USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 914 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: B 163 SER OG : rot -125:sc= 1.36 USER MOD Set 1.2: B 165 THR OG1 : rot 180:sc= 1.03 USER MOD Set 2.1: A 118 GLN : amide:sc= 0.715 K(o=1.8,f=-4.5) USER MOD Set 2.2: A 121 LYS NZ :NH3+ -178:sc= 1.13 (180deg=0) USER MOD Set 3.1: A 60 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 117 ASN : amide:sc= -2.2! C(o=-4.7!,f=-5.7!) USER MOD Set 3.3: A 120 HIS : no HD1:sc= -2.47! K(o=-4.7!,f=-0.29) USER MOD Set 4.1: A 54 SER OG : rot 160:sc= 0.809 USER MOD Set 4.2: A 62 LYS NZ :NH3+ 166:sc= 0.922 (180deg=0) USER MOD Set 5.1: A 53 TYR OH : rot 107:sc= 0.5 USER MOD Set 5.2: A 61 HIS : no HD1:sc= -1.87 K(o=-1.4,f=-4.3) USER MOD Set 6.1: A 44 SER OG : rot 180:sc= 0 USER MOD Set 6.2: A 45 LYS NZ :NH3+ 171:sc= 1.03 (180deg=0.961) USER MOD Set 7.1: A 25 SER OG : rot 120:sc= 0.135 USER MOD Set 7.2: A 27 SER OG : rot -125:sc= -0.128 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 13 THR OG1 : rot 82:sc= 1.33 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ -126:sc= 0.504 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot -77:sc= 0.921 USER MOD Single : A 34 THR OG1 : rot 85:sc= 1.19 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 HIS : no HD1:sc= -0.279 X(o=-0.28,f=-0.013) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 57 CYS SG : rot 160:sc= -0.352 USER MOD Single : A 65 SER OG : rot -44:sc= 0.976 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot -86:sc= 0.556 USER MOD Single : A 76 TYR OH : rot 180:sc=-0.00905 USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot -12:sc= 0.713 USER MOD Single : A 94 CYS SG : rot 180:sc= -0.0352 USER MOD Single : A 96 HIS : no HD1:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 99 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 100 THR OG1 : rot 85:sc= 1.23 USER MOD Single : A 106 GLN : amide:sc= 0.0438 K(o=0.044,f=-0.72) USER MOD Single : A 110 SER OG : rot -92:sc= 1.27 USER MOD Single : A 115 LYS NZ :NH3+ -155:sc= 0 (180deg=-0.253) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 161:sc= 0.0583 (180deg=0.0191) USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 161 SER OG : rot 180:sc= -0.0926 USER MOD Single : B 162 TYR OH : rot 180:sc= 1.22 USER MOD ----------------------------------------------------------------- ATOM 78 N ASP A 6 -2.322 -5.741 20.416 1.00 0.00 N ATOM 79 CA ASP A 6 -1.736 -4.415 20.272 1.00 0.00 C ATOM 80 C ASP A 6 -1.100 -4.275 18.885 1.00 0.00 C ATOM 81 O ASP A 6 -1.421 -5.032 17.968 1.00 0.00 O ATOM 82 CB ASP A 6 -0.691 -4.211 21.372 1.00 0.00 C ATOM 83 CG ASP A 6 -1.311 -4.241 22.763 1.00 0.00 C ATOM 84 OD1 ASP A 6 -2.253 -3.449 22.992 1.00 0.00 O ATOM 85 OD2 ASP A 6 -0.837 -5.055 23.587 1.00 0.00 O ATOM 0 HA ASP A 6 -2.509 -3.653 20.370 1.00 0.00 H new ATOM 0 HB2 ASP A 6 0.070 -4.988 21.298 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -0.187 -3.256 21.220 1.00 0.00 H new ATOM 90 N PHE A 7 -0.198 -3.302 18.729 1.00 0.00 N ATOM 91 CA PHE A 7 0.531 -3.072 17.489 1.00 0.00 C ATOM 92 C PHE A 7 1.254 -4.341 17.033 1.00 0.00 C ATOM 93 O PHE A 7 1.702 -4.428 15.889 1.00 0.00 O ATOM 94 CB PHE A 7 1.530 -1.938 17.728 1.00 0.00 C ATOM 95 CG PHE A 7 2.258 -1.434 16.500 1.00 0.00 C ATOM 96 CD1 PHE A 7 1.559 -1.186 15.307 1.00 0.00 C ATOM 97 CD2 PHE A 7 3.642 -1.212 16.551 1.00 0.00 C ATOM 98 CE1 PHE A 7 2.236 -0.711 14.175 1.00 0.00 C ATOM 99 CE2 PHE A 7 4.319 -0.738 15.418 1.00 0.00 C ATOM 100 CZ PHE A 7 3.618 -0.484 14.232 1.00 0.00 C ATOM 0 H PHE A 7 0.046 -2.647 19.472 1.00 0.00 H new ATOM 0 HA PHE A 7 -0.166 -2.797 16.698 1.00 0.00 H new ATOM 0 HB2 PHE A 7 1.000 -1.101 18.182 1.00 0.00 H new ATOM 0 HB3 PHE A 7 2.270 -2.277 18.453 1.00 0.00 H new ATOM 0 HD1 PHE A 7 0.494 -1.362 15.262 1.00 0.00 H new ATOM 0 HD2 PHE A 7 4.187 -1.406 17.463 1.00 0.00 H new ATOM 0 HE1 PHE A 7 1.694 -0.520 13.261 1.00 0.00 H new ATOM 0 HE2 PHE A 7 5.385 -0.568 15.460 1.00 0.00 H new ATOM 0 HZ PHE A 7 4.142 -0.114 13.363 1.00 0.00 H new ATOM 110 N GLN A 8 1.369 -5.327 17.929 1.00 0.00 N ATOM 111 CA GLN A 8 1.949 -6.623 17.621 1.00 0.00 C ATOM 112 C GLN A 8 1.258 -7.244 16.408 1.00 0.00 C ATOM 113 O GLN A 8 1.920 -7.924 15.627 1.00 0.00 O ATOM 114 CB GLN A 8 1.789 -7.519 18.852 1.00 0.00 C ATOM 115 CG GLN A 8 2.020 -8.992 18.507 1.00 0.00 C ATOM 116 CD GLN A 8 2.033 -9.864 19.754 1.00 0.00 C ATOM 117 OE1 GLN A 8 3.071 -10.403 20.131 1.00 0.00 O ATOM 118 NE2 GLN A 8 0.885 -10.013 20.408 1.00 0.00 N ATOM 0 H GLN A 8 1.057 -5.239 18.896 1.00 0.00 H new ATOM 0 HA GLN A 8 3.005 -6.513 17.376 1.00 0.00 H new ATOM 0 HB2 GLN A 8 2.495 -7.210 19.623 1.00 0.00 H new ATOM 0 HB3 GLN A 8 0.789 -7.394 19.267 1.00 0.00 H new ATOM 0 HG2 GLN A 8 1.237 -9.335 17.831 1.00 0.00 H new ATOM 0 HG3 GLN A 8 2.967 -9.098 17.978 1.00 0.00 H new ATOM 0 HE21 GLN A 8 0.041 -9.552 20.068 1.00 0.00 H new ATOM 0 HE22 GLN A 8 0.848 -10.589 21.249 1.00 0.00 H new ATOM 127 N ASN A 9 -0.051 -7.029 16.227 1.00 0.00 N ATOM 128 CA ASN A 9 -0.740 -7.606 15.081 1.00 0.00 C ATOM 129 C ASN A 9 -0.192 -7.017 13.788 1.00 0.00 C ATOM 130 O ASN A 9 0.127 -7.760 12.862 1.00 0.00 O ATOM 131 CB ASN A 9 -2.254 -7.383 15.183 1.00 0.00 C ATOM 132 CG ASN A 9 -2.882 -8.227 16.285 1.00 0.00 C ATOM 133 OD1 ASN A 9 -2.191 -8.874 17.067 1.00 0.00 O ATOM 134 ND2 ASN A 9 -4.209 -8.226 16.357 1.00 0.00 N ATOM 0 H ASN A 9 -0.638 -6.472 16.848 1.00 0.00 H new ATOM 0 HA ASN A 9 -0.561 -8.681 15.076 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -2.453 -6.329 15.376 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -2.721 -7.626 14.229 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -4.681 -8.773 17.077 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -4.755 -7.678 15.693 1.00 0.00 H new ATOM 141 N PHE A 10 -0.075 -5.686 13.713 1.00 0.00 N ATOM 142 CA PHE A 10 0.398 -5.034 12.501 1.00 0.00 C ATOM 143 C PHE A 10 1.832 -5.453 12.195 1.00 0.00 C ATOM 144 O PHE A 10 2.144 -5.834 11.066 1.00 0.00 O ATOM 145 CB PHE A 10 0.291 -3.521 12.672 1.00 0.00 C ATOM 146 CG PHE A 10 0.524 -2.743 11.397 1.00 0.00 C ATOM 147 CD1 PHE A 10 1.830 -2.486 10.955 1.00 0.00 C ATOM 148 CD2 PHE A 10 -0.569 -2.281 10.653 1.00 0.00 C ATOM 149 CE1 PHE A 10 2.041 -1.775 9.764 1.00 0.00 C ATOM 150 CE2 PHE A 10 -0.358 -1.567 9.466 1.00 0.00 C ATOM 151 CZ PHE A 10 0.946 -1.319 9.020 1.00 0.00 C ATOM 0 H PHE A 10 -0.302 -5.048 14.476 1.00 0.00 H new ATOM 0 HA PHE A 10 -0.221 -5.339 11.657 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -0.699 -3.278 13.059 1.00 0.00 H new ATOM 0 HB3 PHE A 10 1.014 -3.198 13.421 1.00 0.00 H new ATOM 0 HD1 PHE A 10 2.674 -2.836 11.532 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -1.575 -2.475 10.994 1.00 0.00 H new ATOM 0 HE1 PHE A 10 3.047 -1.580 9.422 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -1.201 -1.208 8.895 1.00 0.00 H new ATOM 0 HZ PHE A 10 1.107 -0.775 8.101 1.00 0.00 H new ATOM 161 N VAL A 11 2.706 -5.381 13.203 1.00 0.00 N ATOM 162 CA VAL A 11 4.108 -5.721 13.025 1.00 0.00 C ATOM 163 C VAL A 11 4.253 -7.193 12.653 1.00 0.00 C ATOM 164 O VAL A 11 4.815 -7.506 11.607 1.00 0.00 O ATOM 165 CB VAL A 11 4.901 -5.389 14.294 1.00 0.00 C ATOM 166 CG1 VAL A 11 6.364 -5.797 14.136 1.00 0.00 C ATOM 167 CG2 VAL A 11 4.843 -3.887 14.566 1.00 0.00 C ATOM 0 H VAL A 11 2.461 -5.089 14.149 1.00 0.00 H new ATOM 0 HA VAL A 11 4.515 -5.126 12.208 1.00 0.00 H new ATOM 0 HB VAL A 11 4.457 -5.939 15.124 1.00 0.00 H new ATOM 0 HG11 VAL A 11 6.910 -5.553 15.047 1.00 0.00 H new ATOM 0 HG12 VAL A 11 6.425 -6.870 13.953 1.00 0.00 H new ATOM 0 HG13 VAL A 11 6.803 -5.260 13.295 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.409 -3.659 15.469 1.00 0.00 H new ATOM 0 HG22 VAL A 11 5.273 -3.348 13.722 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.805 -3.581 14.701 1.00 0.00 H new ATOM 177 N ALA A 12 3.749 -8.095 13.499 1.00 0.00 N ATOM 178 CA ALA A 12 3.881 -9.525 13.270 1.00 0.00 C ATOM 179 C ALA A 12 3.249 -9.948 11.946 1.00 0.00 C ATOM 180 O ALA A 12 3.706 -10.917 11.341 1.00 0.00 O ATOM 181 CB ALA A 12 3.238 -10.282 14.428 1.00 0.00 C ATOM 0 H ALA A 12 3.244 -7.852 14.351 1.00 0.00 H new ATOM 0 HA ALA A 12 4.943 -9.766 13.213 1.00 0.00 H new ATOM 0 HB1 ALA A 12 3.335 -11.355 14.260 1.00 0.00 H new ATOM 0 HB2 ALA A 12 3.737 -10.014 15.359 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.182 -10.019 14.493 1.00 0.00 H new ATOM 187 N THR A 13 2.211 -9.243 11.484 1.00 0.00 N ATOM 188 CA THR A 13 1.614 -9.563 10.197 1.00 0.00 C ATOM 189 C THR A 13 2.546 -9.159 9.062 1.00 0.00 C ATOM 190 O THR A 13 2.750 -9.942 8.136 1.00 0.00 O ATOM 191 CB THR A 13 0.246 -8.897 10.046 1.00 0.00 C ATOM 192 OG1 THR A 13 -0.637 -9.417 11.014 1.00 0.00 O ATOM 193 CG2 THR A 13 -0.334 -9.206 8.671 1.00 0.00 C ATOM 0 H THR A 13 1.778 -8.462 11.977 1.00 0.00 H new ATOM 0 HA THR A 13 1.464 -10.642 10.149 1.00 0.00 H new ATOM 0 HB THR A 13 0.366 -7.821 10.171 1.00 0.00 H new ATOM 0 HG1 THR A 13 -0.495 -8.957 11.867 1.00 0.00 H new ATOM 0 HG21 THR A 13 -1.309 -8.728 8.571 1.00 0.00 H new ATOM 0 HG22 THR A 13 0.337 -8.827 7.900 1.00 0.00 H new ATOM 0 HG23 THR A 13 -0.445 -10.284 8.557 1.00 0.00 H new ATOM 201 N LEU A 14 3.113 -7.951 9.119 1.00 0.00 N ATOM 202 CA LEU A 14 4.020 -7.491 8.076 1.00 0.00 C ATOM 203 C LEU A 14 5.295 -8.341 8.072 1.00 0.00 C ATOM 204 O LEU A 14 5.888 -8.591 7.024 1.00 0.00 O ATOM 205 CB LEU A 14 4.350 -6.017 8.325 1.00 0.00 C ATOM 206 CG LEU A 14 4.988 -5.319 7.115 1.00 0.00 C ATOM 207 CD1 LEU A 14 4.021 -5.290 5.931 1.00 0.00 C ATOM 208 CD2 LEU A 14 5.297 -3.880 7.510 1.00 0.00 C ATOM 0 H LEU A 14 2.959 -7.281 9.873 1.00 0.00 H new ATOM 0 HA LEU A 14 3.546 -7.594 7.100 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.436 -5.490 8.598 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.027 -5.943 9.176 1.00 0.00 H new ATOM 0 HG LEU A 14 5.888 -5.861 6.825 1.00 0.00 H new ATOM 0 HD11 LEU A 14 4.495 -4.791 5.086 1.00 0.00 H new ATOM 0 HD12 LEU A 14 3.760 -6.310 5.650 1.00 0.00 H new ATOM 0 HD13 LEU A 14 3.118 -4.748 6.212 1.00 0.00 H new ATOM 0 HD21 LEU A 14 5.752 -3.361 6.666 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.374 -3.374 7.792 1.00 0.00 H new ATOM 0 HD23 LEU A 14 5.987 -3.874 8.354 1.00 0.00 H new ATOM 220 N GLU A 15 5.712 -8.783 9.261 1.00 0.00 N ATOM 221 CA GLU A 15 6.883 -9.632 9.449 1.00 0.00 C ATOM 222 C GLU A 15 6.616 -11.010 8.860 1.00 0.00 C ATOM 223 O GLU A 15 7.473 -11.583 8.191 1.00 0.00 O ATOM 224 CB GLU A 15 7.168 -9.773 10.944 1.00 0.00 C ATOM 225 CG GLU A 15 7.634 -8.459 11.562 1.00 0.00 C ATOM 226 CD GLU A 15 9.142 -8.280 11.402 1.00 0.00 C ATOM 227 OE1 GLU A 15 9.560 -7.793 10.327 1.00 0.00 O ATOM 228 OE2 GLU A 15 9.869 -8.633 12.357 1.00 0.00 O ATOM 0 H GLU A 15 5.235 -8.555 10.133 1.00 0.00 H new ATOM 0 HA GLU A 15 7.740 -9.182 8.948 1.00 0.00 H new ATOM 0 HB2 GLU A 15 6.267 -10.115 11.454 1.00 0.00 H new ATOM 0 HB3 GLU A 15 7.930 -10.537 11.097 1.00 0.00 H new ATOM 0 HG2 GLU A 15 7.114 -7.626 11.089 1.00 0.00 H new ATOM 0 HG3 GLU A 15 7.373 -8.438 12.620 1.00 0.00 H new ATOM 235 N SER A 16 5.417 -11.546 9.110 1.00 0.00 N ATOM 236 CA SER A 16 4.996 -12.801 8.510 1.00 0.00 C ATOM 237 C SER A 16 4.930 -12.643 6.993 1.00 0.00 C ATOM 238 O SER A 16 5.175 -13.599 6.261 1.00 0.00 O ATOM 239 CB SER A 16 3.633 -13.207 9.074 1.00 0.00 C ATOM 240 OG SER A 16 3.246 -14.464 8.560 1.00 0.00 O ATOM 0 H SER A 16 4.724 -11.123 9.727 1.00 0.00 H new ATOM 0 HA SER A 16 5.716 -13.585 8.747 1.00 0.00 H new ATOM 0 HB2 SER A 16 3.680 -13.250 10.162 1.00 0.00 H new ATOM 0 HB3 SER A 16 2.887 -12.456 8.817 1.00 0.00 H new ATOM 0 HG SER A 16 2.373 -14.714 8.929 1.00 0.00 H new ATOM 246 N PHE A 17 4.601 -11.438 6.517 1.00 0.00 N ATOM 247 CA PHE A 17 4.563 -11.148 5.094 1.00 0.00 C ATOM 248 C PHE A 17 5.981 -11.114 4.524 1.00 0.00 C ATOM 249 O PHE A 17 6.197 -11.481 3.372 1.00 0.00 O ATOM 250 CB PHE A 17 3.844 -9.812 4.881 1.00 0.00 C ATOM 251 CG PHE A 17 2.890 -9.787 3.704 1.00 0.00 C ATOM 252 CD1 PHE A 17 2.029 -10.870 3.465 1.00 0.00 C ATOM 253 CD2 PHE A 17 2.862 -8.676 2.847 1.00 0.00 C ATOM 254 CE1 PHE A 17 1.140 -10.839 2.382 1.00 0.00 C ATOM 255 CE2 PHE A 17 1.973 -8.647 1.761 1.00 0.00 C ATOM 256 CZ PHE A 17 1.111 -9.728 1.533 1.00 0.00 C ATOM 0 H PHE A 17 4.356 -10.645 7.110 1.00 0.00 H new ATOM 0 HA PHE A 17 4.017 -11.931 4.567 1.00 0.00 H new ATOM 0 HB2 PHE A 17 3.289 -9.565 5.786 1.00 0.00 H new ATOM 0 HB3 PHE A 17 4.591 -9.031 4.742 1.00 0.00 H new ATOM 0 HD1 PHE A 17 2.052 -11.730 4.118 1.00 0.00 H new ATOM 0 HD2 PHE A 17 3.525 -7.842 3.023 1.00 0.00 H new ATOM 0 HE1 PHE A 17 0.477 -11.673 2.203 1.00 0.00 H new ATOM 0 HE2 PHE A 17 1.953 -7.792 1.102 1.00 0.00 H new ATOM 0 HZ PHE A 17 0.423 -9.703 0.701 1.00 0.00 H new ATOM 266 N LYS A 18 6.947 -10.672 5.336 1.00 0.00 N ATOM 267 CA LYS A 18 8.355 -10.649 4.957 1.00 0.00 C ATOM 268 C LYS A 18 8.955 -12.052 4.934 1.00 0.00 C ATOM 269 O LYS A 18 9.773 -12.356 4.067 1.00 0.00 O ATOM 270 CB LYS A 18 9.114 -9.762 5.950 1.00 0.00 C ATOM 271 CG LYS A 18 10.557 -9.544 5.493 1.00 0.00 C ATOM 272 CD LYS A 18 11.276 -8.566 6.427 1.00 0.00 C ATOM 273 CE LYS A 18 11.373 -9.129 7.845 1.00 0.00 C ATOM 274 NZ LYS A 18 12.048 -8.178 8.748 1.00 0.00 N ATOM 0 H LYS A 18 6.769 -10.320 6.277 1.00 0.00 H new ATOM 0 HA LYS A 18 8.442 -10.246 3.948 1.00 0.00 H new ATOM 0 HB2 LYS A 18 8.609 -8.801 6.045 1.00 0.00 H new ATOM 0 HB3 LYS A 18 9.107 -10.225 6.937 1.00 0.00 H new ATOM 0 HG2 LYS A 18 11.087 -10.496 5.477 1.00 0.00 H new ATOM 0 HG3 LYS A 18 10.567 -9.156 4.474 1.00 0.00 H new ATOM 0 HD2 LYS A 18 12.276 -8.362 6.044 1.00 0.00 H new ATOM 0 HD3 LYS A 18 10.741 -7.616 6.445 1.00 0.00 H new ATOM 0 HE2 LYS A 18 10.374 -9.347 8.222 1.00 0.00 H new ATOM 0 HE3 LYS A 18 11.920 -10.071 7.