471 6.164 8.959 1.00 10.34 H new ATOM 1534 N ARG A 99 4.862 9.535 2.733 1.00 61.22 N ATOM 1535 CA ARG A 99 5.968 9.536 1.758 1.00 54.14 C ATOM 1536 C ARG A 99 7.244 9.973 2.490 1.00 34.02 C ATOM 1537 O ARG A 99 7.171 10.854 3.347 1.00 22.24 O ATOM 1538 CB ARG A 99 5.632 10.449 0.550 1.00 15.54 C ATOM 1539 CG ARG A 99 5.313 11.933 0.896 1.00 14.43 C ATOM 1540 CD ARG A 99 4.178 12.513 0.036 1.00 55.33 C ATOM 1541 NE ARG A 99 4.440 12.421 -1.416 1.00 44.21 N ATOM 1542 CZ ARG A 99 3.754 13.077 -2.367 1.00 14.43 C ATOM 1543 NH1 ARG A 99 2.751 13.893 -2.058 1.00 53.52 N ATOM 1544 NH2 ARG A 99 4.084 12.907 -3.636 1.00 30.12 N ATOM 0 H ARG A 99 5.072 10.073 3.574 1.00 61.22 H new ATOM 0 HA ARG A 99 6.123 8.538 1.347 1.00 54.14 H new ATOM 0 HB2 ARG A 99 6.473 10.429 -0.143 1.00 15.54 H new ATOM 0 HB3 ARG A 99 4.776 10.025 0.024 1.00 15.54 H new ATOM 0 HG2 ARG A 99 5.039 12.005 1.948 1.00 14.43 H new ATOM 0 HG3 ARG A 99 6.211 12.535 0.758 1.00 14.43 H new ATOM 0 HD2 ARG A 99 3.252 11.986 0.265 1.00 55.33 H new ATOM 0 HD3 ARG A 99 4.025 13.558 0.305 1.00 55.33 H new ATOM 0 HE ARG A 99 5.200 11.812 -1.719 1.00 44.21 H new ATOM 0 HH11 ARG A 99 2.488 14.031 -1.082 1.00 53.52 H new ATOM 0 HH12 ARG A 99 2.244 14.381 -2.797 1.00 53.52 H new ATOM 0 HH21 ARG A 99 4.852 12.283 -3.884 1.00 30.12 H new ATOM 0 HH22 ARG A 99 3.571 13.400 -4.367 1.00 30.12 H new ATOM 1558 N GLN A 100 8.391 9.355 2.127 1.00 75.14 N ATOM 1559 CA GLN A 100 9.639 9.354 2.937 1.00 34.41 C ATOM 1560 C GLN A 100 10.050 10.766 3.440 1.00 44.40 C ATOM 1561 O GLN A 100 9.863 11.074 4.626 1.00 72.03 O ATOM 1562 CB GLN A 100 10.785 8.669 2.135 1.00 22.15 C ATOM 1563 CG GLN A 100 10.445 7.232 1.668 1.00 44.45 C ATOM 1564 CD GLN A 100 11.496 6.558 0.770 1.00 3.31 C ATOM 1565 OE1 GLN A 100 11.153 5.760 -0.105 1.00 14.24 O ATOM 1566 NE2 GLN A 100 12.773 6.826 0.997 1.00 42.21 N ATOM 0 H GLN A 100 8.481 8.836 1.254 1.00 75.14 H new ATOM 0 HA GLN A 100 9.441 8.778 3.841 1.00 34.41 H new ATOM 0 HB2 GLN A 100 11.021 9.279 1.263 1.00 22.15 H new ATOM 0 HB3 GLN A 100 11.682 8.638 2.754 1.00 22.15 H new ATOM 0 HG2 GLN A 100 10.294 6.609 2.550 1.00 44.45 H new ATOM 0 HG3 GLN A 100 9.497 7.259 1.130 1.00 44.45 H new ATOM 0 HE21 GLN A 100 13.033 7.490 1.726 1.00 42.21 H new ATOM 0 HE22 GLN A 100 13.497 6.369 0.442 1.00 42.21 H new ATOM 1575 N ALA A 101 10.572 11.630 2.550 1.00 30.24 N ATOM 1576 CA ALA A 101 10.925 13.012 2.924 1.00 24.31 C ATOM 1577 C ALA A 101 10.056 14.031 2.170 1.00 10.14 C ATOM 1578 O ALA A 101 9.053 14.514 2.702 1.00 5.05 O ATOM 1579 CB ALA A 101 12.427 13.252 2.686 1.00 40.11 C ATOM 0 H ALA A 101 10.758 11.398 1.574 1.00 30.24 H new ATOM 0 HA ALA A 101 10.723 13.152 3.986 1.00 24.31 H new ATOM 0 HB1 ALA A 101 12.681 14.275 2.964 1.00 40.11 H new ATOM 0 HB2 ALA A 101 13.007 12.556 3.292 1.00 40.11 H new ATOM 0 HB3 ALA A 101 12.658 13.095 1.632 1.00 40.11 H new ATOM 1585 N ALA A 102 10.400 14.304 0.901 1.00 43.13 N ATOM 1586 CA ALA A 102 9.770 15.379 0.108 1.00 21.41 C ATOM 1587 C ALA A 102 9.326 14.877 -1.272 1.00 43.41 C ATOM 1588 O ALA A 102 9.450 15.602 -2.270 1.00 14.04 O ATOM 1589 CB ALA A 102 10.766 16.551 -0.011 1.00 71.15 C ATOM 0 H ALA A 102 11.120 13.789 0.395 1.00 43.13 H new ATOM 0 HA ALA A 102 8.867 15.720 0.615 1.00 21.41 H new ATOM 0 HB1 ALA A 102 10.315 17.354 -0.594 1.00 71.15 H new ATOM 0 HB2 ALA A 102 11.014 16.921 0.984 1.00 71.15 H new ATOM 0 HB3 ALA A 102 11.674 16.208 -0.507 1.00 71.15 H new ATOM 1595 N ASP A 103 8.786 13.646 -1.321 1.00 41.33 N ATOM 1596 CA ASP A 103 8.406 12.976 -2.585 1.00 34.01 C ATOM 1597 C ASP A 103 7.400 13.809 -3.405 1.00 40.22 C ATOM 1598 O ASP A 103 6.476 14.391 -2.854 1.00 74.23 O ATOM 1599 CB ASP A 103 7.790 11.586 -2.296 1.00 74.22 C ATOM 1600 CG ASP A 103 7.291 10.877 -3.568 1.00 2.04 C ATOM 1601 OD1 ASP A 103 8.131 10.412 -4.348 1.00 64.24 O ATOM 1602 OD2 ASP A 103 6.065 10.824 -3.807 1.00 71.22 O ATOM 0 H ASP A 103 8.600 13.086 -0.489 1.00 41.33 H new ATOM 0 HA ASP A 103 9.319 12.867 -3.170 1.00 34.01 H new ATOM 0 HB2 ASP A 103 8.534 10.959 -1.805 1.00 74.22 H new ATOM 0 HB3 ASP A 103 6.959 11.700 -1.600 1.00 74.22 H new ATOM 1607 N GLU A 104 7.611 13.852 -4.720 1.00 51.03 N ATOM 1608 CA GLU A 104 6.678 14.471 -5.684 1.00 12.01 C ATOM 1609 C GLU A 104 6.431 13.534 -6.882 1.00 44.53 C ATOM 1610 O GLU A 104 5.811 13.925 -7.876 1.00 21.22 O ATOM 1611 CB GLU A 104 7.255 15.850 -6.113 1.00 52.13 C ATOM 1612 CG GLU A 104 8.729 15.823 -6.583 1.00 42.15 C ATOM 1613 CD GLU A 104 9.356 17.227 -6.661 1.00 4.21 C ATOM 1614 OE1 GLU A 104 9.738 17.769 -5.603 1.00 10.13 O ATOM 1615 OE2 GLU A 104 9.457 17.795 -7.764 1.00 71.52 O ATOM 0 H GLU A 104 8.442 13.456 -5.159 1.00 51.03 H new ATOM 0 HA GLU A 104 5.705 14.633 -5.221 1.00 12.01 H new ATOM 0 HB2 GLU A 104 6.639 16.250 -6.919 1.00 52.13 H new ATOM 0 HB3 GLU A 104 7.169 16.540 -5.274 1.00 52.13 H new ATOM 0 HG2 GLU A 104 9.313 15.207 -5.899 1.00 42.15 H new ATOM 0 HG3 GLU A 104 8.784 15.350 -7.564 1.00 42.15 H new ATOM 1622 N SER A 105 6.872 12.270 -6.735 1.00 55.01 N ATOM 1623 CA SER A 105 6.734 11.213 -7.754 1.00 21.14 C ATOM 1624 C SER A 105 5.410 10.415 -7.571 1.00 60.41 C ATOM 1625 O SER A 105 5.290 9.280 -8.061 1.00 41.52 O ATOM 1626 CB SER A 105 7.973 10.293 -7.662 1.00 41.43 C ATOM 1627 OG SER A 105 8.019 9.335 -8.703 1.00 21.22 O ATOM 0 H SER A 105 7.343 11.949 -5.889 1.00 55.01 H new ATOM 0 HA SER A 105 6.683 11.660 -8.747 1.00 21.14 H new ATOM 0 HB2 SER A 105 8.876 10.902 -7.694 1.00 41.43 H new ATOM 0 HB3 SER A 105 7.969 9.779 -6.701 1.00 41.43 H new ATOM 0 HG SER A 105 7.120 8.975 -8.856 1.00 21.22 H new ATOM 1633 N ARG A 106 4.444 11.016 -6.827 1.00 62.20 N ATOM 1634 CA ARG A 106 3.077 10.460 -6.596 1.00 4.23 C ATOM 1635 C ARG A 106 3.092 9.238 -5.655 1.00 60.33 C ATOM 1636 O ARG A 106 2.037 8.676 -5.372 1.00 50.11 O ATOM 1637 CB ARG A 106 2.350 10.096 -7.941 1.00 13.04 C ATOM 1638 CG ARG A 106 2.109 11.280 -8.908 1.00 3.43 C ATOM 1639 CD ARG A 106 1.099 12.305 -8.374 1.00 44.30 C ATOM 1640 NE ARG A 106 0.918 13.440 -9.296 1.00 32.23 N ATOM 1641 CZ ARG A 106 1.350 14.696 -9.083 1.00 30.44 C ATOM 1642 NH1 ARG A 106 2.005 15.013 -7.971 1.00 64.15 N ATOM 1643 NH2 ARG A 106 1.082 15.641 -9.970 1.00 5.11 N ATOM 0 H ARG A 106 4.592 11.912 -6.363 1.00 62.20 H new ATOM 0 HA ARG A 106 2.513 11.255 -6.108 1.00 4.23 H new ATOM 0 HB2 ARG A 106 2.939 9.340 -8.460 1.00 13.04 H new ATOM 0 HB3 ARG A 106 1.388 9.642 -7.703 1.00 13.04 H new ATOM 0 HG2 ARG A 106 3.057 11.781 -9.101 1.00 3.43 H new ATOM 0 HG3 ARG A 106 1.753 10.893 -9.863 1.00 3.43 H new ATOM 0 HD2 ARG A 106 0.139 11.815 -8.210 1.00 44.30 H new ATOM 0 HD3 ARG A 106 1.437 12.675 -7.406 1.00 44.30 H new ATOM 0 HE ARG A 106 0.423 13.258 -10.169 1.00 32.23 H new ATOM 0 HH11 ARG A 106 2.186 14.300 -7.265 1.00 64.15 H new ATOM 0 HH12 ARG A 106 2.326 15.970 -7.824 1.00 64.15 H new ATOM 0 HH21 ARG A 106 0.550 15.415 -10.811 1.00 5.11 H new ATOM 0 HH22 ARG A 106 1.407 16.595 -9.813 1.00 5.11 H new ATOM 1657 N THR A 107 4.270 8.874 -5.125 1.00 53.35 N ATOM 1658 CA THR A 107 4.459 7.613 -4.399 1.00 53.42 C ATOM 1659 C THR A 107 3.950 7.749 -2.952 1.00 34.12 C ATOM 1660 O THR A 107 4.625 8.327 -2.088 1.00 72.10 O ATOM 1661 CB THR A 107 5.963 7.200 -4.422 1.00 25.50 C ATOM 1662 OG1 THR A 107 6.430 7.189 -5.783 1.00 73.01 O ATOM 1663 CG2 THR A 107 6.204 5.814 -3.790 1.00 51.13 C ATOM 0 H THR A 107 5.113 9.444 -5.188 1.00 53.35 H new ATOM 0 HA THR A 107 3.881 6.831 -4.891 1.00 53.42 H new ATOM 0 HB THR A 107 6.513 7.930 -3.829 1.00 25.50 H new ATOM 0 HG1 THR A 107 5.778 6.725 -6.349 1.00 73.01 H new ATOM 0 HG21 THR A 107 7.267 5.575 -3.832 1.00 51.13 H new ATOM 0 HG22 THR A 107 5.875 5.826 -2.751 1.00 51.13 H new ATOM 0 HG23 THR A 107 5.641 5.060 -4.340 1.00 51.13 H new ATOM 1671 N LEU A 108 2.722 7.262 -2.721 1.00 53.55 N ATOM 1672 CA LEU A 108 2.067 7.299 -1.408 1.00 4.31 C ATOM 1673 C LEU A 108 1.984 5.881 -0.838 1.00 32.22 C ATOM 1674 O LEU A 108 1.501 4.964 -1.508 1.00 34.52 O ATOM 1675 CB LEU A 108 0.651 7.918 -1.521 1.00 1.24 C ATOM 1676 CG LEU A 108 0.546 9.300 -2.235 1.00 72.44 C ATOM 1677 CD1 LEU A 108 -0.886 9.847 -2.157 1.00 53.14 C ATOM 1678 CD2 LEU A 108 1.559 10.317 -1.667 1.00 41.43 C ATOM 0 H LEU A 108 2.152 6.828 -3.447 1.00 53.55 H new ATOM 0 HA LEU A 108 2.656 7.923 -0.736 1.00 4.31 H new ATOM 0 HB2 LEU A 108 0.012 7.212 -2.051 1.00 1.24 H new ATOM 0 HB3 LEU A 108 0.244 8.023 -0.515 1.00 1.24 H new ATOM 0 HG LEU A 108 0.797 9.146 -3.285 1.00 72.44 H new ATOM 0 HD11 LEU A 108 -0.935 10.812 -2.662 1.00 53.14 H new ATOM 0 HD12 LEU A 108 -1.569 9.149 -2.641 1.00 53.14 H new ATOM 0 HD13 LEU A 108 -1.172 9.969 -1.112 1.00 53.14 H new ATOM 0 HD21 LEU A 108 1.454 11.267 -2.191 1.00 41.43 H new ATOM 0 HD22 LEU A 108 1.368 10.466 -0.604 1.00 41.43 H new ATOM 0 HD23 LEU A 108 2.572 9.937 -1.804 1.00 41.43 H new ATOM 1690 N PHE A 109 2.438 5.720 0.402 1.00 64.10 N ATOM 