USER MOD reduce.3.24.130724 H: found=0, std=0, add=1045, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1045 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 129 ASN : amide:sc= -0.468 X(o=-1.1,f=-1.4) USER MOD Set 1.2: A 132 GLN : amide:sc= -0.584 K(o=-1.1,f=-11!) USER MOD Set 2.1: A 27 THR OG1 : rot 120:sc= -1.13 USER MOD Set 2.2: A 59 ASN : amide:sc= -1.59 K(o=-2.7,f=-4.4!) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot -84:sc= 1.28 USER MOD Single : A 14 ASN : amide:sc= -0.0478 X(o=-0.048,f=-0.04) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot -174:sc= 0.0327 USER MOD Single : A 22 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00989) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot -81:sc= 1.68 USER MOD Single : A 41 SER OG : rot 92:sc= 0.182 USER MOD Single : A 45 GLN : amide:sc= -0.0872 X(o=-0.087,f=-0.47) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= -0.0264 X(o=-0.026,f=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 103:sc= 0.437 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -88:sc= -0.605 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 72 LYS NZ :NH3+ -146:sc= 1.54 (180deg=-0.011) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -0.221 K(o=-0.22,f=-4.7!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 136:sc= -0.331 USER MOD Single : A 85 ASN : amide:sc= 0.26 X(o=0.26,f=-0.096) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot -160:sc= -0.635 USER MOD Single : A 95 ASN : amide:sc= -0.0937 K(o=-0.094,f=-0.74) USER MOD Single : A 98 THR OG1 : rot 88:sc= 1.35 USER MOD Single : A 101 GLN : amide:sc= -0.0522 X(o=-0.052,f=-0.4) USER MOD Single : A 102 SER OG : rot 90:sc= 0.107 USER MOD Single : A 104 ASN : amide:sc= -0.0111 X(o=-0.011,f=0) USER MOD Single : A 106 SER OG : rot 180:sc= 0.0273 USER MOD Single : A 108 TYR OH : rot 79:sc= 0.659 USER MOD Single : A 110 SER OG : rot 104:sc= 0.767 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot -59:sc= 0.701 USER MOD Single : A 141 ASN : amide:sc= -0.392 K(o=-0.39,f=-3.4!) USER MOD ----------------------------------------------------------------- ATOM 123 N LEU A 9 8.105 9.369 8.698 1.00 33.02 N ATOM 124 CA LEU A 9 8.817 9.344 9.971 1.00 12.41 C ATOM 125 C LEU A 9 10.279 9.737 9.785 1.00 51.12 C ATOM 126 O LEU A 9 10.854 9.543 8.713 1.00 33.04 O ATOM 127 CB LEU A 9 8.727 7.954 10.602 1.00 72.44 C ATOM 128 CG LEU A 9 7.684 7.784 11.707 1.00 74.14 C ATOM 129 CD1 LEU A 9 7.941 8.765 12.839 1.00 5.15 C ATOM 130 CD2 LEU A 9 6.280 7.968 11.148 1.00 41.30 C ATOM 0 HA LEU A 9 8.347 10.069 10.636 1.00 12.41 H new ATOM 0 HB2 LEU A 9 8.513 7.232 9.814 1.00 72.44 H new ATOM 0 HB3 LEU A 9 9.705 7.699 11.011 1.00 72.44 H new ATOM 0 HG LEU A 9 7.766 6.772 12.105 1.00 74.14 H new ATOM 0 HD11 LEU A 9 7.189 8.629 13.616 1.00 5.15 H new ATOM 0 HD12 LEU A 9 8.931 8.586 13.258 1.00 5.15 H new ATOM 0 HD13 LEU A 9 7.887 9.784 12.456 1.00 5.15 H new ATOM 0 HD21 LEU A 9 5.551 7.844 11.948 1.00 41.30 H new ATOM 0 HD22 LEU A 9 6.186 8.967 10.723 1.00 41.30 H new ATOM 0 HD23 LEU A 9 6.097 7.225 10.372 1.00 41.30 H new ATOM 142 N LYS A 10 10.877 10.289 10.836 1.00 75.35 N ATOM 143 CA LYS A 10 12.273 10.706 10.790 1.00 31.15 C ATOM 144 C LYS A 10 13.106 9.928 11.804 1.00 42.10 C ATOM 145 O LYS A 10 12.576 9.386 12.775 1.00 41.24 O ATOM 146 CB LYS A 10 12.387 12.207 11.065 1.00 1.12 C ATOM 147 CG LYS A 10 11.811 12.625 12.407 1.00 51.41 C ATOM 148 CD LYS A 10 10.811 13.760 12.255 1.00 24.22 C ATOM 149 CE LYS A 10 10.893 14.734 13.420 1.00 10.13 C ATOM 150 NZ LYS A 10 10.114 14.258 14.597 1.00 25.21 N ATOM 0 H LYS A 10 10.416 10.458 11.730 1.00 75.35 H new ATOM 0 HA LYS A 10 12.657 10.495 9.792 1.00 31.15 H new ATOM 0 HB2 LYS A 10 13.437 12.497 11.024 1.00 1.12 H new ATOM 0 HB3 LYS A 10 11.874 12.753 10.273 1.00 1.12 H new ATOM 0 HG2 LYS A 10 11.324 11.771 12.877 1.00 51.41 H new ATOM 0 HG3 LYS A 10 12.619 12.936 13.070 1.00 51.41 H new ATOM 0 HD2 LYS A 10 11.000 14.290 11.322 1.00 24.22 H new ATOM 0 HD3 LYS A 10 9.802 13.352 12.191 1.00 24.22 H new ATOM 0 HE2 LYS A 10 11.936 14.871 13.706 1.00 10.13 H new ATOM 0 HE3 LYS A 10 10.518 15.708 13.106 1.00 10.13 H new ATOM 0 HZ1 LYS A 10 10.195 14.949 15.370 1.00 25.21 H new ATOM 0 HZ2 LYS A 10 9.114 14.151 14.331 1.00 25.21 H new ATOM 0 HZ3 LYS A 10 10.488 13.340 14.913 1.00 25.21 H new ATOM 164 N THR A 11 14.415 9.878 11.574 1.00 74.44 N ATOM 165 CA THR A 11 15.321 9.167 12.466 1.00 30.33 C ATOM 166 C THR A 11 16.204 10.138 13.242 1.00 55.25 C ATOM 167 O THR A 11 16.203 11.340 12.975 1.00 65.51 O ATOM 168 CB THR A 11 16.218 8.184 11.690 1.00 33.32 C ATOM 169 OG1 THR A 11 17.149 8.907 10.878 1.00 71.03 O ATOM 170 CG2 THR A 11 15.381 7.264 10.814 1.00 33.45 C ATOM 0 H THR A 11 14.871 10.322 10.777 1.00 74.44 H new ATOM 0 HA THR A 11 14.700 8.607 13.165 1.00 30.33 H new ATOM 0 HB THR A 11 16.763 7.576 12.412 1.00 33.32 H new ATOM 0 HG1 THR A 11 16.724 9.147 10.028 1.00 71.03 H new ATOM 0 HG21 THR A 11 16.036 6.579 10.276 1.00 33.45 H new ATOM 0 HG22 THR A 11 14.693 6.693 11.438 1.00 33.45 H new ATOM 0 HG23 THR A 11 14.813 7.860 10.099 1.00 33.45 H new ATOM 178 N ALA A 12 16.955 9.610 14.202 1.00 44.12 N ATOM 179 CA ALA A 12 17.845 10.431 15.014 1.00 52.00 C ATOM 180 C ALA A 12 19.064 10.877 14.214 1.00 71.14 C ATOM 181 O ALA A 12 19.824 11.741 14.652 1.00 60.52 O ATOM 182 CB ALA A 12 18.278 9.669 16.258 1.00 74.23 C ATOM 0 H ALA A 12 16.965 8.617 14.437 1.00 44.12 H new ATOM 0 HA ALA A 12 17.298 11.323 15.319 1.00 52.00 H new ATOM 0 HB1 ALA A 12 18.942 10.294 16.855 1.00 74.23 H new ATOM 0 HB2 ALA A 12 17.400 9.406 16.848 1.00 74.23 H new ATOM 0 HB3 ALA A 12 18.803 8.760 15.964 1.00 74.23 H new ATOM 188 N ASP A 13 19.244 10.282 13.039 1.00 5.45 N ATOM 189 CA ASP A 13 20.372 10.619 12.177 1.00 34.25 C ATOM 190 C ASP A 13 19.994 11.724 11.196 1.00 3.22 C ATOM 191 O ASP A 13 20.699 11.966 10.217 1.00 22.33 O ATOM 192 CB ASP A 13 20.844 9.381 11.414 1.00 63.04 C ATOM 193 CG ASP A 13 21.130 8.208 12.331 1.00 10.41 C ATOM 194 OD1 ASP A 13 21.937 8.372 13.270 1.00 44.21 O ATOM 195 OD2 ASP A 13 20.545 7.127 12.111 1.00 5.30 O ATOM 0 H ASP A 13 18.624 9.565 12.662 1.00 5.45 H new ATOM 0 HA ASP A 13 21.185 10.980 12.807 1.00 34.25 H new ATOM 0 HB2 ASP A 13 20.083 9.094 10.688 1.00 63.04 H new ATOM 0 HB3 ASP A 13 21.745 9.626 10.851 1.00 63.04 H new ATOM 200 N ASN A 14 18.877 12.391 11.465 1.00 12.44 N ATOM 201 CA ASN A 14 18.405 13.470 10.605 1.00 13.21 C ATOM 202 C ASN A 14 18.047 12.943 9.219 1.00 51.43 C ATOM 203 O ASN A 14 18.111 13.674 8.230 1.00 2.31 O ATOM 204 CB ASN A 14 19.471 14.562 10.489 1.00 73.42 C ATOM 205 CG ASN A 14 18.881 15.908 10.115 1.00 3.03 C ATOM 206 OD1 ASN A 14 19.093 16.406 9.009 1.00 20.53 O ATOM 207 ND2 ASN A 14 18.137 16.505 11.039 1.00 21.32 N ATOM 0 H ASN A 14 18.282 12.204 12.272 1.00 12.44 H new ATOM 0 HA ASN A 14 17.508 13.895 11.056 1.00 13.21 H new ATOM 0 HB2 ASN A 14 20.001 14.651 11.438 1.00 73.42 H new ATOM 0 HB3 ASN A 14 20.207 14.270 9.740 1.00 73.42 H new ATOM 0 HD21 ASN A 14 17.715 17.413 10.845 1.00 21.32 H new ATOM 0 HD22 ASN A 14 17.988 16.055 11.942 1.00 21.32 H new ATOM 214 N ARG A 15 17.670 11.671 9.155 1.00 74.35 N ATOM 215 CA ARG A 15 17.302 11.046 7.890 1.00 60.42 C ATOM 216 C ARG A 15 15.973 10.307 8.015 1.00 72.44 C ATOM 217 O ARG A 15 15.550 9.918 9.104 1.00 42.32 O ATOM 218 CB ARG A 15 18.396 10.076 7.438 1.00 2.45 C ATOM 219 CG ARG A 15 19.250 10.609 6.300 1.00 43.42 C ATOM 220 CD ARG A 15 20.020 9.493 5.611 1.00 5.45 C ATOM 221 NE ARG A 15 21.427 9.837 5.419 1.00 73.03 N ATOM 222 CZ ARG A 15 21.864 10.621 4.440 1.00 42.22 C ATOM 223 NH1 ARG A 15 21.009 11.141 3.570 1.00 61.43 N ATOM 224 NH2 ARG A 15 23.159 10.888 4.330 1.00 24.31 N ATOM 0 H ARG A 15 17.611 11.053 9.964 1.00 74.35 H new ATOM 0 HA ARG A 15 17.192 11.833 7.144 1.00 60.42 H new ATOM 0 HB2 ARG A 15 19.040 9.846 8.287 1.00 2.45 H new ATOM 0 HB3 ARG A 15 17.933 9.140 7.126 1.00 2.45 H new ATOM 0 HG2 ARG A 15 18.615 11.116 5.574 1.00 43.42 H new ATOM 0 HG3 ARG A 15 19.949 11.351 6.685 1.00 43.42 H new ATOM 0 HD2 ARG A 15 19.947 8.582 6.205 1.00 5.45 H new ATOM 0 HD3 ARG A 15 19.563 9.281 4.644 1.00 5.45 H new ATOM 0 HE ARG A 15 22.111 9.454 6.072 1.00 73.03 H new ATOM 0 HH11 ARG A 15 20.012 10.939 3.651 1.00 61.43 H new ATOM 0 HH12 ARG A 15 21.348 11.743 2.819 1.00 61.43 H new ATOM 0 HH21 ARG A 15 23.820 10.491 4.998 1.00 24.31 H new ATOM 0 HH22 ARG A 15 23.493 11.490 3.578 1.00 24.31 H new ATOM 238 N PRO A 16 15.297 10.108 6.873 1.00 32.43 N ATOM 239 CA PRO A 16 14.006 9.414 6.829 1.00 51.44 C ATOM 240 C PRO A 16 14.137 7.924 7.125 1.00 4.43 C ATOM 241 O PRO A 16 14.965 7.234 6.531 1.00 54.23 O ATOM 242 CB PRO A 16 13.535 9.633 5.389 1.00 44.35 C ATOM 243 CG PRO A 16 14.787 9.845 4.609 1.00 22.01 C ATOM 244 CD PRO A 16 15.741 10.543 5.539 1.00 53.43 C ATOM 0 HA PRO A 16 13.314 9.793 7.581 1.00 51.44 H new ATOM 0 HB2 PRO A 16 12.979 8.772 5.019 1.00 44.35 H new ATOM 0 HB3 PRO A 16 12.872 10.495 5.316 1.00 44.35 H new ATOM 0 HG2 PRO A 16 15.199 8.896 4.267 1.00 22.01 H new ATOM 0 HG3 PRO A 16 14.596 10.448 3.721 1.00 22.01 H new ATOM 0 HD2 PRO A 16 16.774 10.254 5.346 1.00 53.43 H new ATOM 0 HD3 PRO A 16 15.687 11.626 5.431 1.00 53.43 H new ATOM 252 N ALA