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 12.844 -8.652 9.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 12.403 -7.370 8.198 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 11.373 -7.841 9.464 1.00 0.00 H new ATOM 359 N ILE A 24 0.503 -12.757 -2.746 1.00 0.00 N ATOM 360 CA ILE A 24 -0.003 -11.626 -1.983 1.00 0.00 C ATOM 361 C ILE A 24 -1.275 -12.026 -1.232 1.00 0.00 C ATOM 362 O ILE A 24 -2.378 -11.675 -1.649 1.00 0.00 O ATOM 363 CB ILE A 24 -0.235 -10.429 -2.919 1.00 0.00 C ATOM 364 CG1 ILE A 24 0.946 -10.197 -3.870 1.00 0.00 C ATOM 365 CG2 ILE A 24 -0.495 -9.169 -2.089 1.00 0.00 C ATOM 366 CD1 ILE A 24 2.280 -9.998 -3.146 1.00 0.00 C ATOM 0 HA ILE A 24 0.733 -11.324 -1.238 1.00 0.00 H new ATOM 0 HB ILE A 24 -1.106 -10.656 -3.535 1.00 0.00 H new ATOM 0 HG12 ILE A 24 1.031 -11.048 -4.546 1.00 0.00 H new ATOM 0 HG13 ILE A 24 0.741 -9.321 -4.485 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -0.659 -8.322 -2.755 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -1.378 -9.318 -1.468 1.00 0.00 H new ATOM 0 HG23 ILE A 24 0.367 -8.968 -1.452 1.00 0.00 H new ATOM 0 HD11 ILE A 24 3.071 -9.839 -3.879 1.00 0.00 H new ATOM 0 HD12 ILE A 24 2.212 -9.130 -2.491 1.00 0.00 H new ATOM 0 HD13 ILE A 24 2.507 -10.883 -2.552 1.00 0.00 H new ATOM 378 N SER A 25 -1.127 -12.760 -0.126 1.00 0.00 N ATOM 379 CA SER A 25 -2.278 -13.199 0.647 1.00 0.00 C ATOM 380 C SER A 25 -3.010 -11.993 1.231 1.00 0.00 C ATOM 381 O SER A 25 -2.416 -11.170 1.929 1.00 0.00 O ATOM 382 CB SER A 25 -1.831 -14.157 1.746 1.00 0.00 C ATOM 383 OG SER A 25 -2.966 -14.664 2.407 1.00 0.00 O ATOM 0 H SER A 25 -0.226 -13.058 0.247 1.00 0.00 H new ATOM 0 HA SER A 25 -2.970 -13.729 -0.007 1.00 0.00 H new ATOM 0 HB2 SER A 25 -1.249 -14.974 1.319 1.00 0.00 H new ATOM 0 HB3 SER A 25 -1.183 -13.640 2.454 1.00 0.00 H new ATOM 0 HG SER A 25 -2.988 -15.640 2.318 1.00 0.00 H new ATOM 389 N GLY A 26 -4.309 -11.889 0.938 1.00 0.00 N ATOM 390 CA GLY A 26 -5.119 -10.757 1.351 1.00 0.00 C ATOM 391 C GLY A 26 -5.340 -10.716 2.858 1.00 0.00 C ATOM 392 O GLY A 26 -5.566 -9.642 3.409 1.00 0.00 O ATOM 0 H GLY A 26 -4.822 -12.592 0.407 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -4.636 -9.833 1.033 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -6.084 -10.802 0.847 1.00 0.00 H new ATOM 396 N SER A 27 -5.280 -11.862 3.544 1.00 0.00 N ATOM 397 CA SER A 27 -5.574 -11.906 4.970 1.00 0.00 C ATOM 398 C SER A 27 -4.558 -11.092 5.765 1.00 0.00 C ATOM 399 O SER A 27 -4.905 -10.487 6.780 1.00 0.00 O ATOM 400 CB SER A 27 -5.618 -13.361 5.436 1.00 0.00 C ATOM 401 OG SER A 27 -4.369 -13.981 5.218 1.00 0.00 O ATOM 0 H SER A 27 -5.032 -12.762 3.134 1.00 0.00 H new ATOM 0 HA SER A 27 -6.550 -11.455 5.148 1.00 0.00 H new ATOM 0 HB2 SER A 27 -5.873 -13.404 6.495 1.00 0.00 H new ATOM 0 HB3 SER A 27 -6.398 -13.899 4.898 1.00 0.00 H new ATOM 0 HG SER A 27 -4.495 -14.791 4.682 1.00 0.00 H new ATOM 407 N ARG A 28 -3.303 -11.070 5.310 1.00 0.00 N ATOM 408 CA ARG A 28 -2.275 -10.268 5.958 1.00 0.00 C ATOM 409 C ARG A 28 -2.566 -8.791 5.706 1.00 0.00 C ATOM 410 O ARG A 28 -2.385 -7.965 6.597 1.00 0.00 O ATOM 411 CB ARG A 28 -0.890 -10.674 5.444 1.00 0.00 C ATOM 412 CG ARG A 28 -0.401 -12.007 6.026 1.00 0.00 C ATOM 413 CD ARG A 28 -1.264 -13.202 5.612 1.00 0.00 C ATOM 414 NE ARG A 28 -0.670 -14.466 6.066 1.00 0.00 N ATOM 415 CZ ARG A 28 -1.071 -15.678 5.665 1.00 0.00 C ATOM 416 NH1 ARG A 28 -2.064 -15.817 4.786 1.00 0.00 N ATOM 417 NH2 ARG A 28 -0.474 -16.765 6.146 1.00 0.00 N ATOM 0 H ARG A 28 -2.980 -11.597 4.499 1.00 0.00 H new ATOM 0 HA ARG A 28 -2.283 -10.441 7.034 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -0.919 -10.748 4.357 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -0.173 -9.891 5.691 1.00 0.00 H new ATOM 0 HG2 ARG A 28 0.626 -12.181 5.705 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -0.387 -11.937 7.114 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -2.264 -13.095 6.032 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -1.374 -13.217 4.528 1.00 0.00 H new ATOM 0 HE ARG A 28 0.101 -14.417 6.732 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -2.530 -14.992 4.409 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -2.357 -16.748 4.491 1.00 0.00 H new ATOM 0 HH21 ARG A 28 0.287 -16.673 6.819 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -0.778 -17.690 5.842 1.00 0.00 H new ATOM 431 N ILE A 29 -3.016 -8.449 4.497 1.00 0.00 N ATOM 432 CA ILE A 29 -3.384 -7.072 4.192 1.00 0.00 C ATOM 433 C ILE A 29 -4.572 -6.671 5.063 1.00 0.00 C ATOM 434 O ILE A 29 -4.641 -5.535 5.530 1.00 0.00 O ATOM 435 CB ILE A 29 -3.702 -6.929 2.698 1.00 0.00 C ATOM 436 CG1 ILE A 29 -2.474 -7.342 1.875 1.00 0.00 C ATOM 437 CG2 ILE A 29 -4.097 -5.484 2.388 1.00 0.00 C ATOM 438 CD1 ILE A 29 -2.703 -7.183 0.371 1.00 0.00 C ATOM 0 H ILE A 29 -3.132 -9.102 3.722 1.00 0.00 H new ATOM 0 HA ILE A 29 -2.552 -6.403 4.412 1.00 0.00 H new ATOM 0 HB ILE A 29 -4.537 -7.578 2.436 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.618 -6.738 2.176 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.225 -8.380 2.095 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -4.322 -5.388 1.326 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -4.978 -5.214 2.971 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.273 -4.818 2.646 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.806 -7.488 -0.168 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -3.541 -7.808 0.063 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -2.925 -6.140 0.145 1.00 0.00 H new ATOM 450 N LYS A 30 -5.513 -7.597 5.287 1.00 0.00 N ATOM 451 CA LYS A 30 -6.648 -7.350 6.159 1.00 0.00 C ATOM 452 C LYS A 30 -6.180 -7.044 7.577 1.00 0.00 C ATOM 453 O LYS A 30 -6.685 -6.101 8.178 1.00 0.00 O ATOM 454 CB LYS A 30 -7.588 -8.557 6.130 1.00 0.00 C ATOM 455 CG LYS A 30 -8.743 -8.288 5.163 1.00 0.00 C ATOM 456 CD LYS A 30 -8.283 -8.094 3.717 1.00 0.00 C ATOM 457 CE LYS A 30 -9.470 -7.595 2.899 1.00 0.00 C ATOM 458 NZ LYS A 30 -9.099 -7.402 1.485 1.00 0.00 N ATOM 0 H LYS A 30 -5.502 -8.527 4.869 1.00 0.00 H new ATOM 0 HA LYS A 30 -7.194 -6.477 5.801 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -7.042 -9.448 5.820 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -7.976 -8.752 7.130 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -9.446 -9.120 5.206 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -9.282 -7.398 5.489 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -7.463 -7.377 3.672 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -7.908 -9.033 3.309 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -10.289 -8.310 2.968 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -9.832 -6.655 3.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -9.925 -7.062 0.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -8.333 -6.701 1.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -8.777 -8.306 1.084 1.00 0.00 H new ATOM 472 N LYS A 31 -5.230 -7.808 8.132 1.00 0.00 N ATOM 473 CA LYS A 31 -4.730 -7.514 9.474 1.00 0.00 C ATOM 474 C LYS A 31 -4.049 -6.148 9.528 1.00 0.00 C ATOM 475 O LYS A 31 -4.225 -5.416 10.500 1.00 0.00 O ATOM 476 CB LYS A 31 -3.755 -8.604 9.926 1.00 0.00 C ATOM 477 CG LYS A 31 -4.289 -9.341 11.158 1.00 0.00 C ATOM 478 CD LYS A 31 -5.553 -10.155 10.868 1.00 0.00 C ATOM 479 CE LYS A 31 -5.245 -11.293 9.895 1.00 0.00 C ATOM 480 NZ LYS A 31 -6.450 -12.103 9.629 1.00 0.00 N ATOM 0 H LYS A 31 -4.802 -8.617 7.681 1.00 0.00 H new ATOM 0 HA LYS A 31 -5.584 -7.492 10.151 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.595 -9.314 9.114 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.787 -8.159 10.155 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -3.515 -10.006 11.540 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -4.503 -8.616 11.944 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -5.952 -10.561 11.797 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -6.322 -9.507 10.447 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -4.864 -10.883 8.959 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -4.460 -11.927 10.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -6.214 -12.869 8.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -6.797 -12.512 10.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -7.189 -11.500 9.213 1.00 0.00 H new ATOM 494 N LEU A 32 -3.278 -5.804 8.493 1.00 0.00 N ATOM 495 CA LEU A 32 -2.591 -4.520 8.437 1.00 0.00 C ATOM 496 C LEU A 32 -3.593 -3.362 8.374 1.00 0.00 C ATOM 497 O LEU A 32 -3.578 -2.493 9.248 1.00 0.00 O ATOM 498 CB LEU A 32 -1.629 -4.504 7.245 1.00 0.00 C ATOM 499 CG LEU A 32 -0.459 -5.481 7.425 1.00 0.00 C ATOM 500 CD1 LEU A 32 0.351 -5.544 6.139 1.00 0.00 C ATOM 501 CD2 LEU A 32 0.464 -5.028 8.548 1.00 0.00 C ATOM 0 H LEU A 32 -3.116 -6.402 7.682 1.00 0.00 H new ATOM 0 HA LEU A 32 -2.010 -4.386 9.349 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -2.175 -4.759 6.337 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.239 -3.495 7.110 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.872 -6.459 7.672 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.182 -6.238 6.266 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -0.286 -5.887 5.324 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.739 -4.553 5.904 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.284 -5.738 8.654 1.00 0.00 H new ATOM 0 HD22 LEU A 32 0.866 -4.042 8.314 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.096 -4.979 9.482 1.00 0.00 H new ATOM 513 N THR A 33 -4.463 -3.338 7.356 1.00 0.00 N ATOM 514 CA THR A 33 -5.507 -2.328 7.266 1.00 0.00 C ATOM 515 C THR A 33 -6.356 -2.281 8.531 1.00 0.00 C ATOM 516 O THR A 33 -6.698 -1.198 9.000 1.00 0.00 O ATOM 517 CB THR A 33 -6.404 -2.653 6.077 1.00 0.00 C ATOM 518 OG1 THR A 33 -6.907 -3.967 6.176 1.00 0.00 O ATOM 519 CG2 THR A 33 -5.623 -2.545 4.779 1.00 0.00 C ATOM 0 H THR A 33 -4.459 -4.009 6.588 1.00 0.00 H new ATOM 0 HA THR A 33 -5.032 -1.355 7.142 1.00 0.00 H new ATOM 0 HB THR A 33 -7.227 -1.939 6.082 1.00 0.00 H new ATOM 0 HG1 THR A 33 -6.208 -4.605 5.921 1.00 0.00 H new ATOM 0 HG21 THR A 33 -6.278 -2.780 3.940 1.00 0.00 H new ATOM 0 HG22 THR A 33 -5.241 -1.530 4.668 1.00 0.00 H new ATOM 0 HG23 THR A 33 -4.789 -3.247 4.796 1.00 0.00 H new ATOM 527 N THR A 34 -6.700 -3.442 9.093 1.00 0.00 N ATOM 528 CA THR A 34 -7.488 -3.521 10.309 1.00 0.00 C ATOM 529 C THR A 34 -6.837 -2.730 11.437 1.00 0.00 C ATOM 530 O THR A 34 -7.453 -1.799 11.950 1.00 0.00 O ATOM 531 CB THR A 34 -7.682 -4.987 10.697 1.00 0.00 C ATOM 532 OG1 THR A 34 -8.653 -5.566 9.852 1.00 0.00 O ATOM 533 CG2 THR A 34 -8.154 -5.139 12.135 1.00 0.00 C ATOM 0 H THR A 34 -6.436 -4.350 8.712 1.00 0.00 H new ATOM 0 HA THR A 34 -8.466 -3.074 10.128 1.00 0.00 H new ATOM 0 HB THR A 34 -6.717 -5.484 10.594 1.00 0.00 H new ATOM 0 HG1 THR A 34 -8.225 -5.877 9.027 1.00 0.00 H new ATOM 0 HG21 THR A 34 -8.279 -6.197 12.367 1.00 0.00 H new ATOM 0 HG22 THR A 34 -7.415 -4.704 12.808 1.00 0.00 H new ATOM 0 HG23 THR A 34 -9.107 -4.625 12.261 1.00 0.00 H new ATOM 541 N TYR A 35 -5.605 -3.075 11.839 1.00 0.00 N ATOM 542 CA TYR A 35 -5.026 -2.411 12.995 1.00 0.00 C ATOM 543 C TYR A 35 -4.747 -0.936 12.718 1.00 0.00 C ATOM 544 O TYR A 35 -4.842 -0.110 13.627 1.00 0.00 O ATOM 545 CB TYR A 35 -3.775 -3.132 13.488 1.00 0.00 C ATOM 546 CG TYR A 35 -3.341 -2.590 14.830 1.00 0.00 C ATOM 547 CD1 TYR A 35 -3.927 -3.088 16.004 1.00 0.00 C ATOM 548 CD2 TYR A 35 -2.367 -1.583 14.903 1.00 0.00 C ATOM 549 CE1 TYR A 35 -3.572 -2.559 17.251 1.00 0.00 C ATOM 550 CE2 TYR A 35 -2.001 -1.051 16.150 1.00 0.00 C ATOM 551 CZ TYR A 35 -2.611 -1.531 17.327 1.00 0.00 C ATOM 552 OH TYR A 35 -2.271 -1.004 18.535 1.00 0.00 O ATOM 0 H TYR A 35 -5.018 -3.782 11.396 1.00 0.00 H new ATOM 0 HA TYR A 35 -5.765 -2.456 13.795 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -3.973 -4.201 13.569 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -2.970 -3.011 12.763 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -4.655 -3.883 15.945 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -1.899 -1.217 14.001 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -4.033 -2.937 18.151 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -1.253 -0.274 16.207 1.00 0.00 H new ATOM 0 HH TYR A 35 -1.594 -0.307 18.409 1.00 0.00 H new ATOM 562 N ALA A 36 -4.402 -0.586 11.476 1.00 0.00 N ATOM 563 CA ALA A 36 -4.238 0.816 11.118 1.00 0.00 C ATOM 564 C ALA A 36 -5.543 1.576 11.358 1.00 0.00 C ATOM 565 O ALA A 36 -5.571 2.542 12.117 1.00 0.00 O ATOM 566 CB ALA A 36 -3.804 0.905 9.656 1.00 0.00 C ATOM 0 H ALA A 36 -4.234 -1.245 10.716 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.471 1.275 11.742 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.678 1.951 9.377 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -2.859 0.378 9.524 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.565 0.449 9.022 1.00 0.00 