1691 CA PHE A 109 2.486 4.430 1.090 1.00 25.00 C ATOM 1692 C PHE A 109 1.286 4.348 2.048 1.00 71.54 C ATOM 1693 O PHE A 109 1.199 5.142 2.991 1.00 1.02 O ATOM 1694 CB PHE A 109 3.833 4.329 1.852 1.00 42.42 C ATOM 1695 CG PHE A 109 4.107 2.983 2.525 1.00 32.11 C ATOM 1696 CD1 PHE A 109 4.585 1.896 1.787 1.00 51.30 C ATOM 1697 CD2 PHE A 109 3.896 2.804 3.894 1.00 72.03 C ATOM 1698 CE1 PHE A 109 4.859 0.686 2.402 1.00 23.13 C ATOM 1699 CE2 PHE A 109 4.166 1.594 4.506 1.00 51.11 C ATOM 1700 CZ PHE A 109 4.641 0.536 3.760 1.00 13.33 C ATOM 0 H PHE A 109 2.789 6.493 0.967 1.00 64.10 H new ATOM 0 HA PHE A 109 2.426 3.598 0.388 1.00 25.00 H new ATOM 0 HB2 PHE A 109 4.643 4.538 1.153 1.00 42.42 H new ATOM 0 HB3 PHE A 109 3.860 5.109 2.613 1.00 42.42 H new ATOM 0 HD1 PHE A 109 4.743 2.001 0.724 1.00 51.30 H new ATOM 0 HD2 PHE A 109 3.516 3.624 4.484 1.00 72.03 H new ATOM 0 HE1 PHE A 109 5.243 -0.140 1.822 1.00 23.13 H new ATOM 0 HE2 PHE A 109 4.005 1.478 5.568 1.00 51.11 H new ATOM 0 HZ PHE A 109 4.843 -0.412 4.237 1.00 13.33 H new ATOM 1710 N VAL A 110 0.343 3.424 1.776 1.00 65.41 N ATOM 1711 CA VAL A 110 -0.869 3.224 2.610 1.00 13.14 C ATOM 1712 C VAL A 110 -0.909 1.789 3.196 1.00 73.40 C ATOM 1713 O VAL A 110 -1.329 0.838 2.529 1.00 42.53 O ATOM 1714 CB VAL A 110 -2.203 3.559 1.820 1.00 75.12 C ATOM 1715 CG1 VAL A 110 -2.326 5.073 1.570 1.00 4.35 C ATOM 1716 CG2 VAL A 110 -2.302 2.791 0.480 1.00 74.20 C ATOM 0 H VAL A 110 0.396 2.795 0.975 1.00 65.41 H new ATOM 0 HA VAL A 110 -0.808 3.929 3.439 1.00 13.14 H new ATOM 0 HB VAL A 110 -3.030 3.231 2.449 1.00 75.12 H new ATOM 0 HG11 VAL A 110 -3.248 5.278 1.027 1.00 4.35 H new ATOM 0 HG12 VAL A 110 -2.342 5.599 2.524 1.00 4.35 H new ATOM 0 HG13 VAL A 110 -1.475 5.415 0.981 1.00 4.35 H new ATOM 0 HG21 VAL A 110 -3.233 3.055 -0.023 1.00 74.20 H new ATOM 0 HG22 VAL A 110 -1.458 3.058 -0.156 1.00 74.20 H new ATOM 0 HG23 VAL A 110 -2.285 1.718 0.673 1.00 74.20 H new ATOM 1726 N PRO A 111 -0.436 1.595 4.463 1.00 32.53 N ATOM 1727 CA PRO A 111 -0.521 0.286 5.135 1.00 32.13 C ATOM 1728 C PRO A 111 -1.955 -0.013 5.616 1.00 15.30 C ATOM 1729 O PRO A 111 -2.681 0.905 6.014 1.00 71.53 O ATOM 1730 CB PRO A 111 0.468 0.439 6.321 1.00 62.33 C ATOM 1731 CG PRO A 111 0.443 1.906 6.652 1.00 44.11 C ATOM 1732 CD PRO A 111 0.222 2.622 5.331 1.00 71.53 C ATOM 0 HA PRO A 111 -0.273 -0.550 4.481 1.00 32.13 H new ATOM 0 HB2 PRO A 111 0.159 -0.165 7.174 1.00 62.33 H new ATOM 0 HB3 PRO A 111 1.471 0.112 6.045 1.00 62.33 H new ATOM 0 HG2 PRO A 111 -0.354 2.134 7.359 1.00 44.11 H new ATOM 0 HG3 PRO A 111 1.379 2.219 7.115 1.00 44.11 H new ATOM 0 HD2 PRO A 111 -0.409 3.502 5.456 1.00 71.53 H new ATOM 0 HD3 PRO A 111 1.163 2.963 4.901 1.00 71.53 H new ATOM 1740 N PHE A 112 -2.371 -1.297 5.560 1.00 33.21 N ATOM 1741 CA PHE A 112 -3.620 -1.754 6.195 1.00 34.12 C ATOM 1742 C PHE A 112 -3.356 -3.065 6.957 1.00 52.44 C ATOM 1743 O PHE A 112 -2.913 -4.052 6.377 1.00 60.40 O ATOM 1744 CB PHE A 112 -4.797 -1.884 5.174 1.00 31.33 C ATOM 1745 CG PHE A 112 -4.768 -3.048 4.193 1.00 41.42 C ATOM 1746 CD1 PHE A 112 -4.066 -2.963 3.002 1.00 52.41 C ATOM 1747 CD2 PHE A 112 -5.483 -4.224 4.454 1.00 44.52 C ATOM 1748 CE1 PHE A 112 -4.077 -4.008 2.106 1.00 20.23 C ATOM 1749 CE2 PHE A 112 -5.484 -5.267 3.559 1.00 42.40 C ATOM 1750 CZ PHE A 112 -4.783 -5.160 2.384 1.00 22.22 C ATOM 0 H PHE A 112 -1.856 -2.035 5.079 1.00 33.21 H new ATOM 0 HA PHE A 112 -3.943 -0.996 6.909 1.00 34.12 H new ATOM 0 HB2 PHE A 112 -5.725 -1.949 5.741 1.00 31.33 H new ATOM 0 HB3 PHE A 112 -4.841 -0.961 4.596 1.00 31.33 H new ATOM 0 HD1 PHE A 112 -3.505 -2.069 2.774 1.00 52.41 H new ATOM 0 HD2 PHE A 112 -6.043 -4.312 5.373 1.00 44.52 H new ATOM 0 HE1 PHE A 112 -3.529 -3.925 1.179 1.00 20.23 H new ATOM 0 HE2 PHE A 112 -6.035 -6.169 3.780 1.00 42.40 H new ATOM 0 HZ PHE A 112 -4.784 -5.977 1.678 1.00 22.22 H new ATOM 1760 N ARG A 113 -3.598 -3.069 8.272 1.00 74.24 N ATOM 1761 CA ARG A 113 -3.338 -4.249 9.121 1.00 64.11 C ATOM 1762 C ARG A 113 -4.681 -4.899 9.465 1.00 12.23 C ATOM 1763 O ARG A 113 -5.465 -4.330 10.226 1.00 61.31 O ATOM 1764 CB ARG A 113 -2.562 -3.803 10.389 1.00 31.12 C ATOM 1765 CG ARG A 113 -1.896 -4.952 11.169 1.00 23.14 C ATOM 1766 CD ARG A 113 -1.073 -4.462 12.375 1.00 12.11 C ATOM 1767 NE ARG A 113 -0.121 -5.485 12.844 1.00 72.21 N ATOM 1768 CZ ARG A 113 -0.266 -6.259 13.929 1.00 35.24 C ATOM 1769 NH1 ARG A 113 -1.338 -6.157 14.705 1.00 65.14 N ATOM 1770 NH2 ARG A 113 0.682 -7.125 14.243 1.00 23.03 N ATOM 0 H ARG A 113 -3.975 -2.268 8.778 1.00 74.24 H new ATOM 0 HA ARG A 113 -2.723 -4.985 8.602 1.00 64.11 H new ATOM 0 HB2 ARG A 113 -1.794 -3.087 10.096 1.00 31.12 H new ATOM 0 HB3 ARG A 113 -3.249 -3.280 11.054 1.00 31.12 H new ATOM 0 HG2 ARG A 113 -2.665 -5.641 11.517 1.00 23.14 H new ATOM 0 HG3 ARG A 113 -1.247 -5.512 10.496 1.00 23.14 H new ATOM 0 HD2 ARG A 113 -0.529 -3.559 12.100 1.00 12.11 H new ATOM 0 HD3 ARG A 113 -1.747 -4.193 13.189 1.00 12.11 H new ATOM 0 HE ARG A 113 0.727 -5.616 12.292 1.00 72.21 H new ATOM 0 HH11 ARG A 113 -2.068 -5.481 14.480 1.00 65.14 H new ATOM 0 HH12 ARG A 113 -1.432 -6.754 15.527 1.00 65.14 H new ATOM 0 HH21 ARG A 113 1.516 -7.201 13.661 1.00 23.03 H new ATOM 0 HH22 ARG A 113 0.579 -7.717 15.067 1.00 23.03 H new ATOM 1784 N ASP A 114 -4.952 -6.090 8.915 1.00 11.30 N ATOM 1785 CA ASP A 114 -6.304 -6.677 8.911 1.00 65.03 C ATOM 1786 C ASP A 114 -6.320 -8.019 9.680 1.00 13.11 C ATOM 1787 O ASP A 114 -5.399 -8.299 10.449 1.00 21.35 O ATOM 1788 CB ASP A 114 -6.785 -6.821 7.439 1.00 23.03 C ATOM 1789 CG ASP A 114 -6.112 -7.979 6.689 1.00 0.43 C ATOM 1790 OD1 ASP A 114 -4.864 -8.083 6.730 1.00 3.14 O ATOM 1791 OD2 ASP A 114 -6.832 -8.809 6.095 1.00 4.53 O ATOM 0 H ASP A 114 -4.247 -6.673 8.463 1.00 11.30 H new ATOM 0 HA ASP A 114 -7.001 -6.021 9.432 1.00 65.03 H new ATOM 0 HB2 ASP A 114 -7.865 -6.971 7.430 1.00 23.03 H new ATOM 0 HB3 ASP A 114 -6.588 -5.890 6.907 1.00 23.03 H new ATOM 1796 N LYS A 115 -7.367 -8.846 9.472 1.00 4.31 N ATOM 1797 CA LYS A 115 -7.544 -10.126 10.193 1.00 15.42 C ATOM 1798 C LYS A 115 -6.884 -11.314 9.468 1.00 5.13 C ATOM 1799 O LYS A 115 -6.948 -12.429 9.979 1.00 63.13 O ATOM 1800 CB LYS A 115 -9.053 -10.411 10.454 1.00 25.35 C ATOM 1801 CG LYS A 115 -9.788 -9.413 11.396 1.00 61.25 C ATOM 1802 CD LYS A 115 -9.361 -9.485 12.895 1.00 52.22 C ATOM 1803 CE LYS A 115 -8.162 -8.588 13.255 1.00 65.24 C ATOM 1804 NZ LYS A 115 -7.791 -8.711 14.688 1.00 52.13 N ATOM 0 H LYS A 115 -8.111 -8.647 8.803 1.00 4.31 H new ATOM 0 HA LYS A 115 -7.034 -10.018 11.150 1.00 15.42 H new ATOM 0 HB2 LYS A 115 -9.571 -10.421 9.495 1.00 25.35 H new ATOM 0 HB3 LYS A 115 -9.145 -11.412 10.876 1.00 25.35 H new ATOM 0 HG2 LYS A 115 -9.615 -8.400 11.033 1.00 61.25 H new ATOM 0 HG3 LYS A 115 -10.860 -9.597 11.330 1.00 61.25 H new ATOM 0 HD2 LYS A 115 -10.211 -9.203 13.517 1.00 52.22 H new ATOM 0 HD3 LYS A 115 -9.114 -10.518 13.141 1.00 52.22 H new ATOM 0 HE2 LYS A 115 -7.308 -8.857 12.634 1.00 65.24 H new ATOM 0 HE3 LYS A 115 -8.405 -7.549 13.030 1.00 65.24 H new ATOM 0 HZ1 LYS A 115 -6.980 -8.092 14.891 1.00 52.13 H new ATOM 0 HZ2 LYS A 115 -8.598 -8.430 15.281 1.00 52.13 H new ATOM 0 HZ3 LYS A 115 -7.535 -9.697 14.897 1.00 52.13 H new ATOM 1818 N THR A 116 -6.276 -11.103 8.274 1.00 74.25 N ATOM 1819 CA THR A 116 -5.377 -12.127 7.682 1.00 44.31 C ATOM 1820 C THR A 116 -4.022 -12.118 8.416 1.00 33.23 C ATOM 1821 O THR A 116 -3.307 -13.126 8.427 1.00 75.42 O ATOM 1822 CB THR A 116 -5.133 -11.959 6.137 1.00 13.20 C ATOM 1823 OG1 THR A 116 -4.392 -10.761 5.863 1.00 14.31 O ATOM 1824 CG2 THR A 116 -6.449 -11.955 5.332 1.00 54.11 C ATOM 0 H THR A 116 -6.386 -10.257 7.714 1.00 74.25 H new ATOM 0 HA THR A 116 -5.888 -13.081 7.810 1.00 44.31 H new ATOM 0 HB THR A 116 -4.551 -12.824 5.818 1.00 13.20 H new ATOM 0 HG1 THR A 116 -4.721 -10.035 6.434 1.00 14.31 H new ATOM 0 HG21 THR A 116 -6.226 -11.836 4.272 1.00 54.11 H new ATOM 0 HG22 THR A 116 -6.975 -12.897 5.489 1.00 54.11 H new ATOM 0 HG23 THR A 116 -7.077 -11.129 5.665 1.00 54.11 H new ATOM 1832 N THR A 117 -3.702 -10.962 9.043 1.00 11.05 N ATOM 1833 CA THR A 117 -2.451 -10.736 9.778 1.00 71.33 C ATOM 1834 C THR A 117 -2.310 -11.729 10.961 1.00 2.14 C ATOM 1835 O THR A 117 -3.044 -11.649 11.953 1.00 41.13 O ATOM 1836 CB THR A 117 -2.378 -9.251 10.284 1.00 21.55 C ATOM 1837 OG1 THR A 117 -2.478 -8.351 9.156 1.00 63.13 O ATOM 1838 CG2 THR A 117 -1.082 -8.956 11.070 1.00 60.01 C ATOM 0 H THR A 117 -4.321 -10.151 9.048 1.00 11.05 H new ATOM 0 HA THR A 117 -1.618 -10.912 9.097 1.00 71.33 H new ATOM 0 HB THR A 117 -3.213 -9.098 10.968 1.00 21.55 H new ATOM 0 HG1 THR A 117 -1.839 -8.622 8.464 1.00 63.13 H new ATOM 0 HG21 THR A 117 -1.083 -7.916 11.396 1.00 60.01 H new ATOM 0 HG22 THR A 117 -1.028 -9.610 11.941 1.00 60.01 H new ATOM 0 HG23 THR A 117 -0.219 -9.134 10.429 1.00 60.01 H new ATOM 1846 N GLY A 118 -1.377 -12.682 