A 17 13.316 7.435 8.048 1.00 30.22 N ATOM 253 CA ALA A 17 13.339 6.026 8.422 1.00 43.13 C ATOM 254 C ALA A 17 13.038 5.135 7.221 1.00 21.14 C ATOM 255 O ALA A 17 13.343 3.942 7.230 1.00 51.33 O ATOM 256 CB ALA A 17 12.344 5.760 9.542 1.00 42.44 C ATOM 0 H ALA A 17 12.626 7.994 8.551 1.00 30.22 H new ATOM 0 HA ALA A 17 14.341 5.786 8.778 1.00 43.13 H new ATOM 0 HB1 ALA A 17 12.372 4.704 9.811 1.00 42.44 H new ATOM 0 HB2 ALA A 17 12.605 6.363 10.412 1.00 42.44 H new ATOM 0 HB3 ALA A 17 11.340 6.022 9.207 1.00 42.44 H new ATOM 262 N SER A 18 12.437 5.721 6.191 1.00 44.22 N ATOM 263 CA SER A 18 12.091 4.979 4.985 1.00 73.33 C ATOM 264 C SER A 18 13.329 4.333 4.370 1.00 75.33 C ATOM 265 O SER A 18 13.253 3.254 3.780 1.00 15.54 O ATOM 266 CB SER A 18 11.424 5.904 3.965 1.00 63.14 C ATOM 267 OG SER A 18 12.363 6.374 3.013 1.00 61.02 O ATOM 0 H SER A 18 12.180 6.708 6.168 1.00 44.22 H new ATOM 0 HA SER A 18 11.391 4.191 5.262 1.00 73.33 H new ATOM 0 HB2 SER A 18 10.621 5.371 3.456 1.00 63.14 H new ATOM 0 HB3 SER A 18 10.969 6.750 4.480 1.00 63.14 H new ATOM 0 HG SER A 18 11.912 6.962 2.371 1.00 61.02 H new ATOM 273 N VAL A 19 14.469 5.000 4.512 1.00 41.55 N ATOM 274 CA VAL A 19 15.725 4.492 3.972 1.00 54.54 C ATOM 275 C VAL A 19 16.033 3.101 4.514 1.00 40.33 C ATOM 276 O VAL A 19 16.597 2.261 3.812 1.00 2.32 O ATOM 277 CB VAL A 19 16.899 5.432 4.303 1.00 41.44 C ATOM 278 CG1 VAL A 19 18.206 4.860 3.775 1.00 1.24 C ATOM 279 CG2 VAL A 19 16.647 6.820 3.733 1.00 11.32 C ATOM 0 H VAL A 19 14.549 5.894 4.997 1.00 41.55 H new ATOM 0 HA VAL A 19 15.606 4.439 2.890 1.00 54.54 H new ATOM 0 HB VAL A 19 16.979 5.518 5.387 1.00 41.44 H new ATOM 0 HG11 VAL A 19 19.024 5.538 4.018 1.00 1.24 H new ATOM 0 HG12 VAL A 19 18.390 3.889 4.235 1.00 1.24 H new ATOM 0 HG13 VAL A 19 18.141 4.743 2.693 1.00 1.24 H new ATOM 0 HG21 VAL A 19 17.487 7.471 3.976 1.00 11.32 H new ATOM 0 HG22 VAL A 19 16.540 6.755 2.650 1.00 11.32 H new ATOM 0 HG23 VAL A 19 15.733 7.230 4.164 1.00 11.32 H new ATOM 289 N TYR A 20 15.659 2.864 5.766 1.00 51.30 N ATOM 290 CA TYR A 20 15.897 1.575 6.404 1.00 62.12 C ATOM 291 C TYR A 20 14.932 0.518 5.874 1.00 4.51 C ATOM 292 O TYR A 20 15.090 -0.673 6.142 1.00 35.51 O ATOM 293 CB TYR A 20 15.753 1.699 7.922 1.00 74.45 C ATOM 294 CG TYR A 20 16.822 2.553 8.564 1.00 13.20 C ATOM 295 CD1 TYR A 20 18.168 2.243 8.417 1.00 41.24 C ATOM 296 CD2 TYR A 20 16.486 3.670 9.319 1.00 34.02 C ATOM 297 CE1 TYR A 20 19.148 3.021 9.002 1.00 25.43 C ATOM 298 CE2 TYR A 20 17.459 4.454 9.907 1.00 22.12 C ATOM 299 CZ TYR A 20 18.789 4.125 9.746 1.00 0.11 C ATOM 300 OH TYR A 20 19.762 4.903 10.331 1.00 32.25 O ATOM 0 H TYR A 20 15.190 3.548 6.360 1.00 51.30 H new ATOM 0 HA TYR A 20 16.914 1.263 6.167 1.00 62.12 H new ATOM 0 HB2 TYR A 20 14.775 2.122 8.152 1.00 74.45 H new ATOM 0 HB3 TYR A 20 15.782 0.703 8.364 1.00 74.45 H new ATOM 0 HD1 TYR A 20 18.453 1.379 7.835 1.00 41.24 H new ATOM 0 HD2 TYR A 20 15.446 3.930 9.448 1.00 34.02 H new ATOM 0 HE1 TYR A 20 20.190 2.766 8.877 1.00 25.43 H new ATOM 0 HE2 TYR A 20 17.180 5.320 10.490 1.00 22.12 H new ATOM 0 HH TYR A 20 19.340 5.587 10.892 1.00 32.25 H new ATOM 310 N LEU A 21 13.934 0.964 5.120 1.00 13.10 N ATOM 311 CA LEU A 21 12.942 0.058 4.550 1.00 11.55 C ATOM 312 C LEU A 21 13.132 -0.079 3.043 1.00 22.34 C ATOM 313 O LEU A 21 13.047 0.901 2.303 1.00 0.15 O ATOM 314 CB LEU A 21 11.529 0.561 4.854 1.00 44.32 C ATOM 315 CG LEU A 21 11.407 1.570 5.997 1.00 60.32 C ATOM 316 CD1 LEU A 21 9.982 2.092 6.098 1.00 62.24 C ATOM 317 CD2 LEU A 21 11.841 0.940 7.312 1.00 34.24 C ATOM 0 H LEU A 21 13.790 1.947 4.889 1.00 13.10 H new ATOM 0 HA LEU A 21 13.078 -0.923 5.005 1.00 11.55 H new ATOM 0 HB2 LEU A 21 11.124 1.016 3.950 1.00 44.32 H new ATOM 0 HB3 LEU A 21 10.901 -0.299 5.087 1.00 44.32 H new ATOM 0 HG LEU A 21 12.066 2.412 5.786 1.00 60.32 H new ATOM 0 HD11 LEU A 21 9.914 2.809 6.917 1.00 62.24 H new ATOM 0 HD12 LEU A 21 9.707 2.581 5.164 1.00 62.24 H new ATOM 0 HD13 LEU A 21 9.303 1.261 6.286 1.00 62.24 H new ATOM 0 HD21 LEU A 21 11.748 1.672 8.114 1.00 34.24 H new ATOM 0 HD22 LEU A 21 11.208 0.080 7.530 1.00 34.24 H new ATOM 0 HD23 LEU A 21 12.879 0.616 7.235 1.00 34.24 H new ATOM 329 N LYS A 22 13.388 -1.303 2.594 1.00 23.21 N ATOM 330 CA LYS A 22 13.587 -1.572 1.175 1.00 43.32 C ATOM 331 C LYS A 22 13.875 -3.050 0.936 1.00 61.51 C ATOM 332 O LYS A 22 13.726 -3.876 1.837 1.00 25.20 O ATOM 333 CB LYS A 22 14.738 -0.723 0.631 1.00 44.25 C ATOM 334 CG LYS A 22 14.312 0.265 -0.442 1.00 32.32 C ATOM 335 CD LYS A 22 15.001 -0.018 -1.766 1.00 71.22 C ATOM 336 CE LYS A 22 14.555 0.956 -2.846 1.00 4.44 C ATOM 337 NZ LYS A 22 15.109 2.321 -2.623 1.00 53.05 N ATOM 0 H LYS A 22 13.463 -2.125 3.193 1.00 23.21 H new ATOM 0 HA LYS A 22 12.669 -1.310 0.649 1.00 43.32 H new ATOM 0 HB2 LYS A 22 15.196 -0.176 1.455 1.00 44.25 H new ATOM 0 HB3 LYS A 22 15.503 -1.383 0.222 1.00 44.25 H new ATOM 0 HG2 LYS A 22 13.231 0.215 -0.575 1.00 32.32 H new ATOM 0 HG3 LYS A 22 14.547 1.279 -0.118 1.00 32.32 H new ATOM 0 HD2 LYS A 22 16.081 0.050 -1.637 1.00 71.22 H new ATOM 0 HD3 LYS A 22 14.781 -1.038 -2.081 1.00 71.22 H new ATOM 0 HE2 LYS A 22 14.875 0.589 -3.821 1.00 4.44 H new ATOM 0 HE3 LYS A 22 13.466 1.004 -2.865 1.00 4.44 H new ATOM 0 HZ1 LYS A 22 14.825 2.943 -3.406 1.00 53.05 H new ATOM 0 HZ2 LYS A 22 14.743 2.702 -1.727 1.00 53.05 H new ATOM 0 HZ3 LYS A 22 16.147 2.272 -2.580 1.00 53.05 H new ATOM 351 N LYS A 23 14.289 -3.379 -0.283 1.00 41.53 N ATOM 352 CA LYS A 23 14.601 -4.757 -0.641 1.00 31.32 C ATOM 353 C LYS A 23 13.345 -5.623 -0.618 1.00 50.42 C ATOM 354 O LYS A 23 13.416 -6.830 -0.387 1.00 54.25 O ATOM 355 CB LYS A 23 15.646 -5.331 0.319 1.00 14.12 C ATOM 356 CG LYS A 23 16.287 -6.616 -0.176 1.00 54.44 C ATOM 357 CD LYS A 23 17.770 -6.430 -0.447 1.00 24.32 C ATOM 358 CE LYS A 23 18.011 -5.687 -1.752 1.00 75.31 C ATOM 359 NZ LYS A 23 19.128 -6.286 -2.534 1.00 11.14 N ATOM 0 H LYS A 23 14.416 -2.708 -1.041 1.00 41.53 H new ATOM 0 HA LYS A 23 15.005 -4.760 -1.653 1.00 31.32 H new ATOM 0 HB2 LYS A 23 16.425 -4.586 0.482 1.00 14.12 H new ATOM 0 HB3 LYS A 23 15.176 -5.518 1.285 1.00 14.12 H new ATOM 0 HG2 LYS A 23 16.147 -7.403 0.566 1.00 54.44 H new ATOM 0 HG3 LYS A 23 15.788 -6.945 -1.087 1.00 54.44 H new ATOM 0 HD2 LYS A 23 18.225 -5.878 0.376 1.00 24.32 H new ATOM 0 HD3 LYS A 23 18.258 -7.404 -0.486 1.00 24.32 H new ATOM 0 HE2 LYS A 23 17.100 -5.701 -2.351 1.00 75.31 H new ATOM 0 HE3 LYS A 23 18.237 -4.642 -1.539 1.00 75.31 H new ATOM 0 HZ1 LYS A 23 19.260 -5.751 -3.416 1.00 11.14 H new ATOM 0 HZ2 LYS A 23 20.003 -6.250 -1.973 1.00 11.14 H new ATOM 0 HZ3 LYS A 23 18.902 -7.276 -2.760 1.00 11.14 H new ATOM 373 N ASP A 24 12.198 -4.998 -0.860 1.00 73.33 N ATOM 374 CA ASP A 24 10.926 -5.712 -0.870 1.00 61.24 C ATOM 375 C ASP A 24 10.744 -6.516 0.414 1.00 52.35 C ATOM 376 O ASP A 24 10.089 -7.558 0.419 1.00 61.32 O ATOM 377 CB ASP A 24 10.848 -6.641 -2.083 1.00 54.43 C ATOM 378 CG ASP A 24 11.214 -5.937 -3.375 1.00 70.34 C ATOM 379 OD1 ASP A 24 12.420 -5.711 -3.607 1.00 4.24 O ATOM 380 OD2 ASP A 24 10.294 -5.614 -4.156 1.00 25.22 O ATOM 0 H ASP A 24 12.123 -3.999 -1.052 1.00 73.33 H new ATOM 0 HA ASP A 24 10.125 -4.976 -0.933 1.00 61.24 H new ATOM 0 HB2 ASP A 24 11.517 -7.488 -1.932 1.00 54.43 H new ATOM 0 HB3 ASP A 24 9.838 -7.043 -2.165 1.00 54.43 H new ATOM 385 N LYS A 25 11.328 -6.024 1.501 1.00 62.21 N ATOM 386 CA LYS A 25 11.231 -6.695 2.792 1.00 61.22 C ATOM 387 C LYS A 25 10.503 -5.820 3.807 1.00 52.34 C ATOM 388 O LYS A 25 10.481 -4.593 3.702 1.00 60.21 O ATOM 389 CB LYS A 25 12.626 -7.046 3.314 1.00 63.25 C ATOM 390 CG LYS A 25 13.478 -7.804 2.310 1.00 42.32 C ATOM 391 CD LYS A 25 14.063 -9.068 2.917 1.00 44.13 C ATOM 392 CE LYS A 25 13.153 -10.266 2.694 1.00 1.13 C ATOM 393 NZ LYS A 25 13.354 -10.873 1.349 1.00 13.22 N ATOM 0 H LYS A 25 11.874 -5.162 1.514 1.00 62.21 H new ATOM 0 HA LYS A 25 10.660 -7.613 2.654 1.00 61.22 H new ATOM 0 HB2 LYS A 25 13.141 -6.128 3.595 1.00 63.25 H new ATOM 0 HB3 LYS A 25 12.526 -7.645 4.219 1.00 63.25 H new ATOM 0 HG2 LYS A 25 12.874 -8.063 1.441 1.00 42.32 H new ATOM 0 HG3 LYS A 25 14.285 -7.161 1.958 1.00 42.32 H new ATOM 0 HD2 LYS A 25 15.041 -9.265 2.477 1.00 44.13 H new ATOM 0 HD3 LYS A 25 14.218 -8.922 3.986 1.00 44.13 H new ATOM 0 HE2 LYS A 25 13.344 -11.015 3.463 1.00 1.13 H new ATOM 0 HE3 LYS A 25 12.113 -9.957 2.801 1.00 1.13 H new ATOM 0 HZ1 LYS A 25 12.716 -11.686 1.236 1.00 13.22 H new ATOM 0 HZ2 LYS A 25 13.147 -10.166 0.615 1.00 13.22 H new ATOM 0 HZ3 LYS A 25 14.340 -11.191 1.256 1.00 13.22 H new ATOM 407 N PRO A 26 9.893 -6.462 4.814 1.00 72.13 N ATOM 408 CA PRO A 26 9.154 -5.761 5.868 1.00 41.31 C ATOM 409 C PRO A 26 10.074 -4.975 6.796 1.00 23.32 C ATOM 410 O PRO A 26 11.248 -4.762 6.490 1.00 51.41 O ATOM 411 CB PRO A 26 8.465 -6.894 6.632 1.00 55.21 C ATOM 412 CG PRO A 26 9.318 -8.090 6.387 1.00 72.12 C ATOM 413 CD PRO A 26 9.878 -7.923 5.001 1.00 14.42 C ATOM 0 HA PRO A 26 8.464 -5.023 5.460 1.00 41.31 H new ATOM 0 HB2 PRO A 26 8.395 -6.669 7.696 1.00 55.21 H new ATOM 0 HB3 PRO A 26 7.448 -7.053 6.273 1.00 55.21 H new ATOM 0 HG2 PRO A 26 10.117 -8.157 7.125 1.00 72.12 H new ATOM 0 HG3 PRO A 26 8.735 -9.008 6.464 1.00 72.12 H new ATOM 0 HD2 PRO A 26 