H new ATOM 572 N LEU A 37 -6.619 1.132 10.704 1.00 0.00 N ATOM 573 CA LEU A 37 -7.913 1.796 10.737 1.00 0.00 C ATOM 574 C LEU A 37 -8.601 1.669 12.098 1.00 0.00 C ATOM 575 O LEU A 37 -9.529 2.425 12.380 1.00 0.00 O ATOM 576 CB LEU A 37 -8.782 1.202 9.622 1.00 0.00 C ATOM 577 CG LEU A 37 -8.132 1.391 8.244 1.00 0.00 C ATOM 578 CD1 LEU A 37 -8.850 0.533 7.202 1.00 0.00 C ATOM 579 CD2 LEU A 37 -8.179 2.853 7.806 1.00 0.00 C ATOM 0 H LEU A 37 -6.610 0.289 10.130 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.767 2.864 10.576 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -8.940 0.140 9.809 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -9.763 1.677 9.631 1.00 0.00 H new ATOM 0 HG LEU A 37 -7.090 1.083 8.324 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.381 0.675 6.228 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.784 -0.517 7.487 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -9.898 0.829 7.147 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.711 2.955 6.827 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.216 3.182 7.748 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -7.643 3.467 8.530 1.00 0.00 H new ATOM 591 N ASP A 38 -8.164 0.732 12.942 1.00 0.00 N ATOM 592 CA ASP A 38 -8.767 0.512 14.249 1.00 0.00 C ATOM 593 C ASP A 38 -8.561 1.678 15.224 1.00 0.00 C ATOM 594 O ASP A 38 -9.328 1.801 16.181 1.00 0.00 O ATOM 595 CB ASP A 38 -8.204 -0.783 14.840 1.00 0.00 C ATOM 596 CG ASP A 38 -8.840 -1.111 16.190 1.00 0.00 C ATOM 597 OD1 ASP A 38 -10.044 -1.449 16.196 1.00 0.00 O ATOM 598 OD2 ASP A 38 -8.119 -1.023 17.208 1.00 0.00 O ATOM 0 H ASP A 38 -7.384 0.108 12.735 1.00 0.00 H new ATOM 0 HA ASP A 38 -9.844 0.435 14.103 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -8.378 -1.606 14.146 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -7.125 -0.690 14.959 1.00 0.00 H new ATOM 603 N HIS A 39 -7.551 2.534 15.018 1.00 0.00 N ATOM 604 CA HIS A 39 -7.278 3.591 15.990 1.00 0.00 C ATOM 605 C HIS A 39 -6.713 4.875 15.386 1.00 0.00 C ATOM 606 O HIS A 39 -6.953 5.951 15.931 1.00 0.00 O ATOM 607 CB HIS A 39 -6.319 3.026 17.040 1.00 0.00 C ATOM 608 CG HIS A 39 -6.119 3.932 18.226 1.00 0.00 C ATOM 609 ND1 HIS A 39 -7.110 4.695 18.850 1.00 0.00 N ATOM 610 CD2 HIS A 39 -4.930 4.136 18.866 1.00 0.00 C ATOM 611 CE1 HIS A 39 -6.489 5.340 19.849 1.00 0.00 C ATOM 612 NE2 HIS A 39 -5.182 5.027 19.882 1.00 0.00 N ATOM 0 H HIS A 39 -6.928 2.515 14.211 1.00 0.00 H new ATOM 0 HA HIS A 39 -8.230 3.887 16.430 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -6.700 2.066 17.388 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -5.353 2.836 16.572 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -3.979 3.686 18.622 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -6.974 6.019 20.534 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -4.497 5.388 20.546 1.00 0.00 H new ATOM 620 N ILE A 40 -5.970 4.775 14.279 1.00 0.00 N ATOM 621 CA ILE A 40 -5.342 5.921 13.624 1.00 0.00 C ATOM 622 C ILE A 40 -4.685 6.860 14.645 1.00 0.00 C ATOM 623 O ILE A 40 -5.184 7.945 14.936 1.00 0.00 O ATOM 624 CB ILE A 40 -6.344 6.630 12.703 1.00 0.00 C ATOM 625 CG1 ILE A 40 -6.940 5.655 11.680 1.00 0.00 C ATOM 626 CG2 ILE A 40 -5.652 7.776 11.957 1.00 0.00 C ATOM 627 CD1 ILE A 40 -5.905 5.142 10.681 1.00 0.00 C ATOM 0 H ILE A 40 -5.788 3.888 13.810 1.00 0.00 H new ATOM 0 HA ILE A 40 -4.532 5.562 12.989 1.00 0.00 H new ATOM 0 HB ILE A 40 -7.148 7.023 13.325 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -7.382 4.809 12.206 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -7.746 6.150 11.139 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -6.371 8.273 11.306 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -5.258 8.493 12.677 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -4.834 7.378 11.357 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -6.383 4.456 9.982 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -5.481 5.983 10.132 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -5.111 4.620 11.215 1.00 0.00 H new ATOM 639 N ASP A 41 -3.546 6.422 15.188 1.00 0.00 N ATOM 640 CA ASP A 41 -2.779 7.173 16.180 1.00 0.00 C ATOM 641 C ASP A 41 -1.288 6.845 16.039 1.00 0.00 C ATOM 642 O ASP A 41 -0.502 7.032 16.967 1.00 0.00 O ATOM 643 CB ASP A 41 -3.300 6.818 17.574 1.00 0.00 C ATOM 644 CG ASP A 41 -2.703 7.710 18.661 1.00 0.00 C ATOM 645 OD1 ASP A 41 -2.662 8.941 18.445 1.00 0.00 O ATOM 646 OD2 ASP A 41 -2.289 7.150 19.701 1.00 0.00 O ATOM 0 H ASP A 41 -3.127 5.524 14.947 1.00 0.00 H new ATOM 0 HA ASP A 41 -2.899 8.245 16.023 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -4.386 6.910 17.588 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -3.065 5.776 17.793 1.00 0.00 H new ATOM 651 N ILE A 42 -0.912 6.348 14.857 1.00 0.00 N ATOM 652 CA ILE A 42 0.412 5.820 14.568 1.00 0.00 C ATOM 653 C ILE A 42 0.747 6.081 13.102 1.00 0.00 C ATOM 654 O ILE A 42 1.378 5.266 12.438 1.00 0.00 O ATOM 655 CB ILE A 42 0.495 4.324 14.927 1.00 0.00 C ATOM 656 CG1 ILE A 42 -0.871 3.638 14.827 1.00 0.00 C ATOM 657 CG2 ILE A 42 1.095 4.153 16.324 1.00 0.00 C ATOM 658 CD1 ILE A 42 -0.707 2.127 14.963 1.00 0.00 C ATOM 0 H ILE A 42 -1.543 6.303 14.057 1.00 0.00 H new ATOM 0 HA ILE A 42 1.154 6.329 15.184 1.00 0.00 H new ATOM 0 HB ILE A 42 1.148 3.839 14.202 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -1.533 4.012 15.608 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -1.338 3.877 13.872 1.00 0.00 H new ATOM 0 HG21 ILE A 42 1.150 3.092 16.569 1.00 0.00 H new ATOM 0 HG22 ILE A 42 2.097 4.582 16.345 1.00 0.00 H new ATOM 0 HG23 ILE A 42 0.467 4.662 17.055 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -1.683 1.647 14.891 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -0.061 1.758 14.166 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -0.259 1.895 15.929 1.00 0.00 H new ATOM 670 N GLU A 43 0.320 7.235 12.593 1.00 0.00 N ATOM 671 CA GLU A 43 0.475 7.606 11.199 1.00 0.00 C ATOM 672 C GLU A 43 1.905 7.451 10.675 1.00 0.00 C ATOM 673 O GLU A 43 2.126 6.751 9.689 1.00 0.00 O ATOM 674 CB GLU A 43 -0.040 9.038 11.013 1.00 0.00 C ATOM 675 CG GLU A 43 0.714 10.118 11.804 1.00 0.00 C ATOM 676 CD GLU A 43 0.701 9.861 13.310 1.00 0.00 C ATOM 677 OE1 GLU A 43 -0.398 9.965 13.896 1.00 0.00 O ATOM 678 OE2 GLU A 43 1.786 9.562 13.856 1.00 0.00 O ATOM 0 H GLU A 43 -0.151 7.947 13.152 1.00 0.00 H new ATOM 0 HA GLU A 43 -0.116 6.912 10.601 1.00 0.00 H new ATOM 0 HB2 GLU A 43 0.008 9.288 9.953 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -1.091 9.068 11.301 1.00 0.00 H new ATOM 0 HG2 GLU A 43 1.746 10.164 11.456 1.00 0.00 H new ATOM 0 HG3 GLU A 43 0.266 11.091 11.601 1.00 0.00 H new ATOM 685 N SER A 44 2.881 8.095 11.318 1.00 0.00 N ATOM 686 CA SER A 44 4.246 8.120 10.808 1.00 0.00 C ATOM 687 C SER A 44 4.970 6.800 11.029 1.00 0.00 C ATOM 688 O SER A 44 5.895 6.480 10.283 1.00 0.00 O ATOM 689 CB SER A 44 5.006 9.275 11.460 1.00 0.00 C ATOM 690 OG SER A 44 5.028 9.114 12.861 1.00 0.00 O ATOM 0 H SER A 44 2.748 8.605 12.192 1.00 0.00 H new ATOM 0 HA SER A 44 4.203 8.271 9.729 1.00 0.00 H new ATOM 0 HB2 SER A 44 6.025 9.313 11.075 1.00 0.00 H new ATOM 0 HB3 SER A 44 4.533 10.223 11.203 1.00 0.00 H new ATOM 0 HG SER A 44 5.519 9.858 13.268 1.00 0.00 H new ATOM 696 N LYS A 45 4.564 6.031 12.040 1.00 0.00 N ATOM 697 CA LYS A 45 5.194 4.760 12.349 1.00 0.00 C ATOM 698 C LYS A 45 4.619 3.663 11.458 1.00 0.00 C ATOM 699 O LYS A 45 5.372 2.832 10.955 1.00 0.00 O ATOM 700 CB LYS A 45 5.111 4.452 13.855 1.00 0.00 C ATOM 701 CG LYS A 45 3.903 5.023 14.596 1.00 0.00 C ATOM 702 CD LYS A 45 3.876 6.558 14.654 1.00 0.00 C ATOM 703 CE LYS A 45 3.437 7.052 16.027 1.00 0.00 C ATOM 704 NZ LYS A 45 3.336 8.525 16.041 1.00 0.00 N ATOM 0 H LYS A 45 3.793 6.276 12.661 1.00 0.00 H new ATOM 0 HA LYS A 45 6.259 4.814 12.125 1.00 0.00 H new ATOM 0 HB2 LYS A 45 5.111 3.370 13.984 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.015 4.830 14.332 1.00 0.00 H new ATOM 0 HG2 LYS A 45 2.992 4.672 14.111 1.00 0.00 H new ATOM 0 HG3 LYS A 45 3.894 4.631 15.613 1.00 0.00 H new ATOM 0 HD2 LYS A 45 4.866 6.950 14.423 1.00 0.00 H new ATOM 0 HD3 LYS A 45 3.196 6.941 13.893 1.00 0.00 H new ATOM 0 HE2 LYS A 45 2.473 6.613 16.286 1.00 0.00 H new ATOM 0 HE3 LYS A 45 4.150 6.724 16.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 2.892 8.834 16.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 4.287 8.939 15.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 2.757 8.841 15.237 1.00 0.00 H new ATOM 718 N ILE A 46 3.300 3.650 11.251 1.00 0.00 N ATOM 719 CA ILE A 46 2.686 2.759 10.276 1.00 0.00 C ATOM 720 C ILE A 46 3.289 3.012 8.895 1.00 0.00 C ATOM 721 O ILE A 46 3.751 2.081 8.238 1.00 0.00 O ATOM 722 CB ILE A 46 1.167 2.983 10.253 1.00 0.00 C ATOM 723 CG1 ILE A 46 0.548 2.291 11.473 1.00 0.00 C ATOM 724 CG2 ILE A 46 0.521 2.437 8.976 1.00 0.00 C ATOM 725 CD1 ILE A 46 -0.969 2.476 11.522 1.00 0.00 C ATOM 0 H ILE A 46 2.640 4.248 11.748 1.00 0.00 H new ATOM 0 HA ILE A 46 2.880 1.724 10.556 1.00 0.00 H new ATOM 0 HB ILE A 46 0.983 4.057 10.279 1.00 0.00 H new ATOM 0 HG12 ILE A 46 0.784 1.227 11.446 1.00 0.00 H new ATOM 0 HG13 ILE A 46 0.993 2.693 12.383 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -0.553 2.619 9.005 1.00 0.00 H new ATOM 0 HG22 ILE A 46 0.950 2.938 8.108 1.00 0.00 H new ATOM 0 HG23 ILE A 46 0.706 1.365 8.904 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -1.369 1.971 12.401 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -1.204 3.539 11.576 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.417 2.050 10.624 1.00 0.00 H new ATOM 737 N ILE A 47 3.288 4.271 8.446 1.00 0.00 N ATOM 738 CA ILE A 47 3.773 4.604 7.114 1.00 0.00 C ATOM 739 C ILE A 47 5.270 4.342 6.982 1.00 0.00 C ATOM 740 O ILE A 47 5.693 3.732 6.004 1.00 0.00 O ATOM 741 CB ILE A 47 3.404 6.051 6.773 1.00 0.00 C ATOM 742 CG1 ILE A 47 1.896 6.195 6.547 1.00 0.00 C ATOM 743 CG2 ILE A 47 4.142 6.506 5.514 1.00 0.00 C ATOM 744 CD1 ILE A 47 1.311 5.163 5.583 1.00 0.00 C ATOM 0 H ILE A 47 2.957 5.070 8.987 1.00 0.00 H new ATOM 0 HA ILE A 47 3.285 3.952 6.389 1.00 0.00 H new ATOM 0 HB ILE A 47 3.698 6.675 7.617 1.00 0.00 H new ATOM 0 HG12 ILE A 47 1.385 6.111 7.506 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.690 7.194 6.163 1.00 0.00 H new ATOM 0 HG21 ILE A 47 3.869 7.536 5.285 1.00 0.00 H new ATOM 0 HG22 ILE A 47 5.217 6.444 5.680 1.00 0.00 H new ATOM 0 HG23 ILE A 47 3.866 5.863 4.678 1.00 0.00 H new ATOM 0 HD11 ILE A 47 0.239 5.332 5.476 1.00 0.00 H new ATOM 0 HD12 ILE A 47 1.793 5.260 4.610 1.00 0.00 H new ATOM 0 HD13 ILE A 47 1.483 4.161 5.975 1.00 0.00 H new ATOM 756 N SER A 48 6.077 4.787 7.950 1.00 0.00 N ATOM 757 CA SER A 48 7.502 4.514 7.891 1.00 0.00 C ATOM 758 C SER A 48 7.738 3.009 7.790 1.00 0.00 C ATOM 759 O SER A 48 8.617 2.576 7.050 1.00 0.00 O ATOM 760 CB SER A 48 8.196 5.080 9.129 1.00 0.00 C ATOM 761 OG SER A 48 9.583 4.812 9.069 1.00 0.00 O ATOM 0 H SER A 48 5.771 5.324 8.762 1.00 0.00 H new ATOM 0 HA SER A 48 7.921 4.995 7.007 1.00 0.00 H new ATOM 0 HB2 SER A 48 8.027 6.155 9.192 1.00 0.00 H new ATOM 0 HB3 SER A 48 7.770 4.637 10.029 1.00 0.00 H new ATOM 0 HG SER A 48 10.022 5.179 9.865 1.00 0.00 H new ATOM 767 N LEU A 49 6.960 2.208 8.529 1.00 0.00 N ATOM 768 CA LEU A 49 7.143 0.767 8.559 1.00 0.00 C ATOM 769 C LEU A 49 6.787 0.102 7.226 1.00 0.00 C ATOM 770 O LEU A 49 7.513 -0.791 6.797 1.00 0.00 O ATOM 771 CB LEU A 49 6.332 0.195 9.727 1.00 0.00 C ATOM 772 CG LEU A 49 6.498 -1.319 9.877 1.00 0.00 C ATOM 773 CD1 LEU A 49 7.961 -1.714 10.071 1.00 0.00 C ATOM 774 CD2 LEU A 49 5.710 -1.785 11.097 1.00 0.00 C ATOM 0 H LEU A 49 6.196 2.544 9.115 1.00 0.00 H new ATOM 0 HA LEU A 49 8.200 0.547 8.712 1.00 0.00 H new ATOM 0 HB2 LEU A 49 6.640 0.683 10.651 1.00 0.00 H new ATOM 0 HB3 LEU A 49 5.277 0.428 9.580 1.00 0.00 H new ATOM 0 HG LEU A 49 6.132 -1.788 8.964 1.00 0.00 H new ATOM 0 HD11 LEU A 49 8.035 -2.797 10.173 1.00 0.00 H new ATOM 0 HD12 LEU A 49 8.543 -1.391 9.208 1.00 0.00 H new ATOM 0 HD13 LEU A 49 8.350 -1.237 10.970 1.00 0.00 H new ATOM 0 HD21 LEU A 49 5.822 -2.863 11.212 1.00 0.00 H new ATOM 0 HD22 LEU A 49 6.088 -1.283 11.988 1.00 0.00 H new ATOM 0 HD23 LEU A 49 4.656 -1.542 10.964 1.00 0.00 H new ATOM 786 N ILE A 50 5.700 0.502 6.555 1.00 0.00 N ATOM 787 CA ILE A 50 5.349 -0.136 5.287 1.00 0.00 C ATOM 788 C ILE A 50 6.266 0.313 4.148 1.00 0.00 C ATOM 789 O ILE A 50 6.599 -0.487 3.275 1.00 0.00 O ATOM 790 CB ILE A 50 3.870 0.066 4.931 1.00 0.00 C ATOM 791 CG1 ILE A 50 3.566 1.546 4.678 1.00 0.00 C ATOM 792 CG2 ILE A 50 2.987 -0.509 6.041 1.00 0.00 C ATOM 793 CD1 ILE A 50 2.109 1.780 4.282 1.00 0.00 C ATOM 0 H ILE A 50 5.067 1.242 6.859 1.00 0.00 H new ATOM 0 HA ILE A 50 5.503 -1.206 5.423 1.00 0.00 H new ATOM 0 HB ILE A 50 3.650 -0.469 4.007 1.00 0.00 H new ATOM 0 HG12 ILE A 50 3.792 2.120 5.577 1.00 0.00 H new ATOM 0 HG13 ILE A 50 4.219 1.919 3.889 1.00 0.00 H new ATOM 0 HG21 ILE A 50 1.938 -0.363 5.784 1.00 0.00 H new ATOM 0 HG22 ILE A 50 3.189 -1.574 6.151 1.00 0.00 H new ATOM 0 HG23 ILE A 50 3.205 0.001 6.980 1.00 0.00 H new ATOM 0 HD11 ILE A 50 1.944 2.844 4.114 1.00 0.00 H new ATOM 0 HD12 ILE A 50 1.888 1.229 3.368 1.00 0.00 H new ATOM 0 HD13 ILE A 50 1.454 1.434 5.082 1.00 0.00 H new ATOM 805 N ILE A 51 6.682 1.583 4.136 1.00 0.00 N ATOM 806 CA ILE A 51 