10.797 1.00 61.02 N ATOM 1847 CA GLY A 118 -1.064 -13.691 11.815 1.00 2.52 C ATOM 1848 C GLY A 118 -2.127 -14.772 11.983 1.00 75.14 C ATOM 1849 O GLY A 118 -2.095 -15.503 12.972 1.00 55.34 O ATOM 0 H GLY A 118 -0.818 -12.772 9.949 1.00 61.02 H new ATOM 0 HA2 GLY A 118 -0.118 -14.167 11.558 1.00 2.52 H new ATOM 0 HA3 GLY A 118 -0.919 -13.190 12.772 1.00 2.52 H new ATOM 1853 N GLN A 119 -3.082 -14.875 11.033 1.00 30.32 N ATOM 1854 CA GLN A 119 -4.193 -15.848 11.112 1.00 60.41 C ATOM 1855 C GLN A 119 -4.135 -16.820 9.911 1.00 21.33 C ATOM 1856 O GLN A 119 -3.539 -17.898 10.022 1.00 30.24 O ATOM 1857 CB GLN A 119 -5.559 -15.100 11.197 1.00 60.13 C ATOM 1858 CG GLN A 119 -5.745 -14.189 12.436 1.00 3.43 C ATOM 1859 CD GLN A 119 -5.776 -14.956 13.757 1.00 35.44 C ATOM 1860 OE1 GLN A 119 -6.832 -15.400 14.212 1.00 74.45 O ATOM 1861 NE2 GLN A 119 -4.631 -15.097 14.402 1.00 31.22 N ATOM 0 H GLN A 119 -3.105 -14.291 10.197 1.00 30.32 H new ATOM 0 HA GLN A 119 -4.091 -16.443 12.019 1.00 60.41 H new ATOM 0 HB2 GLN A 119 -5.677 -14.492 10.300 1.00 60.13 H new ATOM 0 HB3 GLN A 119 -6.360 -15.840 11.188 1.00 60.13 H new ATOM 0 HG2 GLN A 119 -4.934 -13.461 12.467 1.00 3.43 H new ATOM 0 HG3 GLN A 119 -6.673 -13.628 12.329 1.00 3.43 H new ATOM 0 HE21 GLN A 119 -3.771 -14.720 14.003 1.00 31.22 H new ATOM 0 HE22 GLN A 119 -4.607 -15.583 15.299 1.00 31.22 H new ATOM 1870 N GLN A 120 -4.717 -16.420 8.752 1.00 11.12 N ATOM 1871 CA GLN A 120 -4.670 -17.228 7.499 1.00 63.31 C ATOM 1872 C GLN A 120 -3.537 -16.737 6.570 1.00 30.01 C ATOM 1873 O GLN A 120 -3.400 -17.191 5.433 1.00 1.32 O ATOM 1874 CB GLN A 120 -6.037 -17.222 6.749 1.00 42.25 C ATOM 1875 CG GLN A 120 -6.577 -15.832 6.306 1.00 45.11 C ATOM 1876 CD GLN A 120 -7.453 -15.113 7.354 1.00 31.34 C ATOM 1877 OE1 GLN A 120 -7.288 -15.272 8.557 1.00 72.40 O ATOM 1878 NE2 GLN A 120 -8.389 -14.306 6.899 1.00 1.10 N ATOM 0 H GLN A 120 -5.226 -15.541 8.656 1.00 11.12 H new ATOM 0 HA GLN A 120 -4.461 -18.258 7.788 1.00 63.31 H new ATOM 0 HB2 GLN A 120 -5.943 -17.850 5.863 1.00 42.25 H new ATOM 0 HB3 GLN A 120 -6.782 -17.688 7.393 1.00 42.25 H new ATOM 0 HG2 GLN A 120 -5.731 -15.191 6.059 1.00 45.11 H new ATOM 0 HG3 GLN A 120 -7.158 -15.958 5.392 1.00 45.11 H new ATOM 0 HE21 GLN A 120 -8.513 -14.185 5.894 1.00 1.10 H new ATOM 0 HE22 GLN A 120 -8.990 -13.802 7.552 1.00 1.10 H new ATOM 1887 N SER A 121 -2.711 -15.846 7.116 1.00 12.13 N ATOM 1888 CA SER A 121 -1.562 -15.221 6.445 1.00 3.24 C ATOM 1889 C SER A 121 -0.575 -14.788 7.539 1.00 65.01 C ATOM 1890 O SER A 121 -0.890 -14.872 8.738 1.00 63.10 O ATOM 1891 CB SER A 121 -1.998 -14.013 5.567 1.00 50.34 C ATOM 1892 OG SER A 121 -2.973 -14.385 4.600 1.00 41.35 O ATOM 0 H SER A 121 -2.825 -15.524 8.077 1.00 12.13 H new ATOM 0 HA SER A 121 -1.091 -15.932 5.766 1.00 3.24 H new ATOM 0 HB2 SER A 121 -2.401 -13.227 6.205 1.00 50.34 H new ATOM 0 HB3 SER A 121 -1.126 -13.598 5.062 1.00 50.34 H new ATOM 0 HG SER A 121 -3.223 -13.600 4.069 1.00 41.35 H new ATOM 1898 N TYR A 122 0.616 -14.330 7.128 1.00 13.51 N ATOM 1899 CA TYR A 122 1.709 -13.996 8.062 1.00 44.33 C ATOM 1900 C TYR A 122 1.376 -12.704 8.842 1.00 15.42 C ATOM 1901 O TYR A 122 0.462 -11.960 8.464 1.00 21.31 O ATOM 1902 CB TYR A 122 3.054 -13.879 7.283 1.00 73.34 C ATOM 1903 CG TYR A 122 4.311 -14.120 8.145 1.00 61.00 C ATOM 1904 CD1 TYR A 122 4.758 -15.419 8.404 1.00 64.23 C ATOM 1905 CD2 TYR A 122 5.043 -13.066 8.694 1.00 64.13 C ATOM 1906 CE1 TYR A 122 5.884 -15.650 9.170 1.00 20.25 C ATOM 1907 CE2 TYR A 122 6.168 -13.295 9.456 1.00 43.23 C ATOM 1908 CZ TYR A 122 6.584 -14.584 9.690 1.00 24.34 C ATOM 1909 OH TYR A 122 7.704 -14.808 10.455 1.00 52.24 O ATOM 0 H TYR A 122 0.851 -14.180 6.147 1.00 13.51 H new ATOM 0 HA TYR A 122 1.818 -14.795 8.795 1.00 44.33 H new ATOM 0 HB2 TYR A 122 3.048 -14.596 6.462 1.00 73.34 H new ATOM 0 HB3 TYR A 122 3.118 -12.886 6.839 1.00 73.34 H new ATOM 0 HD1 TYR A 122 4.213 -16.258 7.997 1.00 64.23 H new ATOM 0 HD2 TYR A 122 4.721 -12.050 8.518 1.00 64.13 H new ATOM 0 HE1 TYR A 122 6.214 -16.661 9.360 1.00 20.25 H new ATOM 0 HE2 TYR A 122 6.721 -12.464 9.868 1.00 43.23 H new ATOM 0 HH TYR A 122 8.080 -13.950 10.743 1.00 52.24 H new ATOM 1919 N ASP A 123 2.096 -12.470 9.942 1.00 34.22 N ATOM 1920 CA ASP A 123 1.877 -11.304 10.831 1.00 21.43 C ATOM 1921 C ASP A 123 2.561 -10.029 10.283 1.00 32.23 C ATOM 1922 O ASP A 123 2.999 -9.997 9.122 1.00 44.31 O ATOM 1923 CB ASP A 123 2.350 -11.628 12.269 1.00 13.42 C ATOM 1924 CG ASP A 123 3.850 -11.964 12.366 1.00 41.32 C ATOM 1925 OD1 ASP A 123 4.224 -13.122 12.076 1.00 63.20 O ATOM 1926 OD2 ASP A 123 4.651 -11.080 12.737 1.00 65.11 O ATOM 0 H ASP A 123 2.852 -13.081 10.251 1.00 34.22 H new ATOM 0 HA ASP A 123 0.807 -11.099 10.861 1.00 21.43 H new ATOM 0 HB2 ASP A 123 2.135 -10.776 12.913 1.00 13.42 H new ATOM 0 HB3 ASP A 123 1.773 -12.470 12.651 1.00 13.42 H new ATOM 1931 N GLY A 124 2.599 -8.961 11.113 1.00 24.32 N ATOM 1932 CA GLY A 124 3.167 -7.669 10.715 1.00 61.12 C ATOM 1933 C GLY A 124 2.099 -6.718 10.192 1.00 44.22 C ATOM 1934 O GLY A 124 1.999 -5.570 10.643 1.00 65.44 O ATOM 0 H GLY A 124 2.238 -8.978 12.067 1.00 24.32 H new ATOM 0 HA2 GLY A 124 3.671 -7.215 11.568 1.00 61.12 H new ATOM 0 HA3 GLY A 124 3.922 -7.826 9.945 1.00 61.12 H new ATOM 1938 N GLY A 125 1.277 -7.221 9.260 1.00 73.33 N ATOM 1939 CA GLY A 125 0.259 -6.423 8.580 1.00 44.34 C ATOM 1940 C GLY A 125 0.419 -6.492 7.080 1.00 53.23 C ATOM 1941 O GLY A 125 1.401 -7.059 6.584 1.00 25.21 O ATOM 0 H GLY A 125 1.303 -8.195 8.959 1.00 73.33 H new ATOM 0 HA2 GLY A 125 -0.732 -6.780 8.859 1.00 44.34 H new ATOM 0 HA3 GLY A 125 0.328 -5.386 8.908 1.00 44.34 H new ATOM 1945 N ARG A 126 -0.535 -5.916 6.348 1.00 10.02 N ATOM 1946 CA ARG A 126 -0.446 -5.772 4.886 1.00 61.25 C ATOM 1947 C ARG A 126 -0.090 -4.309 4.624 1.00 24.05 C ATOM 1948 O ARG A 126 -0.368 -3.442 5.468 1.00 52.01 O ATOM 1949 CB ARG A 126 -1.797 -6.119 4.176 1.00 32.14 C ATOM 1950 CG ARG A 126 -2.494 -7.439 4.594 1.00 70.13 C ATOM 1951 CD ARG A 126 -1.722 -8.725 4.235 1.00 62.24 C ATOM 1952 NE ARG A 126 -0.521 -8.904 5.070 1.00 15.03 N ATOM 1953 CZ ARG A 126 -0.387 -9.798 6.065 1.00 62.32 C ATOM 1954 NH1 ARG A 126 -1.379 -10.633 6.395 1.00 32.42 N ATOM 1955 NH2 ARG A 126 0.742 -9.818 6.757 1.00 13.51 N ATOM 0 H ARG A 126 -1.393 -5.535 6.747 1.00 10.02 H new ATOM 0 HA ARG A 126 0.300 -6.460 4.488 1.00 61.25 H new ATOM 0 HB2 ARG A 126 -2.493 -5.298 4.352 1.00 32.14 H new ATOM 0 HB3 ARG A 126 -1.615 -6.158 3.102 1.00 32.14 H new ATOM 0 HG2 ARG A 126 -2.658 -7.420 5.671 1.00 70.13 H new ATOM 0 HG3 ARG A 126 -3.476 -7.479 4.123 1.00 70.13 H new ATOM 0 HD2 ARG A 126 -2.378 -9.587 4.356 1.00 62.24 H new ATOM 0 HD3 ARG A 126 -1.431 -8.691 3.185 1.00 62.24 H new ATOM 0 HE ARG A 126 0.276 -8.298 4.877 1.00 15.03 H new ATOM 0 HH11 ARG A 126 -2.263 -10.601 5.887 1.00 32.42 H new ATOM 0 HH12 ARG A 126 -1.251 -11.302 7.154 1.00 32.42 H new ATOM 0 HH21 ARG A 126 1.490 -9.163 6.531 1.00 13.51 H new ATOM 0 HH22 ARG A 126 0.863 -10.489 7.516 1.00 13.51 H new ATOM 1969 N TYR A 127 0.543 -4.015 3.489 1.00 75.10 N ATOM 1970 CA TYR A 127 0.756 -2.625 3.082 1.00 31.40 C ATOM 1971 C TYR A 127 0.666 -2.474 1.566 1.00 12.32 C ATOM 1972 O TYR A 127 1.291 -3.213 0.792 1.00 22.30 O ATOM 1973 CB TYR A 127 2.070 -1.993 3.672 1.00 72.54 C ATOM 1974 CG TYR A 127 3.219 -2.950 4.029 1.00 24.23 C ATOM 1975 CD1 TYR A 127 3.239 -3.605 5.270 1.00 50.13 C ATOM 1976 CD2 TYR A 127 4.300 -3.159 3.169 1.00 61.33 C ATOM 1977 CE1 TYR A 127 4.277 -4.428 5.626 1.00 54.33 C ATOM 1978 CE2 TYR A 127 5.347 -3.984 3.532 1.00 44.33 C ATOM 1979 CZ TYR A 127 5.326 -4.613 4.762 1.00 1.53 C ATOM 1980 OH TYR A 127 6.356 -5.447 5.123 1.00 31.23 O ATOM 0 H TYR A 127 0.914 -4.710 2.841 1.00 75.10 H new ATOM 0 HA TYR A 127 -0.057 -2.047 3.521 1.00 31.40 H new ATOM 0 HB2 TYR A 127 2.448 -1.268 2.951 1.00 72.54 H new ATOM 0 HB3 TYR A 127 1.802 -1.438 4.571 1.00 72.54 H new ATOM 0 HD1 TYR A 127 2.420 -3.458 5.959 1.00 50.13 H new ATOM 0 HD2 TYR A 127 4.317 -2.669 2.207 1.00 61.33 H new ATOM 0 HE1 TYR A 127 4.268 -4.928 6.583 1.00 54.33 H new ATOM 0 HE2 TYR A 127 6.177 -4.136 2.858 1.00 44.33 H new ATOM 0 HH TYR A 127 6.930 -4.994 5.776 1.00 31.23 H new ATOM 1990 N MET A 128 -0.167 -1.508 1.182 1.00 60.33 N ATOM 1991 CA MET A 128 -0.371 -1.077 -0.188 1.00 42.34 C ATOM 1992 C MET A 128 0.490 0.152 -0.482 1.00 53.32 C ATOM 1993 O MET A 128 0.992 0.820 0.435 1.00 21.45 O ATOM 1994 CB MET A 128 -1.865 -0.729 -0.405 1.00 55.10 C ATOM 1995 CG MET A 128 -2.827 -1.918 -0.413 1.00 13.21 C ATOM 1996 SD MET A 128 -4.264 -1.618 -1.437 1.00 23.53 S ATOM 1997 CE MET A 128 -4.963 -0.153 -0.686 1.00 14.34 C ATOM 0 H MET A 128 -0.738 -0.988 1.848 1.00 60.33 H new ATOM 0 HA MET A 128 -0.084 -1.883 -0.863 1.00 42.34 H new ATOM 0 HB2 MET A 128 -2.176 -0.038 0.379 1.00 55.10 H new ATOM 0 HB3 MET A 128 -1.962 -0.200 -1.353 1.00 55.10 H new