10.878 -8.349 4.917 1.00 14.42 H new ATOM 0 HD3 PRO A 26 9.257 -8.418 4.254 1.00 14.42 H new ATOM 421 N THR A 27 9.535 -4.547 7.933 1.00 31.04 N ATOM 422 CA THR A 27 10.307 -3.785 8.906 1.00 3.32 C ATOM 423 C THR A 27 9.750 -3.965 10.314 1.00 40.25 C ATOM 424 O THR A 27 8.569 -3.716 10.562 1.00 44.35 O ATOM 425 CB THR A 27 10.322 -2.284 8.560 1.00 14.31 C ATOM 426 OG1 THR A 27 10.728 -2.098 7.200 1.00 63.53 O ATOM 427 CG2 THR A 27 11.262 -1.524 9.484 1.00 61.42 C ATOM 0 H THR A 27 8.566 -4.715 8.203 1.00 31.04 H new ATOM 0 HA THR A 27 11.327 -4.169 8.870 1.00 3.32 H new ATOM 0 HB THR A 27 9.313 -1.894 8.694 1.00 14.31 H new ATOM 0 HG1 THR A 27 10.014 -1.646 6.704 1.00 63.53 H new ATOM 0 HG21 THR A 27 11.255 -0.466 9.220 1.00 61.42 H new ATOM 0 HG22 THR A 27 10.932 -1.642 10.516 1.00 61.42 H new ATOM 0 HG23 THR A 27 12.273 -1.918 9.379 1.00 61.42 H new ATOM 435 N LEU A 28 10.606 -4.398 11.233 1.00 73.25 N ATOM 436 CA LEU A 28 10.199 -4.611 12.617 1.00 33.02 C ATOM 437 C LEU A 28 10.556 -3.406 13.481 1.00 2.02 C ATOM 438 O LEU A 28 11.726 -3.176 13.788 1.00 2.55 O ATOM 439 CB LEU A 28 10.863 -5.870 13.177 1.00 5.31 C ATOM 440 CG LEU A 28 9.926 -6.901 13.805 1.00 33.33 C ATOM 441 CD1 LEU A 28 8.817 -7.276 12.834 1.00 11.12 C ATOM 442 CD2 LEU A 28 10.703 -8.138 14.233 1.00 12.32 C ATOM 0 H LEU A 28 11.586 -4.608 11.045 1.00 73.25 H new ATOM 0 HA LEU A 28 9.117 -4.740 12.636 1.00 33.02 H new ATOM 0 HB2 LEU A 28 11.415 -6.354 12.371 1.00 5.31 H new ATOM 0 HB3 LEU A 28 11.593 -5.568 13.928 1.00 5.31 H new ATOM 0 HG LEU A 28 9.471 -6.458 14.691 1.00 33.33 H new ATOM 0 HD11 LEU A 28 8.160 -8.011 13.299 1.00 11.12 H new ATOM 0 HD12 LEU A 28 8.242 -6.386 12.577 1.00 11.12 H new ATOM 0 HD13 LEU A 28 9.253 -7.700 11.929 1.00 11.12 H new ATOM 0 HD21 LEU A 28 10.019 -8.861 14.678 1.00 12.32 H new ATOM 0 HD22 LEU A 28 11.186 -8.583 13.363 1.00 12.32 H new ATOM 0 HD23 LEU A 28 11.460 -7.857 14.965 1.00 12.32 H new ATOM 454 N ILE A 29 9.541 -2.642 13.871 1.00 23.34 N ATOM 455 CA ILE A 29 9.749 -1.463 14.703 1.00 72.22 C ATOM 456 C ILE A 29 9.717 -1.823 16.184 1.00 14.34 C ATOM 457 O ILE A 29 9.014 -2.746 16.596 1.00 73.02 O ATOM 458 CB ILE A 29 8.686 -0.384 14.425 1.00 74.12 C ATOM 459 CG1 ILE A 29 8.600 -0.096 12.924 1.00 33.45 C ATOM 460 CG2 ILE A 29 9.007 0.887 15.196 1.00 41.31 C ATOM 461 CD1 ILE A 29 7.460 0.824 12.550 1.00 15.41 C ATOM 0 H ILE A 29 8.567 -2.818 13.624 1.00 23.34 H new ATOM 0 HA ILE A 29 10.732 -1.067 14.449 1.00 72.22 H new ATOM 0 HB ILE A 29 7.717 -0.754 14.761 1.00 74.12 H new ATOM 0 HG12 ILE A 29 9.539 0.349 12.593 1.00 33.45 H new ATOM 0 HG13 ILE A 29 8.487 -1.038 12.387 1.00 33.45 H new ATOM 0 HG21 ILE A 29 8.247 1.640 14.989 1.00 41.31 H new ATOM 0 HG22 ILE A 29 9.022 0.671 16.264 1.00 41.31 H new ATOM 0 HG23 ILE A 29 9.983 1.263 14.888 1.00 41.31 H new ATOM 0 HD11 ILE A 29 7.460 0.984 11.472 1.00 15.41 H new ATOM 0 HD12 ILE A 29 6.514 0.372 12.850 1.00 15.41 H new ATOM 0 HD13 ILE A 29 7.582 1.780 13.059 1.00 15.41 H new ATOM 473 N LYS A 30 10.481 -1.086 16.983 1.00 3.10 N ATOM 474 CA LYS A 30 10.539 -1.324 18.420 1.00 4.44 C ATOM 475 C LYS A 30 10.401 -0.016 19.194 1.00 21.31 C ATOM 476 O LYS A 30 11.200 0.905 19.024 1.00 63.20 O ATOM 477 CB LYS A 30 11.855 -2.012 18.792 1.00 50.43 C ATOM 478 CG LYS A 30 12.131 -2.030 20.285 1.00 5.21 C ATOM 479 CD LYS A 30 13.450 -2.717 20.600 1.00 52.23 C ATOM 480 CE LYS A 30 13.321 -3.650 21.794 1.00 71.23 C ATOM 481 NZ LYS A 30 13.830 -3.024 23.045 1.00 43.20 N ATOM 0 H LYS A 30 11.069 -0.318 16.659 1.00 3.10 H new ATOM 0 HA LYS A 30 9.707 -1.975 18.689 1.00 4.44 H new ATOM 0 HB2 LYS A 30 11.837 -3.037 18.422 1.00 50.43 H new ATOM 0 HB3 LYS A 30 12.676 -1.505 18.285 1.00 50.43 H new ATOM 0 HG2 LYS A 30 12.152 -1.008 20.664 1.00 5.21 H new ATOM 0 HG3 LYS A 30 11.320 -2.545 20.800 1.00 5.21 H new ATOM 0 HD2 LYS A 30 13.784 -3.282 19.730 1.00 52.23 H new ATOM 0 HD3 LYS A 30 14.213 -1.966 20.805 1.00 52.23 H new ATOM 0 HE2 LYS A 30 12.275 -3.928 21.926 1.00 71.23 H new ATOM 0 HE3 LYS A 30 13.873 -4.569 21.598 1.00 71.23 H new ATOM 0 HZ1 LYS A 30 13.724 -3.692 23.835 1.00 43.20 H new ATOM 0 HZ2 LYS A 30 14.835 -2.782 22.928 1.00 43.20 H new ATOM 0 HZ3 LYS A 30 13.287 -2.160 23.247 1.00 43.20 H new ATOM 495 N PHE A 31 9.383 0.058 20.045 1.00 23.53 N ATOM 496 CA PHE A 31 9.141 1.252 20.846 1.00 41.23 C ATOM 497 C PHE A 31 9.851 1.157 22.193 1.00 12.22 C ATOM 498 O PHE A 31 9.559 0.273 22.999 1.00 45.40 O ATOM 499 CB PHE A 31 7.639 1.452 21.060 1.00 4.25 C ATOM 500 CG PHE A 31 6.858 1.547 19.781 1.00 3.11 C ATOM 501 CD1 PHE A 31 6.552 0.408 19.055 1.00 62.43 C ATOM 502 CD2 PHE A 31 6.430 2.776 19.305 1.00 33.31 C ATOM 503 CE1 PHE A 31 5.834 0.492 17.877 1.00 43.42 C ATOM 504 CE2 PHE A 31 5.711 2.867 18.128 1.00 60.31 C ATOM 505 CZ PHE A 31 5.412 1.723 17.413 1.00 1.34 C ATOM 0 H PHE A 31 8.712 -0.695 20.198 1.00 23.53 H new ATOM 0 HA PHE A 31 9.541 2.110 20.305 1.00 41.23 H new ATOM 0 HB2 PHE A 31 7.251 0.623 21.652 1.00 4.25 H new ATOM 0 HB3 PHE A 31 7.481 2.361 21.641 1.00 4.25 H new ATOM 0 HD1 PHE A 31 6.878 -0.557 19.414 1.00 62.43 H new ATOM 0 HD2 PHE A 31 6.661 3.673 19.860 1.00 33.31 H new ATOM 0 HE1 PHE A 31 5.603 -0.404 17.320 1.00 43.42 H new ATOM 0 HE2 PHE A 31 5.383 3.831 17.768 1.00 60.31 H new ATOM 0 HZ PHE A 31 4.850 1.791 16.493 1.00 1.34 H new ATOM 515 N TRP A 32 10.783 2.073 22.429 1.00 21.14 N ATOM 516 CA TRP A 32 11.535 2.093 23.679 1.00 64.31 C ATOM 517 C TRP A 32 11.533 3.488 24.294 1.00 74.11 C ATOM 518 O TRP A 32 10.840 4.385 23.816 1.00 51.54 O ATOM 519 CB TRP A 32 12.974 1.630 23.440 1.00 54.24 C ATOM 520 CG TRP A 32 13.710 2.472 22.442 1.00 50.01 C ATOM 521 CD1 TRP A 32 13.465 2.556 21.101 1.00 65.32 C ATOM 522 CD2 TRP A 32 14.812 3.347 22.706 1.00 12.22 C ATOM 523 NE1 TRP A 32 14.349 3.430 20.516 1.00 40.34 N ATOM 524 CE2 TRP A 32 15.185 3.930 21.479 1.00 33.11 C ATOM 525 CE3 TRP A 32 15.518 3.697 23.860 1.00 63.00 C ATOM 526 CZ2 TRP A 32 16.233 4.841 21.376 1.00 72.51 C ATOM 527 CZ3 TRP A 32 16.558 4.601 23.756 1.00 65.32 C ATOM 528 CH2 TRP A 32 16.907 5.165 22.521 1.00 24.25 C ATOM 0 H TRP A 32 11.036 2.811 21.772 1.00 21.14 H new ATOM 0 HA TRP A 32 11.051 1.409 24.376 1.00 64.31 H new ATOM 0 HB2 TRP A 32 13.515 1.644 24.386 1.00 54.24 H new ATOM 0 HB3 TRP A 32 12.963 0.596 23.095 1.00 54.24 H new ATOM 0 HD1 TRP A 32 12.690 2.015 20.578 1.00 65.32 H new ATOM 0 HE1 TRP A 32 14.378 3.668 19.525 1.00 40.34 H new ATOM 0 HE3 TRP A 32 15.256 3.269 24.816 1.00 63.00 H new ATOM 0 HZ2 TRP A 32 16.504 5.276 20.426 1.00 72.51 H new ATOM 0 HZ3 TRP A 32 17.111 4.878 24.641 1.00 65.32 H new ATOM 0 HH2 TRP A 32 17.724 5.869 22.473 1.00 24.25 H new ATOM 539 N ALA A 33 12.312 3.663 25.356 1.00 15.13 N ATOM 540 CA ALA A 33 12.400 4.950 26.035 1.00 51.23 C ATOM 541 C ALA A 33 13.666 5.039 26.880 1.00 12.33 C ATOM 542 O ALA A 33 14.193 4.024 27.335 1.00 73.00 O ATOM 543 CB ALA A 33 11.168 5.177 26.899 1.00 24.11 C ATOM 0 H ALA A 33 12.891 2.930 25.765 1.00 15.13 H new ATOM 0 HA ALA A 33 12.446 5.731 25.276 1.00 51.23 H new ATOM 0 HB1 ALA A 33 11.248 6.142 27.400 1.00 24.11 H new ATOM 0 HB2 ALA A 33 10.277 5.166 26.272 1.00 24.11 H new ATOM 0 HB3 ALA A 33 11.096 4.386 27.645 1.00 24.11 H new ATOM 549 N SER A 34 14.149 6.260 27.087 1.00 43.12 N ATOM 550 CA SER A 34 15.357 6.481 27.874 1.00 14.03 C ATOM 551 C SER A 34 15.110 6.166 29.346 1.00 21.45 C ATOM 552 O SER A 34 16.049 5.939 30.110 1.00 42.45 O ATOM 553 CB SER A 34 15.832 7.927 27.723 1.00 13.44 C ATOM 554 OG SER A 34 15.790 8.339 26.368 1.00 1.21 O ATOM 0 H SER A 34 13.723 7.111 26.721 1.00 43.12 H new ATOM 0 HA SER A 34 16.132 5.811 27.501 1.00 14.03 H new ATOM 0 HB2 SER A 34 15.205 8.584 28.326 1.00 13.44 H new ATOM 0 HB3 SER A 34 16.849 8.020 28.103 1.00 13.44 H new ATOM 0 HG SER A 34 16.590 8.017 25.903 1.00 1.21 H new ATOM 560 N TRP A 35 13.841 6.153 29.737 1.00 20.25 N ATOM 561 CA TRP A 35 13.470 5.865 31.118 1.00 12.23 C ATOM 562 C TRP A 35 13.129 4.390 31.294 1.00 32.43 C ATOM 563 O TRP A 35 12.368 4.020 32.190 1.00 44.33 O ATOM 564 CB TRP A 35 12.280 6.730 31.539 1.00 63.11 C ATOM 565 CG TRP A 35 11.081 6.560 30.657 1.00 73.44 C ATOM 566 CD1 TRP A 35 10.838 7.194 29.472 1.00 11.51 C ATOM 567 CD2 TRP A 35 9.960 5.699 30.890 1.00 3.52 C ATOM 568 NE1 TRP A 35 9.634 6.781 28.955 1.00 32.22 N ATOM 569 CE2 TRP A 35 9.076 5.863 29.806 1.00 42.23 C ATOM 570 CE3 TRP A 35 9.619 4.806 31.908 1.00 34.54 C ATOM 571 CZ2 TRP A 35 7.874 5.167 29.714 1.00 21.20 C ATOM 572 CZ3 TRP A 35 8.425 4.115 31.816 1.00 1.31 C ATOM 573 CH2 TRP A 35 7.565 4.298 30.725 1.00 12.12 C ATOM 0 H TRP A 35 13.052 6.338 29.118 1.00 20.25 H new ATOM 0 HA TRP A 35 14.324 6.099 31.754 1.00 12.23 H new ATOM 0 HB2 TRP A 35 12.006 6.483 32.565 1.00 63.11 H new ATOM 0 HB3 TRP A 35 12.581 7.778 31.533 1.00 63.11 H new ATOM 0 HD1 TRP A 35 11.496 7.915 29.009 1.00 11.51 H new ATOM 0 HE1 TRP A 35 9.222 7.105 28.080 1.00 32.22 H new ATOM 0 HE3 TRP A 35 10.276 4.658 32.752 1.00 34.54 H new ATOM 0 HZ2 TRP A 35 7.209 5.308 28.875 1.00 21.20 H new ATOM 0 HZ3 TRP A 35 8.151 3.423 32.598 1.00 1.31 H new ATOM 0 HH2 TRP A 35 6.640 3.742 30.681 1.00 12.12 H new ATOM 584 N CYS A 36 13.696 3.549 30.435 1.00 13.21 N ATOM 585 CA CYS A 36 13.452 2.113 