7.592 2.072 3.108 1.00 0.00 C ATOM 807 C ILE A 51 8.923 1.335 3.240 1.00 0.00 C ATOM 808 O ILE A 51 9.479 0.825 2.265 1.00 0.00 O ATOM 809 CB ILE A 51 7.820 3.575 3.285 1.00 0.00 C ATOM 810 CG1 ILE A 51 6.519 4.346 3.027 1.00 0.00 C ATOM 811 CG2 ILE A 51 8.909 4.062 2.325 1.00 0.00 C ATOM 812 CD1 ILE A 51 6.674 5.786 3.507 1.00 0.00 C ATOM 0 H ILE A 51 6.403 2.283 4.823 1.00 0.00 H new ATOM 0 HA ILE A 51 7.162 1.894 2.122 1.00 0.00 H new ATOM 0 HB ILE A 51 8.142 3.757 4.310 1.00 0.00 H new ATOM 0 HG12 ILE A 51 6.280 4.330 1.964 1.00 0.00 H new ATOM 0 HG13 ILE A 51 5.690 3.866 3.547 1.00 0.00 H new ATOM 0 HG21 ILE A 51 9.062 5.133 2.461 1.00 0.00 H new ATOM 0 HG22 ILE A 51 9.840 3.534 2.532 1.00 0.00 H new ATOM 0 HG23 ILE A 51 8.602 3.867 1.297 1.00 0.00 H new ATOM 0 HD11 ILE A 51 5.749 6.332 3.323 1.00 0.00 H new ATOM 0 HD12 ILE A 51 6.893 5.792 4.575 1.00 0.00 H new ATOM 0 HD13 ILE A 51 7.491 6.264 2.967 1.00 0.00 H new ATOM 824 N ASP A 52 9.427 1.285 4.471 1.00 0.00 N ATOM 825 CA ASP A 52 10.657 0.581 4.790 1.00 0.00 C ATOM 826 C ASP A 52 10.541 -0.902 4.435 1.00 0.00 C ATOM 827 O ASP A 52 11.468 -1.480 3.866 1.00 0.00 O ATOM 828 CB ASP A 52 10.925 0.771 6.279 1.00 0.00 C ATOM 829 CG ASP A 52 12.292 0.235 6.688 1.00 0.00 C ATOM 830 OD1 ASP A 52 13.290 0.655 6.060 1.00 0.00 O ATOM 831 OD2 ASP A 52 12.329 -0.592 7.626 1.00 0.00 O ATOM 0 H ASP A 52 8.989 1.735 5.275 1.00 0.00 H new ATOM 0 HA ASP A 52 11.486 0.981 4.207 1.00 0.00 H new ATOM 0 HB2 ASP A 52 10.863 1.831 6.526 1.00 0.00 H new ATOM 0 HB3 ASP A 52 10.150 0.264 6.854 1.00 0.00 H new ATOM 836 N TYR A 53 9.404 -1.521 4.771 1.00 0.00 N ATOM 837 CA TYR A 53 9.161 -2.913 4.431 1.00 0.00 C ATOM 838 C TYR A 53 9.313 -3.110 2.923 1.00 0.00 C ATOM 839 O TYR A 53 9.867 -4.117 2.485 1.00 0.00 O ATOM 840 CB TYR A 53 7.749 -3.308 4.868 1.00 0.00 C ATOM 841 CG TYR A 53 7.276 -4.601 4.244 1.00 0.00 C ATOM 842 CD1 TYR A 53 7.893 -5.815 4.581 1.00 0.00 C ATOM 843 CD2 TYR A 53 6.222 -4.580 3.320 1.00 0.00 C ATOM 844 CE1 TYR A 53 7.464 -7.010 3.982 1.00 0.00 C ATOM 845 CE2 TYR A 53 5.787 -5.771 2.720 1.00 0.00 C ATOM 846 CZ TYR A 53 6.414 -6.990 3.044 1.00 0.00 C ATOM 847 OH TYR A 53 6.000 -8.144 2.449 1.00 0.00 O ATOM 0 H TYR A 53 8.641 -1.073 5.279 1.00 0.00 H new ATOM 0 HA TYR A 53 9.886 -3.543 4.947 1.00 0.00 H new ATOM 0 HB2 TYR A 53 7.725 -3.405 5.953 1.00 0.00 H new ATOM 0 HB3 TYR A 53 7.056 -2.509 4.604 1.00 0.00 H new ATOM 0 HD1 TYR A 53 8.698 -5.830 5.301 1.00 0.00 H new ATOM 0 HD2 TYR A 53 5.744 -3.645 3.069 1.00 0.00 H new ATOM 0 HE1 TYR A 53 7.939 -7.945 4.241 1.00 0.00 H new ATOM 0 HE2 TYR A 53 4.973 -5.753 2.011 1.00 0.00 H new ATOM 0 HH TYR A 53 5.129 -8.406 2.814 1.00 0.00 H new ATOM 857 N SER A 54 8.821 -2.148 2.134 1.00 0.00 N ATOM 858 CA SER A 54 8.910 -2.218 0.685 1.00 0.00 C ATOM 859 C SER A 54 10.353 -2.153 0.201 1.00 0.00 C ATOM 860 O SER A 54 10.801 -3.040 -0.523 1.00 0.00 O ATOM 861 CB SER A 54 8.084 -1.085 0.074 1.00 0.00 C ATOM 862 OG SER A 54 8.009 -1.250 -1.327 1.00 0.00 O ATOM 0 H SER A 54 8.356 -1.311 2.485 1.00 0.00 H new ATOM 0 HA SER A 54 8.510 -3.179 0.362 1.00 0.00 H new ATOM 0 HB2 SER A 54 7.082 -1.081 0.503 1.00 0.00 H new ATOM 0 HB3 SER A 54 8.537 -0.123 0.312 1.00 0.00 H new ATOM 0 HG SER A 54 7.247 -0.743 -1.676 1.00 0.00 H new ATOM 868 N ARG A 55 11.097 -1.111 0.586 1.00 0.00 N ATOM 869 CA ARG A 55 12.441 -0.910 0.053 1.00 0.00 C ATOM 870 C ARG A 55 13.447 -1.956 0.535 1.00 0.00 C ATOM 871 O ARG A 55 14.477 -2.152 -0.110 1.00 0.00 O ATOM 872 CB ARG A 55 12.884 0.529 0.346 1.00 0.00 C ATOM 873 CG ARG A 55 13.137 0.818 1.827 1.00 0.00 C ATOM 874 CD ARG A 55 14.568 0.479 2.243 1.00 0.00 C ATOM 875 NE ARG A 55 14.771 0.738 3.672 1.00 0.00 N ATOM 876 CZ ARG A 55 15.950 1.013 4.236 1.00 0.00 C ATOM 877 NH1 ARG A 55 17.064 1.080 3.510 1.00 0.00 N ATOM 878 NH2 ARG A 55 16.007 1.220 5.551 1.00 0.00 N ATOM 0 H ARG A 55 10.793 -0.404 1.256 1.00 0.00 H new ATOM 0 HA ARG A 55 12.409 -1.054 -1.027 1.00 0.00 H new ATOM 0 HB2 ARG A 55 13.795 0.738 -0.214 1.00 0.00 H new ATOM 0 HB3 ARG A 55 12.120 1.214 -0.021 1.00 0.00 H new ATOM 0 HG2 ARG A 55 12.941 1.871 2.029 1.00 0.00 H new ATOM 0 HG3 ARG A 55 12.438 0.242 2.433 1.00 0.00 H new ATOM 0 HD2 ARG A 55 14.776 -0.569 2.026 1.00 0.00 H new ATOM 0 HD3 ARG A 55 15.271 1.072 1.658 1.00 0.00 H new ATOM 0 HE ARG A 55 13.952 0.706 4.279 1.00 0.00 H new ATOM 0 HH11 ARG A 55 17.027 0.920 2.503 1.00 0.00 H new ATOM 0 HH12 ARG A 55 17.954 1.291 3.960 1.00 0.00 H new ATOM 0 HH21 ARG A 55 15.157 1.167 6.113 1.00 0.00 H new ATOM 0 HH22 ARG A 55 16.900 1.431 5.996 1.00 0.00 H new ATOM 892 N LEU A 56 13.164 -2.629 1.655 1.00 0.00 N ATOM 893 CA LEU A 56 14.051 -3.658 2.187 1.00 0.00 C ATOM 894 C LEU A 56 13.905 -5.028 1.524 1.00 0.00 C ATOM 895 O LEU A 56 14.780 -5.873 1.708 1.00 0.00 O ATOM 896 CB LEU A 56 13.791 -3.817 3.684 1.00 0.00 C ATOM 897 CG LEU A 56 14.353 -2.663 4.521 1.00 0.00 C ATOM 898 CD1 LEU A 56 14.009 -2.916 5.985 1.00 0.00 C ATOM 899 CD2 LEU A 56 15.871 -2.563 4.388 1.00 0.00 C ATOM 0 H LEU A 56 12.322 -2.475 2.210 1.00 0.00 H new ATOM 0 HA LEU A 56 15.064 -3.316 1.976 1.00 0.00 H new ATOM 0 HB2 LEU A 56 12.717 -3.891 3.854 1.00 0.00 H new ATOM 0 HB3 LEU A 56 14.233 -4.753 4.025 1.00 0.00 H new ATOM 0 HG LEU A 56 13.914 -1.731 4.164 1.00 0.00 H new ATOM 0 HD11 LEU A 56 14.402 -2.104 6.597 1.00 0.00 H new ATOM 0 HD12 LEU A 56 12.926 -2.967 6.101 1.00 0.00 H new ATOM 0 HD13 LEU A 56 14.453 -3.859 6.305 1.00 0.00 H new ATOM 0 HD21 LEU A 56 16.236 -1.734 4.995 1.00 0.00 H new ATOM 0 HD22 LEU A 56 16.328 -3.492 4.730 1.00 0.00 H new ATOM 0 HD23 LEU A 56 16.134 -2.392 3.344 1.00 0.00 H new ATOM 911 N CYS A 57 12.832 -5.272 0.767 1.00 0.00 N ATOM 912 CA CYS A 57 12.525 -6.622 0.302 1.00 0.00 C ATOM 913 C CYS A 57 12.362 -6.752 -1.223 1.00 0.00 C ATOM 914 O CYS A 57 12.191 -5.749 -1.919 1.00 0.00 O ATOM 915 CB CYS A 57 11.276 -7.098 1.046 1.00 0.00 C ATOM 916 SG CYS A 57 11.609 -7.122 2.829 1.00 0.00 S ATOM 0 H CYS A 57 12.168 -4.558 0.467 1.00 0.00 H new ATOM 0 HA CYS A 57 13.382 -7.258 0.526 1.00 0.00 H new ATOM 0 HB2 CYS A 57 10.437 -6.437 0.831 1.00 0.00 H new ATOM 0 HB3 CYS A 57 10.993 -8.094 0.704 1.00 0.00 H new ATOM 0 HG CYS A 57 10.484 -7.104 3.481 1.00 0.00 H new ATOM 922 N PRO A 58 12.415 -7.995 -1.743 1.00 0.00 N ATOM 923 CA PRO A 58 12.300 -8.341 -3.160 1.00 0.00 C ATOM 924 C PRO A 58 10.989 -7.901 -3.821 1.00 0.00 C ATOM 925 O PRO A 58 10.088 -7.402 -3.160 1.00 0.00 O ATOM 926 CB PRO A 58 12.427 -9.868 -3.226 1.00 0.00 C ATOM 927 CG PRO A 58 13.184 -10.220 -1.954 1.00 0.00 C ATOM 928 CD PRO A 58 12.623 -9.201 -0.966 1.00 0.00 C ATOM 0 HA PRO A 58 13.077 -7.813 -3.713 1.00 0.00 H new ATOM 0 HB2 PRO A 58 11.450 -10.350 -3.258 1.00 0.00 H new ATOM 0 HB3 PRO A 58 12.969 -10.187 -4.116 1.00 0.00 H new ATOM 0 HG2 PRO A 58 12.995 -11.245 -1.636 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.262 -10.119 -2.078 1.00 0.00 H new ATOM 0 HD2 PRO A 58 11.690 -9.552 -0.525 1.00 0.00 H new ATOM 0 HD3 PRO A 58 13.317 -9.025 -0.144 1.00 0.00 H new ATOM 936 N ASP A 59 10.893 -8.092 -5.142 1.00 0.00 N ATOM 937 CA ASP A 59 9.771 -7.627 -5.950 1.00 0.00 C ATOM 938 C ASP A 59 8.428 -8.202 -5.513 1.00 0.00 C ATOM 939 O ASP A 59 7.405 -7.539 -5.681 1.00 0.00 O ATOM 940 CB ASP A 59 10.020 -7.953 -7.426 1.00 0.00 C ATOM 941 CG ASP A 59 10.473 -9.395 -7.649 1.00 0.00 C ATOM 942 OD1 ASP A 59 11.611 -9.709 -7.240 1.00 0.00 O ATOM 943 OD2 ASP A 59 9.679 -10.169 -8.226 1.00 0.00 O ATOM 0 H ASP A 59 11.606 -8.582 -5.683 1.00 0.00 H new ATOM 0 HA ASP A 59 9.711 -6.549 -5.804 1.00 0.00 H new ATOM 0 HB2 ASP A 59 9.106 -7.773 -7.992 1.00 0.00 H new ATOM 0 HB3 ASP A 59 10.777 -7.275 -7.820 1.00 0.00 H new ATOM 948 N SER A 60 8.398 -9.418 -4.957 1.00 0.00 N ATOM 949 CA SER A 60 7.143 -9.967 -4.459 1.00 0.00 C ATOM 950 C SER A 60 6.645 -9.089 -3.312 1.00 0.00 C ATOM 951 O SER A 60 5.445 -8.863 -3.153 1.00 0.00 O ATOM 952 CB SER A 60 7.362 -11.399 -3.977 1.00 0.00 C ATOM 953 OG SER A 60 6.122 -11.970 -3.624 1.00 0.00 O ATOM 0 H SER A 60 9.210 -10.025 -4.844 1.00 0.00 H new ATOM 0 HA SER A 60 6.398 -9.982 -5.255 1.00 0.00 H new ATOM 0 HB2 SER A 60 7.837 -11.989 -4.761 1.00 0.00 H new ATOM 0 HB3 SER A 60 8.035 -11.407 -3.120 1.00 0.00 H new ATOM 0 HG SER A 60 6.261 -12.890 -3.316 1.00 0.00 H new ATOM 959 N HIS A 61 7.591 -8.595 -2.510 1.00 0.00 N ATOM 960 CA HIS A 61 7.293 -7.737 -1.387 1.00 0.00 C ATOM 961 C HIS A 61 7.022 -6.317 -1.872 1.00 0.00 C ATOM 962 O HIS A 61 6.276 -5.597 -1.213 1.00 0.00 O ATOM 963 CB HIS A 61 8.446 -7.775 -0.385 1.00 0.00 C ATOM 964 CG HIS A 61 8.776 -9.160 0.115 1.00 0.00 C ATOM 965 ND1 HIS A 61 9.022 -10.284 -0.683 1.00 0.00 N ATOM 966 CD2 HIS A 61 8.886 -9.515 1.428 1.00 0.00 C ATOM 967 CE1 HIS A 61 9.268 -11.285 0.175 1.00 0.00 C ATOM 968 NE2 HIS A 61 9.197 -10.853 1.447 1.00 0.00 N ATOM 0 H HIS A 61 8.586 -8.786 -2.631 1.00 0.00 H new ATOM 0 HA HIS A 61 6.395 -8.095 -0.883 1.00 0.00 H new ATOM 0 HB2 HIS A 61 9.333 -7.346 -0.851 1.00 0.00 H new ATOM 0 HB3 HIS A 61 8.196 -7.142 0.466 1.00 0.00 H new ATOM 0 HD2 HIS A 61 8.754 -8.870 2.284 1.00 0.00 H new ATOM 0 HE1 HIS A 61 9.493 -12.301 -0.116 1.00 0.00 H new ATOM 0 HE2 HIS A 61 9.348 -11.420 2.281 1.00 0.00 H new ATOM 976 N LYS A 62 7.604 -5.894 -3.004 1.00 0.00 N ATOM 977 CA LYS A 62 7.283 -4.597 -3.596 1.00 0.00 C ATOM 978 C LYS A 62 5.813 -4.583 -4.000 1.00 0.00 C ATOM 979 O LYS A 62 5.110 -3.611 -3.730 1.00 0.00 O ATOM 980 CB LYS A 62 8.167 -4.332 -4.822 1.00 0.00 C ATOM 981 CG LYS A 62 9.662 -4.290 -4.497 1.00 0.00 C ATOM 982 CD LYS A 62 10.020 -3.181 -3.508 1.00 0.00 C ATOM 983 CE LYS A 62 9.657 -1.815 -4.088 1.00 0.00 C ATOM 984 NZ LYS A 62 10.090 -0.729 -3.191 1.00 0.00 N ATOM 0 H LYS A 62 8.297 -6.433 -3.523 1.00 0.00 H new ATOM 0 HA LYS A 62 7.470 -3.812 -2.863 1.00 0.00 H new ATOM 0 HB2 LYS A 62 7.986 -5.108 -5.565 1.00 0.00 H new ATOM 0 HB3 LYS A 62 7.874 -3.384 -5.273 1.00 0.00 H new ATOM 0 HG2 LYS A 62 9.967 -5.252 -4.084 1.00 0.00 H new ATOM 0 HG3 LYS A 62 10.226 -4.145 -5.418 1.00 0.00 H new ATOM 0 HD2 LYS A 62 9.490 -3.337 -2.569 1.00 0.00 H new ATOM 0 HD3 LYS A 62 11.086 -3.216 -3.282 1.00 0.00 H new ATOM 0 HE2 LYS A 62 10.126 -1.694 -5.064 1.00 0.00 H new ATOM 0 HE3 LYS A 62 8.580 -1.756 -4.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 10.052 0.177 -3.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 9.460 -0.689 -2.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 11.064 -0.908 -2.875 1.00 0.00 H new ATOM 998 N LEU A 63 5.347 -5.656 -4.643 1.00 0.00 N ATOM 999 CA LEU A 63 3.952 -5.781 -5.037 1.00 0.00 C ATOM 1000 C LEU A 63 3.063 -5.805 -3.795 1.00 0.00 C ATOM 1001 O LEU A 63 2.064 -5.088 -3.722 1.00 0.00 O ATOM 1002 CB LEU A 63 3.792 -7.059 -5.868 1.00 0.00 C ATOM 1003 CG LEU A 63 2.333 -7.342 -6.234 1.00 0.00 C ATOM 1004 CD1 LEU A 63 1.745 -6.225 -7.092 1.00 0.00 C ATOM 1005 CD2 LEU A 63 2.253 -8.646 -7.022 1.00 0.00 C ATOM 0 H LEU A 63 5.926 -6.455 -4.901 1.00 0.00 H new ATOM 0 HA LEU A 63 3.647 -4.927 -5.643 1.00 0.00 H new ATOM 0 HB2 LEU A 63 4.382 -6.971 -6.781 1.00 0.00 H new ATOM 0 HB3 LEU A 63 4.193 -7.904 -5.309 1.00 0.00 H new ATOM 0 HG LEU A 63 1.764 -7.411 -5.307 1.00 0.00 H new ATOM 0 HD11 LEU A 63 0.708 -6.459 -7.333 1.00 0.00 H new ATOM 0 HD12 LEU A 63 1.787 -5.284 -6.543 1.00 0.00 H new ATOM 0 HD13 LEU A 63 2.320 -6.133 -8.013 1.00 0.00 H new ATOM 0 HD21 LEU A 63 1.215 -8.850 -7.284 1.00 0.00 H new ATOM 0 HD22 LEU A 63 2.846 -8.558 -7.932 1.00 0.00 H new ATOM 0 HD23 LEU A 63 2.641 -9.463 -6.414 1.00 0.00 H new ATOM 1017 N GLY A 64 3.427 -6.634 -2.812 1.00 0.00 N ATOM 1018 CA GLY A 64 2.677 -6.719 -1.570 1.00 0.00 C ATOM 1019 C GLY A 64 2.619 -5.368 -0.871 1.00 0.00 C ATOM 1020 O GLY A 64 1.573 -4.985 -0.355 1.00 0.00 O ATOM 0 H GLY A 64 4.237 -7.252 -2.859 1.00 0.00 H new ATOM 0 HA2 GLY A 64 1.665 -7.069 -1.776 1.00 0.00 H new ATOM 0 HA3 GLY A 64 3.141 -7.453 -0.911 1.00 0.00 H new ATOM 1024 N SER A 65 3.741 -4.644 -0.855 1.00 0.00 N ATOM 1025 CA SER A 65 3.803 -3.340 -0.217 1.00 0.00 C ATOM 1026 C SER A 65 2.877 -2.363 -0.917 1.00 0.00 C ATOM 1027 O SER A 65 2.164 -1.621 -0.250 1.00 0.00 O ATOM 1028 CB SER A 65 5.221 -2.787 -0.247 1.00 0.00 C ATOM 1029 OG SER A 65 6.077 -3.615 0.501 1.00 0.00 O ATOM 0 H SER A 65 4.618 -4.946 -1.280 1.00 0.00 H new ATOM 0 HA SER A 65 3.489 -3.464 0.820 1.00 0.00 H new ATOM 0 HB2 SER A 65 5.573 -2.722 -1.277 1.00 0.00 H new ATOM 0 HB3 SER A 65 5.234 -1.775 0.159 1.00 0.00 H new ATOM 0 HG SER A 65 5.639 -3.865 1.341 1.00 0.00 H new ATOM 1035 N LEU A 66 2.870 -2.350 -2.253 1.00 0.00 N ATOM 1036 CA LEU A 66 1.994 -1.453 -2.986 1.00 0.00 C ATOM 1037 C LEU A 66 0.531 -1.766 -2.691 1.00 0.00 C ATOM 1038 O LEU A 66 -0.278 -0.846 -2.605 1.00 0.00 O ATOM 1039 CB LEU A 66 2.289 -1.554 -4.485 1.00 0.00 C ATOM 1040 CG LEU A 66 3.651 -0.942 -4.842 1.00 0.00 C ATOM 1041 CD1 LEU A 66 3.919 -1.174 -6.326 1.00 0.00 C ATOM 1042 CD2 LEU A 66 3.673 0.561 -4.560 1.00 0.00 C ATOM 0 H LEU A 66 3.457 -2.946 -2.837 1.00 0.00 H new ATOM 0 HA LEU A 66 2.182 -0.429 -2.663 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.270 -2.601 -4.789 1.00 0.00 H new ATOM 0 HB3 LEU A 66 1.504 -1.045 -5.045 1.00 0.00 H new ATOM 0 HG LEU A 66 4.418 -1.417 -4.231 1.00 0.00 H new ATOM 0 HD11 LEU A 66 4.884 -0.744 -6.593 1.00 0.00 H new ATOM 0 HD12 LEU A 66 3.930 -2.245 -6.531 