ATOM 0 HG2 MET A 128 -2.304 -2.804 -0.774 1.00 13.21 H new ATOM 0 HG3 MET A 128 -3.148 -2.131 0.607 1.00 13.21 H new ATOM 0 HE1 MET A 128 -5.942 0.047 -1.122 1.00 14.34 H new ATOM 0 HE2 MET A 128 -5.069 -0.310 0.387 1.00 14.34 H new ATOM 0 HE3 MET A 128 -4.305 0.697 -0.866 1.00 14.34 H new ATOM 2007 N GLU A 129 0.639 0.436 -1.771 1.00 2.32 N ATOM 2008 CA GLU A 129 1.255 1.663 -2.265 1.00 2.12 C ATOM 2009 C GLU A 129 0.467 2.118 -3.503 1.00 53.25 C ATOM 2010 O GLU A 129 0.311 1.347 -4.460 1.00 23.20 O ATOM 2011 CB GLU A 129 2.749 1.423 -2.616 1.00 50.23 C ATOM 2012 CG GLU A 129 3.529 2.700 -3.003 1.00 20.35 C ATOM 2013 CD GLU A 129 4.933 2.403 -3.551 1.00 73.41 C ATOM 2014 OE1 GLU A 129 5.821 2.000 -2.768 1.00 74.14 O ATOM 2015 OE2 GLU A 129 5.151 2.571 -4.768 1.00 64.51 O ATOM 0 H GLU A 129 0.330 -0.190 -2.515 1.00 2.32 H new ATOM 0 HA GLU A 129 1.225 2.437 -1.498 1.00 2.12 H new ATOM 0 HB2 GLU A 129 3.240 0.958 -1.761 1.00 50.23 H new ATOM 0 HB3 GLU A 129 2.806 0.713 -3.441 1.00 50.23 H new ATOM 0 HG2 GLU A 129 2.962 3.252 -3.752 1.00 20.35 H new ATOM 0 HG3 GLU A 129 3.615 3.345 -2.129 1.00 20.35 H new ATOM 2022 N LEU A 130 -0.044 3.357 -3.470 1.00 5.02 N ATOM 2023 CA LEU A 130 -0.811 3.946 -4.583 1.00 44.35 C ATOM 2024 C LEU A 130 -0.118 5.207 -5.078 1.00 62.50 C ATOM 2025 O LEU A 130 0.473 5.961 -4.299 1.00 61.03 O ATOM 2026 CB LEU A 130 -2.313 4.220 -4.220 1.00 31.44 C ATOM 2027 CG LEU A 130 -2.673 4.473 -2.722 1.00 24.50 C ATOM 2028 CD1 LEU A 130 -2.159 5.827 -2.208 1.00 4.11 C ATOM 2029 CD2 LEU A 130 -4.186 4.355 -2.501 1.00 71.21 C ATOM 0 H LEU A 130 0.062 3.982 -2.671 1.00 5.02 H new ATOM 0 HA LEU A 130 -0.834 3.211 -5.388 1.00 44.35 H new ATOM 0 HB2 LEU A 130 -2.642 5.087 -4.793 1.00 31.44 H new ATOM 0 HB3 LEU A 130 -2.900 3.369 -4.565 1.00 31.44 H new ATOM 0 HG LEU A 130 -2.166 3.701 -2.144 1.00 24.50 H new ATOM 0 HD11 LEU A 130 -2.438 5.949 -1.161 1.00 4.11 H new ATOM 0 HD12 LEU A 130 -1.074 5.863 -2.300 1.00 4.11 H new ATOM 0 HD13 LEU A 130 -2.600 6.631 -2.797 1.00 4.11 H new ATOM 0 HD21 LEU A 130 -4.415 4.535 -1.451 1.00 71.21 H new ATOM 0 HD22 LEU A 130 -4.702 5.092 -3.116 1.00 71.21 H new ATOM 0 HD23 LEU A 130 -4.517 3.354 -2.779 1.00 71.21 H new ATOM 2041 N GLU A 131 -0.212 5.411 -6.393 1.00 40.24 N ATOM 2042 CA GLU A 131 0.361 6.556 -7.090 1.00 74.22 C ATOM 2043 C GLU A 131 -0.760 7.222 -7.910 1.00 42.45 C ATOM 2044 O GLU A 131 -1.077 6.755 -9.006 1.00 52.24 O ATOM 2045 CB GLU A 131 1.576 6.108 -7.953 1.00 65.52 C ATOM 2046 CG GLU A 131 2.684 5.425 -7.113 1.00 55.53 C ATOM 2047 CD GLU A 131 3.932 5.040 -7.912 1.00 61.12 C ATOM 2048 OE1 GLU A 131 3.987 3.913 -8.457 1.00 52.10 O ATOM 2049 OE2 GLU A 131 4.868 5.863 -7.996 1.00 72.31 O ATOM 0 H GLU A 131 -0.701 4.767 -7.015 1.00 40.24 H new ATOM 0 HA GLU A 131 0.752 7.294 -6.389 1.00 74.22 H new ATOM 0 HB2 GLU A 131 1.234 5.419 -8.725 1.00 65.52 H new ATOM 0 HB3 GLU A 131 1.995 6.976 -8.463 1.00 65.52 H new ATOM 0 HG2 GLU A 131 2.977 6.095 -6.305 1.00 55.53 H new ATOM 0 HG3 GLU A 131 2.272 4.528 -6.650 1.00 55.53 H new ATOM 2056 N PRO A 132 -1.439 8.281 -7.336 1.00 2.43 N ATOM 2057 CA PRO A 132 -2.580 8.994 -7.990 1.00 71.42 C ATOM 2058 C PRO A 132 -2.177 9.734 -9.280 1.00 24.00 C ATOM 2059 O PRO A 132 -0.986 9.834 -9.619 1.00 3.40 O ATOM 2060 CB PRO A 132 -3.046 9.999 -6.895 1.00 60.13 C ATOM 2061 CG PRO A 132 -1.832 10.211 -6.042 1.00 75.02 C ATOM 2062 CD PRO A 132 -1.145 8.870 -5.996 1.00 73.24 C ATOM 0 HA PRO A 132 -3.356 8.300 -8.314 1.00 71.42 H new ATOM 0 HB2 PRO A 132 -3.390 10.935 -7.335 1.00 60.13 H new ATOM 0 HB3 PRO A 132 -3.875 9.596 -6.313 1.00 60.13 H new ATOM 0 HG2 PRO A 132 -1.180 10.974 -6.467 1.00 75.02 H new ATOM 0 HG3 PRO A 132 -2.107 10.548 -5.042 1.00 75.02 H new ATOM 0 HD2 PRO A 132 -0.073 8.974 -5.830 1.00 73.24 H new ATOM 0 HD3 PRO A 132 -1.534 8.247 -5.190 1.00 73.24 H new ATOM 2070 N ASP A 133 -3.199 10.255 -9.981 1.00 44.13 N ATOM 2071 CA ASP A 133 -3.026 11.035 -11.209 1.00 45.21 C ATOM 2072 C ASP A 133 -2.339 12.365 -10.866 1.00 42.21 C ATOM 2073 O ASP A 133 -1.245 12.670 -11.360 1.00 34.22 O ATOM 2074 CB ASP A 133 -4.407 11.273 -11.881 1.00 61.21 C ATOM 2075 CG ASP A 133 -4.311 12.104 -13.171 1.00 0.02 C ATOM 2076 OD1 ASP A 133 -3.979 11.531 -14.230 1.00 50.43 O ATOM 2077 OD2 ASP A 133 -4.545 13.333 -13.132 1.00 12.23 O ATOM 0 H ASP A 133 -4.175 10.143 -9.705 1.00 44.13 H new ATOM 0 HA ASP A 133 -2.399 10.489 -11.914 1.00 45.21 H new ATOM 0 HB2 ASP A 133 -4.865 10.310 -12.108 1.00 61.21 H new ATOM 0 HB3 ASP A 133 -5.065 11.781 -11.176 1.00 61.21 H new ATOM 2082 N ARG A 134 -2.985 13.143 -9.984 1.00 63.34 N ATOM 2083 CA ARG A 134 -2.434 14.405 -9.464 1.00 21.53 C ATOM 2084 C ARG A 134 -2.119 14.269 -7.961 1.00 21.13 C ATOM 2085 O ARG A 134 -2.329 13.198 -7.379 1.00 33.13 O ATOM 2086 CB ARG A 134 -3.421 15.572 -9.795 1.00 52.12 C ATOM 2087 CG ARG A 134 -4.840 15.505 -9.145 1.00 45.33 C ATOM 2088 CD ARG A 134 -4.902 16.121 -7.721 1.00 53.02 C ATOM 2089 NE ARG A 134 -6.185 16.765 -7.397 1.00 21.24 N ATOM 2090 CZ ARG A 134 -6.383 18.095 -7.326 1.00 10.23 C ATOM 2091 NH1 ARG A 134 -5.391 18.950 -7.571 1.00 22.21 N ATOM 2092 NH2 ARG A 134 -7.569 18.559 -6.978 1.00 63.42 N ATOM 0 H ARG A 134 -3.906 12.915 -9.610 1.00 63.34 H new ATOM 0 HA ARG A 134 -1.487 14.641 -9.949 1.00 21.53 H new ATOM 0 HB2 ARG A 134 -2.953 16.508 -9.491 1.00 52.12 H new ATOM 0 HB3 ARG A 134 -3.545 15.614 -10.877 1.00 52.12 H new ATOM 0 HG2 ARG A 134 -5.550 16.025 -9.788 1.00 45.33 H new ATOM 0 HG3 ARG A 134 -5.159 14.464 -9.095 1.00 45.33 H new ATOM 0 HD2 ARG A 134 -4.707 15.337 -6.989 1.00 53.02 H new ATOM 0 HD3 ARG A 134 -4.104 16.856 -7.620 1.00 53.02 H new ATOM 0 HE ARG A 134 -6.984 16.158 -7.212 1.00 21.24 H new ATOM 0 HH11 ARG A 134 -4.465 18.600 -7.817 1.00 22.21 H new ATOM 0 HH12 ARG A 134 -5.558 19.955 -7.513 1.00 22.21 H new ATOM 0 HH21 ARG A 134 -8.328 17.911 -6.765 1.00 63.42 H new ATOM 0 HH22 ARG A 134 -7.727 19.565 -6.922 1.00 63.42 H new ATOM 2106 N ASP A 135 -1.619 15.352 -7.335 1.00 63.33 N ATOM 2107 CA ASP A 135 -1.261 15.344 -5.902 1.00 70.11 C ATOM 2108 C ASP A 135 -2.531 15.524 -5.057 1.00 24.01 C ATOM 2109 O ASP A 135 -3.210 16.552 -5.169 1.00 71.44 O ATOM 2110 CB ASP A 135 -0.232 16.452 -5.567 1.00 45.33 C ATOM 2111 CG ASP A 135 0.166 16.455 -4.075 1.00 75.41 C ATOM 2112 OD1 ASP A 135 1.048 15.661 -3.682 1.00 51.33 O ATOM 2113 OD2 ASP A 135 -0.414 17.233 -3.285 1.00 25.21 O ATOM 0 H ASP A 135 -1.453 16.245 -7.799 1.00 63.33 H new ATOM 0 HA ASP A 135 -0.798 14.385 -5.669 1.00 70.11 H new ATOM 0 HB2 ASP A 135 0.660 16.312 -6.178 1.00 45.33 H new ATOM 0 HB3 ASP A 135 -0.650 17.424 -5.831 1.00 45.33 H new ATOM 2118 N LEU A 136 -2.809 14.545 -4.189 1.00 75.23 N ATOM 2119 CA LEU A 136 -4.068 14.470 -3.441 1.00 12.15 C ATOM 2120 C LEU A 136 -4.150 15.601 -2.404 1.00 61.04 C ATOM 2121 O LEU A 136 -3.264 15.735 -1.554 1.00 50.10 O ATOM 2122 CB LEU A 136 -4.185 13.098 -2.745 1.00 62.11 C ATOM 2123 CG LEU A 136 -4.295 11.864 -3.681 1.00 52.05 C ATOM 2124 CD1 LEU A 136 -4.280 10.565 -2.857 1.00 4.14 C ATOM 2125 CD2 LEU A 136 -5.555 11.941 -4.581 1.00 44.42 C ATOM 0 H LEU A 136 -2.165 13.781 -3.985 1.00 75.23 H new ATOM 0 HA LEU A 136 -4.896 14.586 -4.140 1.00 12.15 H new ATOM 0 HB2 LEU A 136 -3.315 12.964 -2.102 1.00 62.11 H new ATOM 0 HB3 LEU A 136 -5.061 13.116 -2.097 1.00 62.11 H new ATOM 0 HG LEU A 136 -3.428 11.864 -4.342 1.00 52.05 H new ATOM 0 HD11 LEU A 136 -4.358 9.708 -3.527 1.00 4.14 H new ATOM 0 HD12 LEU A 136 -3.349 10.502 -2.294 1.00 4.14 H new ATOM 0 HD13 LEU A 136 -5.123 10.563 -2.166 1.00 4.14 H new ATOM 0 HD21 LEU A 136 -5.598 11.061 -5.222 1.00 44.42 H new ATOM 0 HD22 LEU A 136 -6.447 11.979 -3.956 1.00 44.42 H new ATOM 0 HD23 LEU A 136 -5.507 12.838 -5.199 1.00 44.42 H new ATOM 2137 N SER A 137 -5.218 16.392 -2.489 1.00 42.42 N ATOM 2138 CA SER A 137 -5.448 17.547 -1.613 1.00 3.12 C ATOM 2139 C SER A 137 -6.690 17.280 -0.739 1.00 3.10 C ATOM 2140 O SER A 137 -7.464 16.356 -1.031 1.00 24.11 O ATOM 2141 CB SER A 137 -5.612 18.807 -2.481 1.00 62.32 C ATOM 2142 OG SER A 137 -4.495 18.968 -3.344 1.00 13.35 O ATOM 0 H SER A 137 -5.959 16.250 -3.175 1.00 42.42 H new ATOM 0 HA SER A 137 -4.600 17.706 -0.946 1.00 3.12 H new ATOM 0 HB2 SER A 137 -6.526 18.733 -3.070 1.00 62.32 H new ATOM 0 HB3 SER A 137 -5.715 19.684 -1.842 1.00 62.32 H new ATOM 0 HG SER A 137 -4.617 19.773 -3.890 1.00 13.35 H new ATOM 2148 N ASP A 138 -6.862 18.068 0.340 1.00 34.00 N ATOM 2149 CA ASP A 138 -7.964 17.880 1.301 1.00 43.14 C ATOM 2150 C ASP A 138 -9.317 18.208 0.635 1.00 62.04 C ATOM 2151 O ASP A 138 -9.635 19.370 0.365 1.00 52.40 O ATOM 2152 CB ASP A 138 -7.732 18.710 2.598 1.00 3.31 C ATOM 2153 CG ASP A 138 -7.622 20.230 2.374 1.00 4.10 C ATOM 2154 OD1 ASP A 138 -6.638 20.674 1.757 1.00 74.31 O ATOM 2155 OD2 ASP A 138 -8.521 20.985 2.798 1.00 55.22 O ATOM 0 H ASP A 138 -6.245 18.847 0.568 1.00 34.00 H new