30.495 1.00 14.13 C ATOM 586 C CYS A 36 14.764 1.343 30.606 1.00 61.55 C ATOM 587 O CYS A 36 15.631 1.416 29.735 1.00 43.43 O ATOM 588 CB CYS A 36 12.680 1.653 29.257 1.00 41.53 C ATOM 589 SG CYS A 36 12.390 -0.144 29.186 1.00 12.40 S ATOM 0 H CYS A 36 14.328 3.838 29.689 1.00 13.21 H new ATOM 0 HA CYS A 36 12.855 1.908 31.383 1.00 14.13 H new ATOM 0 HB2 CYS A 36 11.719 2.167 29.230 1.00 41.53 H new ATOM 0 HB3 CYS A 36 13.229 1.957 28.366 1.00 41.53 H new ATOM 594 N PRO A 37 14.915 0.584 31.702 1.00 53.43 N ATOM 595 CA PRO A 37 16.118 -0.215 31.952 1.00 35.21 C ATOM 596 C PRO A 37 16.236 -1.399 30.998 1.00 51.32 C ATOM 597 O PRO A 37 17.303 -1.655 30.439 1.00 4.41 O ATOM 598 CB PRO A 37 15.925 -0.705 33.390 1.00 43.43 C ATOM 599 CG PRO A 37 14.450 -0.697 33.598 1.00 22.52 C ATOM 600 CD PRO A 37 13.922 0.449 32.781 1.00 60.11 C ATOM 0 HA PRO A 37 17.030 0.363 31.802 1.00 35.21 H new ATOM 0 HB2 PRO A 37 16.339 -1.704 33.527 1.00 43.43 H new ATOM 0 HB3 PRO A 37 16.429 -0.051 34.102 1.00 43.43 H new ATOM 0 HG2 PRO A 37 14.006 -1.640 33.280 1.00 22.52 H new ATOM 0 HG3 PRO A 37 14.205 -0.570 34.653 1.00 22.52 H new ATOM 0 HD2 PRO A 37 12.928 0.238 32.388 1.00 60.11 H new ATOM 0 HD3 PRO A 37 13.844 1.362 33.372 1.00 60.11 H new ATOM 608 N LEU A 38 15.134 -2.118 30.815 1.00 51.52 N ATOM 609 CA LEU A 38 15.114 -3.275 29.927 1.00 51.33 C ATOM 610 C LEU A 38 15.270 -2.847 28.471 1.00 53.40 C ATOM 611 O LEU A 38 15.489 -3.677 27.589 1.00 42.15 O ATOM 612 CB LEU A 38 13.811 -4.056 30.104 1.00 54.22 C ATOM 613 CG LEU A 38 13.750 -5.423 29.422 1.00 74.01 C ATOM 614 CD1 LEU A 38 14.643 -6.420 30.144 1.00 42.25 C ATOM 615 CD2 LEU A 38 12.316 -5.930 29.370 1.00 54.40 C ATOM 0 H LEU A 38 14.243 -1.920 31.270 1.00 51.52 H new ATOM 0 HA LEU A 38 15.954 -3.918 30.189 1.00 51.33 H new ATOM 0 HB2 LEU A 38 13.637 -4.196 31.171 1.00 54.22 H new ATOM 0 HB3 LEU A 38 12.991 -3.446 29.725 1.00 54.22 H new ATOM 0 HG LEU A 38 14.113 -5.314 28.400 1.00 74.01 H new ATOM 0 HD11 LEU A 38 14.587 -7.387 29.644 1.00 42.25 H new ATOM 0 HD12 LEU A 38 15.673 -6.063 30.129 1.00 42.25 H new ATOM 0 HD13 LEU A 38 14.310 -6.525 31.177 1.00 42.25 H new ATOM 0 HD21 LEU A 38 12.292 -6.904 28.881 1.00 54.40 H new ATOM 0 HD22 LEU A 38 11.926 -6.023 30.384 1.00 54.40 H new ATOM 0 HD23 LEU A 38 11.702 -5.227 28.808 1.00 54.40 H new ATOM 627 N CYS A 39 15.157 -1.545 28.227 1.00 32.31 N ATOM 628 CA CYS A 39 15.287 -1.005 26.879 1.00 33.31 C ATOM 629 C CYS A 39 16.663 -0.380 26.674 1.00 44.20 C ATOM 630 O CYS A 39 17.389 -0.740 25.746 1.00 3.03 O ATOM 631 CB CYS A 39 14.197 0.036 26.617 1.00 10.23 C ATOM 632 SG CYS A 39 12.528 -0.491 27.121 1.00 32.24 S ATOM 0 H CYS A 39 14.976 -0.845 28.946 1.00 32.31 H new ATOM 0 HA CYS A 39 15.172 -1.827 26.172 1.00 33.31 H new ATOM 0 HB2 CYS A 39 14.452 0.954 27.147 1.00 10.23 H new ATOM 0 HB3 CYS A 39 14.185 0.274 25.553 1.00 10.23 H new ATOM 637 N LEU A 40 17.016 0.558 27.546 1.00 44.43 N ATOM 638 CA LEU A 40 18.306 1.235 27.461 1.00 22.34 C ATOM 639 C LEU A 40 19.451 0.227 27.466 1.00 30.42 C ATOM 640 O LEU A 40 20.433 0.383 26.740 1.00 15.42 O ATOM 641 CB LEU A 40 18.468 2.213 28.626 1.00 43.20 C ATOM 642 CG LEU A 40 19.387 3.410 28.374 1.00 35.34 C ATOM 643 CD1 LEU A 40 18.586 4.601 27.873 1.00 55.05 C ATOM 644 CD2 LEU A 40 20.149 3.772 29.641 1.00 53.54 C ATOM 0 H LEU A 40 16.428 0.867 28.320 1.00 44.43 H new ATOM 0 HA LEU A 40 18.337 1.788 26.522 1.00 22.34 H new ATOM 0 HB2 LEU A 40 17.482 2.589 28.899 1.00 43.20 H new ATOM 0 HB3 LEU A 40 18.849 1.663 29.486 1.00 43.20 H new ATOM 0 HG LEU A 40 20.109 3.135 27.605 1.00 35.34 H new ATOM 0 HD11 LEU A 40 19.256 5.443 27.699 1.00 55.05 H new ATOM 0 HD12 LEU A 40 18.086 4.337 26.941 1.00 55.05 H new ATOM 0 HD13 LEU A 40 17.841 4.878 28.619 1.00 55.05 H new ATOM 0 HD21 LEU A 40 20.798 4.625 29.444 1.00 53.54 H new ATOM 0 HD22 LEU A 40 19.442 4.028 30.430 1.00 53.54 H new ATOM 0 HD23 LEU A 40 20.753 2.922 29.957 1.00 53.54 H new ATOM 656 N SER A 41 19.317 -0.809 28.288 1.00 32.41 N ATOM 657 CA SER A 41 20.341 -1.843 28.389 1.00 54.14 C ATOM 658 C SER A 41 20.272 -2.794 27.197 1.00 13.43 C ATOM 659 O SER A 41 21.175 -3.601 26.982 1.00 52.04 O ATOM 660 CB SER A 41 20.177 -2.628 29.692 1.00 41.52 C ATOM 661 OG SER A 41 20.266 -1.771 30.817 1.00 31.13 O ATOM 0 H SER A 41 18.509 -0.955 28.894 1.00 32.41 H new ATOM 0 HA SER A 41 21.316 -1.355 28.387 1.00 54.14 H new ATOM 0 HB2 SER A 41 19.214 -3.138 29.694 1.00 41.52 H new ATOM 0 HB3 SER A 41 20.946 -3.398 29.756 1.00 41.52 H new ATOM 0 HG SER A 41 19.370 -1.457 31.061 1.00 31.13 H new ATOM 667 N GLU A 42 19.193 -2.690 26.427 1.00 32.45 N ATOM 668 CA GLU A 42 19.005 -3.541 25.258 1.00 22.44 C ATOM 669 C GLU A 42 19.457 -2.828 23.988 1.00 42.44 C ATOM 670 O GLU A 42 19.516 -3.427 22.913 1.00 43.41 O ATOM 671 CB GLU A 42 17.537 -3.954 25.130 1.00 2.52 C ATOM 672 CG GLU A 42 17.253 -5.358 25.637 1.00 53.52 C ATOM 673 CD GLU A 42 16.979 -6.339 24.513 1.00 0.35 C ATOM 674 OE1 GLU A 42 17.533 -6.147 23.411 1.00 44.11 O ATOM 675 OE2 GLU A 42 16.211 -7.298 24.736 1.00 11.54 O ATOM 0 H GLU A 42 18.437 -2.026 26.592 1.00 32.45 H new ATOM 0 HA GLU A 42 19.616 -4.434 25.389 1.00 22.44 H new ATOM 0 HB2 GLU A 42 16.920 -3.246 25.682 1.00 2.52 H new ATOM 0 HB3 GLU A 42 17.240 -3.888 24.083 1.00 2.52 H new ATOM 0 HG2 GLU A 42 18.104 -5.709 26.221 1.00 53.52 H new ATOM 0 HG3 GLU A 42 16.395 -5.331 26.308 1.00 53.52 H new ATOM 682 N LEU A 43 19.775 -1.544 24.118 1.00 33.42 N ATOM 683 CA LEU A 43 20.221 -0.747 22.981 1.00 23.11 C ATOM 684 C LEU A 43 21.348 -1.451 22.232 1.00 43.32 C ATOM 685 O LEU A 43 21.405 -1.419 21.003 1.00 20.43 O ATOM 686 CB LEU A 43 20.689 0.631 23.452 1.00 51.23 C ATOM 687 CG LEU A 43 19.712 1.785 23.225 1.00 15.12 C ATOM 688 CD1 LEU A 43 18.307 1.385 23.648 1.00 15.44 C ATOM 689 CD2 LEU A 43 20.166 3.025 23.981 1.00 12.13 C ATOM 0 H LEU A 43 19.732 -1.033 25.000 1.00 33.42 H new ATOM 0 HA LEU A 43 19.378 -0.625 22.301 1.00 23.11 H new ATOM 0 HB2 LEU A 43 20.910 0.573 24.518 1.00 51.23 H new ATOM 0 HB3 LEU A 43 21.624 0.868 22.945 1.00 51.23 H new ATOM 0 HG LEU A 43 19.696 2.019 22.160 1.00 15.12 H new ATOM 0 HD11 LEU A 43 17.625 2.218 23.479 1.00 15.44 H new ATOM 0 HD12 LEU A 43 17.981 0.526 23.062 1.00 15.44 H new ATOM 0 HD13 LEU A 43 18.306 1.124 24.706 1.00 15.44 H new ATOM 0 HD21 LEU A 43 19.459 3.836 23.808 1.00 12.13 H new ATOM 0 HD22 LEU A 43 20.211 2.805 25.048 1.00 12.13 H new ATOM 0 HD23 LEU A 43 21.154 3.324 23.630 1.00 12.13 H new ATOM 701 N GLY A 44 22.243 -2.087 22.981 1.00 24.33 N ATOM 702 CA GLY A 44 23.356 -2.792 22.371 1.00 54.33 C ATOM 703 C GLY A 44 22.907 -3.993 21.563 1.00 64.25 C ATOM 704 O GLY A 44 23.290 -4.146 20.403 1.00 53.02 O ATOM 0 H GLY A 44 22.218 -2.127 24.000 1.00 24.33 H new ATOM 0 HA2 GLY A 44 23.905 -2.108 21.725 1.00 54.33 H new ATOM 0 HA3 GLY A 44 24.046 -3.119 23.149 1.00 54.33 H new ATOM 708 N GLN A 45 22.096 -4.848 22.177 1.00 63.42 N ATOM 709 CA GLN A 45 21.598 -6.044 21.507 1.00 42.23 C ATOM 710 C GLN A 45 20.930 -5.687 20.183 1.00 32.30 C ATOM 711 O GLN A 45 21.237 -6.270 19.143 1.00 70.44 O ATOM 712 CB GLN A 45 20.609 -6.785 22.408 1.00 11.40 C ATOM 713 CG GLN A 45 19.887 -7.926 21.710 1.00 12.20 C ATOM 714 CD GLN A 45 19.552 -9.067 22.651 1.00 51.54 C ATOM 715 OE1 GLN A 45 18.382 -9.359 22.898 1.00 73.31 O ATOM 716 NE2 GLN A 45 20.580 -9.718 23.181 1.00 62.20 N ATOM 0 H GLN A 45 21.770 -4.735 23.137 1.00 63.42 H new ATOM 0 HA GLN A 45 22.448 -6.695 21.301 1.00 42.23 H new ATOM 0 HB2 GLN A 45 21.143 -7.179 23.273 1.00 11.40 H new ATOM 0 HB3 GLN A 45 19.872 -6.076 22.785 1.00 11.40 H new ATOM 0 HG2 GLN A 45 18.968 -7.549 21.261 1.00 12.20 H new ATOM 0 HG3 GLN A 45 20.509 -8.301 20.897 1.00 12.20 H new ATOM 0 HE21 GLN A 45 21.534 -9.441 22.948 1.00 62.20 H new ATOM 0 HE22 GLN A 45 20.416 -10.495 23.821 1.00 62.20 H new ATOM 725 N THR A 46 20.013 -4.726 20.229 1.00 50.44 N ATOM 726 CA THR A 46 19.300 -4.292 19.034 1.00 72.21 C ATOM 727 C THR A 46 20.255 -3.683 18.014 1.00 11.21 C ATOM 728 O THR A 46 20.089 -3.865 16.809 1.00 73.43 O ATOM 729 CB THR A 46 18.206 -3.263 19.375 1.00 52.20 C ATOM 730 OG1 THR A 46 17.331 -3.792 20.378 1.00 51.25 O ATOM 731 CG2 THR A 46 17.403 -2.896 18.136 1.00 32.01 C ATOM 0 H THR A 46 19.746 -4.233 21.081 1.00 50.44 H new ATOM 0 HA THR A 46 18.833 -5.179 18.605 1.00 72.21 H new ATOM 0 HB THR A 46 18.690 -2.363 19.754 1.00 52.20 H new ATOM 0 HG1 THR A 46 16.639 -3.131 20.590 1.00 51.25 H new ATOM 0 HG21 THR A 46 16.636 -2.168 18.402 1.00 32.01 H new ATOM 0 HG22 THR A 46 18.067 -2.466 17.386 1.00 32.01 H new ATOM 0 HG23 THR A 46 16.929 -3.790 17.731 1.00 32.01 H new ATOM 739 N GLU A 47 21.255 -2.959 18.506 1.00 5.21 N ATOM 740 CA GLU A 47 22.237 -2.323 17.636 1.00 42.44 C ATOM 741 C GLU A 47 22.919 -3.353 16.740 1.00 21.11 C ATOM 742 O GLU A 47 23.281 -3.060 15.600 1.00 34.12 O ATOM 743 CB GLU A 47 23.285 -1.581 18.468 1.00 23.10 C ATOM 744 CG GLU A 47 24.459 -1.068 17.651 1.00 4.15 C ATOM 745 CD GLU A 47 24.070 0.060 16.716 1.00 45.23 C ATOM 746 OE1 GLU A 47 23.133 -0.132 15.913 1.00 21.21 O ATOM 747 OE2 GLU A 47 24.703 1.134 16.786 1.00 51.55 O ATOM 0 H GLU A 47 21.406 -2.798 19.502 1.00 5.21 H new ATOM 0 HA GLU A 47 21.713 -1.607 17.003 1.00 42.44 H