1.00 0.00 H new ATOM 0 HD13 LEU A 66 3.135 -0.700 -6.916 1.00 0.00 H new ATOM 0 HD21 LEU A 66 4.650 0.966 -4.823 1.00 0.00 H new ATOM 0 HD22 LEU A 66 2.904 1.054 -5.155 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.481 0.735 -3.501 1.00 0.00 H new ATOM 1054 N TYR A 67 0.168 -3.043 -2.534 1.00 0.00 N ATOM 1055 CA TYR A 67 -1.208 -3.393 -2.204 1.00 0.00 C ATOM 1056 C TYR A 67 -1.555 -2.995 -0.766 1.00 0.00 C ATOM 1057 O TYR A 67 -2.698 -2.628 -0.493 1.00 0.00 O ATOM 1058 CB TYR A 67 -1.445 -4.884 -2.465 1.00 0.00 C ATOM 1059 CG TYR A 67 -1.805 -5.195 -3.905 1.00 0.00 C ATOM 1060 CD1 TYR A 67 -1.018 -4.712 -4.965 1.00 0.00 C ATOM 1061 CD2 TYR A 67 -2.942 -5.967 -4.180 1.00 0.00 C ATOM 1062 CE1 TYR A 67 -1.379 -4.980 -6.293 1.00 0.00 C ATOM 1063 CE2 TYR A 67 -3.312 -6.237 -5.505 1.00 0.00 C ATOM 1064 CZ TYR A 67 -2.530 -5.744 -6.570 1.00 0.00 C ATOM 1065 OH TYR A 67 -2.886 -6.006 -7.858 1.00 0.00 O ATOM 0 H TYR A 67 0.801 -3.837 -2.629 1.00 0.00 H new ATOM 0 HA TYR A 67 -1.880 -2.828 -2.851 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.547 -5.440 -2.195 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -2.245 -5.236 -1.814 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -0.131 -4.132 -4.755 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -3.536 -6.356 -3.367 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -0.775 -4.601 -7.104 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -4.196 -6.823 -5.710 1.00 0.00 H new ATOM 0 HH TYR A 67 -3.704 -6.546 -7.868 1.00 0.00 H new ATOM 1075 N ILE A 68 -0.588 -3.058 0.152 1.00 0.00 N ATOM 1076 CA ILE A 68 -0.790 -2.623 1.528 1.00 0.00 C ATOM 1077 C ILE A 68 -0.895 -1.097 1.581 1.00 0.00 C ATOM 1078 O ILE A 68 -1.730 -0.551 2.302 1.00 0.00 O ATOM 1079 CB ILE A 68 0.364 -3.148 2.393 1.00 0.00 C ATOM 1080 CG1 ILE A 68 0.238 -4.672 2.510 1.00 0.00 C ATOM 1081 CG2 ILE A 68 0.336 -2.517 3.790 1.00 0.00 C ATOM 1082 CD1 ILE A 68 1.545 -5.312 2.978 1.00 0.00 C ATOM 0 H ILE A 68 0.350 -3.410 -0.040 1.00 0.00 H new ATOM 0 HA ILE A 68 -1.723 -3.028 1.921 1.00 0.00 H new ATOM 0 HB ILE A 68 1.310 -2.881 1.922 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -0.560 -4.919 3.211 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -0.046 -5.089 1.544 1.00 0.00 H new ATOM 0 HG21 ILE A 68 1.164 -2.907 4.382 1.00 0.00 H new ATOM 0 HG22 ILE A 68 0.430 -1.435 3.702 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -0.606 -2.761 4.280 1.00 0.00 H new ATOM 0 HD11 ILE A 68 1.416 -6.392 3.049 1.00 0.00 H new ATOM 0 HD12 ILE A 68 2.337 -5.087 2.263 1.00 0.00 H new ATOM 0 HD13 ILE A 68 1.815 -4.914 3.956 1.00 0.00 H new ATOM 1094 N ILE A 69 -0.047 -0.406 0.814 1.00 0.00 N ATOM 1095 CA ILE A 69 -0.058 1.043 0.710 1.00 0.00 C ATOM 1096 C ILE A 69 -1.366 1.496 0.060 1.00 0.00 C ATOM 1097 O ILE A 69 -1.885 2.556 0.395 1.00 0.00 O ATOM 1098 CB ILE A 69 1.152 1.481 -0.127 1.00 0.00 C ATOM 1099 CG1 ILE A 69 2.440 1.268 0.679 1.00 0.00 C ATOM 1100 CG2 ILE A 69 1.038 2.954 -0.528 1.00 0.00 C ATOM 1101 CD1 ILE A 69 3.676 1.305 -0.219 1.00 0.00 C ATOM 0 H ILE A 69 0.673 -0.849 0.243 1.00 0.00 H new ATOM 0 HA ILE A 69 0.007 1.500 1.697 1.00 0.00 H new ATOM 0 HB ILE A 69 1.178 0.877 -1.034 1.00 0.00 H new ATOM 0 HG12 ILE A 69 2.523 2.039 1.445 1.00 0.00 H new ATOM 0 HG13 ILE A 69 2.393 0.309 1.195 1.00 0.00 H new ATOM 0 HG21 ILE A 69 1.908 3.238 -1.120 1.00 0.00 H new ATOM 0 HG22 ILE A 69 0.134 3.101 -1.118 1.00 0.00 H new ATOM 0 HG23 ILE A 69 0.991 3.573 0.368 1.00 0.00 H new ATOM 0 HD11 ILE A 69 4.570 1.151 0.386 1.00 0.00 H new ATOM 0 HD12 ILE A 69 3.605 0.517 -0.969 1.00 0.00 H new ATOM 0 HD13 ILE A 69 3.736 2.274 -0.715 1.00 0.00 H new ATOM 1113 N ASP A 70 -1.899 0.695 -0.869 1.00 0.00 N ATOM 1114 CA ASP A 70 -3.124 1.043 -1.567 1.00 0.00 C ATOM 1115 C ASP A 70 -4.346 0.849 -0.675 1.00 0.00 C ATOM 1116 O ASP A 70 -5.234 1.693 -0.673 1.00 0.00 O ATOM 1117 CB ASP A 70 -3.224 0.232 -2.858 1.00 0.00 C ATOM 1118 CG ASP A 70 -4.281 0.808 -3.789 1.00 0.00 C ATOM 1119 OD1 ASP A 70 -3.982 1.849 -4.414 1.00 0.00 O ATOM 1120 OD2 ASP A 70 -5.378 0.213 -3.874 1.00 0.00 O ATOM 0 H ASP A 70 -1.494 -0.198 -1.150 1.00 0.00 H new ATOM 0 HA ASP A 70 -3.097 2.101 -1.827 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -2.257 0.224 -3.362 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -3.469 -0.804 -2.622 1.00 0.00 H new ATOM 1125 N SER A 71 -4.413 -0.247 0.090 1.00 0.00 N ATOM 1126 CA SER A 71 -5.548 -0.498 0.968 1.00 0.00 C ATOM 1127 C SER A 71 -5.574 0.505 2.117 1.00 0.00 C ATOM 1128 O SER A 71 -6.612 1.109 2.374 1.00 0.00 O ATOM 1129 CB SER A 71 -5.460 -1.924 1.516 1.00 0.00 C ATOM 1130 OG SER A 71 -4.154 -2.196 1.976 1.00 0.00 O ATOM 0 H SER A 71 -3.693 -0.969 0.115 1.00 0.00 H new ATOM 0 HA SER A 71 -6.469 -0.383 0.396 1.00 0.00 H new ATOM 0 HB2 SER A 71 -6.173 -2.052 2.331 1.00 0.00 H new ATOM 0 HB3 SER A 71 -5.734 -2.637 0.738 1.00 0.00 H new ATOM 0 HG SER A 71 -3.600 -2.502 1.227 1.00 0.00 H new ATOM 1136 N ILE A 72 -4.444 0.688 2.809 1.00 0.00 N ATOM 1137 CA ILE A 72 -4.373 1.634 3.915 1.00 0.00 C ATOM 1138 C ILE A 72 -4.516 3.066 3.403 1.00 0.00 C ATOM 1139 O ILE A 72 -5.222 3.865 4.015 1.00 0.00 O ATOM 1140 CB ILE A 72 -3.060 1.436 4.680 1.00 0.00 C ATOM 1141 CG1 ILE A 72 -3.036 0.022 5.279 1.00 0.00 C ATOM 1142 CG2 ILE A 72 -2.944 2.481 5.791 1.00 0.00 C ATOM 1143 CD1 ILE A 72 -1.782 -0.242 6.110 1.00 0.00 C ATOM 0 H ILE A 72 -3.572 0.193 2.620 1.00 0.00 H new ATOM 0 HA ILE A 72 -5.199 1.450 4.603 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.217 1.555 4.000 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -3.918 -0.119 5.904 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -3.095 -0.711 4.474 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.009 2.335 6.331 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -2.959 3.480 5.354 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -3.782 2.374 6.480 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.817 -1.256 6.509 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -0.899 -0.130 5.481 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.734 0.471 6.933 1.00 0.00 H new ATOM 1155 N GLY A 73 -3.856 3.401 2.290 1.00 0.00 N ATOM 1156 CA GLY A 73 -3.901 4.746 1.740 1.00 0.00 C ATOM 1157 C GLY A 73 -5.299 5.102 1.242 1.00 0.00 C ATOM 1158 O GLY A 73 -5.752 6.231 1.426 1.00 0.00 O ATOM 0 H GLY A 73 -3.283 2.749 1.754 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -3.592 5.462 2.502 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -3.189 4.828 0.918 1.00 0.00 H new ATOM 1162 N ARG A 74 -5.986 4.144 0.611 1.00 0.00 N ATOM 1163 CA ARG A 74 -7.333 4.337 0.098 1.00 0.00 C ATOM 1164 C ARG A 74 -8.325 4.455 1.248 1.00 0.00 C ATOM 1165 O ARG A 74 -9.243 5.270 1.195 1.00 0.00 O ATOM 1166 CB ARG A 74 -7.666 3.148 -0.804 1.00 0.00 C ATOM 1167 CG ARG A 74 -8.996 3.265 -1.531 1.00 0.00 C ATOM 1168 CD ARG A 74 -9.167 1.983 -2.356 1.00 0.00 C ATOM 1169 NE ARG A 74 -8.112 1.810 -3.364 1.00 0.00 N ATOM 1170 CZ ARG A 74 -7.774 2.676 -4.321 1.00 0.00 C ATOM 1171 NH1 ARG A 74 -8.464 3.794 -4.539 1.00 0.00 N ATOM 1172 NH2 ARG A 74 -6.714 2.403 -5.070 1.00 0.00 N ATOM 0 H ARG A 74 -5.614 3.209 0.444 1.00 0.00 H new ATOM 0 HA ARG A 74 -7.397 5.261 -0.477 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -6.872 3.033 -1.541 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -7.674 2.241 -0.200 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -9.815 3.380 -0.821 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -9.008 4.144 -2.176 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -9.168 1.123 -1.686 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -10.137 2.002 -2.852 1.00 0.00 H new ATOM 0 HE ARG A 74 -7.584 0.938 -3.328 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -9.279 4.010 -3.965 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -8.177 4.434 -5.280 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -6.181 1.549 -4.907 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -6.432 3.047 -5.809 1.00 0.00 H new ATOM 1186 N ALA A 75 -8.137 3.639 2.286 1.00 0.00 N ATOM 1187 CA ALA A 75 -8.992 3.674 3.459 1.00 0.00 C ATOM 1188 C ALA A 75 -8.787 4.981 4.223 1.00 0.00 C ATOM 1189 O ALA A 75 -9.755 5.569 4.708 1.00 0.00 O ATOM 1190 CB ALA A 75 -8.675 2.458 4.327 1.00 0.00 C ATOM 0 H ALA A 75 -7.393 2.943 2.332 1.00 0.00 H new ATOM 0 HA ALA A 75 -10.041 3.634 3.165 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -9.309 2.469 5.214 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -8.861 1.547 3.759 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -7.628 2.490 4.629 1.00 0.00 H new ATOM 1196 N TYR A 76 -7.532 5.436 4.332 1.00 0.00 N ATOM 1197 CA TYR A 76 -7.220 6.712 4.961 1.00 0.00 C ATOM 1198 C TYR A 76 -7.866 7.847 4.183 1.00 0.00 C ATOM 1199 O TYR A 76 -8.525 8.698 4.772 1.00 0.00 O ATOM 1200 CB TYR A 76 -5.705 6.933 4.988 1.00 0.00 C ATOM 1201 CG TYR A 76 -4.928 6.182 6.050 1.00 0.00 C ATOM 1202 CD1 TYR A 76 -5.516 5.166 6.818 1.00 0.00 C ATOM 1203 CD2 TYR A 76 -3.584 6.526 6.263 1.00 0.00 C ATOM 1204 CE1 TYR A 76 -4.767 4.507 7.803 1.00 0.00 C ATOM 1205 CE2 TYR A 76 -2.833 5.877 7.251 1.00 0.00 C ATOM 1206 CZ TYR A 76 -3.427 4.871 8.033 1.00 0.00 C ATOM 1207 OH TYR A 76 -2.699 4.262 9.009 1.00 0.00 O ATOM 0 H TYR A 76 -6.716 4.930 3.988 1.00 0.00 H new ATOM 0 HA TYR A 76 -7.606 6.696 5.980 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -5.303 6.657 4.013 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -5.519 7.999 5.120 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -6.547 4.891 6.650 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -3.126 7.297 5.661 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -5.219 3.719 8.386 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -1.800 6.149 7.412 1.00 0.00 H new ATOM 0 HH TYR A 76 -1.794 4.638 9.025 1.00 0.00 H new ATOM 1217 N LEU A 77 -7.673 7.852 2.859 1.00 0.00 N ATOM 1218 CA LEU A 77 -8.165 8.907 1.992 1.00 0.00 C ATOM 1219 C LEU A 77 -9.679 9.042 2.131 1.00 0.00 C ATOM 1220 O LEU A 77 -10.192 10.149 2.300 1.00 0.00 O ATOM 1221 CB LEU A 77 -7.765 8.567 0.553 1.00 0.00 C ATOM 1222 CG LEU A 77 -8.132 9.674 -0.437 1.00 0.00 C ATOM 1223 CD1 LEU A 77 -7.346 10.953 -0.142 1.00 0.00 C ATOM 1224 CD2 LEU A 77 -7.793 9.204 -1.849 1.00 0.00 C ATOM 0 H LEU A 77 -7.167 7.117 2.365 1.00 0.00 H new ATOM 0 HA LEU A 77 -7.728 9.866 2.272 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -6.690 8.389 0.511 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -8.254 7.640 0.253 1.00 0.00 H new ATOM 0 HG LEU A 77 -9.197 9.887 -0.344 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -7.625 11.725 -0.859 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -7.575 11.296 0.867 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -6.278 10.751 -0.223 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -8.050 9.985 -2.564 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.726 8.989 -1.915 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -8.360 8.302 -2.078 1.00 0.00 H new ATOM 1236 N ASP A 78 -10.393 7.916 2.060 1.00 0.00 N ATOM 1237 CA ASP A 78 -11.841 7.921 2.169 1.00 0.00 C ATOM 1238 C ASP A 78 -12.278 8.391 3.550 1.00 0.00 C ATOM 1239 O ASP A 78 -13.206 9.188 3.668 1.00 0.00 O ATOM 1240 CB ASP A 78 -12.367 6.509 1.920 1.00 0.00 C ATOM 1241 CG ASP A 78 -13.892 6.492 1.871 1.00 0.00 C ATOM 1242 OD1 ASP A 78 -14.439 7.001 0.865 1.00 0.00 O ATOM 1243 OD2 ASP A 78 -14.494 5.971 2.837 1.00 0.00 O ATOM 0 H ASP A 78 -9.984 6.991 1.927 1.00 0.00 H new ATOM 0 HA ASP A 78 -12.247 8.608 1.427 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -11.966 6.128 0.981 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -12.018 5.843 2.709 1.00 0.00 H new ATOM 1248 N GLU A 79 -11.615 7.899 4.598 1.00 0.00 N ATOM 1249 CA GLU A 79 -12.019 8.213 5.956 1.00 0.00 C ATOM 1250 C GLU A 79 -11.783 9.686 6.284 1.00 0.00 C ATOM 1251 O GLU A 79 -12.608 10.304 6.955 1.00 0.00 O ATOM 1252 CB GLU A 79 -11.271 7.301 6.932 1.00 0.00 C ATOM 1253 CG GLU A 79 -11.774 7.522 8.360 1.00 0.00 C ATOM 1254 CD GLU A 79 -11.110 6.549 9.330 1.00 0.00 C ATOM 1255 OE1 GLU A 79 -11.637 5.421 9.473 1.00 0.00 O ATOM 1256 OE2 GLU A 79 -10.079 6.938 9.925 1.00 0.00 O ATOM 0 H GLU A 79 -10.803 7.286 4.527 1.00 0.00 H new ATOM 0 HA GLU A 79 -13.090 8.036 6.053 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -11.413 6.259 6.647 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -10.201 7.503 6.881 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -11.566 8.547 8.668 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -12.856 7.392 8.393 1.00 0.00 H new ATOM 1263 N THR A 80 -10.670 10.261 5.819 1.00 0.00 N ATOM 1264 CA THR A 80 -10.364 11.651 6.127 1.00 0.00 C ATOM 1265 C THR A 80 -11.136 12.615 5.231 1.00 0.00 C ATOM 1266 O THR A 80 -11.354 13.761 5.621 1.00 0.00 O ATOM 1267 CB THR A 80 -8.850 11.891 6.113 1.00 0.00 C ATOM 1268 OG1 THR A 80 -8.568 13.142 6.706 1.00 0.00 O ATOM 1269 CG2 THR A 80 -8.245 11.861 4.710 1.00 0.00 C ATOM 0 H THR A 80 -9.978 9.789 5.237 1.00 0.00 H new ATOM 0 HA THR A 80 -10.705 11.860 7.141 1.00 0.00 H new ATOM 0 HB THR A 80 -8.398 11.074 6.676 1.00 0.00 H new ATOM 0 HG1 THR A 80 -7.600 13.296 6.699 1.00 0.00 H new ATOM 0 HG21 THR A 80 -7.171 12.038 4.773 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.426 