ATOM 0 HA ASP A 138 -7.988 16.833 1.602 1.00 43.14 H new ATOM 0 HB2 ASP A 138 -8.552 18.516 3.290 1.00 3.31 H new ATOM 0 HB3 ASP A 138 -6.819 18.360 3.080 1.00 3.31 H new ATOM 2160 N GLY A 139 -10.067 17.147 0.304 1.00 70.03 N ATOM 2161 CA GLY A 139 -11.348 17.259 -0.402 1.00 61.35 C ATOM 2162 C GLY A 139 -11.415 16.313 -1.590 1.00 71.14 C ATOM 2163 O GLY A 139 -12.506 15.863 -1.964 1.00 71.40 O ATOM 0 H GLY A 139 -9.800 16.186 0.519 1.00 70.03 H new ATOM 0 HA2 GLY A 139 -12.164 17.039 0.286 1.00 61.35 H new ATOM 0 HA3 GLY A 139 -11.487 18.284 -0.744 1.00 61.35 H new ATOM 2167 N ASP A 140 -10.233 16.023 -2.191 1.00 45.41 N ATOM 2168 CA ASP A 140 -10.084 14.979 -3.235 1.00 33.35 C ATOM 2169 C ASP A 140 -10.370 13.595 -2.652 1.00 35.20 C ATOM 2170 O ASP A 140 -10.391 13.417 -1.431 1.00 61.10 O ATOM 2171 CB ASP A 140 -8.647 14.973 -3.840 1.00 24.43 C ATOM 2172 CG ASP A 140 -8.379 16.153 -4.776 1.00 34.21 C ATOM 2173 OD1 ASP A 140 -8.785 16.086 -5.962 1.00 74.31 O ATOM 2174 OD2 ASP A 140 -7.774 17.147 -4.343 1.00 32.51 O ATOM 0 H ASP A 140 -9.362 16.504 -1.967 1.00 45.41 H new ATOM 0 HA ASP A 140 -10.801 15.211 -4.023 1.00 33.35 H new ATOM 0 HB2 ASP A 140 -7.919 14.989 -3.029 1.00 24.43 H new ATOM 0 HB3 ASP A 140 -8.495 14.043 -4.387 1.00 24.43 H new ATOM 2179 N GLU A 141 -10.584 12.617 -3.537 1.00 0.13 N ATOM 2180 CA GLU A 141 -10.723 11.202 -3.163 1.00 11.13 C ATOM 2181 C GLU A 141 -9.724 10.355 -3.965 1.00 4.04 C ATOM 2182 O GLU A 141 -9.139 10.826 -4.951 1.00 61.51 O ATOM 2183 CB GLU A 141 -12.184 10.719 -3.357 1.00 33.51 C ATOM 2184 CG GLU A 141 -13.209 11.528 -2.532 1.00 25.44 C ATOM 2185 CD GLU A 141 -14.652 11.048 -2.702 1.00 5.34 C ATOM 2186 OE1 GLU A 141 -15.253 11.308 -3.764 1.00 24.23 O ATOM 2187 OE2 GLU A 141 -15.202 10.442 -1.767 1.00 3.13 O ATOM 0 H GLU A 141 -10.667 12.783 -4.540 1.00 0.13 H new ATOM 0 HA GLU A 141 -10.492 11.085 -2.104 1.00 11.13 H new ATOM 0 HB2 GLU A 141 -12.444 10.786 -4.413 1.00 33.51 H new ATOM 0 HB3 GLU A 141 -12.252 9.668 -3.078 1.00 33.51 H new ATOM 0 HG2 GLU A 141 -12.939 11.472 -1.478 1.00 25.44 H new ATOM 0 HG3 GLU A 141 -13.148 12.577 -2.821 1.00 25.44 H new ATOM 2194 N ILE A 142 -9.540 9.105 -3.535 1.00 73.50 N ATOM 2195 CA ILE A 142 -8.482 8.215 -4.045 1.00 14.25 C ATOM 2196 C ILE A 142 -8.983 6.758 -4.038 1.00 52.42 C ATOM 2197 O ILE A 142 -9.750 6.371 -3.161 1.00 34.11 O ATOM 2198 CB ILE A 142 -7.176 8.368 -3.172 1.00 30.14 C ATOM 2199 CG1 ILE A 142 -6.040 7.367 -3.587 1.00 24.43 C ATOM 2200 CG2 ILE A 142 -7.499 8.252 -1.667 1.00 20.03 C ATOM 2201 CD1 ILE A 142 -5.476 7.562 -4.990 1.00 21.40 C ATOM 0 H ILE A 142 -10.123 8.674 -2.818 1.00 73.50 H new ATOM 0 HA ILE A 142 -8.237 8.493 -5.070 1.00 14.25 H new ATOM 0 HB ILE A 142 -6.789 9.368 -3.367 1.00 30.14 H new ATOM 0 HG12 ILE A 142 -5.223 7.454 -2.870 1.00 24.43 H new ATOM 0 HG13 ILE A 142 -6.427 6.351 -3.508 1.00 24.43 H new ATOM 0 HG21 ILE A 142 -6.582 8.361 -1.089 1.00 20.03 H new ATOM 0 HG22 ILE A 142 -8.202 9.036 -1.384 1.00 20.03 H new ATOM 0 HG23 ILE A 142 -7.942 7.277 -1.464 1.00 20.03 H new ATOM 0 HD11 ILE A 142 -4.699 6.821 -5.176 1.00 21.40 H new ATOM 0 HD12 ILE A 142 -6.274 7.443 -5.723 1.00 21.40 H new ATOM 0 HD13 ILE A 142 -5.051 8.562 -5.076 1.00 21.40 H new ATOM 2213 N THR A 143 -8.547 5.978 -5.031 1.00 73.25 N ATOM 2214 CA THR A 143 -8.918 4.571 -5.193 1.00 13.40 C ATOM 2215 C THR A 143 -8.099 3.663 -4.242 1.00 51.30 C ATOM 2216 O THR A 143 -6.870 3.772 -4.182 1.00 4.50 O ATOM 2217 CB THR A 143 -8.676 4.155 -6.674 1.00 45.30 C ATOM 2218 OG1 THR A 143 -9.353 5.073 -7.552 1.00 55.40 O ATOM 2219 CG2 THR A 143 -9.167 2.739 -6.949 1.00 14.43 C ATOM 0 H THR A 143 -7.915 6.314 -5.758 1.00 73.25 H new ATOM 0 HA THR A 143 -9.971 4.450 -4.939 1.00 13.40 H new ATOM 0 HB THR A 143 -7.602 4.183 -6.856 1.00 45.30 H new ATOM 0 HG1 THR A 143 -9.198 4.810 -8.483 1.00 55.40 H new ATOM 0 HG21 THR A 143 -8.981 2.486 -7.993 1.00 14.43 H new ATOM 0 HG22 THR A 143 -8.636 2.038 -6.305 1.00 14.43 H new ATOM 0 HG23 THR A 143 -10.236 2.679 -6.746 1.00 14.43 H new ATOM 2227 N LEU A 144 -8.796 2.765 -3.514 1.00 23.45 N ATOM 2228 CA LEU A 144 -8.212 1.842 -2.513 1.00 54.14 C ATOM 2229 C LEU A 144 -8.709 0.414 -2.834 1.00 54.13 C ATOM 2230 O LEU A 144 -9.807 0.018 -2.408 1.00 73.31 O ATOM 2231 CB LEU A 144 -8.637 2.214 -1.033 1.00 44.44 C ATOM 2232 CG LEU A 144 -7.879 3.369 -0.279 1.00 0.13 C ATOM 2233 CD1 LEU A 144 -6.388 3.044 -0.080 1.00 31.34 C ATOM 2234 CD2 LEU A 144 -8.063 4.735 -0.951 1.00 72.01 C ATOM 0 H LEU A 144 -9.806 2.658 -3.607 1.00 23.45 H new ATOM 0 HA LEU A 144 -7.126 1.915 -2.569 1.00 54.14 H new ATOM 0 HB2 LEU A 144 -9.695 2.475 -1.052 1.00 44.44 H new ATOM 0 HB3 LEU A 144 -8.542 1.312 -0.429 1.00 44.44 H new ATOM 0 HG LEU A 144 -8.339 3.437 0.707 1.00 0.13 H new ATOM 0 HD11 LEU A 144 -5.903 3.867 0.444 1.00 31.34 H new ATOM 0 HD12 LEU A 144 -6.290 2.131 0.508 1.00 31.34 H new ATOM 0 HD13 LEU A 144 -5.914 2.903 -1.051 1.00 31.34 H new ATOM 0 HD21 LEU A 144 -7.519 5.494 -0.388 1.00 72.01 H new ATOM 0 HD22 LEU A 144 -7.679 4.694 -1.970 1.00 72.01 H new ATOM 0 HD23 LEU A 144 -9.123 4.990 -0.973 1.00 72.01 H new ATOM 2246 N ASP A 145 -7.932 -0.330 -3.624 1.00 61.01 N ATOM 2247 CA ASP A 145 -8.157 -1.777 -3.825 1.00 44.13 C ATOM 2248 C ASP A 145 -7.173 -2.537 -2.949 1.00 64.20 C ATOM 2249 O ASP A 145 -5.990 -2.602 -3.269 1.00 52.44 O ATOM 2250 CB ASP A 145 -7.971 -2.217 -5.297 1.00 73.22 C ATOM 2251 CG ASP A 145 -9.033 -1.671 -6.240 1.00 74.32 C ATOM 2252 OD1 ASP A 145 -9.023 -0.455 -6.486 1.00 31.24 O ATOM 2253 OD2 ASP A 145 -9.872 -2.453 -6.738 1.00 2.31 O ATOM 0 H ASP A 145 -7.135 0.042 -4.141 1.00 61.01 H new ATOM 0 HA ASP A 145 -9.190 -1.996 -3.556 1.00 44.13 H new ATOM 0 HB2 ASP A 145 -6.990 -1.892 -5.642 1.00 73.22 H new ATOM 0 HB3 ASP A 145 -7.981 -3.306 -5.345 1.00 73.22 H new ATOM 2258 N PHE A 146 -7.679 -3.132 -1.862 1.00 2.32 N ATOM 2259 CA PHE A 146 -6.869 -3.897 -0.873 1.00 64.25 C ATOM 2260 C PHE A 146 -6.221 -5.155 -1.489 1.00 33.13 C ATOM 2261 O PHE A 146 -5.384 -5.819 -0.865 1.00 65.45 O ATOM 2262 CB PHE A 146 -7.768 -4.269 0.324 1.00 41.11 C ATOM 2263 CG PHE A 146 -8.528 -3.070 0.858 1.00 33.32 C ATOM 2264 CD1 PHE A 146 -7.841 -2.009 1.437 1.00 32.03 C ATOM 2265 CD2 PHE A 146 -9.913 -2.970 0.722 1.00 63.51 C ATOM 2266 CE1 PHE A 146 -8.511 -0.895 1.870 1.00 51.11 C ATOM 2267 CE2 PHE A 146 -10.581 -1.847 1.151 1.00 72.51 C ATOM 2268 CZ PHE A 146 -9.879 -0.810 1.726 1.00 12.12 C ATOM 0 H PHE A 146 -8.672 -3.103 -1.631 1.00 2.32 H new ATOM 0 HA PHE A 146 -6.046 -3.265 -0.539 1.00 64.25 H new ATOM 0 HB2 PHE A 146 -8.475 -5.041 0.020 1.00 41.11 H new ATOM 0 HB3 PHE A 146 -7.155 -4.694 1.119 1.00 41.11 H new ATOM 0 HD1 PHE A 146 -6.768 -2.063 1.547 1.00 32.03 H new ATOM 0 HD2 PHE A 146 -10.466 -3.783 0.275 1.00 63.51 H new ATOM 0 HE1 PHE A 146 -7.966 -0.081 2.325 1.00 51.11 H new ATOM 0 HE2 PHE A 146 -11.653 -1.778 1.038 1.00 72.51 H new ATOM 0 HZ PHE A 146 -10.402 0.072 2.065 1.00 12.12 H new ATOM 2278 N ASN A 147 -6.641 -5.443 -2.722 1.00 71.22 N ATOM 2279 CA ASN A 147 -6.113 -6.508 -3.560 1.00 53.34 C ATOM 2280 C ASN A 147 -4.648 -6.247 -3.944 1.00 11.10 C ATOM 2281 O ASN A 147 -3.843 -7.174 -4.039 1.00 14.21 O ATOM 2282 CB ASN A 147 -6.973 -6.640 -4.843 1.00 64.34 C ATOM 2283 CG ASN A 147 -8.466 -6.824 -4.561 1.00 25.55 C ATOM 2284 OD1 ASN A 147 -9.059 -6.151 -3.716 1.00 34.33 O ATOM 2285 ND2 ASN A 147 -9.073 -7.762 -5.229 1.00 71.41 N ATOM 0 H ASN A 147 -7.387 -4.917 -3.177 1.00 71.22 H new ATOM 0 HA ASN A 147 -6.153 -7.436 -2.990 1.00 53.34 H new ATOM 0 HB2 ASN A 147 -6.834 -5.750 -5.457 1.00 64.34 H new ATOM 0 HB3 ASN A 147 -6.614 -7.488 -5.426 1.00 64.34 H new ATOM 0 HD21 ASN A 147 -10.060 -7.953 -5.058 1.00 71.41 H new ATOM 0 HD22 ASN A 147 -8.561 -8.306 -5.924 1.00 71.41 H new ATOM 2292 N LEU A 148 -4.310 -4.954 -4.091 1.00 72.35 N ATOM 2293 CA LEU A 148 -3.006 -4.496 -4.618 1.00 0.52 C ATOM 2294 C LEU A 148 -1.928 -4.455 -3.504 1.00 1.45 C ATOM 2295 O LEU A 148 -0.887 -3.804 -3.665 1.00 54.12 O ATOM 2296 CB LEU A 148 -3.188 -3.083 -5.265 1.00 14.45 C ATOM 2297 CG LEU A 148 -4.482 -2.878 -6.126 1.00 2.40 C ATOM 2298 CD1 LEU A 148 -4.564 -1.454 -6.715 1.00 60.53 C ATOM 2299 CD2 LEU A 148 -4.643 -3.960 -7.217 1.00 13.12 C ATOM 0 H LEU A 148 -4.938 -4.188 -3.846 1.00 72.35 H new ATOM 0 HA LEU A 148 -2.661 -5.203 -5.372 1.00 0.52 H new ATOM 0 HB2 LEU A 148 -3.185 -2.339 -4.469 1.00 14.45 H new ATOM 0 HB3 LEU A 148 -2.322 -2.880 -5.895 1.00 14.45 H new ATOM 0 HG LEU A 148 -5.326 -2.994 -5.446 1.00 2.40 H new ATOM 0 HD11 LEU A 148 -5.476 -1.356 -7.304 1.00 60.53 H new ATOM 0 HD12 LEU A 148 -4.575 -0.725 -5.905 1.00 60.53 H new ATOM 0 HD13 LEU A 148 -3.699 -1.274 -7.353 1.00 60.53 H new ATOM 0 HD21 LEU A 148 -5.554 -3.772 -7.784 1.00 13.12 H new ATOM 0 HD22 LEU A 148 -3.785 -3.930 -7.888 1.00 13.12 H new ATOM 0 HD23 LEU A 148 -4.703 -4.943 -6.749 1.00 13.12 