new ATOM 0 HB2 GLU A 47 22.808 -0.740 18.971 1.00 23.10 H new ATOM 0 HB3 GLU A 47 23.658 -2.248 19.246 1.00 23.10 H new ATOM 0 HG2 GLU A 47 25.243 -0.722 18.325 1.00 4.15 H new ATOM 0 HG3 GLU A 47 24.878 -1.889 17.069 1.00 4.15 H new ATOM 754 N LYS A 48 23.092 -4.562 17.265 1.00 43.44 N ATOM 755 CA LYS A 48 23.730 -5.637 16.515 1.00 72.42 C ATOM 756 C LYS A 48 22.726 -6.332 15.600 1.00 21.23 C ATOM 757 O LYS A 48 23.074 -6.779 14.507 1.00 22.03 O ATOM 758 CB LYS A 48 24.352 -6.655 17.473 1.00 24.31 C ATOM 759 CG LYS A 48 25.254 -6.030 18.523 1.00 12.44 C ATOM 760 CD LYS A 48 26.571 -5.566 17.924 1.00 73.34 C ATOM 761 CE LYS A 48 27.686 -5.570 18.958 1.00 40.22 C ATOM 762 NZ LYS A 48 28.245 -4.207 19.175 1.00 1.24 N ATOM 0 H LYS A 48 22.799 -4.821 18.207 1.00 43.44 H new ATOM 0 HA LYS A 48 24.515 -5.200 15.898 1.00 72.42 H new ATOM 0 HB2 LYS A 48 23.555 -7.206 17.972 1.00 24.31 H new ATOM 0 HB3 LYS A 48 24.927 -7.379 16.897 1.00 24.31 H new ATOM 0 HG2 LYS A 48 24.745 -5.183 18.984 1.00 12.44 H new ATOM 0 HG3 LYS A 48 25.448 -6.754 19.314 1.00 12.44 H new ATOM 0 HD2 LYS A 48 26.843 -6.216 17.092 1.00 73.34 H new ATOM 0 HD3 LYS A 48 26.453 -4.561 17.518 1.00 73.34 H new ATOM 0 HE2 LYS A 48 27.305 -5.961 19.902 1.00 40.22 H new ATOM 0 HE3 LYS A 48 28.481 -6.241 18.633 1.00 40.22 H new ATOM 0 HZ1 LYS A 48 29.002 -4.252 19.886 1.00 1.24 H new ATOM 0 HZ2 LYS A 48 28.631 -3.844 18.280 1.00 1.24 H new ATOM 0 HZ3 LYS A 48 27.492 -3.572 19.510 1.00 1.24 H new ATOM 776 N TRP A 49 21.481 -6.418 16.054 1.00 72.14 N ATOM 777 CA TRP A 49 20.426 -7.057 15.274 1.00 24.44 C ATOM 778 C TRP A 49 20.261 -6.376 13.921 1.00 53.04 C ATOM 779 O TRP A 49 20.205 -7.038 12.885 1.00 74.30 O ATOM 780 CB TRP A 49 19.104 -7.022 16.042 1.00 20.32 C ATOM 781 CG TRP A 49 19.081 -7.940 17.227 1.00 13.22 C ATOM 782 CD1 TRP A 49 20.147 -8.587 17.784 1.00 12.40 C ATOM 783 CD2 TRP A 49 17.934 -8.314 17.999 1.00 3.51 C ATOM 784 NE1 TRP A 49 19.732 -9.340 18.856 1.00 62.03 N ATOM 785 CE2 TRP A 49 18.379 -9.189 19.009 1.00 4.10 C ATOM 786 CE3 TRP A 49 16.576 -7.992 17.937 1.00 33.40 C ATOM 787 CZ2 TRP A 49 17.513 -9.746 19.946 1.00 41.11 C ATOM 788 CZ3 TRP A 49 15.717 -8.546 18.867 1.00 21.34 C ATOM 789 CH2 TRP A 49 16.188 -9.414 19.861 1.00 21.35 C ATOM 0 H TRP A 49 21.177 -6.054 16.957 1.00 72.14 H new ATOM 0 HA TRP A 49 20.712 -8.095 15.104 1.00 24.44 H new ATOM 0 HB2 TRP A 49 18.914 -6.002 16.377 1.00 20.32 H new ATOM 0 HB3 TRP A 49 18.292 -7.292 15.366 1.00 20.32 H new ATOM 0 HD1 TRP A 49 21.166 -8.517 17.434 1.00 12.40 H new ATOM 0 HE1 TRP A 49 20.334 -9.918 19.443 1.00 62.03 H new ATOM 0 HE3 TRP A 49 16.204 -7.322 17.176 1.00 33.40 H new ATOM 0 HZ2 TRP A 49 17.874 -10.416 20.712 1.00 41.11 H new ATOM 0 HZ3 TRP A 49 14.665 -8.306 18.827 1.00 21.34 H new ATOM 0 HH2 TRP A 49 15.492 -9.829 20.574 1.00 21.35 H new ATOM 800 N ALA A 50 20.183 -5.049 13.936 1.00 21.32 N ATOM 801 CA ALA A 50 20.026 -4.279 12.709 1.00 50.21 C ATOM 802 C ALA A 50 21.218 -4.478 11.779 1.00 4.34 C ATOM 803 O ALA A 50 21.170 -4.110 10.606 1.00 13.21 O ATOM 804 CB ALA A 50 19.846 -2.803 13.032 1.00 43.13 C ATOM 0 H ALA A 50 20.226 -4.485 14.785 1.00 21.32 H new ATOM 0 HA ALA A 50 19.135 -4.639 12.195 1.00 50.21 H new ATOM 0 HB1 ALA A 50 19.730 -2.239 12.106 1.00 43.13 H new ATOM 0 HB2 ALA A 50 18.958 -2.672 13.651 1.00 43.13 H new ATOM 0 HB3 ALA A 50 20.721 -2.439 13.571 1.00 43.13 H new ATOM 810 N GLN A 51 22.287 -5.061 12.312 1.00 4.23 N ATOM 811 CA GLN A 51 23.493 -5.307 11.529 1.00 13.45 C ATOM 812 C GLN A 51 23.691 -6.800 11.290 1.00 42.41 C ATOM 813 O GLN A 51 24.587 -7.206 10.550 1.00 42.33 O ATOM 814 CB GLN A 51 24.716 -4.725 12.241 1.00 73.11 C ATOM 815 CG GLN A 51 24.686 -3.210 12.362 1.00 32.11 C ATOM 816 CD GLN A 51 25.341 -2.517 11.184 1.00 71.35 C ATOM 817 OE1 GLN A 51 24.676 -1.843 10.397 1.00 54.30 O ATOM 818 NE2 GLN A 51 26.652 -2.680 11.055 1.00 64.21 N ATOM 0 H GLN A 51 22.343 -5.372 13.282 1.00 4.23 H new ATOM 0 HA GLN A 51 23.376 -4.816 10.563 1.00 13.45 H new ATOM 0 HB2 GLN A 51 24.786 -5.159 13.238 1.00 73.11 H new ATOM 0 HB3 GLN A 51 25.615 -5.020 11.701 1.00 73.11 H new ATOM 0 HG2 GLN A 51 23.652 -2.877 12.445 1.00 32.11 H new ATOM 0 HG3 GLN A 51 25.192 -2.913 13.281 1.00 32.11 H new ATOM 0 HE21 GLN A 51 27.164 -3.247 11.730 1.00 64.21 H new ATOM 0 HE22 GLN A 51 27.147 -2.238 10.280 1.00 64.21 H new ATOM 827 N ASP A 52 22.850 -7.612 11.921 1.00 43.33 N ATOM 828 CA ASP A 52 22.933 -9.060 11.776 1.00 72.53 C ATOM 829 C ASP A 52 22.462 -9.496 10.392 1.00 55.34 C ATOM 830 O ASP A 52 21.312 -9.268 10.017 1.00 73.23 O ATOM 831 CB ASP A 52 22.096 -9.751 12.854 1.00 53.14 C ATOM 832 CG ASP A 52 22.733 -11.035 13.348 1.00 40.42 C ATOM 833 OD1 ASP A 52 23.896 -10.983 13.800 1.00 34.34 O ATOM 834 OD2 ASP A 52 22.070 -12.091 13.281 1.00 15.22 O ATOM 0 H ASP A 52 22.103 -7.292 12.538 1.00 43.33 H new ATOM 0 HA ASP A 52 23.976 -9.353 11.894 1.00 72.53 H new ATOM 0 HB2 ASP A 52 21.958 -9.071 13.694 1.00 53.14 H new ATOM 0 HB3 ASP A 52 21.105 -9.970 12.456 1.00 53.14 H new ATOM 839 N ALA A 53 23.358 -10.122 9.637 1.00 43.24 N ATOM 840 CA ALA A 53 23.034 -10.590 8.295 1.00 51.33 C ATOM 841 C ALA A 53 21.780 -11.457 8.304 1.00 21.50 C ATOM 842 O ALA A 53 20.990 -11.436 7.360 1.00 42.02 O ATOM 843 CB ALA A 53 24.207 -11.360 7.706 1.00 12.24 C ATOM 0 H ALA A 53 24.315 -10.317 9.932 1.00 43.24 H new ATOM 0 HA ALA A 53 22.837 -9.718 7.671 1.00 51.33 H new ATOM 0 HB1 ALA A 53 23.950 -11.703 6.704 1.00 12.24 H new ATOM 0 HB2 ALA A 53 25.080 -10.710 7.654 1.00 12.24 H new ATOM 0 HB3 ALA A 53 24.432 -12.220 8.337 1.00 12.24 H new ATOM 849 N LYS A 54 21.603 -12.222 9.377 1.00 41.45 N ATOM 850 CA LYS A 54 20.445 -13.097 9.510 1.00 71.20 C ATOM 851 C LYS A 54 19.155 -12.286 9.583 1.00 21.15 C ATOM 852 O LYS A 54 18.094 -12.749 9.164 1.00 21.24 O ATOM 853 CB LYS A 54 20.582 -13.971 10.759 1.00 72.54 C ATOM 854 CG LYS A 54 21.270 -15.300 10.498 1.00 33.41 C ATOM 855 CD LYS A 54 21.932 -15.841 11.754 1.00 34.43 C ATOM 856 CE LYS A 54 20.942 -16.603 12.622 1.00 35.11 C ATOM 857 NZ LYS A 54 21.627 -17.398 13.679 1.00 51.42 N ATOM 0 H LYS A 54 22.248 -12.253 10.167 1.00 41.45 H new ATOM 0 HA LYS A 54 20.401 -13.737 8.629 1.00 71.20 H new ATOM 0 HB2 LYS A 54 21.143 -13.423 11.516 1.00 72.54 H new ATOM 0 HB3 LYS A 54 19.591 -14.159 11.171 1.00 72.54 H new ATOM 0 HG2 LYS A 54 20.541 -16.022 10.130 1.00 33.41 H new ATOM 0 HG3 LYS A 54 22.019 -15.176 9.716 1.00 33.41 H new ATOM 0 HD2 LYS A 54 22.756 -16.498 11.478 1.00 34.43 H new ATOM 0 HD3 LYS A 54 22.359 -15.017 12.325 1.00 34.43 H new ATOM 0 HE2 LYS A 54 20.251 -15.900 13.087 1.00 35.11 H new ATOM 0 HE3 LYS A 54 20.347 -17.268 11.996 1.00 35.11 H new ATOM 0 HZ1 LYS A 54 20.918 -17.902 14.249 1.00 51.42 H new ATOM 0 HZ2 LYS A 54 22.268 -18.087 13.235 1.00 51.42 H new ATOM 0 HZ3 LYS A 54 22.174 -16.761 14.292 1.00 51.42 H new ATOM 871 N PHE A 55 19.254 -11.073 10.117 1.00 31.23 N ATOM 872 CA PHE A 55 18.095 -10.197 10.245 1.00 70.32 C ATOM 873 C PHE A 55 17.739 -9.568 8.901 1.00 15.24 C ATOM 874 O PHE A 55 16.686 -8.947 8.754 1.00 34.33 O ATOM 875 CB PHE A 55 18.368 -9.102 11.278 1.00 42.04 C ATOM 876 CG PHE A 55 17.724 -9.360 12.610 1.00 50.13 C ATOM 877 CD1 PHE A 55 16.345 -9.347 12.741 1.00 33.51 C ATOM 878 CD2 PHE A 55 18.498 -9.614 13.731 1.00 72.34 C ATOM 879 CE1 PHE A 55 15.749 -9.585 13.965 1.00 14.14 C ATOM 880 CE2 PHE A 55 17.907 -9.853 14.957 1.00 4.33 C ATOM 881 CZ PHE A 55 16.531 -9.837 15.075 1.00 2.21 C ATOM 0 H PHE A 55 20.125 -10.674 10.468 1.00 31.23 H new ATOM 0 HA PHE A 55 17.250 -10.799 10.580 1.00 70.32 H new ATOM 0 HB2 PHE A 55 19.445 -9.005 11.417 1.00 42.04 H new ATOM 0 HB3 PHE A 55 18.010 -8.149 10.889 1.00 42.04 H new ATOM 0 HD1 PHE A 55 15.729 -9.149 11.877 1.00 33.51 H new ATOM 0 HD2 PHE A 55 19.575 -9.625 13.646 1.00 72.34 H new ATOM 0 HE1 PHE A 55 14.673 -9.574 14.053 1.00 14.14 H new ATOM 0 HE2 PHE A 55 18.521 -10.052 15.823 1.00 4.33 H new ATOM 0 HZ PHE A 55 16.068 -10.021 16.033 1.00 2.21 H new ATOM 891 N SER A 56 18.624 -9.732 7.924 1.00 23.10 N ATOM 892 CA SER A 56 18.406 -9.177 6.593 1.00 3.45 C ATOM 893 C SER A 56 17.038 -9.582 6.053 1.00 3.21 C ATOM 894 O SER A 56 16.455 -8.885 5.222 1.00 25.13 O ATOM 895 CB SER A 56 19.504 -9.644 5.636 1.00 23.33 C ATOM 896 OG SER A 56 20.763 -9.108 6.003 1.00 4.43 O ATOM 0 H SER A 56 19.499 -10.245 8.029 1.00 23.10 H new ATOM 0 HA SER A 56 18.440 -8.090 6.670 1.00 3.45 H new ATOM 0 HB2 SER A 56 19.554 -10.733 5.639 1.00 23.33 H new ATOM 0 HB3 SER A 56 19.258 -9.339 4.619 1.00 23.33 H new ATOM 0 HG SER A 56 21.295 -9.799 6.449 1.00 4.43 H new ATOM 902 N SER A 57 16.532 -10.714 6.531 1.00 12.12 N ATOM 903 CA SER A 57 15.234 -11.215 6.094 1.00 21.43 C ATOM 904 C SER A 57 14.150 -10.159 6.287 1.00 4.12 C ATOM 905 O SER A 57 13.138 -10.157 5.587 1.00 23.33 O ATOM 906 CB SER A 57 14.868 -12.485 6.866 1.00 10.40 C ATOM 907 OG SER A 57 15.256 -13.645 6.152 1.00 22.50 O ATOM 0 H SER A 57 17.001 -11.301 7.221 1.00 12.12 H new ATOM 0 HA SER A 57 15.302 -11.450 5.032 1.00 21.43 H new ATOM 0 HB2 SER A 57 15.355 -12.475 7.841 1.00 10.40 H new ATOM 0 HB3 SER A 57 13.793 -12.508 7.046 1.00 10.40 H new ATOM 0 HG SER A 57 15.013 -14.443 6.667 1.00 22.50 H new ATOM 913 N ALA A 58 