10.887 4.256 1.00 0.00 H new ATOM 0 HG23 THR A 80 -8.705 12.637 4.099 1.00 0.00 H new ATOM 1277 N ARG A 81 -11.558 12.177 4.036 1.00 0.00 N ATOM 1278 CA ARG A 81 -12.438 12.988 3.200 1.00 0.00 C ATOM 1279 C ARG A 81 -13.899 12.855 3.626 1.00 0.00 C ATOM 1280 O ARG A 81 -14.695 13.756 3.363 1.00 0.00 O ATOM 1281 CB ARG A 81 -12.273 12.601 1.729 1.00 0.00 C ATOM 1282 CG ARG A 81 -10.945 13.129 1.184 1.00 0.00 C ATOM 1283 CD ARG A 81 -10.849 12.815 -0.309 1.00 0.00 C ATOM 1284 NE ARG A 81 -9.644 13.407 -0.897 1.00 0.00 N ATOM 1285 CZ ARG A 81 -9.363 13.393 -2.203 1.00 0.00 C ATOM 1286 NH1 ARG A 81 -10.188 12.808 -3.071 1.00 0.00 N ATOM 1287 NH2 ARG A 81 -8.249 13.970 -2.647 1.00 0.00 N ATOM 0 H ARG A 81 -11.304 11.274 3.635 1.00 0.00 H new ATOM 0 HA ARG A 81 -12.152 14.032 3.328 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -12.310 11.517 1.625 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -13.100 13.006 1.145 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -10.874 14.205 1.346 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -10.112 12.671 1.718 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -10.836 11.735 -0.456 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -11.732 13.196 -0.821 1.00 0.00 H new ATOM 0 HE ARG A 81 -8.978 13.858 -0.270 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -11.045 12.364 -2.741 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -9.962 12.804 -4.066 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -7.612 14.422 -1.991 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -8.032 13.961 -3.644 1.00 0.00 H new ATOM 1441 N THR A 93 -1.842 12.633 11.769 1.00 0.00 N ATOM 1442 CA THR A 93 -2.659 11.446 11.538 1.00 0.00 C ATOM 1443 C THR A 93 -2.670 10.978 10.078 1.00 0.00 C ATOM 1444 O THR A 93 -1.771 11.309 9.308 1.00 0.00 O ATOM 1445 CB THR A 93 -4.059 11.635 12.134 1.00 0.00 C ATOM 1446 OG1 THR A 93 -4.309 12.972 12.516 1.00 0.00 O ATOM 1447 CG2 THR A 93 -4.130 10.741 13.373 1.00 0.00 C ATOM 0 HA THR A 93 -2.187 10.619 12.069 1.00 0.00 H new ATOM 0 HB THR A 93 -4.807 11.376 11.384 1.00 0.00 H new ATOM 0 HG1 THR A 93 -3.471 13.480 12.496 1.00 0.00 H new ATOM 0 HG21 THR A 93 -5.112 10.839 13.837 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.968 9.703 13.082 1.00 0.00 H new ATOM 0 HG23 THR A 93 -3.361 11.043 14.084 1.00 0.00 H new ATOM 1455 N CYS A 94 -3.690 10.202 9.691 1.00 0.00 N ATOM 1456 CA CYS A 94 -3.797 9.595 8.373 1.00 0.00 C ATOM 1457 C CYS A 94 -3.654 10.601 7.225 1.00 0.00 C ATOM 1458 O CYS A 94 -3.174 10.234 6.152 1.00 0.00 O ATOM 1459 CB CYS A 94 -5.141 8.868 8.289 1.00 0.00 C ATOM 1460 SG CYS A 94 -6.491 10.028 8.639 1.00 0.00 S ATOM 0 H CYS A 94 -4.475 9.979 10.302 1.00 0.00 H new ATOM 0 HA CYS A 94 -2.968 8.898 8.254 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -5.269 8.435 7.297 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -5.164 8.044 9.002 1.00 0.00 H new ATOM 0 HG CYS A 94 -7.629 9.405 8.564 1.00 0.00 H new ATOM 1466 N ALA A 95 -4.052 11.861 7.416 1.00 0.00 N ATOM 1467 CA ALA A 95 -3.856 12.871 6.388 1.00 0.00 C ATOM 1468 C ALA A 95 -2.360 13.049 6.112 1.00 0.00 C ATOM 1469 O ALA A 95 -1.929 13.086 4.959 1.00 0.00 O ATOM 1470 CB ALA A 95 -4.494 14.176 6.854 1.00 0.00 C ATOM 0 H ALA A 95 -4.506 12.198 8.265 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.330 12.561 5.457 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.354 14.942 6.091 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -5.560 14.021 7.021 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.025 14.499 7.783 1.00 0.00 H new ATOM 1476 N HIS A 96 -1.562 13.156 7.180 1.00 0.00 N ATOM 1477 CA HIS A 96 -0.119 13.290 7.046 1.00 0.00 C ATOM 1478 C HIS A 96 0.515 11.964 6.639 1.00 0.00 C ATOM 1479 O HIS A 96 1.606 11.961 6.077 1.00 0.00 O ATOM 1480 CB HIS A 96 0.483 13.802 8.351 1.00 0.00 C ATOM 1481 CG HIS A 96 0.285 15.284 8.552 1.00 0.00 C ATOM 1482 ND1 HIS A 96 -0.857 16.013 8.205 1.00 0.00 N ATOM 1483 CD2 HIS A 96 1.205 16.126 9.105 1.00 0.00 C ATOM 1484 CE1 HIS A 96 -0.595 17.280 8.565 1.00 0.00 C ATOM 1485 NE2 HIS A 96 0.633 17.378 9.106 1.00 0.00 N ATOM 0 H HIS A 96 -1.897 13.152 8.143 1.00 0.00 H new ATOM 0 HA HIS A 96 0.091 14.014 6.259 1.00 0.00 H new ATOM 0 HB2 HIS A 96 0.034 13.265 9.187 1.00 0.00 H new ATOM 0 HB3 HIS A 96 1.550 13.579 8.364 1.00 0.00 H new ATOM 0 HD2 HIS A 96 2.187 15.863 9.470 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -1.277 18.108 8.438 1.00 0.00 H new ATOM 0 HE2 HIS A 96 1.066 18.233 9.456 1.00 0.00 H new ATOM 1493 N ALA A 97 -0.154 10.843 6.914 1.00 0.00 N ATOM 1494 CA ALA A 97 0.327 9.544 6.483 1.00 0.00 C ATOM 1495 C ALA A 97 0.321 9.473 4.960 1.00 0.00 C ATOM 1496 O ALA A 97 1.291 9.024 4.352 1.00 0.00 O ATOM 1497 CB ALA A 97 -0.565 8.464 7.084 1.00 0.00 C ATOM 0 H ALA A 97 -1.031 10.816 7.434 1.00 0.00 H new ATOM 0 HA ALA A 97 1.350 9.388 6.825 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -0.213 7.483 6.766 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -0.531 8.527 8.172 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -1.591 8.609 6.744 1.00 0.00 H new ATOM 1503 N ILE A 98 -0.777 9.919 4.345 1.00 0.00 N ATOM 1504 CA ILE A 98 -0.873 9.983 2.895 1.00 0.00 C ATOM 1505 C ILE A 98 0.151 10.987 2.377 1.00 0.00 C ATOM 1506 O ILE A 98 0.828 10.723 1.383 1.00 0.00 O ATOM 1507 CB ILE A 98 -2.296 10.387 2.490 1.00 0.00 C ATOM 1508 CG1 ILE A 98 -3.294 9.311 2.941 1.00 0.00 C ATOM 1509 CG2 ILE A 98 -2.382 10.573 0.973 1.00 0.00 C ATOM 1510 CD1 ILE A 98 -4.735 9.788 2.754 1.00 0.00 C ATOM 0 H ILE A 98 -1.611 10.241 4.835 1.00 0.00 H new ATOM 0 HA ILE A 98 -0.661 9.007 2.458 1.00 0.00 H new ATOM 0 HB ILE A 98 -2.544 11.331 2.975 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -3.132 8.397 2.369 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -3.121 9.066 3.989 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -3.397 10.860 0.699 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -1.688 11.354 0.662 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -2.122 9.638 0.476 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -5.422 9.007 3.081 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -4.900 10.688 3.346 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -4.911 10.009 1.701 1.00 0.00 H new ATOM 1522 N ASN A 99 0.269 12.138 3.051 1.00 0.00 N ATOM 1523 CA ASN A 99 1.236 13.149 2.656 1.00 0.00 C ATOM 1524 C ASN A 99 2.666 12.603 2.709 1.00 0.00 C ATOM 1525 O ASN A 99 3.504 12.987 1.895 1.00 0.00 O ATOM 1526 CB ASN A 99 1.075 14.356 3.584 1.00 0.00 C ATOM 1527 CG ASN A 99 1.797 15.594 3.070 1.00 0.00 C ATOM 1528 OD1 ASN A 99 2.251 15.642 1.931 1.00 0.00 O ATOM 1529 ND2 ASN A 99 1.912 16.618 3.912 1.00 0.00 N ATOM 0 H ASN A 99 -0.293 12.384 3.866 1.00 0.00 H new ATOM 0 HA ASN A 99 1.051 13.447 1.624 1.00 0.00 H new ATOM 0 HB2 ASN A 99 0.015 14.581 3.700 1.00 0.00 H new ATOM 0 HB3 ASN A 99 1.457 14.102 4.573 1.00 0.00 H new ATOM 0 HD21 ASN A 99 2.387 17.471 3.616 1.00 0.00 H new ATOM 0 HD22 ASN A 99 1.525 16.550 4.853 1.00 0.00 H new ATOM 1536 N THR A 100 2.953 11.711 3.662 1.00 0.00 N ATOM 1537 CA THR A 100 4.281 11.127 3.798 1.00 0.00 C ATOM 1538 C THR A 100 4.542 10.085 2.717 1.00 0.00 C ATOM 1539 O THR A 100 5.642 10.043 2.169 1.00 0.00 O ATOM 1540 CB THR A 100 4.461 10.525 5.191 1.00 0.00 C ATOM 1541 OG1 THR A 100 4.267 11.523 6.171 1.00 0.00 O ATOM 1542 CG2 THR A 100 5.879 9.977 5.336 1.00 0.00 C ATOM 0 H THR A 100 2.277 11.380 4.351 1.00 0.00 H new ATOM 0 HA THR A 100 5.014 11.924 3.670 1.00 0.00 H new ATOM 0 HB THR A 100 3.734 9.724 5.323 1.00 0.00 H new ATOM 0 HG1 THR A 100 3.310 11.611 6.364 1.00 0.00 H new ATOM 0 HG21 THR A 100 6.004 9.549 6.331 1.00 0.00 H new ATOM 0 HG22 THR A 100 6.050 9.206 4.585 1.00 0.00 H new ATOM 0 HG23 THR A 100 6.597 10.785 5.196 1.00 0.00 H new ATOM 1550 N LEU A 101 3.558 9.240 2.391 1.00 0.00 N ATOM 1551 CA LEU A 101 3.729 8.318 1.276 1.00 0.00 C ATOM 1552 C LEU A 101 3.940 9.120 -0.008 1.00 0.00 C ATOM 1553 O LEU A 101 4.628 8.666 -0.920 1.00 0.00 O ATOM 1554 CB LEU A 101 2.487 7.448 1.112 1.00 0.00 C ATOM 1555 CG LEU A 101 2.331 6.391 2.208 1.00 0.00 C ATOM 1556 CD1 LEU A 101 0.889 5.888 2.183 1.00 0.00 C ATOM 1557 CD2 LEU A 101 3.281 5.228 1.936 1.00 0.00 C ATOM 0 H LEU A 101 2.660 9.179 2.871 1.00 0.00 H new ATOM 0 HA LEU A 101 4.591 7.680 1.474 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.604 8.087 1.107 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.527 6.951 0.143 1.00 0.00 H new ATOM 0 HG LEU A 101 2.566 6.820 3.182 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.754 5.132 2.957 1.00 0.00 H new ATOM 0 HD12 LEU A 101 0.210 6.721 2.366 1.00 0.00 H new ATOM 0 HD13 LEU A 101 0.673 5.451 1.208 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.169 4.476 2.717 1.00 0.00 H new ATOM 0 HD22 LEU A 101 3.045 4.784 0.969 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.308 5.592 1.927 1.00 0.00 H new ATOM 1569 N GLY A 102 3.347 10.315 -0.076 1.00 0.00 N ATOM 1570 CA GLY A 102 3.456 11.204 -1.222 1.00 0.00 C ATOM 1571 C GLY A 102 4.893 11.620 -1.541 1.00 0.00 C ATOM 1572 O GLY A 102 5.143 12.133 -2.631 1.00 0.00 O ATOM 0 H GLY A 102 2.771 10.692 0.677 1.00 0.00 H new ATOM 0 HA2 GLY A 102 3.027 10.712 -2.095 1.00 0.00 H new ATOM 0 HA3 GLY A 102 2.861 12.098 -1.035 1.00 0.00 H new ATOM 1576 N GLU A 103 5.842 11.412 -0.620 1.00 0.00 N ATOM 1577 CA GLU A 103 7.229 11.789 -0.865 1.00 0.00 C ATOM 1578 C GLU A 103 8.089 10.584 -1.261 1.00 0.00 C ATOM 1579 O GLU A 103 9.252 10.750 -1.626 1.00 0.00 O ATOM 1580 CB GLU A 103 7.795 12.554 0.341 1.00 0.00 C ATOM 1581 CG GLU A 103 8.458 11.650 1.381 1.00 0.00 C ATOM 1582 CD GLU A 103 8.942 12.462 2.579 1.00 0.00 C ATOM 1583 OE1 GLU A 103 8.103 12.758 3.457 1.00 0.00 O ATOM 1584 OE2 GLU A 103 10.151 12.783 2.611 1.00 0.00 O ATOM 0 H GLU A 103 5.672 10.988 0.292 1.00 0.00 H new ATOM 0 HA GLU A 103 7.256 12.463 -1.721 1.00 0.00 H new ATOM 0 HB2 GLU A 103 8.524 13.284 -0.011 1.00 0.00 H new ATOM 0 HB3 GLU A 103 6.989 13.112 0.818 1.00 0.00 H new ATOM 0 HG2 GLU A 103 7.750 10.891 1.713 1.00 0.00 H new ATOM 0 HG3 GLU A 103 9.299 11.125 0.929 1.00 0.00 H new ATOM 1591 N VAL A 104 7.526 9.370 -1.193 1.00 0.00 N ATOM 1592 CA VAL A 104 8.254 8.145 -1.509 1.00 0.00 C ATOM 1593 C VAL A 104 7.607 7.357 -2.641 1.00 0.00 C ATOM 1594 O VAL A 104 8.278 6.535 -3.259 1.00 0.00 O ATOM 1595 CB VAL A 104 8.356 7.252 -0.273 1.00 0.00 C ATOM 1596 CG1 VAL A 104 9.177 7.925 0.826 1.00 0.00 C ATOM 1597 CG2 VAL A 104 6.964 6.918 0.255 1.00 0.00 C ATOM 0 H VAL A 104 6.556 9.215 -0.918 1.00 0.00 H new ATOM 0 HA VAL A 104 9.248 8.449 -1.836 1.00 0.00 H new ATOM 0 HB VAL A 104 8.861 6.331 -0.566 1.00 0.00 H new ATOM 0 HG11 VAL A 104 9.233 7.267 1.693 1.00 0.00 H new ATOM 0 HG12 VAL A 104 10.183 8.126 0.457 1.00 0.00 H new ATOM 0 HG13 VAL A 104 8.702 8.863 1.112 1.00 0.00 H new ATOM 0 HG21 VAL A 104 7.052 6.281 1.135 1.00 0.00 H new ATOM 0 HG22 VAL A 104 6.446 7.839 0.523 1.00 0.00 H new ATOM 0 HG23 VAL A 104 6.398 6.395 -0.516 1.00 0.00 H new ATOM 1607 N ILE A 105 6.319 7.591 -2.923 1.00 0.00 N ATOM 1608 CA ILE A 105 5.586 6.860 -3.943 1.00 0.00 C ATOM 1609 C ILE A 105 6.322 6.849 -5.284 1.00 0.00 C ATOM 1610 O ILE A 105 6.156 5.921 -6.073 1.00 0.00 O ATOM 1611 CB ILE A 105 4.191 7.488 -4.073 1.00 0.00 C ATOM 1612 CG1 ILE A 105 3.226 6.567 -4.823 1.00 0.00 C ATOM 1613 CG2 ILE A 105 4.264 8.845 -4.774 1.00 0.00 C ATOM 1614 CD1 ILE A 105 3.037 5.247 -4.074 1.00 0.00 C ATOM 0 H ILE A 105 5.761 8.297 -2.443 1.00 0.00 H new ATOM 0 HA ILE A 105 5.497 5.816 -3.644 1.00 0.00 H new ATOM 0 HB ILE A 105 3.810 7.632 -3.062 1.00 0.00 H new ATOM 0 HG12 ILE A 105 2.263 7.063 -4.942 1.00 0.00 H new ATOM 0 HG13 ILE A 105 3.609 6.370 -5.824 1.00 0.00 H new ATOM 0 HG21 ILE A 105 3.263 9.268 -4.853 1.00 0.00 H new ATOM 0 HG22 ILE A 105 4.898 9.519 -4.197 1.00 0.00 H new ATOM 0 HG23 ILE A 105 4.684 8.717 -5.772 1.00 0.00 H new ATOM 0 HD11 ILE A 105 2.347 4.610 -4.627 1.00 0.00 H new ATOM 0 HD12 ILE A 105 3.998 4.742 -3.978 1.00 0.00 H new ATOM 0 HD13 ILE A 105 2.631 5.446 -3.082 1.00 0.00 H new ATOM 1626 N GLN A 106 7.133 7.877 -5.540 1.00 0.00 N ATOM 1627 CA GLN A 106 7.932 7.965 -6.748 1.00 0.00 C ATOM 1628 C GLN A 106 8.965 6.837 -6.800 1.00 0.00 C ATOM 1629 O GLN A 106 8.992 6.069 -7.765 1.00 0.00 O ATOM 1630 CB GLN A 106 8.556 9.363 -6.850 1.00 0.00 C ATOM 1631 CG GLN A 106 9.269 9.800 -5.565 1.00 0.00 C ATOM 1632 CD GLN A 106 9.765 11.242 -5.644 1.00 0.00 C ATOM 1633 OE1 GLN A 106 9.757 11.864 -6.704 1.00 0.00 O ATOM 1634 NE2 GLN A 106 10.205 11.783 -4.512 1.00 0.00 N ATOM 0 H GLN A 106 7.249 8.670 -4.909 1.00 0.00 H new ATOM 0 HA GLN A 106 7.297 7.829 -7.623 1.00 0.00 H new ATOM 0 HB2 GLN A 106 9.267 9.377 -7.676 1.00 0.00 H new ATOM 0 HB3 GLN A 106 7.776 10.086 -7.089 1.00 0.00 H new ATOM 0 HG2 GLN A 106 8.588 9.697 -4.720 1.00 0.00 H new ATOM 0 HG3 GLN A 106 10.113 9.137 -5.376 1.00 0.00 H new ATOM 0 HE21 GLN A 106 10.198 11.238 -3.650 1.00 0.00 H new ATOM 0 HE22 GLN A 106 10.550 12.743 -4.506 1.00 0.00 H new ATOM 1643 N GLU A 107 9.811 6.729 -5.770 1.00 0.00 N ATOM 1644 CA GLU A 107 10.839 5.705 -5.720 1.00 0.00 C ATOM 1645 C GLU A 107 10.177 4.338 -5.611 1.00 0.00 C ATOM 1646 O GLU A 107 10.619 3.379 -6.238 1.00 0.00 O ATOM 1647 CB GLU A 107 11.744 5.915 -4.500 1.00 0.00 C ATOM 