H new ATOM 2311 N ALA A 149 -2.199 -5.153 -2.380 1.00 51.42 N ATOM 2312 CA ALA A 149 -1.281 -5.262 -1.247 1.00 12.44 C ATOM 2313 C ALA A 149 -0.059 -6.100 -1.621 1.00 63.45 C ATOM 2314 O ALA A 149 -0.193 -7.276 -1.950 1.00 1.13 O ATOM 2315 CB ALA A 149 -1.999 -5.879 -0.035 1.00 0.32 C ATOM 0 H ALA A 149 -3.074 -5.659 -2.241 1.00 51.42 H new ATOM 0 HA ALA A 149 -0.943 -4.260 -0.982 1.00 12.44 H new ATOM 0 HB1 ALA A 149 -1.303 -5.954 0.801 1.00 0.32 H new ATOM 0 HB2 ALA A 149 -2.841 -5.248 0.249 1.00 0.32 H new ATOM 0 HB3 ALA A 149 -2.362 -6.873 -0.295 1.00 0.32 H new ATOM 2321 N TYR A 150 1.126 -5.499 -1.518 1.00 32.41 N ATOM 2322 CA TYR A 150 2.384 -6.154 -1.903 1.00 63.21 C ATOM 2323 C TYR A 150 2.819 -7.082 -0.765 1.00 24.01 C ATOM 2324 O TYR A 150 2.694 -6.698 0.411 1.00 51.31 O ATOM 2325 CB TYR A 150 3.472 -5.083 -2.209 1.00 11.54 C ATOM 2326 CG TYR A 150 3.099 -4.095 -3.337 1.00 13.20 C ATOM 2327 CD1 TYR A 150 2.292 -4.492 -4.412 1.00 14.02 C ATOM 2328 CD2 TYR A 150 3.552 -2.769 -3.328 1.00 74.33 C ATOM 2329 CE1 TYR A 150 1.952 -3.614 -5.419 1.00 11.44 C ATOM 2330 CE2 TYR A 150 3.214 -1.888 -4.342 1.00 22.05 C ATOM 2331 CZ TYR A 150 2.414 -2.314 -5.381 1.00 21.24 C ATOM 2332 OH TYR A 150 2.072 -1.435 -6.390 1.00 61.32 O ATOM 0 H TYR A 150 1.245 -4.549 -1.167 1.00 32.41 H new ATOM 0 HA TYR A 150 2.242 -6.745 -2.808 1.00 63.21 H new ATOM 0 HB2 TYR A 150 3.673 -4.517 -1.299 1.00 11.54 H new ATOM 0 HB3 TYR A 150 4.398 -5.591 -2.479 1.00 11.54 H new ATOM 0 HD1 TYR A 150 1.928 -5.508 -4.452 1.00 14.02 H new ATOM 0 HD2 TYR A 150 4.176 -2.428 -2.515 1.00 74.33 H new ATOM 0 HE1 TYR A 150 1.326 -3.943 -6.235 1.00 11.44 H new ATOM 0 HE2 TYR A 150 3.576 -0.871 -4.319 1.00 22.05 H new ATOM 0 HH TYR A 150 2.477 -0.560 -6.213 1.00 61.32 H new ATOM 2342 N SER A 151 3.252 -8.322 -1.126 1.00 0.14 N ATOM 2343 CA SER A 151 3.739 -9.344 -0.178 1.00 11.52 C ATOM 2344 C SER A 151 4.728 -8.724 0.842 1.00 33.44 C ATOM 2345 O SER A 151 5.821 -8.293 0.440 1.00 72.12 O ATOM 2346 CB SER A 151 4.399 -10.512 -0.966 1.00 41.13 C ATOM 2347 OG SER A 151 5.332 -10.027 -1.922 1.00 23.44 O ATOM 0 H SER A 151 3.270 -8.636 -2.096 1.00 0.14 H new ATOM 0 HA SER A 151 2.894 -9.738 0.388 1.00 11.52 H new ATOM 0 HB2 SER A 151 4.903 -11.184 -0.271 1.00 41.13 H new ATOM 0 HB3 SER A 151 3.628 -11.095 -1.470 1.00 41.13 H new ATOM 0 HG SER A 151 5.876 -9.319 -1.518 1.00 23.44 H new ATOM 2353 N PRO A 152 4.317 -8.621 2.161 1.00 2.52 N ATOM 2354 CA PRO A 152 4.995 -7.745 3.150 1.00 0.14 C ATOM 2355 C PRO A 152 6.503 -8.035 3.275 1.00 11.44 C ATOM 2356 O PRO A 152 6.900 -9.145 3.647 1.00 4.24 O ATOM 2357 CB PRO A 152 4.235 -8.048 4.474 1.00 14.10 C ATOM 2358 CG PRO A 152 2.900 -8.572 4.047 1.00 32.53 C ATOM 2359 CD PRO A 152 3.173 -9.357 2.784 1.00 34.31 C ATOM 0 HA PRO A 152 4.958 -6.694 2.863 1.00 0.14 H new ATOM 0 HB2 PRO A 152 4.771 -8.780 5.077 1.00 14.10 H new ATOM 0 HB3 PRO A 152 4.130 -7.150 5.082 1.00 14.10 H new ATOM 0 HG2 PRO A 152 2.460 -9.205 4.818 1.00 32.53 H new ATOM 0 HG3 PRO A 152 2.198 -7.759 3.862 1.00 32.53 H new ATOM 0 HD2 PRO A 152 3.433 -10.393 3.003 1.00 34.31 H new ATOM 0 HD3 PRO A 152 2.303 -9.378 2.128 1.00 34.31 H new ATOM 2367 N PHE A 153 7.318 -7.014 2.956 1.00 60.32 N ATOM 2368 CA PHE A 153 8.775 -7.125 2.819 1.00 40.00 C ATOM 2369 C PHE A 153 9.448 -7.584 4.134 1.00 75.03 C ATOM 2370 O PHE A 153 10.285 -8.487 4.115 1.00 72.03 O ATOM 2371 CB PHE A 153 9.399 -5.762 2.372 1.00 11.51 C ATOM 2372 CG PHE A 153 8.721 -4.953 1.244 1.00 4.52 C ATOM 2373 CD1 PHE A 153 7.600 -5.401 0.529 1.00 75.30 C ATOM 2374 CD2 PHE A 153 9.224 -3.691 0.922 1.00 30.12 C ATOM 2375 CE1 PHE A 153 7.020 -4.621 -0.453 1.00 15.11 C ATOM 2376 CE2 PHE A 153 8.643 -2.921 -0.064 1.00 62.14 C ATOM 2377 CZ PHE A 153 7.544 -3.379 -0.750 1.00 14.31 C ATOM 0 H PHE A 153 6.972 -6.070 2.783 1.00 60.32 H new ATOM 0 HA PHE A 153 8.959 -7.880 2.055 1.00 40.00 H new ATOM 0 HB2 PHE A 153 9.448 -5.120 3.252 1.00 11.51 H new ATOM 0 HB3 PHE A 153 10.426 -5.958 2.063 1.00 11.51 H new ATOM 0 HD1 PHE A 153 7.183 -6.372 0.750 1.00 75.30 H new ATOM 0 HD2 PHE A 153 10.083 -3.311 1.454 1.00 30.12 H new ATOM 0 HE1 PHE A 153 6.155 -4.984 -0.989 1.00 15.11 H new ATOM 0 HE2 PHE A 153 9.055 -1.951 -0.299 1.00 62.14 H new ATOM 0 HZ PHE A 153 7.092 -2.770 -1.519 1.00 14.31 H new ATOM 2387 N CYS A 154 9.069 -6.939 5.260 1.00 22.23 N ATOM 2388 CA CYS A 154 9.572 -7.265 6.617 1.00 15.03 C ATOM 2389 C CYS A 154 9.220 -8.699 7.030 1.00 4.34 C ATOM 2390 O CYS A 154 10.056 -9.422 7.588 1.00 4.15 O ATOM 2391 CB CYS A 154 8.986 -6.275 7.645 1.00 73.41 C ATOM 2392 SG CYS A 154 9.496 -6.555 9.351 1.00 33.34 S ATOM 0 H CYS A 154 8.399 -6.170 5.254 1.00 22.23 H new ATOM 0 HA CYS A 154 10.658 -7.180 6.593 1.00 15.03 H new ATOM 0 HB2 CYS A 154 9.273 -5.264 7.357 1.00 73.41 H new ATOM 0 HB3 CYS A 154 7.898 -6.324 7.594 1.00 73.41 H new ATOM 0 HG CYS A 154 10.736 -6.194 9.498 1.00 33.34 H new ATOM 2398 N ALA A 155 7.974 -9.093 6.721 1.00 54.30 N ATOM 2399 CA ALA A 155 7.427 -10.423 7.053 1.00 13.21 C ATOM 2400 C ALA A 155 8.254 -11.568 6.434 1.00 31.03 C ATOM 2401 O ALA A 155 8.352 -12.654 7.012 1.00 75.05 O ATOM 2402 CB ALA A 155 5.971 -10.501 6.581 1.00 71.04 C ATOM 0 H ALA A 155 7.311 -8.494 6.230 1.00 54.30 H new ATOM 0 HA ALA A 155 7.477 -10.548 8.135 1.00 13.21 H new ATOM 0 HB1 ALA A 155 5.562 -11.482 6.824 1.00 71.04 H new ATOM 0 HB2 ALA A 155 5.385 -9.730 7.080 1.00 71.04 H new ATOM 0 HB3 ALA A 155 5.929 -10.347 5.503 1.00 71.04 H new ATOM 2408 N TYR A 156 8.837 -11.307 5.256 1.00 2.51 N ATOM 2409 CA TYR A 156 9.646 -12.294 4.516 1.00 42.22 C ATOM 2410 C TYR A 156 11.158 -12.078 4.729 1.00 63.11 C ATOM 2411 O TYR A 156 11.923 -13.048 4.749 1.00 22.44 O ATOM 2412 CB TYR A 156 9.268 -12.253 3.008 1.00 22.23 C ATOM 2413 CG TYR A 156 7.902 -12.906 2.708 1.00 12.41 C ATOM 2414 CD1 TYR A 156 6.699 -12.224 2.937 1.00 32.23 C ATOM 2415 CD2 TYR A 156 7.818 -14.217 2.222 1.00 23.01 C ATOM 2416 CE1 TYR A 156 5.476 -12.822 2.696 1.00 25.11 C ATOM 2417 CE2 TYR A 156 6.594 -14.813 1.974 1.00 61.11 C ATOM 2418 CZ TYR A 156 5.429 -14.115 2.214 1.00 4.22 C ATOM 2419 OH TYR A 156 4.210 -14.715 1.980 1.00 24.41 O ATOM 0 H TYR A 156 8.763 -10.405 4.786 1.00 2.51 H new ATOM 0 HA TYR A 156 9.422 -13.286 4.908 1.00 42.22 H new ATOM 0 HB2 TYR A 156 9.250 -11.216 2.672 1.00 22.23 H new ATOM 0 HB3 TYR A 156 10.041 -12.761 2.432 1.00 22.23 H new ATOM 0 HD1 TYR A 156 6.728 -11.211 3.309 1.00 32.23 H new ATOM 0 HD2 TYR A 156 8.725 -14.773 2.037 1.00 23.01 H new ATOM 0 HE1 TYR A 156 4.561 -12.280 2.884 1.00 25.11 H new ATOM 0 HE2 TYR A 156 6.551 -15.823 1.593 1.00 61.11 H new ATOM 0 HH TYR A 156 4.352 -15.624 1.642 1.00 24.41 H new ATOM 2429 N SER A 157 11.588 -10.826 4.925 1.00 43.32 N ATOM 2430 CA SER A 157 13.024 -10.485 5.023 1.00 43.23 C ATOM 2431 C SER A 157 13.321 -9.777 6.348 1.00 72.52 C ATOM 2432 O SER A 157 12.708 -8.746 6.659 1.00 64.31 O ATOM 2433 CB SER A 157 13.453 -9.586 3.850 1.00 64.42 C ATOM 2434 OG SER A 157 14.861 -9.474 3.783 1.00 72.21 O ATOM 0 H SER A 157 10.964 -10.025 5.020 1.00 43.32 H new ATOM 0 HA SER A 157 13.591 -11.415 4.981 1.00 43.23 H new ATOM 0 HB2 SER A 157 13.073 -9.997 2.915 1.00 64.42 H new ATOM 0 HB3 SER A 157 13.011 -8.596 3.966 1.00 64.42 H new ATOM 0 HG SER A 157 15.115 -9.036 2.944 1.00 72.21 H new ATOM 2440 N ASP A 158 14.302 -10.323 7.087 1.00 74.22 N ATOM 2441 CA ASP A 158 14.755 -9.800 8.389 1.00 10.55 C ATOM 2442 C ASP A 158 15.294 -8.358 8.291 1.00 71.43 C ATOM 2443 O ASP A 158 15.131 -7.569 9.230 1.00 23.54 O ATOM 2444 CB ASP A 158 15.838 -10.742 8.978 1.00 25.23 C ATOM 2445 CG ASP A 158 16.366 -10.294 10.354 1.00 44.24 C ATOM 2446 OD1 ASP A 158 15.670 -10.513 11.360 1.00 14.23 O ATOM 2447 OD2 ASP A 158 17.475 -9.728 10.440 1.00 42.22 O ATOM 0 H ASP A 158 14.812 -11.155 6.791 1.00 74.22 H new ATOM 0 HA ASP A 158 13.890 -9.768 9.052 1.00 10.55 H new ATOM 0 HB2 ASP A 158 15.424 -11.746 9.067 1.00 25.23 H new ATOM 0 HB3 ASP A 158 16.673 -10.802 8.280 1.00 25.23 H new ATOM 2452 N THR A 159 15.888 -8.019 7.130 1.00 61.31 N ATOM 2453 CA THR A 159 16.629 -6.758 6.932 1.00 22.42 C ATOM 2454 C THR A 159 15.740 -5.498 7.040 1.00 41.41 C ATOM 2455 O THR A 159 16.267 -4.403 7.248 1.00 73.13 O ATOM 2456 CB THR A 159 17.407 -6.758 5.571 1.00 1.12 C ATOM 2457 OG1 THR A 159 18.320 -5.653 5.517 1.00 11.24 O ATOM 2458 CG2 THR A 159 16.472 -6.699 4.355 1.00 51.32 C ATOM 0 H THR A 159 15.867 -8.613 6.301 1.00 61.31 H new ATOM 0 HA THR A 159 17.346 -6.710 7.752 1.00 22.42 H new ATOM 0 HB THR A 159 17.953 -7.700 5.526 1.00 1.12 H new ATOM 0 HG1 THR A 159 18.029 -4.957 6.143 1.00 11.24 H new ATOM 0 HG21 THR A 159 17.064 -6.701 3.440 1.00 51.32 H new ATOM 0 HG22 THR A 159 15.811 -7.566 4.362 1.00 51.32 H new ATOM 0 HG23 THR A 159 15.876 -5.788 4.399 1.00 51.32 H new ATOM 2466 N PHE A 160 14.405 -5.648 6.951 1.00 74.02 N ATOM 2467 CA PHE A 160 13.474 -4.513 