14.371 -9.261 7.242 1.00 23.41 N ATOM 914 CA ALA A 58 13.416 -8.198 7.527 1.00 72.11 C ATOM 915 C ALA A 58 14.096 -7.017 8.210 1.00 45.20 C ATOM 916 O ALA A 58 14.873 -7.193 9.148 1.00 73.31 O ATOM 917 CB ALA A 58 12.280 -8.727 8.390 1.00 11.42 C ATOM 0 H ALA A 58 15.204 -9.249 7.831 1.00 23.41 H new ATOM 0 HA ALA A 58 13.006 -7.848 6.580 1.00 72.11 H new ATOM 0 HB1 ALA A 58 11.574 -7.922 8.595 1.00 11.42 H new ATOM 0 HB2 ALA A 58 11.769 -9.533 7.864 1.00 11.42 H new ATOM 0 HB3 ALA A 58 12.683 -9.105 9.330 1.00 11.42 H new ATOM 923 N ASN A 59 13.801 -5.812 7.733 1.00 75.25 N ATOM 924 CA ASN A 59 14.386 -4.601 8.297 1.00 74.40 C ATOM 925 C ASN A 59 14.118 -4.516 9.797 1.00 64.24 C ATOM 926 O ASN A 59 13.099 -5.005 10.286 1.00 70.14 O ATOM 927 CB ASN A 59 13.823 -3.363 7.596 1.00 34.41 C ATOM 928 CG ASN A 59 13.925 -3.457 6.086 1.00 72.30 C ATOM 929 OD1 ASN A 59 12.968 -3.165 5.369 1.00 70.25 O ATOM 930 ND2 ASN A 59 15.089 -3.867 5.596 1.00 3.23 N ATOM 0 H ASN A 59 13.160 -5.648 6.957 1.00 75.25 H new ATOM 0 HA ASN A 59 15.464 -4.640 8.140 1.00 74.40 H new ATOM 0 HB2 ASN A 59 12.779 -3.232 7.879 1.00 34.41 H new ATOM 0 HB3 ASN A 59 14.360 -2.479 7.939 1.00 34.41 H new ATOM 0 HD21 ASN A 59 15.217 -3.950 4.587 1.00 3.23 H new ATOM 0 HD22 ASN A 59 15.855 -4.098 6.228 1.00 3.23 H new ATOM 937 N LEU A 60 15.040 -3.892 10.522 1.00 41.05 N ATOM 938 CA LEU A 60 14.905 -3.741 11.966 1.00 34.42 C ATOM 939 C LEU A 60 15.319 -2.342 12.409 1.00 1.20 C ATOM 940 O LEU A 60 16.456 -1.922 12.189 1.00 14.12 O ATOM 941 CB LEU A 60 15.752 -4.789 12.690 1.00 71.52 C ATOM 942 CG LEU A 60 15.260 -5.210 14.075 1.00 4.13 C ATOM 943 CD1 LEU A 60 16.021 -6.433 14.563 1.00 74.52 C ATOM 944 CD2 LEU A 60 15.404 -4.062 15.063 1.00 4.44 C ATOM 0 H LEU A 60 15.889 -3.482 10.133 1.00 41.05 H new ATOM 0 HA LEU A 60 13.856 -3.888 12.225 1.00 34.42 H new ATOM 0 HB2 LEU A 60 15.810 -5.678 12.061 1.00 71.52 H new ATOM 0 HB3 LEU A 60 16.766 -4.402 12.789 1.00 71.52 H new ATOM 0 HG LEU A 60 14.204 -5.470 14.001 1.00 4.13 H new ATOM 0 HD11 LEU A 60 15.657 -6.718 15.550 1.00 74.52 H new ATOM 0 HD12 LEU A 60 15.868 -7.258 13.868 1.00 74.52 H new ATOM 0 HD13 LEU A 60 17.084 -6.201 14.621 1.00 74.52 H new ATOM 0 HD21 LEU A 60 15.049 -4.379 16.044 1.00 4.44 H new ATOM 0 HD22 LEU A 60 16.452 -3.772 15.133 1.00 4.44 H new ATOM 0 HD23 LEU A 60 14.814 -3.212 14.721 1.00 4.44 H new ATOM 956 N ILE A 61 14.391 -1.626 13.035 1.00 2.02 N ATOM 957 CA ILE A 61 14.662 -0.275 13.512 1.00 73.32 C ATOM 958 C ILE A 61 13.865 0.032 14.775 1.00 21.54 C ATOM 959 O ILE A 61 12.848 -0.606 15.053 1.00 44.14 O ATOM 960 CB ILE A 61 14.327 0.778 12.439 1.00 30.20 C ATOM 961 CG1 ILE A 61 12.815 0.849 12.217 1.00 72.51 C ATOM 962 CG2 ILE A 61 15.045 0.454 11.137 1.00 15.21 C ATOM 963 CD1 ILE A 61 12.405 1.860 11.169 1.00 34.42 C ATOM 0 H ILE A 61 13.445 -1.958 13.224 1.00 2.02 H new ATOM 0 HA ILE A 61 15.727 -0.227 13.737 1.00 73.32 H new ATOM 0 HB ILE A 61 14.670 1.752 12.787 1.00 30.20 H new ATOM 0 HG12 ILE A 61 12.453 -0.136 11.922 1.00 72.51 H new ATOM 0 HG13 ILE A 61 12.329 1.098 13.160 1.00 72.51 H new ATOM 0 HG21 ILE A 61 14.798 1.207 10.388 1.00 15.21 H new ATOM 0 HG22 ILE A 61 16.122 0.450 11.307 1.00 15.21 H new ATOM 0 HG23 ILE A 61 14.730 -0.527 10.782 1.00 15.21 H new ATOM 0 HD11 ILE A 61 11.320 1.856 11.064 1.00 34.42 H new ATOM 0 HD12 ILE A 61 12.737 2.853 11.472 1.00 34.42 H new ATOM 0 HD13 ILE A 61 12.862 1.600 10.214 1.00 34.42 H new ATOM 975 N THR A 62 14.333 1.014 15.539 1.00 14.12 N ATOM 976 CA THR A 62 13.664 1.407 16.773 1.00 22.14 C ATOM 977 C THR A 62 12.919 2.725 16.600 1.00 41.34 C ATOM 978 O THR A 62 13.029 3.380 15.563 1.00 50.21 O ATOM 979 CB THR A 62 14.666 1.546 17.935 1.00 20.31 C ATOM 980 OG1 THR A 62 15.301 2.828 17.884 1.00 64.15 O ATOM 981 CG2 THR A 62 15.719 0.449 17.876 1.00 41.55 C ATOM 0 H THR A 62 15.173 1.552 15.325 1.00 14.12 H new ATOM 0 HA THR A 62 12.950 0.618 17.010 1.00 22.14 H new ATOM 0 HB THR A 62 14.117 1.451 18.872 1.00 20.31 H new ATOM 0 HG1 THR A 62 16.097 2.776 17.314 1.00 64.15 H new ATOM 0 HG21 THR A 62 16.415 0.568 18.706 1.00 41.55 H new ATOM 0 HG22 THR A 62 15.234 -0.525 17.946 1.00 41.55 H new ATOM 0 HG23 THR A 62 16.263 0.517 16.934 1.00 41.55 H new ATOM 989 N VAL A 63 12.161 3.110 17.621 1.00 12.42 N ATOM 990 CA VAL A 63 11.398 4.353 17.582 1.00 64.41 C ATOM 991 C VAL A 63 11.227 4.937 18.980 1.00 71.44 C ATOM 992 O VAL A 63 10.883 4.225 19.923 1.00 55.13 O ATOM 993 CB VAL A 63 10.009 4.139 16.953 1.00 71.42 C ATOM 994 CG1 VAL A 63 9.199 3.145 17.771 1.00 22.35 C ATOM 995 CG2 VAL A 63 9.272 5.463 16.826 1.00 10.45 C ATOM 0 H VAL A 63 12.058 2.579 18.486 1.00 12.42 H new ATOM 0 HA VAL A 63 11.963 5.053 16.966 1.00 64.41 H new ATOM 0 HB VAL A 63 10.142 3.726 15.953 1.00 71.42 H new ATOM 0 HG11 VAL A 63 8.221 3.007 17.311 1.00 22.35 H new ATOM 0 HG12 VAL A 63 9.722 2.189 17.805 1.00 22.35 H new ATOM 0 HG13 VAL A 63 9.073 3.525 18.785 1.00 22.35 H new ATOM 0 HG21 VAL A 63 8.292 5.293 16.380 1.00 10.45 H new ATOM 0 HG22 VAL A 63 9.148 5.907 17.814 1.00 10.45 H new ATOM 0 HG23 VAL A 63 9.846 6.140 16.193 1.00 10.45 H new ATOM 1005 N ALA A 64 11.469 6.237 19.105 1.00 2.32 N ATOM 1006 CA ALA A 64 11.339 6.918 20.387 1.00 2.25 C ATOM 1007 C ALA A 64 10.260 7.994 20.331 1.00 73.21 C ATOM 1008 O ALA A 64 9.924 8.494 19.257 1.00 32.34 O ATOM 1009 CB ALA A 64 12.672 7.526 20.800 1.00 53.23 C ATOM 0 H ALA A 64 11.756 6.840 18.334 1.00 2.32 H new ATOM 0 HA ALA A 64 11.042 6.181 21.133 1.00 2.25 H new ATOM 0 HB1 ALA A 64 12.560 8.031 21.759 1.00 53.23 H new ATOM 0 HB2 ALA A 64 13.419 6.737 20.890 1.00 53.23 H new ATOM 0 HB3 ALA A 64 12.993 8.245 20.046 1.00 53.23 H new ATOM 1015 N SER A 65 9.719 8.345 21.493 1.00 22.14 N ATOM 1016 CA SER A 65 8.674 9.358 21.575 1.00 11.33 C ATOM 1017 C SER A 65 9.087 10.491 22.511 1.00 61.43 C ATOM 1018 O SER A 65 8.748 10.507 23.694 1.00 2.52 O ATOM 1019 CB SER A 65 7.365 8.733 22.060 1.00 33.15 C ATOM 1020 OG SER A 65 7.307 7.355 21.736 1.00 21.43 O ATOM 0 H SER A 65 9.987 7.943 22.391 1.00 22.14 H new ATOM 0 HA SER A 65 8.524 9.771 20.577 1.00 11.33 H new ATOM 0 HB2 SER A 65 7.275 8.860 23.139 1.00 33.15 H new ATOM 0 HB3 SER A 65 6.521 9.252 21.607 1.00 33.15 H new ATOM 0 HG SER A 65 6.462 6.978 22.058 1.00 21.43 H new ATOM 1026 N PRO A 66 9.838 11.461 21.968 1.00 31.23 N ATOM 1027 CA PRO A 66 10.314 12.616 22.735 1.00 30.44 C ATOM 1028 C PRO A 66 9.183 13.567 23.113 1.00 24.31 C ATOM 1029 O PRO A 66 8.523 14.137 22.246 1.00 60.23 O ATOM 1030 CB PRO A 66 11.291 13.300 21.776 1.00 12.42 C ATOM 1031 CG PRO A 66 10.834 12.895 20.417 1.00 0.23 C ATOM 1032 CD PRO A 66 10.279 11.505 20.564 1.00 3.32 C ATOM 0 HA PRO A 66 10.763 12.319 23.683 1.00 30.44 H new ATOM 0 HB2 PRO A 66 11.269 14.383 21.895 1.00 12.42 H new ATOM 0 HB3 PRO A 66 12.316 12.980 21.961 1.00 12.42 H new ATOM 0 HG2 PRO A 66 10.075 13.580 20.040 1.00 0.23 H new ATOM 0 HG3 PRO A 66 11.660 12.912 19.706 1.00 0.23 H new ATOM 0 HD2 PRO A 66 9.451 11.328 19.877 1.00 3.32 H new ATOM 0 HD3 PRO A 66 11.034 10.747 20.356 1.00 3.32 H new ATOM 1040 N GLY A 67 8.966 13.734 24.414 1.00 21.42 N ATOM 1041 CA GLY A 67 7.915 14.617 24.883 1.00 13.04 C ATOM 1042 C GLY A 67 6.602 13.891 25.101 1.00 11.24 C ATOM 1043 O GLY A 67 5.554 14.520 25.250 1.00 32.12 O ATOM 0 H GLY A 67 9.500 13.273 25.151 1.00 21.42 H new ATOM 0 HA2 GLY A 67 8.227 15.085 25.817 1.00 13.04 H new ATOM 0 HA3 GLY A 67 7.768 15.418 24.159 1.00 13.04 H new ATOM 1047 N PHE A 68 6.657 12.564 25.119 1.00 65.41 N ATOM 1048 CA PHE A 68 5.463 11.751 25.317 1.00 30.04 C ATOM 1049 C PHE A 68 5.675 10.737 26.438 1.00 61.24 C ATOM 1050 O PHE A 68 6.782 10.235 26.635 1.00 65.33 O ATOM 1051 CB PHE A 68 5.092 11.027 24.022 1.00 61.53 C ATOM 1052 CG PHE A 68 3.757 10.341 24.079 1.00 30.14 C ATOM 1053 CD1 PHE A 68 2.665 10.968 24.658 1.00 44.45 C ATOM 1054 CD2 PHE A 68 3.594 9.068 23.556 1.00 53.42 C ATOM 1055 CE1 PHE A 68 1.435 10.340 24.712 1.00 43.41 C ATOM 1056 CE2 PHE A 68 2.366 8.436 23.607 1.00 61.31 C ATOM 1057 CZ PHE A 68 1.286 9.072 24.187 1.00 72.12 C ATOM 0 H PHE A 68 7.516 12.028 24.999 1.00 65.41 H new ATOM 0 HA PHE A 68 4.646 12.414 25.601 1.00 30.04 H new ATOM 0 HB2 PHE A 68 5.087 11.745 23.202 1.00 61.53 H new ATOM 0 HB3 PHE A 68 5.861 10.289 23.795 1.00 61.53 H new ATOM 0 HD1 PHE A 68 2.777 11.959 25.072 1.00 44.45 H new ATOM 0 HD2 PHE A 68 4.436 8.564 23.104 1.00 53.42 H new ATOM 0 HE1 PHE A 68 0.592 10.841 25.164 1.00 43.41 H new ATOM 0 HE2 PHE A 68 2.251 7.445 23.193 1.00 61.31 H new ATOM 0 HZ PHE A 68 0.326 8.578 24.230 1.00 72.12 H new ATOM 1067 N LEU A 69 4.607 10.440 27.169 1.00 14.51 N ATOM 1068 CA LEU A 69 4.674 9.486 28.271 1.00 41.44 C ATOM 1069 C LEU A 69 5.602 9.991 29.372 1.00 74.44 C ATOM 1070 O LEU A 69 5.152 10.583 30.353 1.00 25.14 O ATOM 1071 CB LEU A 69 5.157 8.126 27.764 1.00 1.23 C ATOM 1072 CG LEU A 69 4.067 7.100 27.453 1.00 11.11 C ATOM 1073 CD1 LEU A 69 3.546 6.470 28.735 1.00 32.52 C ATOM 1074 CD2 LEU A 69 2.931 7.748 26.675 1.00 12.23 C ATOM 0 H LEU A 69 3.683 10.846 27.019 1.00 14.51 H new ATOM 0 HA LEU A 69 3.673 9.377 28.687 1.00 41.44 H new ATOM 0 HB2 LEU A 69 5.746 8.286 26.861 1.00 1.23 H new ATOM 0 HB3 LEU A 69 5.827 7.700 28.510 1.00 1.23 H new ATOM 