1648 CG GLU A 107 12.332 7.324 -4.441 1.00 0.00 C ATOM 1649 CD GLU A 107 13.139 7.660 -5.694 1.00 0.00 C ATOM 1650 OE1 GLU A 107 14.295 7.191 -5.784 1.00 0.00 O ATOM 1651 OE2 GLU A 107 12.592 8.385 -6.556 1.00 0.00 O ATOM 0 H GLU A 107 9.797 7.347 -4.958 1.00 0.00 H new ATOM 0 HA GLU A 107 11.441 5.765 -6.627 1.00 0.00 H new ATOM 0 HB2 GLU A 107 11.173 5.725 -3.591 1.00 0.00 H new ATOM 0 HB3 GLU A 107 12.555 5.187 -4.524 1.00 0.00 H new ATOM 0 HG2 GLU A 107 11.526 8.049 -4.324 1.00 0.00 H new ATOM 0 HG3 GLU A 107 12.972 7.414 -3.563 1.00 0.00 H new ATOM 1658 N LEU A 108 9.115 4.259 -4.807 1.00 0.00 N ATOM 1659 CA LEU A 108 8.419 3.004 -4.577 1.00 0.00 C ATOM 1660 C LEU A 108 7.902 2.420 -5.886 1.00 0.00 C ATOM 1661 O LEU A 108 8.229 1.280 -6.200 1.00 0.00 O ATOM 1662 CB LEU A 108 7.269 3.198 -3.586 1.00 0.00 C ATOM 1663 CG LEU A 108 7.754 3.493 -2.164 1.00 0.00 C ATOM 1664 CD1 LEU A 108 6.541 3.686 -1.261 1.00 0.00 C ATOM 1665 CD2 LEU A 108 8.595 2.344 -1.611 1.00 0.00 C ATOM 0 H LEU A 108 8.722 5.055 -4.306 1.00 0.00 H new ATOM 0 HA LEU A 108 9.130 2.299 -4.147 1.00 0.00 H new ATOM 0 HB2 LEU A 108 6.636 4.018 -3.927 1.00 0.00 H new ATOM 0 HB3 LEU A 108 6.650 2.301 -3.575 1.00 0.00 H new ATOM 0 HG LEU A 108 8.371 4.391 -2.192 1.00 0.00 H new ATOM 0 HD11 LEU A 108 6.874 3.897 -0.245 1.00 0.00 H new ATOM 0 HD12 LEU A 108 5.944 4.521 -1.628 1.00 0.00 H new ATOM 0 HD13 LEU A 108 5.937 2.779 -1.264 1.00 0.00 H new ATOM 0 HD21 LEU A 108 8.923 2.587 -0.600 1.00 0.00 H new ATOM 0 HD22 LEU A 108 7.997 1.433 -1.590 1.00 0.00 H new ATOM 0 HD23 LEU A 108 9.466 2.191 -2.248 1.00 0.00 H new ATOM 1677 N LEU A 109 7.106 3.172 -6.651 1.00 0.00 N ATOM 1678 CA LEU A 109 6.536 2.637 -7.881 1.00 0.00 C ATOM 1679 C LEU A 109 7.603 2.428 -8.948 1.00 0.00 C ATOM 1680 O LEU A 109 7.688 1.336 -9.507 1.00 0.00 O ATOM 1681 CB LEU A 109 5.445 3.563 -8.422 1.00 0.00 C ATOM 1682 CG LEU A 109 4.193 3.611 -7.542 1.00 0.00 C ATOM 1683 CD1 LEU A 109 3.241 4.686 -8.063 1.00 0.00 C ATOM 1684 CD2 LEU A 109 3.457 2.274 -7.584 1.00 0.00 C ATOM 0 H LEU A 109 6.847 4.136 -6.442 1.00 0.00 H new ATOM 0 HA LEU A 109 6.098 1.669 -7.638 1.00 0.00 H new ATOM 0 HB2 LEU A 109 5.850 4.570 -8.519 1.00 0.00 H new ATOM 0 HB3 LEU A 109 5.164 3.234 -9.423 1.00 0.00 H new ATOM 0 HG LEU A 109 4.504 3.831 -6.521 1.00 0.00 H new ATOM 0 HD11 LEU A 109 2.350 4.719 -7.435 1.00 0.00 H new ATOM 0 HD12 LEU A 109 3.738 5.656 -8.038 1.00 0.00 H new ATOM 0 HD13 LEU A 109 2.954 4.452 -9.088 1.00 0.00 H new ATOM 0 HD21 LEU A 109 2.570 2.327 -6.953 1.00 0.00 H new ATOM 0 HD22 LEU A 109 3.160 2.054 -8.609 1.00 0.00 H new ATOM 0 HD23 LEU A 109 4.115 1.485 -7.220 1.00 0.00 H new ATOM 1696 N SER A 110 8.416 3.451 -9.243 1.00 0.00 N ATOM 1697 CA SER A 110 9.421 3.308 -10.287 1.00 0.00 C ATOM 1698 C SER A 110 10.332 2.107 -10.034 1.00 0.00 C ATOM 1699 O SER A 110 10.529 1.299 -10.940 1.00 0.00 O ATOM 1700 CB SER A 110 10.232 4.596 -10.441 1.00 0.00 C ATOM 1701 OG SER A 110 10.897 4.921 -9.242 1.00 0.00 O ATOM 0 H SER A 110 8.395 4.361 -8.783 1.00 0.00 H new ATOM 0 HA SER A 110 8.898 3.123 -11.225 1.00 0.00 H new ATOM 0 HB2 SER A 110 10.960 4.478 -11.244 1.00 0.00 H new ATOM 0 HB3 SER A 110 9.571 5.414 -10.728 1.00 0.00 H new ATOM 0 HG SER A 110 10.334 5.518 -8.707 1.00 0.00 H new ATOM 1707 N ASP A 111 10.894 1.964 -8.827 1.00 0.00 N ATOM 1708 CA ASP A 111 11.790 0.850 -8.548 1.00 0.00 C ATOM 1709 C ASP A 111 11.037 -0.477 -8.506 1.00 0.00 C ATOM 1710 O ASP A 111 11.496 -1.450 -9.091 1.00 0.00 O ATOM 1711 CB ASP A 111 12.554 1.073 -7.239 1.00 0.00 C ATOM 1712 CG ASP A 111 13.519 2.254 -7.327 1.00 0.00 C ATOM 1713 OD1 ASP A 111 14.046 2.497 -8.437 1.00 0.00 O ATOM 1714 OD2 ASP A 111 13.724 2.907 -6.281 1.00 0.00 O ATOM 0 H ASP A 111 10.743 2.599 -8.043 1.00 0.00 H new ATOM 0 HA ASP A 111 12.511 0.802 -9.364 1.00 0.00 H new ATOM 0 HB2 ASP A 111 11.843 1.246 -6.431 1.00 0.00 H new ATOM 0 HB3 ASP A 111 13.110 0.170 -6.987 1.00 0.00 H new ATOM 1719 N ALA A 112 9.892 -0.529 -7.822 1.00 0.00 N ATOM 1720 CA ALA A 112 9.112 -1.755 -7.696 1.00 0.00 C ATOM 1721 C ALA A 112 8.848 -2.375 -9.061 1.00 0.00 C ATOM 1722 O ALA A 112 9.186 -3.536 -9.285 1.00 0.00 O ATOM 1723 CB ALA A 112 7.771 -1.430 -7.039 1.00 0.00 C ATOM 0 H ALA A 112 9.484 0.274 -7.344 1.00 0.00 H new ATOM 0 HA ALA A 112 9.678 -2.463 -7.090 1.00 0.00 H new ATOM 0 HB1 ALA A 112 7.183 -2.343 -6.942 1.00 0.00 H new ATOM 0 HB2 ALA A 112 7.944 -1.003 -6.051 1.00 0.00 H new ATOM 0 HB3 ALA A 112 7.229 -0.713 -7.655 1.00 0.00 H new ATOM 1729 N ILE A 113 8.250 -1.606 -9.970 1.00 0.00 N ATOM 1730 CA ILE A 113 7.910 -2.098 -11.292 1.00 0.00 C ATOM 1731 C ILE A 113 9.164 -2.342 -12.117 1.00 0.00 C ATOM 1732 O ILE A 113 9.218 -3.300 -12.884 1.00 0.00 O ATOM 1733 CB ILE A 113 7.029 -1.074 -12.003 1.00 0.00 C ATOM 1734 CG1 ILE A 113 5.858 -0.633 -11.122 1.00 0.00 C ATOM 1735 CG2 ILE A 113 6.445 -1.732 -13.251 1.00 0.00 C ATOM 1736 CD1 ILE A 113 5.211 0.656 -11.623 1.00 0.00 C ATOM 0 H ILE A 113 7.992 -0.633 -9.807 1.00 0.00 H new ATOM 0 HA ILE A 113 7.375 -3.041 -11.184 1.00 0.00 H new ATOM 0 HB ILE A 113 7.640 -0.203 -12.243 1.00 0.00 H new ATOM 0 HG12 ILE A 113 5.110 -1.425 -11.092 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.209 -0.488 -10.100 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.811 -1.018 -13.776 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.255 -2.049 -13.908 1.00 0.00 H new ATOM 0 HG23 ILE A 113 5.852 -2.599 -12.961 1.00 0.00 H new ATOM 0 HD11 ILE A 113 4.385 0.928 -10.965 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.951 1.457 -11.627 1.00 0.00 H new ATOM 0 HD13 ILE A 113 4.834 0.505 -12.635 1.00 0.00 H new ATOM 1748 N ALA A 114 10.178 -1.482 -11.972 1.00 0.00 N ATOM 1749 CA ALA A 114 11.386 -1.643 -12.755 1.00 0.00 C ATOM 1750 C ALA A 114 12.194 -2.850 -12.280 1.00 0.00 C ATOM 1751 O ALA A 114 13.010 -3.379 -13.037 1.00 0.00 O ATOM 1752 CB ALA A 114 12.231 -0.372 -12.672 1.00 0.00 C ATOM 0 H ALA A 114 10.179 -0.688 -11.332 1.00 0.00 H new ATOM 0 HA ALA A 114 11.102 -1.818 -13.793 1.00 0.00 H new ATOM 0 HB1 ALA A 114 13.138 -0.499 -13.263 1.00 0.00 H new ATOM 0 HB2 ALA A 114 11.660 0.471 -13.061 1.00 0.00 H new ATOM 0 HB3 ALA A 114 12.499 -0.180 -11.633 1.00 0.00 H new ATOM 1758 N LYS A 115 11.973 -3.289 -11.036 1.00 0.00 N ATOM 1759 CA LYS A 115 12.741 -4.370 -10.437 1.00 0.00 C ATOM 1760 C LYS A 115 12.007 -5.705 -10.521 1.00 0.00 C ATOM 1761 O LYS A 115 12.610 -6.756 -10.319 1.00 0.00 O ATOM 1762 CB LYS A 115 13.127 -3.980 -9.007 1.00 0.00 C ATOM 1763 CG LYS A 115 12.105 -4.387 -7.942 1.00 0.00 C ATOM 1764 CD LYS A 115 12.819 -5.187 -6.859 1.00 0.00 C ATOM 1765 CE LYS A 115 13.368 -6.499 -7.431 1.00 0.00 C ATOM 1766 NZ LYS A 115 14.168 -7.233 -6.431 1.00 0.00 N ATOM 0 H LYS A 115 11.256 -2.901 -10.422 1.00 0.00 H new ATOM 0 HA LYS A 115 13.660 -4.519 -11.004 1.00 0.00 H new ATOM 0 HB2 LYS A 115 14.087 -4.437 -8.765 1.00 0.00 H new ATOM 0 HB3 LYS A 115 13.268 -2.900 -8.964 1.00 0.00 H new ATOM 0 HG2 LYS A 115 11.636 -3.502 -7.511 1.00 0.00 H new ATOM 0 HG3 LYS A 115 11.310 -4.983 -8.390 1.00 0.00 H new ATOM 0 HD2 LYS A 115 13.635 -4.597 -6.441 1.00 0.00 H new ATOM 0 HD3 LYS A 115 12.129 -5.400 -6.042 1.00 0.00 H new ATOM 0 HE2 LYS A 115 12.541 -7.125 -7.767 1.00 0.00 H new ATOM 0 HE3 LYS A 115 13.983 -6.287 -8.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 14.849 -7.851 -6.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 14.681 -6.555 -5.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 13.538 -7.811 -5.839 1.00 0.00 H new ATOM 1780 N SER A 116 10.706 -5.667 -10.814 1.00 0.00 N ATOM 1781 CA SER A 116 9.858 -6.845 -10.804 1.00 0.00 C ATOM 1782 C SER A 116 9.922 -7.624 -12.113 1.00 0.00 C ATOM 1783 O SER A 116 10.451 -7.143 -13.113 1.00 0.00 O ATOM 1784 CB SER A 116 8.431 -6.425 -10.456 1.00 0.00 C ATOM 1785 OG SER A 116 7.926 -5.535 -11.426 1.00 0.00 O ATOM 0 H SER A 116 10.215 -4.809 -11.066 1.00 0.00 H new ATOM 0 HA SER A 116 10.226 -7.532 -10.042 1.00 0.00 H new ATOM 0 HB2 SER A 116 7.792 -7.306 -10.394 1.00 0.00 H new ATOM 0 HB3 SER A 116 8.415 -5.950 -9.475 1.00 0.00 H new ATOM 0 HG SER A 116 7.011 -5.277 -11.188 1.00 0.00 H new ATOM 1791 N ASN A 117 9.372 -8.841 -12.095 1.00 0.00 N ATOM 1792 CA ASN A 117 9.349 -9.712 -13.260 1.00 0.00 C ATOM 1793 C ASN A 117 8.117 -9.384 -14.096 1.00 0.00 C ATOM 1794 O ASN A 117 7.298 -8.574 -13.676 1.00 0.00 O ATOM 1795 CB ASN A 117 9.386 -11.170 -12.799 1.00 0.00 C ATOM 1796 CG ASN A 117 8.193 -11.504 -11.915 1.00 0.00 C ATOM 1797 OD1 ASN A 117 7.102 -11.761 -12.413 1.00 0.00 O ATOM 1798 ND2 ASN A 117 8.389 -11.503 -10.598 1.00 0.00 N ATOM 0 H ASN A 117 8.931 -9.245 -11.269 1.00 0.00 H new ATOM 0 HA ASN A 117 10.224 -9.553 -13.891 1.00 0.00 H new ATOM 0 HB2 ASN A 117 9.392 -11.828 -13.668 1.00 0.00 H new ATOM 0 HB3 ASN A 117 10.310 -11.357 -12.252 1.00 0.00 H new ATOM 0 HD21 ASN A 117 7.617 -11.721 -9.967 1.00 0.00 H new ATOM 0 HD22 ASN A 117 9.311 -11.284 -10.220 1.00 0.00 H new ATOM 1805 N GLN A 118 7.964 -9.994 -15.274 1.00 0.00 N ATOM 1806 CA GLN A 118 6.863 -9.661 -16.164 1.00 0.00 C ATOM 1807 C GLN A 118 5.503 -9.815 -15.478 1.00 0.00 C ATOM 1808 O GLN A 118 4.621 -8.982 -15.683 1.00 0.00 O ATOM 1809 CB GLN A 118 6.924 -10.535 -17.421 1.00 0.00 C ATOM 1810 CG GLN A 118 8.156 -10.209 -18.275 1.00 0.00 C ATOM 1811 CD GLN A 118 8.087 -8.818 -18.901 1.00 0.00 C ATOM 1812 OE1 GLN A 118 7.083 -8.115 -18.806 1.00 0.00 O ATOM 1813 NE2 GLN A 118 9.171 -8.405 -19.554 1.00 0.00 N ATOM 0 H GLN A 118 8.589 -10.718 -15.628 1.00 0.00 H new ATOM 0 HA GLN A 118 6.970 -8.613 -16.443 1.00 0.00 H new ATOM 0 HB2 GLN A 118 6.947 -11.586 -17.133 1.00 0.00 H new ATOM 0 HB3 GLN A 118 6.021 -10.386 -18.013 1.00 0.00 H new ATOM 0 HG2 GLN A 118 9.051 -10.281 -17.657 1.00 0.00 H new ATOM 0 HG3 GLN A 118 8.253 -10.954 -19.065 1.00 0.00 H new ATOM 0 HE21 GLN A 118 9.990 -9.010 -19.617 1.00 0.00 H new ATOM 0 HE22 GLN A 118 9.183 -7.484 -19.992 1.00 0.00 H new ATOM 1822 N ASP A 119 5.312 -10.860 -14.668 1.00 0.00 N ATOM 1823 CA ASP A 119 4.035 -11.068 -14.002 1.00 0.00 C ATOM 1824 C ASP A 119 3.819 -10.036 -12.899 1.00 0.00 C ATOM 1825 O ASP A 119 2.721 -9.502 -12.760 1.00 0.00 O ATOM 1826 CB ASP A 119 3.960 -12.482 -13.425 1.00 0.00 C ATOM 1827 CG ASP A 119 3.910 -13.546 -14.516 1.00 0.00 C ATOM 1828 OD1 ASP A 119 4.960 -13.776 -15.156 1.00 0.00 O ATOM 1829 OD2 ASP A 119 2.814 -14.121 -14.699 1.00 0.00 O ATOM 0 H ASP A 119 6.020 -11.565 -14.463 1.00 0.00 H new ATOM 0 HA ASP A 119 3.244 -10.947 -14.742 1.00 0.00 H new ATOM 0 HB2 ASP A 119 4.826 -12.659 -12.787 1.00 0.00 H new ATOM 0 HB3 ASP A 119 3.076 -12.569 -12.794 1.00 0.00 H new ATOM 1834 N HIS A 120 4.856 -9.745 -12.109 1.00 0.00 N ATOM 1835 CA HIS A 120 4.732 -8.794 -11.013 1.00 0.00 C ATOM 1836 C HIS A 120 4.595 -7.371 -11.551 1.00 0.00 C ATOM 1837 O HIS A 120 3.778 -6.601 -11.048 1.00 0.00 O ATOM 1838 CB HIS A 120 5.901 -8.966 -10.051 1.00 0.00 C ATOM 1839 CG HIS A 120 5.748 -10.183 -9.173 1.00 0.00 C ATOM 1840 ND1 HIS A 120 5.887 -10.193 -7.782 1.00 0.00 N ATOM 1841 CD2 HIS A 120 5.454 -11.448 -9.601 1.00 0.00 C ATOM 1842 CE1 HIS A 120 5.668 -11.464 -7.409 1.00 0.00 C ATOM 1843 NE2 HIS A 120 5.411 -12.238 -8.477 1.00 0.00 N ATOM 0 H HIS A 120 5.785 -10.155 -12.211 1.00 0.00 H new ATOM 0 HA HIS A 120 3.821 -8.992 -10.448 1.00 0.00 H new ATOM 0 HB2 HIS A 120 6.827 -9.046 -10.620 1.00 0.00 H new ATOM 0 HB3 HIS A 120 5.987 -8.078 -9.425 1.00 0.00 H new ATOM 0 HD2 HIS A 120 5.288 -11.764 -10.620 1.00 0.00 H new ATOM 0 HE1 HIS A 120 5.695 -11.817 -6.389 1.00 0.00 H new ATOM 0 HE2 HIS A 120 5.217 -13.239 -8.457 1.00 0.00 H new ATOM 1851 N LYS A 121 5.382 -7.010 -12.570 1.00 0.00 N ATOM 1852 CA LYS A 121 5.174 -5.759 -13.292 1.00 0.00 C ATOM 1853 C LYS A 121 3.723 -5.665 -13.726 1.00 0.00 C ATOM 1854 O LYS A 121 3.082 -4.646 -13.494 1.00 0.00 O ATOM 1855 CB LYS A 121 6.060 -5.726 -14.541 1.00 0.00 C ATOM 1856 CG LYS A 121 5.657 -4.620 -15.525 1.00 0.00 C ATOM 1857 CD LYS A 121 5.682 -5.150 -16.962 1.00 0.00 C ATOM 1858 CE LYS A 121 4.537 -6.141 -17.213 1.00 0.00 C ATOM 1859 NZ LYS A 121 4.617 -6.701 -18.577 1.00 0.00 N ATOM 0 H LYS A 121 6.166 -7.567 -12.910 1.00 0.00 H new ATOM 0 HA LYS A 121 5.428 -4.925 -12.638 1.00 0.00 H new ATOM 0 HB2 LYS A 121 7.098 -5.579 -14.241 1.00 0.00 H new ATOM 0 HB3 LYS A 121 6.007 -6.691 -15.044 1.00 0.00 H new ATOM 0 HG2 LYS A 121 4.659 -4.254 -15.283 1.00 0.00 H new ATOM 0 HG3 LYS A 121 6.338 -3.774 -15.430 1.00 0.00 H new ATOM 0 HD2 LYS A 121 5.604 -4.317 -17.660 1.00 0.00 H new ATOM 0 HD3 LYS A 121 6.637 -5.639 -17.155 1.00 0.00 H new ATOM 0 HE2 LYS A 121 4.581 -6.947 -16.481 1.00 0.00 H new ATOM 0 HE3 LYS A 121 3.579 -5.639 -17.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 3.814 -7.342 -18.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 4.586 -5.928 -19.