7.096 1.00 4.13 C ATOM 2468 C PHE A 160 12.973 -4.514 8.549 1.00 34.42 C ATOM 2469 O PHE A 160 12.404 -5.521 8.998 1.00 54.03 O ATOM 2470 CB PHE A 160 12.255 -4.643 6.135 1.00 0.50 C ATOM 2471 CG PHE A 160 12.584 -4.692 4.644 1.00 24.45 C ATOM 2472 CD1 PHE A 160 13.027 -5.870 4.048 1.00 52.23 C ATOM 2473 CD2 PHE A 160 12.437 -3.566 3.831 1.00 65.41 C ATOM 2474 CE1 PHE A 160 13.316 -5.924 2.700 1.00 4.10 C ATOM 2475 CE2 PHE A 160 12.725 -3.626 2.479 1.00 71.34 C ATOM 2476 CZ PHE A 160 13.166 -4.803 1.916 1.00 30.53 C ATOM 0 H PHE A 160 13.947 -6.543 6.780 1.00 74.02 H new ATOM 0 HA PHE A 160 13.992 -3.587 6.846 1.00 4.13 H new ATOM 0 HB2 PHE A 160 11.706 -5.548 6.396 1.00 0.50 H new ATOM 0 HB3 PHE A 160 11.586 -3.801 6.312 1.00 0.50 H new ATOM 0 HD1 PHE A 160 13.147 -6.757 4.652 1.00 52.23 H new ATOM 0 HD2 PHE A 160 12.094 -2.637 4.263 1.00 65.41 H new ATOM 0 HE1 PHE A 160 13.661 -6.848 2.259 1.00 4.10 H new ATOM 0 HE2 PHE A 160 12.604 -2.747 1.863 1.00 71.34 H new ATOM 0 HZ PHE A 160 13.394 -4.846 0.861 1.00 30.53 H new ATOM 2486 N SER A 161 13.223 -3.428 9.297 1.00 75.42 N ATOM 2487 CA SER A 161 12.627 -3.239 10.631 1.00 55.44 C ATOM 2488 C SER A 161 11.150 -2.879 10.442 1.00 21.22 C ATOM 2489 O SER A 161 10.835 -2.023 9.598 1.00 70.34 O ATOM 2490 CB SER A 161 13.375 -2.137 11.410 1.00 3.21 C ATOM 2491 OG SER A 161 14.747 -2.471 11.571 1.00 73.32 O ATOM 0 H SER A 161 13.834 -2.667 9.001 1.00 75.42 H new ATOM 0 HA SER A 161 12.710 -4.155 11.216 1.00 55.44 H new ATOM 0 HB2 SER A 161 13.287 -1.188 10.880 1.00 3.21 H new ATOM 0 HB3 SER A 161 12.913 -2.000 12.388 1.00 3.21 H new ATOM 0 HG SER A 161 15.201 -1.758 12.066 1.00 73.32 H new ATOM 2497 N CYS A 162 10.255 -3.521 11.223 1.00 1.24 N ATOM 2498 CA CYS A 162 8.800 -3.437 11.027 1.00 54.25 C ATOM 2499 C CYS A 162 8.302 -1.988 11.215 1.00 64.20 C ATOM 2500 O CYS A 162 8.801 -1.282 12.106 1.00 23.54 O ATOM 2501 CB CYS A 162 8.085 -4.397 12.016 1.00 30.11 C ATOM 2502 SG CYS A 162 6.285 -4.476 11.840 1.00 24.41 S ATOM 0 H CYS A 162 10.527 -4.113 12.008 1.00 1.24 H new ATOM 0 HA CYS A 162 8.564 -3.738 10.006 1.00 54.25 H new ATOM 0 HB2 CYS A 162 8.492 -5.399 11.884 1.00 30.11 H new ATOM 0 HB3 CYS A 162 8.322 -4.088 13.034 1.00 30.11 H new ATOM 0 HG CYS A 162 5.800 -5.308 12.713 1.00 24.41 H new ATOM 2508 N PRO A 163 7.333 -1.512 10.362 1.00 24.12 N ATOM 2509 CA PRO A 163 6.764 -0.151 10.468 1.00 52.04 C ATOM 2510 C PRO A 163 6.055 0.069 11.806 1.00 74.15 C ATOM 2511 O PRO A 163 5.765 -0.889 12.539 1.00 3.32 O ATOM 2512 CB PRO A 163 5.750 -0.079 9.285 1.00 21.43 C ATOM 2513 CG PRO A 163 6.158 -1.170 8.355 1.00 3.14 C ATOM 2514 CD PRO A 163 6.695 -2.262 9.247 1.00 3.00 C ATOM 0 HA PRO A 163 7.533 0.620 10.421 1.00 52.04 H new ATOM 0 HB2 PRO A 163 4.727 -0.221 9.634 1.00 21.43 H new ATOM 0 HB3 PRO A 163 5.787 0.893 8.793 1.00 21.43 H new ATOM 0 HG2 PRO A 163 5.312 -1.523 7.765 1.00 3.14 H new ATOM 0 HG3 PRO A 163 6.916 -0.826 7.652 1.00 3.14 H new ATOM 0 HD2 PRO A 163 5.900 -2.916 9.605 1.00 3.00 H new ATOM 0 HD3 PRO A 163 7.414 -2.892 8.723 1.00 3.00 H new ATOM 2522 N LEU A 164 5.760 1.335 12.114 1.00 21.14 N ATOM 2523 CA LEU A 164 4.936 1.697 13.270 1.00 34.24 C ATOM 2524 C LEU A 164 3.639 2.284 12.692 1.00 21.34 C ATOM 2525 O LEU A 164 3.548 3.498 12.485 1.00 53.05 O ATOM 2526 CB LEU A 164 5.662 2.697 14.232 1.00 30.23 C ATOM 2527 CG LEU A 164 6.926 2.155 15.001 1.00 64.43 C ATOM 2528 CD1 LEU A 164 6.630 0.818 15.727 1.00 62.41 C ATOM 2529 CD2 LEU A 164 8.162 2.034 14.078 1.00 0.35 C ATOM 0 H LEU A 164 6.084 2.135 11.571 1.00 21.14 H new ATOM 0 HA LEU A 164 4.731 0.825 13.891 1.00 34.24 H new ATOM 0 HB2 LEU A 164 5.966 3.567 13.650 1.00 30.23 H new ATOM 0 HB3 LEU A 164 4.939 3.044 14.970 1.00 30.23 H new ATOM 0 HG LEU A 164 7.167 2.895 15.765 1.00 64.43 H new ATOM 0 HD11 LEU A 164 7.527 0.479 16.245 1.00 62.41 H new ATOM 0 HD12 LEU A 164 5.828 0.966 16.450 1.00 62.41 H new ATOM 0 HD13 LEU A 164 6.326 0.067 14.997 1.00 62.41 H new ATOM 0 HD21 LEU A 164 9.009 1.657 14.651 1.00 0.35 H new ATOM 0 HD22 LEU A 164 7.941 1.346 13.262 1.00 0.35 H new ATOM 0 HD23 LEU A 164 8.408 3.014 13.669 1.00 0.35 H new ATOM 2541 N PRO A 165 2.628 1.415 12.345 1.00 65.34 N ATOM 2542 CA PRO A 165 1.409 1.853 11.657 1.00 33.52 C ATOM 2543 C PRO A 165 0.396 2.422 12.668 1.00 11.15 C ATOM 2544 O PRO A 165 0.061 1.725 13.640 1.00 14.23 O ATOM 2545 CB PRO A 165 0.888 0.542 10.969 1.00 0.12 C ATOM 2546 CG PRO A 165 1.846 -0.559 11.378 1.00 61.23 C ATOM 2547 CD PRO A 165 2.567 -0.047 12.605 1.00 23.15 C ATOM 0 HA PRO A 165 1.575 2.654 10.937 1.00 33.52 H new ATOM 0 HB2 PRO A 165 -0.128 0.312 11.288 1.00 0.12 H new ATOM 0 HB3 PRO A 165 0.864 0.654 9.885 1.00 0.12 H new ATOM 0 HG2 PRO A 165 1.309 -1.482 11.597 1.00 61.23 H new ATOM 0 HG3 PRO A 165 2.550 -0.782 10.576 1.00 61.23 H new ATOM 0 HD2 PRO A 165 2.023 -0.275 13.522 1.00 23.15 H new ATOM 0 HD3 PRO A 165 3.560 -0.485 12.706 1.00 23.15 H new ATOM 2555 N PRO A 166 -0.092 3.699 12.478 1.00 53.31 N ATOM 2556 CA PRO A 166 -1.132 4.307 13.351 1.00 61.00 C ATOM 2557 C PRO A 166 -2.364 3.383 13.435 1.00 60.51 C ATOM 2558 O PRO A 166 -2.901 2.991 12.409 1.00 44.13 O ATOM 2559 CB PRO A 166 -1.453 5.669 12.655 1.00 72.54 C ATOM 2560 CG PRO A 166 -0.889 5.543 11.269 1.00 10.33 C ATOM 2561 CD PRO A 166 0.321 4.649 11.407 1.00 31.32 C ATOM 0 HA PRO A 166 -0.810 4.451 14.382 1.00 61.00 H new ATOM 0 HB2 PRO A 166 -2.527 5.855 12.628 1.00 72.54 H new ATOM 0 HB3 PRO A 166 -0.999 6.502 13.191 1.00 72.54 H new ATOM 0 HG2 PRO A 166 -1.620 5.112 10.585 1.00 10.33 H new ATOM 0 HG3 PRO A 166 -0.613 6.518 10.867 1.00 10.33 H new ATOM 0 HD2 PRO A 166 0.551 4.133 10.475 1.00 31.32 H new ATOM 0 HD3 PRO A 166 1.211 5.213 11.687 1.00 31.32 H new ATOM 2569 N GLU A 167 -2.783 3.029 14.664 1.00 0.45 N ATOM 2570 CA GLU A 167 -3.825 1.996 14.916 1.00 10.24 C ATOM 2571 C GLU A 167 -5.164 2.253 14.167 1.00 60.13 C ATOM 2572 O GLU A 167 -5.965 1.332 13.983 1.00 10.54 O ATOM 2573 CB GLU A 167 -4.071 1.837 16.437 1.00 30.00 C ATOM 2574 CG GLU A 167 -2.804 1.494 17.248 1.00 51.02 C ATOM 2575 CD GLU A 167 -3.076 1.328 18.749 1.00 4.51 C ATOM 2576 OE1 GLU A 167 -3.213 2.351 19.452 1.00 12.41 O ATOM 2577 OE2 GLU A 167 -3.179 0.184 19.232 1.00 51.21 O ATOM 0 H GLU A 167 -2.412 3.448 15.517 1.00 0.45 H new ATOM 0 HA GLU A 167 -3.432 1.065 14.508 1.00 10.24 H new ATOM 0 HB2 GLU A 167 -4.497 2.763 16.824 1.00 30.00 H new ATOM 0 HB3 GLU A 167 -4.813 1.054 16.594 1.00 30.00 H new ATOM 0 HG2 GLU A 167 -2.370 0.573 16.860 1.00 51.02 H new ATOM 0 HG3 GLU A 167 -2.064 2.281 17.104 1.00 51.02 H new ATOM 2584 N SER A 168 -5.362 3.493 13.690 1.00 1.05 N ATOM 2585 CA SER A 168 -6.556 3.902 12.929 1.00 22.23 C ATOM 2586 C SER A 168 -6.567 3.322 11.482 1.00 64.03 C ATOM 2587 O SER A 168 -7.637 3.260 10.856 1.00 24.13 O ATOM 2588 CB SER A 168 -6.622 5.443 12.915 1.00 4.21 C ATOM 2589 OG SER A 168 -7.825 5.922 12.344 1.00 23.01 O ATOM 0 H SER A 168 -4.690 4.249 13.823 1.00 1.05 H new ATOM 0 HA SER A 168 -7.441 3.495 13.419 1.00 22.23 H new ATOM 0 HB2 SER A 168 -6.531 5.818 13.934 1.00 4.21 H new ATOM 0 HB3 SER A 168 -5.774 5.836 12.354 1.00 4.21 H new ATOM 0 HG SER A 168 -7.826 6.902 12.357 1.00 23.01 H new ATOM 2595 N ASN A 169 -5.398 2.848 10.973 1.00 33.11 N ATOM 2596 CA ASN A 169 -5.304 2.266 9.605 1.00 53.24 C ATOM 2597 C ASN A 169 -5.513 0.739 9.638 1.00 4.34 C ATOM 2598 O ASN A 169 -5.455 0.065 8.600 1.00 72.33 O ATOM 2599 CB ASN A 169 -3.955 2.621 8.872 1.00 4.03 C ATOM 2600 CG ASN A 169 -2.710 1.826 9.327 1.00 62.51 C ATOM 2601 OD1 ASN A 169 -1.913 2.289 10.125 1.00 64.34 O ATOM 2602 ND2 ASN A 169 -2.528 0.623 8.808 1.00 51.14 N ATOM 0 H ASN A 169 -4.515 2.857 11.484 1.00 33.11 H new ATOM 0 HA ASN A 169 -6.106 2.723 9.026 1.00 53.24 H new ATOM 0 HB2 ASN A 169 -4.093 2.462 7.802 1.00 4.03 H new ATOM 0 HB3 ASN A 169 -3.756 3.683 9.014 1.00 4.03 H new ATOM 0 HD21 ASN A 169 -1.713 0.071 9.074 1.00 51.14 H new ATOM 0 HD22 ASN A 169 -3.203 0.248 8.141 1.00 51.14 H new ATOM 2609 N TRP A 170 -5.751 0.194 10.837 1.00 10.12 N ATOM 2610 CA TRP A 170 -5.931 -1.246 11.038 1.00 3.51 C ATOM 2611 C TRP A 170 -7.405 -1.599 10.787 1.00 1.54 C ATOM 2612 O TRP A 170 -8.293 -1.057 11.449 1.00 53.32 O ATOM 2613 CB TRP A 170 -5.509 -1.659 12.472 1.00 32.03 C ATOM 2614 CG TRP A 170 -4.076 -1.331 12.870 1.00 42.10 C ATOM 2615 CD1 TRP A 170 -3.140 -0.590 12.184 1.00 41.04 C ATOM 2616 CD2 TRP A 170 -3.430 -1.739 14.086 1.00 4.32 C ATOM 2617 NE1 TRP A 170 -1.976 -0.515 12.901 1.00 13.32 N ATOM 2618 CE2 TRP A 170 -2.125 -1.214 14.070 1.00 71.11 C ATOM 2619 CE3 TRP A 170 -3.838 -2.498 15.189 1.00 10.22 C ATOM 2620 CZ2 TRP A 170 -1.225 -1.423 15.110 1.00 51.50 C ATOM 2621 CZ3 TRP A 170 -2.945 -2.704 16.223 1.00 23.11 C ATOM 2622 CH2 TRP A 170 -1.653 -2.171 16.177 1.00 52.12 C ATOM 0 H TRP A 170 -5.824 0.741 11.695 1.00 10.12 H new ATOM 0 HA TRP A 170 -5.298 -1.792 10.338 1.00 3.51 H