0 HG LEU A 69 4.501 6.313 26.836 1.00 11.11 H new ATOM 0 HD11 LEU A 69 2.771 5.742 28.494 1.00 32.52 H new ATOM 0 HD12 LEU A 69 4.364 5.970 29.253 1.00 32.52 H new ATOM 0 HD13 LEU A 69 3.129 7.245 29.378 1.00 32.52 H new ATOM 0 HD21 LEU A 69 2.164 7.003 26.462 1.00 12.23 H new ATOM 0 HD22 LEU A 69 2.499 8.555 27.267 1.00 12.23 H new ATOM 0 HD23 LEU A 69 3.315 8.151 25.738 1.00 12.23 H new ATOM 1086 N HIS A 70 6.898 9.753 29.201 1.00 43.45 N ATOM 1087 CA HIS A 70 7.890 10.186 30.179 1.00 41.14 C ATOM 1088 C HIS A 70 9.273 10.286 29.542 1.00 22.02 C ATOM 1089 O HIS A 70 10.290 10.209 30.231 1.00 71.21 O ATOM 1090 CB HIS A 70 7.929 9.217 31.360 1.00 34.34 C ATOM 1091 CG HIS A 70 7.585 9.856 32.671 1.00 61.33 C ATOM 1092 ND1 HIS A 70 6.316 9.833 33.209 1.00 30.24 N ATOM 1093 CD2 HIS A 70 8.354 10.537 33.552 1.00 21.21 C ATOM 1094 CE1 HIS A 70 6.319 10.474 34.365 1.00 72.44 C ATOM 1095 NE2 HIS A 70 7.544 10.910 34.596 1.00 52.21 N ATOM 0 H HIS A 70 7.286 9.263 28.395 1.00 43.45 H new ATOM 0 HA HIS A 70 7.602 11.174 30.539 1.00 41.14 H new ATOM 0 HB2 HIS A 70 7.235 8.398 31.171 1.00 34.34 H new ATOM 0 HB3 HIS A 70 8.925 8.780 31.428 1.00 34.34 H new ATOM 0 HD2 HIS A 70 9.409 10.748 33.452 1.00 21.21 H new ATOM 0 HE1 HIS A 70 5.465 10.617 35.011 1.00 72.44 H new ATOM 0 HE2 HIS A 70 7.840 11.438 35.417 1.00 52.21 H new ATOM 1103 N GLU A 71 9.302 10.457 28.224 1.00 10.12 N ATOM 1104 CA GLU A 71 10.561 10.565 27.496 1.00 54.50 C ATOM 1105 C GLU A 71 11.044 12.012 27.457 1.00 53.52 C ATOM 1106 O GLU A 71 10.260 12.946 27.631 1.00 71.14 O ATOM 1107 CB GLU A 71 10.399 10.032 26.071 1.00 33.42 C ATOM 1108 CG GLU A 71 10.999 8.651 25.867 1.00 74.42 C ATOM 1109 CD GLU A 71 12.452 8.704 25.437 1.00 73.44 C ATOM 1110 OE1 GLU A 71 13.190 9.574 25.943 1.00 32.14 O ATOM 1111 OE2 GLU A 71 12.850 7.874 24.593 1.00 65.42 O ATOM 0 H GLU A 71 8.469 10.524 27.639 1.00 10.12 H new ATOM 0 HA GLU A 71 11.306 9.965 28.018 1.00 54.50 H new ATOM 0 HB2 GLU A 71 9.338 9.998 25.823 1.00 33.42 H new ATOM 0 HB3 GLU A 71 10.867 10.729 25.376 1.00 33.42 H new ATOM 0 HG2 GLU A 71 10.919 8.084 26.794 1.00 74.42 H new ATOM 0 HG3 GLU A 71 10.421 8.115 25.114 1.00 74.42 H new ATOM 1118 N LYS A 72 12.340 12.191 27.228 1.00 43.12 N ATOM 1119 CA LYS A 72 12.930 13.523 27.165 1.00 62.02 C ATOM 1120 C LYS A 72 12.272 14.359 26.072 1.00 72.43 C ATOM 1121 O LYS A 72 11.559 13.832 25.217 1.00 31.43 O ATOM 1122 CB LYS A 72 14.436 13.425 26.909 1.00 31.32 C ATOM 1123 CG LYS A 72 15.164 12.533 27.900 1.00 1.20 C ATOM 1124 CD LYS A 72 16.530 12.119 27.378 1.00 34.42 C ATOM 1125 CE LYS A 72 17.651 12.708 28.221 1.00 73.53 C ATOM 1126 NZ LYS A 72 18.146 11.740 29.239 1.00 43.14 N ATOM 0 H LYS A 72 13.003 11.429 27.083 1.00 43.12 H new ATOM 0 HA LYS A 72 12.761 14.013 28.124 1.00 62.02 H new ATOM 0 HB2 LYS A 72 14.601 13.044 25.901 1.00 31.32 H new ATOM 0 HB3 LYS A 72 14.868 14.425 26.947 1.00 31.32 H new ATOM 0 HG2 LYS A 72 15.280 13.059 28.848 1.00 1.20 H new ATOM 0 HG3 LYS A 72 14.565 11.644 28.100 1.00 1.20 H new ATOM 0 HD2 LYS A 72 16.606 11.032 27.378 1.00 34.42 H new ATOM 0 HD3 LYS A 72 16.640 12.446 26.344 1.00 34.42 H new ATOM 0 HE2 LYS A 72 18.475 13.006 27.573 1.00 73.53 H new ATOM 0 HE3 LYS A 72 17.295 13.610 28.720 1.00 73.53 H new ATOM 0 HZ1 LYS A 72 18.429 12.254 30.098 1.00 43.14 H new ATOM 0 HZ2 LYS A 72 17.390 11.065 29.473 1.00 43.14 H new ATOM 0 HZ3 LYS A 72 18.965 11.224 28.858 1.00 43.14 H new ATOM 1140 N LYS A 73 12.516 15.664 26.103 1.00 1.24 N ATOM 1141 CA LYS A 73 11.950 16.573 25.114 1.00 14.31 C ATOM 1142 C LYS A 73 12.798 16.595 23.846 1.00 34.24 C ATOM 1143 O LYS A 73 13.991 16.295 23.882 1.00 42.15 O ATOM 1144 CB LYS A 73 11.842 17.986 25.692 1.00 13.12 C ATOM 1145 CG LYS A 73 13.162 18.536 26.204 1.00 14.15 C ATOM 1146 CD LYS A 73 13.039 19.040 27.633 1.00 50.44 C ATOM 1147 CE LYS A 73 13.065 17.895 28.632 1.00 35.54 C ATOM 1148 NZ LYS A 73 13.143 18.385 30.036 1.00 3.03 N ATOM 0 H LYS A 73 13.103 16.117 26.804 1.00 1.24 H new ATOM 0 HA LYS A 73 10.953 16.215 24.857 1.00 14.31 H new ATOM 0 HB2 LYS A 73 11.453 18.655 24.924 1.00 13.12 H new ATOM 0 HB3 LYS A 73 11.119 17.982 26.508 1.00 13.12 H new ATOM 0 HG2 LYS A 73 13.924 17.759 26.156 1.00 14.15 H new ATOM 0 HG3 LYS A 73 13.494 19.349 25.558 1.00 14.15 H new ATOM 0 HD2 LYS A 73 13.855 19.730 27.848 1.00 50.44 H new ATOM 0 HD3 LYS A 73 12.110 19.600 27.744 1.00 50.44 H new ATOM 0 HE2 LYS A 73 12.170 17.286 28.509 1.00 35.54 H new ATOM 0 HE3 LYS A 73 13.920 17.251 28.424 1.00 35.54 H new ATOM 0 HZ1 LYS A 73 13.159 17.574 30.686 1.00 3.03 H new ATOM 0 HZ2 LYS A 73 14.010 18.945 30.160 1.00 3.03 H new ATOM 0 HZ3 LYS A 73 12.315 18.979 30.243 1.00 3.03 H new ATOM 1162 N ASP A 74 12.174 16.952 22.729 1.00 1.11 N ATOM 1163 CA ASP A 74 12.872 17.015 21.450 1.00 5.35 C ATOM 1164 C ASP A 74 14.161 17.822 21.575 1.00 43.15 C ATOM 1165 O ASP A 74 14.226 18.797 22.322 1.00 52.00 O ATOM 1166 CB ASP A 74 11.970 17.634 20.382 1.00 13.11 C ATOM 1167 CG ASP A 74 12.623 17.657 19.014 1.00 22.23 C ATOM 1168 OD1 ASP A 74 13.492 18.524 18.787 1.00 53.35 O ATOM 1169 OD2 ASP A 74 12.265 16.807 18.171 1.00 3.52 O ATOM 0 H ASP A 74 11.186 17.202 22.683 1.00 1.11 H new ATOM 0 HA ASP A 74 13.128 15.998 21.153 1.00 5.35 H new ATOM 0 HB2 ASP A 74 11.038 17.071 20.327 1.00 13.11 H new ATOM 0 HB3 ASP A 74 11.711 18.651 20.675 1.00 13.11 H new ATOM 1174 N GLY A 75 15.187 17.407 20.837 1.00 53.34 N ATOM 1175 CA GLY A 75 16.460 18.102 20.879 1.00 23.45 C ATOM 1176 C GLY A 75 17.388 17.547 21.943 1.00 74.25 C ATOM 1177 O GLY A 75 18.574 17.335 21.692 1.00 42.03 O ATOM 0 H GLY A 75 15.159 16.602 20.211 1.00 53.34 H new ATOM 0 HA2 GLY A 75 16.943 18.028 19.905 1.00 23.45 H new ATOM 0 HA3 GLY A 75 16.286 19.161 21.069 1.00 23.45 H new ATOM 1181 N ASP A 76 16.847 17.312 23.133 1.00 11.50 N ATOM 1182 CA ASP A 76 17.634 16.780 24.239 1.00 62.41 C ATOM 1183 C ASP A 76 17.866 15.282 24.068 1.00 21.55 C ATOM 1184 O ASP A 76 18.981 14.791 24.248 1.00 20.02 O ATOM 1185 CB ASP A 76 16.932 17.051 25.570 1.00 1.43 C ATOM 1186 CG ASP A 76 17.785 17.872 26.518 1.00 61.13 C ATOM 1187 OD1 ASP A 76 18.153 19.007 26.151 1.00 4.34 O ATOM 1188 OD2 ASP A 76 18.085 17.378 27.625 1.00 1.21 O ATOM 0 H ASP A 76 15.866 17.482 23.357 1.00 11.50 H new ATOM 0 HA ASP A 76 18.601 17.282 24.239 1.00 62.41 H new ATOM 0 HB2 ASP A 76 15.995 17.575 25.383 1.00 1.43 H new ATOM 0 HB3 ASP A 76 16.678 16.103 26.043 1.00 1.43 H new ATOM 1193 N PHE A 77 16.806 14.559 23.722 1.00 52.42 N ATOM 1194 CA PHE A 77 16.893 13.117 23.529 1.00 22.43 C ATOM 1195 C PHE A 77 17.916 12.773 22.451 1.00 64.23 C ATOM 1196 O PHE A 77 18.657 11.797 22.572 1.00 15.21 O ATOM 1197 CB PHE A 77 15.525 12.548 23.150 1.00 75.53 C ATOM 1198 CG PHE A 77 15.560 11.089 22.794 1.00 35.44 C ATOM 1199 CD1 PHE A 77 15.841 10.684 21.499 1.00 14.03 C ATOM 1200 CD2 PHE A 77 15.312 10.122 23.755 1.00 31.34 C ATOM 1201 CE1 PHE A 77 15.873 9.342 21.170 1.00 54.34 C ATOM 1202 CE2 PHE A 77 15.343 8.778 23.432 1.00 50.33 C ATOM 1203 CZ PHE A 77 15.625 8.388 22.137 1.00 12.22 C ATOM 0 H PHE A 77 15.876 14.949 23.569 1.00 52.42 H new ATOM 0 HA PHE A 77 17.217 12.669 24.468 1.00 22.43 H new ATOM 0 HB2 PHE A 77 14.836 12.694 23.982 1.00 75.53 H new ATOM 0 HB3 PHE A 77 15.128 13.111 22.305 1.00 75.53 H new ATOM 0 HD1 PHE A 77 16.037 11.425 20.738 1.00 14.03 H new ATOM 0 HD2 PHE A 77 15.092 10.422 24.769 1.00 31.34 H new ATOM 0 HE1 PHE A 77 16.092 9.040 20.157 1.00 54.34 H new ATOM 0 HE2 PHE A 77 15.147 8.035 24.191 1.00 50.33 H new ATOM 0 HZ PHE A 77 15.651 7.339 21.881 1.00 12.22 H new ATOM 1213 N GLN A 78 17.950 13.581 21.396 1.00 2.44 N ATOM 1214 CA GLN A 78 18.881 13.362 20.296 1.00 42.22 C ATOM 1215 C GLN A 78 20.322 13.571 20.751 1.00 14.14 C ATOM 1216 O GLN A 78 21.188 12.730 20.512 1.00 21.11 O ATOM 1217 CB GLN A 78 18.560 14.303 19.133 1.00 31.12 C ATOM 1218 CG GLN A 78 17.307 13.915 18.365 1.00 60.32 C ATOM 1219 CD GLN A 78 16.059 14.583 18.908 1.00 61.53 C ATOM 1220 OE1 GLN A 78 15.651 14.333 20.042 1.00 31.23 O ATOM 1221 NE2 GLN A 78 15.445 15.438 18.098 1.00 22.24 N ATOM 0 H GLN A 78 17.344 14.393 21.280 1.00 2.44 H new ATOM 0 HA GLN A 78 18.771 12.331 19.961 1.00 42.22 H new ATOM 0 HB2 GLN A 78 18.441 15.316 19.518 1.00 31.12 H new ATOM 0 HB3 GLN A 78 19.406 14.320 18.446 1.00 31.12 H new ATOM 0 HG2 GLN A 78 17.431 14.183 17.316 1.00 60.32 H new ATOM 0 HG3 GLN A 78 17.182 12.833 18.405 1.00 60.32 H new ATOM 0 HE21 GLN A 78 15.819 15.615 17.166 1.00 22.24 H new ATOM 0 HE22 GLN A 78 14.600 15.917 18.408 1.00 22.24 H new ATOM 1230 N LYS A 79 20.571 14.698 21.409 1.00 3.30 N ATOM 1231 CA LYS A 79 21.906 15.019 21.900 1.00 64.14 C ATOM 1232 C LYS A 79 22.312 14.076 23.028 1.00 43.01 C ATOM 1233 O LYS A 79 23.499 13.844 23.259 1.00 41.24 O ATOM 1234 CB LYS A 79 21.958 16.468 22.388 1.00 2.23 C ATOM 1235 CG LYS A 79 21.698 16.618 23.877 1.00 34.32 C ATOM 1236 CD LYS A 79 21.200 18.012 24.219 1.00 50.11 C ATOM 1237 CE LYS A 79 22.337 19.023 24.228 1.00 74.12 C ATOM 1238 NZ LYS A 79 21.873 20.382 23.834 1.00 42.13 N ATOM 0 H LYS A 79 19.865 15.405 21.615 1.00 3.30 H new ATOM 0 HA LYS A 79 22.609 14.895 21.076 1.00 64.14 H new ATOM 0 HB2 LYS A 79 22.937 16.886 22.155 1.00 2.23 H new ATOM 0 HB3 LYS A 79 