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 5.507 -7.228 -18.684 1.00 0.00 H new ATOM 1873 N GLU A 122 3.208 -6.721 -14.355 1.00 0.00 N ATOM 1874 CA GLU A 122 1.860 -6.687 -14.887 1.00 0.00 C ATOM 1875 C GLU A 122 0.832 -6.461 -13.781 1.00 0.00 C ATOM 1876 O GLU A 122 -0.148 -5.751 -13.989 1.00 0.00 O ATOM 1877 CB GLU A 122 1.594 -7.987 -15.639 1.00 0.00 C ATOM 1878 CG GLU A 122 0.232 -7.881 -16.304 1.00 0.00 C ATOM 1879 CD GLU A 122 -0.091 -9.130 -17.122 1.00 0.00 C ATOM 1880 OE1 GLU A 122 0.377 -9.192 -18.281 1.00 0.00 O ATOM 1881 OE2 GLU A 122 -0.798 -10.008 -16.581 1.00 0.00 O ATOM 0 H GLU A 122 3.704 -7.600 -14.504 1.00 0.00 H new ATOM 0 HA GLU A 122 1.765 -5.848 -15.577 1.00 0.00 H new ATOM 0 HB2 GLU A 122 2.369 -8.160 -16.386 1.00 0.00 H new ATOM 0 HB3 GLU A 122 1.617 -8.834 -14.954 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -0.535 -7.735 -15.543 1.00 0.00 H new ATOM 0 HG3 GLU A 122 0.210 -7.005 -16.952 1.00 0.00 H new ATOM 1888 N LYS A 123 1.047 -7.056 -12.605 1.00 0.00 N ATOM 1889 CA LYS A 123 0.174 -6.825 -11.465 1.00 0.00 C ATOM 1890 C LYS A 123 0.206 -5.363 -11.023 1.00 0.00 C ATOM 1891 O LYS A 123 -0.842 -4.785 -10.734 1.00 0.00 O ATOM 1892 CB LYS A 123 0.602 -7.726 -10.302 1.00 0.00 C ATOM 1893 CG LYS A 123 0.241 -9.200 -10.524 1.00 0.00 C ATOM 1894 CD LYS A 123 -1.265 -9.437 -10.677 1.00 0.00 C ATOM 1895 CE LYS A 123 -2.035 -8.891 -9.473 1.00 0.00 C ATOM 1896 NZ LYS A 123 -3.483 -9.142 -9.606 1.00 0.00 N ATOM 0 H LYS A 123 1.818 -7.699 -12.423 1.00 0.00 H new ATOM 0 HA LYS A 123 -0.847 -7.063 -11.765 1.00 0.00 H new ATOM 0 HB2 LYS A 123 1.679 -7.639 -10.159 1.00 0.00 H new ATOM 0 HB3 LYS A 123 0.129 -7.376 -9.385 1.00 0.00 H new ATOM 0 HG2 LYS A 123 0.752 -9.562 -11.417 1.00 0.00 H new ATOM 0 HG3 LYS A 123 0.611 -9.788 -9.684 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -1.621 -8.956 -11.588 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -1.459 -10.504 -10.783 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -1.665 -9.357 -8.560 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -1.856 -7.820 -9.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -3.936 -9.065 -8.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -3.899 -8.441 -10.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -3.636 -10.097 -9.987 1.00 0.00 H new ATOM 1910 N ILE A 124 1.393 -4.748 -10.963 1.00 0.00 N ATOM 1911 CA ILE A 124 1.464 -3.343 -10.583 1.00 0.00 C ATOM 1912 C ILE A 124 0.868 -2.493 -11.703 1.00 0.00 C ATOM 1913 O ILE A 124 0.249 -1.463 -11.438 1.00 0.00 O ATOM 1914 CB ILE A 124 2.908 -2.934 -10.260 1.00 0.00 C ATOM 1915 CG1 ILE A 124 3.493 -3.835 -9.162 1.00 0.00 C ATOM 1916 CG2 ILE A 124 2.904 -1.477 -9.779 1.00 0.00 C ATOM 1917 CD1 ILE A 124 4.994 -3.600 -8.975 1.00 0.00 C ATOM 0 H ILE A 124 2.290 -5.190 -11.167 1.00 0.00 H new ATOM 0 HA ILE A 124 0.883 -3.180 -9.675 1.00 0.00 H new ATOM 0 HB ILE A 124 3.523 -3.040 -11.154 1.00 0.00 H new ATOM 0 HG12 ILE A 124 2.975 -3.645 -8.222 1.00 0.00 H new ATOM 0 HG13 ILE A 124 3.318 -4.880 -9.417 1.00 0.00 H new ATOM 0 HG21 ILE A 124 3.923 -1.168 -9.544 1.00 0.00 H new ATOM 0 HG22 ILE A 124 2.502 -0.836 -10.564 1.00 0.00 H new ATOM 0 HG23 ILE A 124 2.284 -1.390 -8.887 1.00 0.00 H new ATOM 0 HD11 ILE A 124 5.370 -4.256 -8.190 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.515 -3.815 -9.908 1.00 0.00 H new ATOM 0 HD13 ILE A 124 5.167 -2.561 -8.694 1.00 0.00 H new ATOM 1929 N ARG A 125 1.049 -2.919 -12.959 1.00 0.00 N ATOM 1930 CA ARG A 125 0.493 -2.228 -14.115 1.00 0.00 C ATOM 1931 C ARG A 125 -1.032 -2.279 -14.057 1.00 0.00 C ATOM 1932 O ARG A 125 -1.691 -1.320 -14.450 1.00 0.00 O ATOM 1933 CB ARG A 125 1.063 -2.862 -15.391 1.00 0.00 C ATOM 1934 CG ARG A 125 0.731 -2.048 -16.644 1.00 0.00 C ATOM 1935 CD ARG A 125 -0.631 -2.417 -17.240 1.00 0.00 C ATOM 1936 NE ARG A 125 -0.962 -1.535 -18.361 1.00 0.00 N ATOM 1937 CZ ARG A 125 -1.444 -0.295 -18.225 1.00 0.00 C ATOM 1938 NH1 ARG A 125 -1.672 0.225 -17.020 1.00 0.00 N ATOM 1939 NH2 ARG A 125 -1.704 0.439 -19.304 1.00 0.00 N ATOM 0 H ARG A 125 1.586 -3.753 -13.196 1.00 0.00 H new ATOM 0 HA ARG A 125 0.774 -1.175 -14.115 1.00 0.00 H new ATOM 0 HB2 ARG A 125 2.145 -2.953 -15.296 1.00 0.00 H new ATOM 0 HB3 ARG A 125 0.666 -3.871 -15.501 1.00 0.00 H new ATOM 0 HG2 ARG A 125 0.740 -0.986 -16.397 1.00 0.00 H new ATOM 0 HG3 ARG A 125 1.507 -2.207 -17.393 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -0.617 -3.453 -17.578 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -1.401 -2.343 -16.473 1.00 0.00 H new ATOM 0 HE ARG A 125 -0.816 -1.889 -19.306 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -1.479 -0.324 -16.183 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -2.040 1.173 -16.935 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -1.536 0.056 -20.234 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -2.072 1.385 -19.201 1.00 0.00 H new ATOM 1953 N MET A 126 -1.592 -3.391 -13.567 1.00 0.00 N ATOM 1954 CA MET A 126 -3.028 -3.540 -13.372 1.00 0.00 C ATOM 1955 C MET A 126 -3.517 -2.585 -12.289 1.00 0.00 C ATOM 1956 O MET A 126 -4.551 -1.942 -12.450 1.00 0.00 O ATOM 1957 CB MET A 126 -3.336 -4.990 -12.989 1.00 0.00 C ATOM 1958 CG MET A 126 -4.788 -5.162 -12.537 1.00 0.00 C ATOM 1959 SD MET A 126 -5.183 -6.828 -11.955 1.00 0.00 S ATOM 1960 CE MET A 126 -6.825 -6.520 -11.255 1.00 0.00 C ATOM 0 H MET A 126 -1.054 -4.214 -13.295 1.00 0.00 H new ATOM 0 HA MET A 126 -3.548 -3.295 -14.298 1.00 0.00 H new ATOM 0 HB2 MET A 126 -3.141 -5.640 -13.842 1.00 0.00 H new ATOM 0 HB3 MET A 126 -2.666 -5.305 -12.189 1.00 0.00 H new ATOM 0 HG2 MET A 126 -4.996 -4.450 -11.738 1.00 0.00 H new ATOM 0 HG3 MET A 126 -5.449 -4.912 -13.367 1.00 0.00 H new ATOM 0 HE1 MET A 126 -7.226 -7.447 -10.846 1.00 0.00 H new ATOM 0 HE2 MET A 126 -6.749 -5.776 -10.462 1.00 0.00 H new ATOM 0 HE3 MET A 126 -7.490 -6.151 -12.036 1.00 0.00 H new ATOM 1970 N LEU A 127 -2.778 -2.482 -11.180 1.00 0.00 N ATOM 1971 CA LEU A 127 -3.139 -1.541 -10.130 1.00 0.00 C ATOM 1972 C LEU A 127 -3.177 -0.123 -10.700 1.00 0.00 C ATOM 1973 O LEU A 127 -4.073 0.653 -10.376 1.00 0.00 O ATOM 1974 CB LEU A 127 -2.147 -1.698 -8.970 1.00 0.00 C ATOM 1975 CG LEU A 127 -2.462 -0.793 -7.767 1.00 0.00 C ATOM 1976 CD1 LEU A 127 -1.865 -1.417 -6.507 1.00 0.00 C ATOM 1977 CD2 LEU A 127 -1.845 0.598 -7.913 1.00 0.00 C ATOM 0 H LEU A 127 -1.940 -3.032 -10.993 1.00 0.00 H new ATOM 0 HA LEU A 127 -4.137 -1.746 -9.742 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -2.145 -2.737 -8.642 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -1.142 -1.475 -9.329 1.00 0.00 H new ATOM 0 HG LEU A 127 -3.546 -0.699 -7.710 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.083 -0.782 -5.648 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -2.300 -2.404 -6.349 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -0.785 -1.511 -6.624 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -2.095 1.200 -7.040 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.762 0.509 -7.994 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -2.238 1.078 -8.809 1.00 0.00 H new ATOM 1989 N LEU A 128 -2.204 0.214 -11.553 1.00 0.00 N ATOM 1990 CA LEU A 128 -2.146 1.522 -12.187 1.00 0.00 C ATOM 1991 C LEU A 128 -3.252 1.700 -13.224 1.00 0.00 C ATOM 1992 O LEU A 128 -3.723 2.816 -13.429 1.00 0.00 O ATOM 1993 CB LEU A 128 -0.773 1.690 -12.845 1.00 0.00 C ATOM 1994 CG LEU A 128 0.351 1.709 -11.808 1.00 0.00 C ATOM 1995 CD1 LEU A 128 1.684 1.561 -12.535 1.00 0.00 C ATOM 1996 CD2 LEU A 128 0.346 3.014 -11.015 1.00 0.00 C ATOM 0 H LEU A 128 -1.443 -0.412 -11.818 1.00 0.00 H new ATOM 0 HA LEU A 128 -2.296 2.285 -11.423 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -0.605 0.876 -13.550 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -0.755 2.617 -13.419 1.00 0.00 H new ATOM 0 HG LEU A 128 0.202 0.887 -11.108 1.00 0.00 H new ATOM 0 HD11 LEU A 128 2.497 1.573 -11.809 1.00 0.00 H new ATOM 0 HD12 LEU A 128 1.698 0.618 -13.081 1.00 0.00 H new ATOM 0 HD13 LEU A 128 1.810 2.387 -13.235 1.00 0.00 H new ATOM 0 HD21 LEU A 128 1.156 2.999 -10.285 1.00 0.00 H new ATOM 0 HD22 LEU A 128 0.486 3.854 -11.696 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -0.607 3.122 -10.497 1.00 0.00 H new ATOM 2008 N ASP A 129 -3.673 0.616 -13.883 1.00 0.00 N ATOM 2009 CA ASP A 129 -4.746 0.684 -14.864 1.00 0.00 C ATOM 2010 C ASP A 129 -6.064 1.012 -14.177 1.00 0.00 C ATOM 2011 O ASP A 129 -6.868 1.781 -14.698 1.00 0.00 O ATOM 2012 CB ASP A 129 -4.840 -0.648 -15.608 1.00 0.00 C ATOM 2013 CG ASP A 129 -5.894 -0.601 -16.706 1.00 0.00 C ATOM 2014 OD1 ASP A 129 -5.622 0.053 -17.738 1.00 0.00 O ATOM 2015 OD2 ASP A 129 -6.964 -1.218 -16.506 1.00 0.00 O ATOM 0 H ASP A 129 -3.283 -0.317 -13.751 1.00 0.00 H new ATOM 0 HA ASP A 129 -4.532 1.475 -15.583 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -3.871 -0.892 -16.043 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -5.083 -1.443 -14.903 1.00 0.00 H new ATOM 2512 N PRO B 160 -8.103 -13.477 1.216 1.00 0.00 N ATOM 2513 CA PRO B 160 -9.303 -13.422 0.395 1.00 0.00 C ATOM 2514 C PRO B 160 -9.055 -12.610 -0.879 1.00 0.00 C ATOM 2515 O PRO B 160 -10.001 -12.252 -1.573 1.00 0.00 O ATOM 2516 CB PRO B 160 -10.336 -12.719 1.277 1.00 0.00 C ATOM 2517 CG PRO B 160 -9.470 -11.710 2.026 1.00 0.00 C ATOM 2518 CD PRO B 160 -8.204 -12.516 2.299 1.00 0.00 C ATOM 0 HA PRO B 160 -9.627 -14.412 0.074 1.00 0.00 H new ATOM 0 HB2 PRO B 160 -11.114 -12.233 0.688 1.00 0.00 H new ATOM 0 HB3 PRO B 160 -10.835 -13.412 1.954 1.00 0.00 H new ATOM 0 HG2 PRO B 160 -9.267 -10.823 1.426 1.00 0.00 H new ATOM 0 HG3 PRO B 160 -9.944 -11.371 2.947 1.00 0.00 H new ATOM 0 HD2 PRO B 160 -7.328 -11.868 2.330 1.00 0.00 H new ATOM 0 HD3 PRO B 160 -8.262 -13.020 3.264 1.00 0.00 H new ATOM 2526 N SER B 161 -7.782 -12.323 -1.181 1.00 0.00 N ATOM 2527 CA SER B 161 -7.360 -11.418 -2.245 1.00 0.00 C ATOM 2528 C SER B 161 -7.839 -9.983 -2.005 1.00 0.00 C ATOM 2529 O SER B 161 -8.626 -9.716 -1.095 1.00 0.00 O ATOM 2530 CB SER B 161 -7.781 -11.976 -3.606 1.00 0.00 C ATOM 2531 OG SER B 161 -7.203 -11.219 -4.652 1.00 0.00 O ATOM 0 H SER B 161 -6.997 -12.730 -0.672 1.00 0.00 H new ATOM 0 HA SER B 161 -6.272 -11.358 -2.240 1.00 0.00 H new ATOM 0 HB2 SER B 161 -7.472 -13.018 -3.690 1.00 0.00 H new ATOM 0 HB3 SER B 161 -8.867 -11.957 -3.693 1.00 0.00 H new ATOM 0 HG SER B 161 -7.480 -11.589 -5.516 1.00 0.00 H new ATOM 2537 N TYR B 162 -7.355 -9.055 -2.832 1.00 0.00 N ATOM 2538 CA TYR B 162 -7.678 -7.641 -2.737 1.00 0.00 C ATOM 2539 C TYR B 162 -7.762 -7.022 -4.130 1.00 0.00 C ATOM 2540 O TYR B 162 -7.062 -7.444 -5.050 1.00 0.00 O ATOM 2541 CB TYR B 162 -6.602 -6.925 -1.914 1.00 0.00 C ATOM 2542 CG TYR B 162 -6.679 -5.413 -1.975 1.00 0.00 C ATOM 2543 CD1 TYR B 162 -7.460 -4.698 -1.050 1.00 0.00 C ATOM 2544 CD2 TYR B 162 -5.963 -4.719 -2.963 1.00 0.00 C ATOM 2545 CE1 TYR B 162 -7.526 -3.298 -1.121 1.00 0.00 C ATOM 2546 CE2 TYR B 162 -6.017 -3.321 -3.036 1.00 0.00 C ATOM 2547 CZ TYR B 162 -6.809 -2.600 -2.116 1.00 0.00 C ATOM 2548 OH TYR B 162 -6.885 -1.240 -2.181 1.00 0.00 O ATOM 0 H TYR B 162 -6.717 -9.274 -3.597 1.00 0.00 H new ATOM 0 HA TYR B 162 -8.645 -7.530 -2.247 1.00 0.00 H new ATOM 0 HB2 TYR B 162 -6.686 -7.240 -0.874 1.00 0.00 H new ATOM 0 HB3 TYR B 162 -5.620 -7.242 -2.265 1.00 0.00 H new ATOM 0 HD1 TYR B 162 -8.009 -5.226 -0.285 1.00 0.00 H new ATOM 0 HD2 TYR B 162 -5.364 -5.269 -3.674 1.00 0.00 H new ATOM 0 HE1 TYR B 162 -8.129 -2.752 -0.410 1.00 0.00 H new ATOM 0 HE2 TYR B 162 -5.454 -2.796 -3.794 1.00 0.00 H new ATOM 0 HH TYR B 162 -6.331 -0.916 -2.922 1.00 0.00 H new ATOM 2558 N SER B 163 -8.626 -6.015 -4.272 1.00 0.00 N ATOM 2559 CA SER B 163 -8.770 -5.260 -5.502 1.00 0.00 C ATOM 2560 C SER B 163 -8.567 -3.782 -5.202 1.00 0.00 C ATOM 2561 O SER B 163 -9.181 -3.265 -4.269 1.00 0.00 O ATOM 2562 CB SER B 163 -10.157 -5.479 -6.101 1.00 0.00 C ATOM 2563 OG SER B 163 -10.364 -4.541 -7.142 1.00 0.00 O ATOM 0 H SER B 163 -9.247 -5.704 -3.525 1.00 0.00 H new ATOM 0 HA SER B 163 -8.025 -5.599 -6.222 1.00 0.00 H new ATOM 0 HB2 SER B 163 -10.244 -6.495 -6.487 1.00 0.00 H new ATOM 0 HB3 SER B 163 -10.921 -5.363 -5.333 1.00 0.00 H new ATOM 0 HG SER B 163 -11.189 -4.041 -6.972 1.00 0.00 H new ATOM 2569 N PRO B 164 -7.720 -3.092 -5.974 1.00 0.00 N ATOM 2570 CA PRO B 164 -7.498 -1.664 -5.835 1.00 0.00 C ATOM 2571 C PRO B 164 -8.784 -0.846 -5.937 1.00 0.00 C ATOM 2572 O PRO B 164 -8.763 0.348 -5.638 1.00 0.00 O ATOM 2573 CB PRO B 164 -6.527 -1.295 -6.958 1.00 0.00 C ATOM 2574 CG PRO B 164 -5.797 -2.604 -7.246 1.00 0.00 C ATOM 2575 CD PRO B 164 -6.895 -3.638 -7.034 1.00 0.00 C ATOM 0 HA PRO B 164 -7.101 -1.436 -4.846 1.00 0.00 H new ATOM 0 HB2 PRO B 164 -7.054 -0.928 -7.839 1.00 0.00 H new ATOM 0 HB3 PRO B 164 -5.836 -0.510 -6.649 1.00 0.00 H new ATOM 0 HG2 PRO B 164 -5.400 -2.634 -8.261 1.00 0.00 H new ATOM 0 HG3 PRO B 164 -4.956 -2.759 -6.570 1.00 0.00 H new ATOM 0 HD2 PRO B 164 -7.473 -3.793 -7.945 1.00 0.00 H new ATOM 0 HD3 PRO B 164 -6.478 -4.605 -6.752 1.00 0.00 H new ATOM 2583 N THR B 165 -9.901 -1.459 -6.351 1.00 0.00 N ATOM 2584 CA THR B 165 -11.147 -0.723 -6.525 1.00 0.00 C ATOM 2585 C THR B 165 -11.796 -0.327 -5.197 1.00 0.00 C ATOM 2586 O THR B 165 -12.629 0.578 -5.188 1.00 0.00 O ATOM 2587 CB THR B 165 -12.137 -1.533 -7.364 1.00 0.00 C ATOM 2588 OG1 THR B 165 -12.421 -2.766 -6.743 1.00 0.00 O ATOM 2589 CG2 THR B 165 -11.582 -1.793 -8.762 1.00 0.00 C ATOM 0 H THR B 165 -9.961 -2.454 -6.568 1.00 0.00 H new ATOM 0 HA THR B 165 -10.890 0.199 -7.047 1.00 0.00 H new ATOM 0 HB THR B 165 -13.054 -0.949 -7.447 1.00 0.00 H new ATOM 0 HG1 THR B 165 -13.057 -3.270 -7.292 1.00 0.00 H new ATOM 0 HG21 THR B 165 -12.304 -2.371 -9.339 1.00 0.00 H new ATOM 0 HG22 THR B 165 -11.395 -0.843 -9.262 1.00 0.00 H new ATOM 0 HG23 THR B 165 -10.649 -2.352 -8.685 1.00 0.00 H new