new ATOM 0 HB2 TRP A 170 -6.181 -1.174 13.180 1.00 32.03 H new ATOM 0 HB3 TRP A 170 -5.657 -2.734 12.577 1.00 32.03 H new ATOM 0 HD1 TRP A 170 -3.301 -0.133 11.219 1.00 41.04 H new ATOM 0 HE1 TRP A 170 -1.133 -0.019 12.611 1.00 13.32 H new ATOM 0 HE3 TRP A 170 -4.833 -2.915 15.231 1.00 10.22 H new ATOM 0 HZ2 TRP A 170 -0.227 -1.012 15.078 1.00 51.50 H new ATOM 0 HZ3 TRP A 170 -3.250 -3.286 17.080 1.00 23.11 H new ATOM 0 HH2 TRP A 170 -0.977 -2.352 17.000 1.00 52.12 H new ATOM 2633 N LEU A 171 -7.658 -2.498 9.826 1.00 71.52 N ATOM 2634 CA LEU A 171 -9.020 -2.899 9.426 1.00 71.54 C ATOM 2635 C LEU A 171 -9.402 -4.182 10.184 1.00 43.35 C ATOM 2636 O LEU A 171 -8.752 -5.201 9.992 1.00 55.21 O ATOM 2637 CB LEU A 171 -9.075 -3.149 7.882 1.00 63.21 C ATOM 2638 CG LEU A 171 -8.325 -2.124 6.959 1.00 65.43 C ATOM 2639 CD1 LEU A 171 -8.499 -2.486 5.469 1.00 22.20 C ATOM 2640 CD2 LEU A 171 -8.757 -0.666 7.227 1.00 31.33 C ATOM 0 H LEU A 171 -6.923 -2.971 9.300 1.00 71.52 H new ATOM 0 HA LEU A 171 -9.725 -2.104 9.671 1.00 71.54 H new ATOM 0 HB2 LEU A 171 -8.667 -4.141 7.686 1.00 63.21 H new ATOM 0 HB3 LEU A 171 -10.122 -3.170 7.581 1.00 63.21 H new ATOM 0 HG LEU A 171 -7.266 -2.193 7.207 1.00 65.43 H new ATOM 0 HD11 LEU A 171 -7.969 -1.759 4.854 1.00 22.20 H new ATOM 0 HD12 LEU A 171 -8.093 -3.481 5.286 1.00 22.20 H new ATOM 0 HD13 LEU A 171 -9.558 -2.474 5.213 1.00 22.20 H new ATOM 0 HD21 LEU A 171 -8.210 0.003 6.563 1.00 31.33 H new ATOM 0 HD22 LEU A 171 -9.827 -0.564 7.044 1.00 31.33 H new ATOM 0 HD23 LEU A 171 -8.540 -0.407 8.263 1.00 31.33 H new ATOM 2652 N GLU A 172 -10.437 -4.159 11.047 1.00 62.11 N ATOM 2653 CA GLU A 172 -10.833 -5.374 11.806 1.00 70.32 C ATOM 2654 C GLU A 172 -11.804 -6.238 10.958 1.00 64.32 C ATOM 2655 O GLU A 172 -12.994 -6.388 11.263 1.00 74.44 O ATOM 2656 CB GLU A 172 -11.415 -5.002 13.198 1.00 3.21 C ATOM 2657 CG GLU A 172 -11.536 -6.193 14.179 1.00 35.34 C ATOM 2658 CD GLU A 172 -12.065 -5.778 15.559 1.00 53.11 C ATOM 2659 OE1 GLU A 172 -11.272 -5.278 16.382 1.00 22.20 O ATOM 2660 OE2 GLU A 172 -13.272 -5.944 15.825 1.00 41.42 O ATOM 0 H GLU A 172 -11.006 -3.334 11.237 1.00 62.11 H new ATOM 0 HA GLU A 172 -9.947 -5.978 12.001 1.00 70.32 H new ATOM 0 HB2 GLU A 172 -10.783 -4.237 13.650 1.00 3.21 H new ATOM 0 HB3 GLU A 172 -12.401 -4.559 13.059 1.00 3.21 H new ATOM 0 HG2 GLU A 172 -12.201 -6.944 13.751 1.00 35.34 H new ATOM 0 HG3 GLU A 172 -10.559 -6.662 14.296 1.00 35.34 H new ATOM 2667 N THR A 173 -11.256 -6.764 9.855 1.00 2.30 N ATOM 2668 CA THR A 173 -11.960 -7.619 8.893 1.00 0.12 C ATOM 2669 C THR A 173 -10.927 -8.401 8.067 1.00 1.43 C ATOM 2670 O THR A 173 -9.778 -7.970 7.942 1.00 64.43 O ATOM 2671 CB THR A 173 -12.881 -6.787 7.939 1.00 44.41 C ATOM 2672 OG1 THR A 173 -13.509 -7.651 6.978 1.00 5.44 O ATOM 2673 CG2 THR A 173 -12.120 -5.657 7.206 1.00 42.43 C ATOM 0 H THR A 173 -10.282 -6.601 9.601 1.00 2.30 H new ATOM 0 HA THR A 173 -12.599 -8.305 9.450 1.00 0.12 H new ATOM 0 HB THR A 173 -13.637 -6.314 8.566 1.00 44.41 H new ATOM 0 HG1 THR A 173 -14.084 -7.121 6.388 1.00 5.44 H new ATOM 0 HG21 THR A 173 -12.809 -5.114 6.559 1.00 42.43 H new ATOM 0 HG22 THR A 173 -11.693 -4.971 7.938 1.00 42.43 H new ATOM 0 HG23 THR A 173 -11.320 -6.088 6.604 1.00 42.43 H new ATOM 2681 N ALA A 174 -11.339 -9.549 7.518 1.00 1.15 N ATOM 2682 CA ALA A 174 -10.472 -10.383 6.677 1.00 61.54 C ATOM 2683 C ALA A 174 -10.631 -9.951 5.223 1.00 41.40 C ATOM 2684 O ALA A 174 -11.738 -10.032 4.672 1.00 71.04 O ATOM 2685 CB ALA A 174 -10.825 -11.866 6.834 1.00 11.30 C ATOM 0 H ALA A 174 -12.279 -9.925 7.643 1.00 1.15 H new ATOM 0 HA ALA A 174 -9.436 -10.253 6.988 1.00 61.54 H new ATOM 0 HB1 ALA A 174 -10.170 -12.465 6.202 1.00 11.30 H new ATOM 0 HB2 ALA A 174 -10.695 -12.163 7.875 1.00 11.30 H new ATOM 0 HB3 ALA A 174 -11.862 -12.027 6.537 1.00 11.30 H new ATOM 2691 N VAL A 175 -9.530 -9.507 4.599 1.00 2.45 N ATOM 2692 CA VAL A 175 -9.552 -9.082 3.197 1.00 34.52 C ATOM 2693 C VAL A 175 -9.382 -10.330 2.319 1.00 40.34 C ATOM 2694 O VAL A 175 -8.266 -10.765 2.003 1.00 53.02 O ATOM 2695 CB VAL A 175 -8.464 -7.984 2.891 1.00 54.41 C ATOM 2696 CG1 VAL A 175 -8.417 -7.633 1.379 1.00 20.33 C ATOM 2697 CG2 VAL A 175 -8.735 -6.724 3.755 1.00 43.30 C ATOM 0 H VAL A 175 -8.616 -9.434 5.045 1.00 2.45 H new ATOM 0 HA VAL A 175 -10.507 -8.607 2.974 1.00 34.52 H new ATOM 0 HB VAL A 175 -7.484 -8.384 3.152 1.00 54.41 H new ATOM 0 HG11 VAL A 175 -7.655 -6.873 1.205 1.00 20.33 H new ATOM 0 HG12 VAL A 175 -8.174 -8.527 0.805 1.00 20.33 H new ATOM 0 HG13 VAL A 175 -9.388 -7.252 1.064 1.00 20.33 H new ATOM 0 HG21 VAL A 175 -7.981 -5.967 3.541 1.00 43.30 H new ATOM 0 HG22 VAL A 175 -9.723 -6.328 3.521 1.00 43.30 H new ATOM 0 HG23 VAL A 175 -8.692 -6.991 4.811 1.00 43.30 H new ATOM 2707 N THR A 176 -10.526 -10.947 2.006 1.00 43.51 N ATOM 2708 CA THR A 176 -10.620 -12.102 1.123 1.00 5.12 C ATOM 2709 C THR A 176 -11.058 -11.628 -0.267 1.00 73.43 C ATOM 2710 O THR A 176 -12.246 -11.388 -0.524 1.00 24.02 O ATOM 2711 CB THR A 176 -11.611 -13.150 1.728 1.00 61.30 C ATOM 2712 OG1 THR A 176 -12.836 -12.498 2.118 1.00 62.10 O ATOM 2713 CG2 THR A 176 -11.005 -13.863 2.953 1.00 52.03 C ATOM 0 H THR A 176 -11.430 -10.646 2.371 1.00 43.51 H new ATOM 0 HA THR A 176 -9.651 -12.592 1.026 1.00 5.12 H new ATOM 0 HB THR A 176 -11.811 -13.897 0.960 1.00 61.30 H new ATOM 0 HG1 THR A 176 -13.110 -11.870 1.417 1.00 62.10 H new ATOM 0 HG21 THR A 176 -11.722 -14.584 3.346 1.00 52.03 H new ATOM 0 HG22 THR A 176 -10.093 -14.383 2.658 1.00 52.03 H new ATOM 0 HG23 THR A 176 -10.770 -13.128 3.723 1.00 52.03 H new ATOM 2721 N ALA A 177 -10.064 -11.440 -1.136 1.00 71.12 N ATOM 2722 CA ALA A 177 -10.248 -10.910 -2.489 1.00 23.51 C ATOM 2723 C ALA A 177 -9.377 -11.696 -3.467 1.00 54.22 C ATOM 2724 O ALA A 177 -8.256 -12.070 -3.111 1.00 12.13 O ATOM 2725 CB ALA A 177 -9.892 -9.415 -2.509 1.00 31.31 C ATOM 0 H ALA A 177 -9.091 -11.655 -0.916 1.00 71.12 H new ATOM 0 HA ALA A 177 -11.289 -11.018 -2.793 1.00 23.51 H new ATOM 0 HB1 ALA A 177 -10.029 -9.022 -3.516 1.00 31.31 H new ATOM 0 HB2 ALA A 177 -10.541 -8.877 -1.818 1.00 31.31 H new ATOM 0 HB3 ALA A 177 -8.853 -9.284 -2.207 1.00 31.31 H new ATOM 2731 N GLY A 178 -9.914 -11.963 -4.678 1.00 32.51 N ATOM 2732 CA GLY A 178 -9.176 -12.651 -5.743 1.00 71.31 C ATOM 2733 C GLY A 178 -8.542 -13.970 -5.309 1.00 35.11 C ATOM 2734 O GLY A 178 -9.119 -14.713 -4.508 1.00 74.31 O ATOM 0 H GLY A 178 -10.867 -11.706 -4.937 1.00 32.51 H new ATOM 0 HA2 GLY A 178 -9.854 -12.842 -6.575 1.00 71.31 H new ATOM 0 HA3 GLY A 178 -8.394 -11.989 -6.115 1.00 71.31 H new ATOM 2738 N GLU A 179 -7.372 -14.274 -5.880 1.00 21.43 N ATOM 2739 CA GLU A 179 -6.483 -15.328 -5.372 1.00 32.23 C ATOM 2740 C GLU A 179 -5.956 -14.928 -3.971 1.00 4.33 C ATOM 2741 O GLU A 179 -5.619 -13.769 -3.744 1.00 32.34 O ATOM 2742 CB GLU A 179 -5.313 -15.543 -6.356 1.00 73.45 C ATOM 2743 CG GLU A 179 -4.382 -16.714 -5.993 1.00 43.11 C ATOM 2744 CD GLU A 179 -3.223 -16.859 -6.978 1.00 3.05 C ATOM 2745 OE1 GLU A 179 -3.405 -17.491 -8.039 1.00 4.23 O ATOM 2746 OE2 GLU A 179 -2.135 -16.319 -6.712 1.00 54.44 O ATOM 0 H GLU A 179 -7.013 -13.797 -6.707 1.00 21.43 H new ATOM 0 HA GLU A 179 -7.035 -16.264 -5.284 1.00 32.23 H new ATOM 0 HB2 GLU A 179 -5.720 -15.714 -7.353 1.00 73.45 H new ATOM 0 HB3 GLU A 179 -4.723 -14.628 -6.405 1.00 73.45 H new ATOM 0 HG2 GLU A 179 -3.986 -16.563 -4.989 1.00 43.11 H new ATOM 0 HG3 GLU A 179 -4.957 -17.640 -5.973 1.00 43.11 H new ATOM 2753 N ARG A 180 -5.892 -15.892 -3.043 1.00 44.52 N ATOM 2754 CA ARG A 180 -5.537 -15.635 -1.627 1.00 61.22 C ATOM 2755 C ARG A 180 -4.049 -15.957 -1.373 1.00 54.25 C ATOM 2756 O ARG A 180 -3.276 -16.120 -2.326 1.00 61.31 O ATOM 2757 CB ARG A 180 -6.490 -16.447 -0.705 1.00 24.22 C ATOM 2758 CG ARG A 180 -7.975 -16.058 -0.860 1.00 14.05 C ATOM 2759 CD ARG A 180 -8.898 -16.905 0.026 1.00 53.00 C ATOM 2760 NE ARG A 180 -8.826 -18.349 -0.296 1.00 53.43 N ATOM 2761 CZ ARG A 180 -9.878 -19.181 -0.389 1.00 72.31 C ATOM 2762 NH1 ARG A 180 -11.115 -18.738 -0.191 1.00 45.43 N ATOM 2763 NH2 ARG A 180 -9.678 -20.460 -0.662 1.00 2.01 N ATOM 0 H ARG A 180 -6.083 -16.873 -3.245 1.00 44.52 H new ATOM 0 HA ARG A 180 -5.668 -14.578 -1.396 1.00 61.22 H new ATOM 0 HB2 ARG A 180 -6.376 -17.509 -0.923 1.00 24.22 H new ATOM 0 HB3 ARG A 180 -6.191 -16.301 0.333 1.00 24.22 H new ATOM 0 HG2 ARG A 180 -8.100 -15.005 -0.608 1.00 14.05 H new ATOM 0 HG3 ARG A 180 -8.271 -16.173 -1.903 1.00 14.05 H new ATOM 0 HD2 ARG A 180 -8.630 -16.756 1.072 1.00 53.00 H new ATOM 0 HD3 ARG A 180 -9.925 -16.561 -0.092 1.00 53.00 H new ATOM 0 HE ARG A 180 -7.901 -18.745 -0.461 1.00 53.43 H new ATOM 0 HH11 ARG A 180 -11.275 -17.756 0.035 1.00 45.43 H new ATOM 0 HH12 ARG A 180 -11.904 -19.380 -0.265 1.00 45.43 H new ATOM 0 HH21 ARG A 180 -8.730 -20.810 -0.801 1.00 2.01 H new ATOM 0 HH22 ARG A 180 -10.472 -21.096 -0.734 1.00 2.01 H new