21.222 17.054 21.838 1.00 2.23 H new ATOM 0 HG2 LYS A 79 20.962 15.880 24.195 1.00 34.32 H new ATOM 0 HG3 LYS A 79 22.615 16.412 24.430 1.00 34.32 H new ATOM 0 HD2 LYS A 79 20.445 18.318 23.494 1.00 50.11 H new ATOM 0 HD3 LYS A 79 20.717 17.997 25.196 1.00 50.11 H new ATOM 0 HE2 LYS A 79 22.778 19.064 25.224 1.00 74.12 H new ATOM 0 HE3 LYS A 79 23.121 18.695 23.545 1.00 74.12 H new ATOM 0 HZ1 LYS A 79 22.676 21.042 23.852 1.00 42.13 H new ATOM 0 HZ2 LYS A 79 21.475 20.348 22.874 1.00 42.13 H new ATOM 0 HZ3 LYS A 79 21.143 20.706 24.500 1.00 42.13 H new ATOM 1252 N TRP A 80 21.321 13.535 23.726 1.00 75.12 N ATOM 1253 CA TRP A 80 21.575 12.616 24.829 1.00 24.32 C ATOM 1254 C TRP A 80 21.855 11.209 24.312 1.00 24.13 C ATOM 1255 O TRP A 80 22.768 10.533 24.788 1.00 33.32 O ATOM 1256 CB TRP A 80 20.383 12.593 25.787 1.00 72.43 C ATOM 1257 CG TRP A 80 20.314 11.349 26.620 1.00 22.21 C ATOM 1258 CD1 TRP A 80 20.863 11.159 27.856 1.00 12.44 C ATOM 1259 CD2 TRP A 80 19.661 10.122 26.276 1.00 23.14 C ATOM 1260 NE1 TRP A 80 20.590 9.888 28.302 1.00 43.41 N ATOM 1261 CE2 TRP A 80 19.854 9.232 27.351 1.00 11.24 C ATOM 1262 CE3 TRP A 80 18.931 9.689 25.166 1.00 21.24 C ATOM 1263 CZ2 TRP A 80 19.343 7.937 27.346 1.00 64.22 C ATOM 1264 CZ3 TRP A 80 18.425 8.403 25.162 1.00 24.13 C ATOM 1265 CH2 TRP A 80 18.633 7.539 26.246 1.00 15.31 C ATOM 0 H TRP A 80 20.333 13.717 23.548 1.00 75.12 H new ATOM 0 HA TRP A 80 22.456 12.968 25.366 1.00 24.32 H new ATOM 0 HB2 TRP A 80 20.439 13.460 26.445 1.00 72.43 H new ATOM 0 HB3 TRP A 80 19.462 12.688 25.212 1.00 72.43 H new ATOM 0 HD1 TRP A 80 21.429 11.899 28.403 1.00 12.44 H new ATOM 0 HE1 TRP A 80 20.887 9.497 29.196 1.00 43.41 H new ATOM 0 HE3 TRP A 80 18.765 10.348 24.326 1.00 21.24 H new ATOM 0 HZ2 TRP A 80 19.501 7.270 28.181 1.00 64.22 H new ATOM 0 HZ3 TRP A 80 17.860 8.058 24.309 1.00 24.13 H new ATOM 0 HH2 TRP A 80 18.225 6.540 26.212 1.00 15.31 H new ATOM 1276 N TYR A 81 21.066 10.774 23.336 1.00 3.13 N ATOM 1277 CA TYR A 81 21.229 9.446 22.757 1.00 54.15 C ATOM 1278 C TYR A 81 22.438 9.401 21.828 1.00 50.34 C ATOM 1279 O TYR A 81 23.054 8.352 21.643 1.00 4.41 O ATOM 1280 CB TYR A 81 19.968 9.044 21.990 1.00 75.21 C ATOM 1281 CG TYR A 81 20.228 8.068 20.865 1.00 23.30 C ATOM 1282 CD1 TYR A 81 20.442 6.719 21.125 1.00 51.43 C ATOM 1283 CD2 TYR A 81 20.262 8.493 19.543 1.00 2.50 C ATOM 1284 CE1 TYR A 81 20.681 5.824 20.100 1.00 22.13 C ATOM 1285 CE2 TYR A 81 20.499 7.605 18.512 1.00 23.13 C ATOM 1286 CZ TYR A 81 20.708 6.271 18.796 1.00 45.31 C ATOM 1287 OH TYR A 81 20.946 5.383 17.772 1.00 4.30 O ATOM 0 H TYR A 81 20.307 11.321 22.929 1.00 3.13 H new ATOM 0 HA TYR A 81 21.393 8.740 23.571 1.00 54.15 H new ATOM 0 HB2 TYR A 81 19.255 8.602 22.686 1.00 75.21 H new ATOM 0 HB3 TYR A 81 19.500 9.940 21.582 1.00 75.21 H new ATOM 0 HD1 TYR A 81 20.421 6.365 22.145 1.00 51.43 H new ATOM 0 HD2 TYR A 81 20.100 9.537 19.317 1.00 2.50 H new ATOM 0 HE1 TYR A 81 20.846 4.779 20.319 1.00 22.13 H new ATOM 0 HE2 TYR A 81 20.521 7.953 17.490 1.00 23.13 H new ATOM 0 HH TYR A 81 20.323 5.558 17.036 1.00 4.30 H new ATOM 1297 N ALA A 82 22.772 10.549 21.246 1.00 74.43 N ATOM 1298 CA ALA A 82 23.908 10.643 20.338 1.00 23.41 C ATOM 1299 C ALA A 82 25.226 10.511 21.094 1.00 44.44 C ATOM 1300 O ALA A 82 26.292 10.405 20.488 1.00 2.33 O ATOM 1301 CB ALA A 82 23.865 11.957 19.572 1.00 21.34 C ATOM 0 H ALA A 82 22.272 11.426 21.388 1.00 74.43 H new ATOM 0 HA ALA A 82 23.843 9.820 19.627 1.00 23.41 H new ATOM 0 HB1 ALA A 82 24.720 12.013 18.898 1.00 21.34 H new ATOM 0 HB2 ALA A 82 22.943 12.011 18.994 1.00 21.34 H new ATOM 0 HB3 ALA A 82 23.902 12.789 20.275 1.00 21.34 H new ATOM 1307 N GLY A 83 25.146 10.520 22.421 1.00 41.12 N ATOM 1308 CA GLY A 83 26.340 10.402 23.237 1.00 2.20 C ATOM 1309 C GLY A 83 26.355 9.131 24.062 1.00 65.41 C ATOM 1310 O GLY A 83 26.961 9.084 25.133 1.00 21.15 O ATOM 0 H GLY A 83 24.275 10.607 22.945 1.00 41.12 H new ATOM 0 HA2 GLY A 83 27.220 10.424 22.594 1.00 2.20 H new ATOM 0 HA3 GLY A 83 26.409 11.263 23.901 1.00 2.20 H new ATOM 1314 N LEU A 84 25.687 8.096 23.564 1.00 52.40 N ATOM 1315 CA LEU A 84 25.624 6.818 24.263 1.00 21.51 C ATOM 1316 C LEU A 84 26.734 5.884 23.790 1.00 35.44 C ATOM 1317 O LEU A 84 27.813 5.838 24.379 1.00 52.11 O ATOM 1318 CB LEU A 84 24.260 6.160 24.044 1.00 44.23 C ATOM 1319 CG LEU A 84 23.213 6.409 25.129 1.00 11.05 C ATOM 1320 CD1 LEU A 84 23.326 7.828 25.665 1.00 21.23 C ATOM 1321 CD2 LEU A 84 21.814 6.151 24.590 1.00 73.22 C ATOM 0 H LEU A 84 25.181 8.117 22.678 1.00 52.40 H new ATOM 0 HA LEU A 84 25.762 7.007 25.328 1.00 21.51 H new ATOM 0 HB2 LEU A 84 23.859 6.510 23.093 1.00 44.23 H new ATOM 0 HB3 LEU A 84 24.409 5.084 23.951 1.00 44.23 H new ATOM 0 HG LEU A 84 23.398 5.716 25.950 1.00 11.05 H new ATOM 0 HD11 LEU A 84 22.573 7.987 26.436 1.00 21.23 H new ATOM 0 HD12 LEU A 84 24.318 7.978 26.090 1.00 21.23 H new ATOM 0 HD13 LEU A 84 23.168 8.537 24.853 1.00 21.23 H new ATOM 0 HD21 LEU A 84 21.082 6.333 25.377 1.00 73.22 H new ATOM 0 HD22 LEU A 84 21.619 6.818 23.751 1.00 73.22 H new ATOM 0 HD23 LEU A 84 21.738 5.116 24.256 1.00 73.22 H new ATOM 1333 N ASN A 85 26.460 5.141 22.722 1.00 1.42 N ATOM 1334 CA ASN A 85 27.436 4.209 22.169 1.00 51.40 C ATOM 1335 C ASN A 85 26.819 3.377 21.049 1.00 50.11 C ATOM 1336 O ASN A 85 27.150 2.203 20.879 1.00 50.51 O ATOM 1337 CB ASN A 85 27.973 3.289 23.267 1.00 13.01 C ATOM 1338 CG ASN A 85 29.485 3.337 23.373 1.00 33.44 C ATOM 1339 OD1 ASN A 85 30.148 2.300 23.411 1.00 43.31 O ATOM 1340 ND2 ASN A 85 30.037 4.543 23.423 1.00 55.43 N ATOM 0 H ASN A 85 25.571 5.166 22.223 1.00 1.42 H new ATOM 0 HA ASN A 85 28.261 4.789 21.755 1.00 51.40 H new ATOM 0 HB2 ASN A 85 27.535 3.575 24.223 1.00 13.01 H new ATOM 0 HB3 ASN A 85 27.658 2.265 23.066 1.00 13.01 H new ATOM 0 HD21 ASN A 85 31.050 4.638 23.496 1.00 55.43 H new ATOM 0 HD22 ASN A 85 29.448 5.375 23.388 1.00 55.43 H new ATOM 1347 N TYR A 86 25.921 3.993 20.288 1.00 65.14 N ATOM 1348 CA TYR A 86 25.257 3.309 19.185 1.00 54.03 C ATOM 1349 C TYR A 86 25.007 4.265 18.022 1.00 23.10 C ATOM 1350 O TYR A 86 23.870 4.611 17.702 1.00 10.01 O ATOM 1351 CB TYR A 86 23.933 2.705 19.656 1.00 73.24 C ATOM 1352 CG TYR A 86 23.973 2.193 21.078 1.00 74.22 C ATOM 1353 CD1 TYR A 86 24.437 0.915 21.365 1.00 45.45 C ATOM 1354 CD2 TYR A 86 23.546 2.987 22.135 1.00 41.40 C ATOM 1355 CE1 TYR A 86 24.475 0.443 22.662 1.00 11.53 C ATOM 1356 CE2 TYR A 86 23.581 2.524 23.436 1.00 3.31 C ATOM 1357 CZ TYR A 86 24.046 1.252 23.695 1.00 60.45 C ATOM 1358 OH TYR A 86 24.083 0.786 24.989 1.00 60.42 O ATOM 0 H TYR A 86 25.636 4.964 20.415 1.00 65.14 H new ATOM 0 HA TYR A 86 25.912 2.509 18.840 1.00 54.03 H new ATOM 0 HB2 TYR A 86 23.149 3.458 19.572 1.00 73.24 H new ATOM 0 HB3 TYR A 86 23.660 1.885 18.991 1.00 73.24 H new ATOM 0 HD1 TYR A 86 24.774 0.280 20.559 1.00 45.45 H new ATOM 0 HD2 TYR A 86 23.180 3.984 21.936 1.00 41.40 H new ATOM 0 HE1 TYR A 86 24.838 -0.553 22.867 1.00 11.53 H new ATOM 0 HE2 TYR A 86 23.246 3.155 24.246 1.00 3.31 H new ATOM 0 HH TYR A 86 23.748 1.479 25.596 1.00 60.42 H new ATOM 1368 N PRO A 87 26.097 4.702 17.373 1.00 53.00 N ATOM 1369 CA PRO A 87 26.024 5.623 16.235 1.00 74.23 C ATOM 1370 C PRO A 87 25.428 4.965 14.994 1.00 4.14 C ATOM 1371 O PRO A 87 25.074 5.642 14.029 1.00 3.30 O ATOM 1372 CB PRO A 87 27.487 6.001 15.990 1.00 74.44 C ATOM 1373 CG PRO A 87 28.270 4.854 16.530 1.00 54.12 C ATOM 1374 CD PRO A 87 27.484 4.331 17.700 1.00 34.30 C ATOM 0 HA PRO A 87 25.378 6.476 16.442 1.00 74.23 H new ATOM 0 HB2 PRO A 87 27.685 6.151 14.929 1.00 74.44 H new ATOM 0 HB3 PRO A 87 27.746 6.931 16.497 1.00 74.44 H new ATOM 0 HG2 PRO A 87 28.403 4.081 15.773 1.00 54.12 H new ATOM 0 HG3 PRO A 87 29.266 5.172 16.839 1.00 54.12 H new ATOM 0 HD2 PRO A 87 27.596 3.252 17.809 1.00 34.30 H new ATOM 0 HD3 PRO A 87 27.810 4.782 18.637 1.00 34.30 H new ATOM 1382 N LYS A 88 25.320 3.641 15.027 1.00 43.24 N ATOM 1383 CA LYS A 88 24.766 2.891 13.906 1.00 61.21 C ATOM 1384 C LYS A 88 23.438 2.245 14.287 1.00 14.51 C ATOM 1385 O LYS A 88 23.009 1.271 13.667 1.00 15.34 O ATOM 1386 CB LYS A 88 25.754 1.816 13.447 1.00 41.13 C ATOM 1387 CG LYS A 88 26.277 2.033 12.037 1.00 2.14 C ATOM 1388 CD LYS A 88 27.770 1.765 11.949 1.00 4.34 C ATOM 1389 CE LYS A 88 28.569 3.060 11.942 1.00 23.53 C ATOM 1390 NZ LYS A 88 30.025 2.814 12.134 1.00 24.52 N ATOM 0 H LYS A 88 25.609 3.065 15.818 1.00 43.24 H new ATOM 0 HA LYS A 88 24.590 3.588 13.087 1.00 61.21 H new ATOM 0 HB2 LYS A 88 26.597 1.790 14.138 1.00 41.13 H new ATOM 0 HB3 LYS A 88 25.268 0.842 13.499 1.00 41.13 H new ATOM 0 HG2 LYS A 88 25.747 1.377 11.346 1.00 2.14 H new ATOM 0 HG3 LYS A 88 26.071 3.057 11.725 1.00 2.14 H new ATOM 0 HD2 LYS A 88 28.081 1.149 12.793 1.00 4.34 H new ATOM 0 HD3 LYS A 88 27.986 1.198 11.044 1.00 4.34 H new ATOM 0 HE2 LYS A 88 28.410 3.580 10.997 1.00 23.53 H new ATOM 0 HE3 LYS A 88 28.204 3.716 12.732 1.00 23.53 H new ATOM 0 HZ1 LYS A 88 30.535 3.721 12.123 1.00 24.52 H new ATOM 0 HZ2 LYS A 88 30.180 2.341 13.047 1.00 24.52 H new ATOM 0 HZ3 LYS A 88 30.379 2.209 11.366 1.00 24.52 H new ATOM 1404 N LEU A 89 22.790 2.795 15.309 1.00 70.33 N ATOM 1405 CA LEU A 89 21.509 2.273 15.772 1.00 55.35 C ATOM 1406 C LEU A 89 20.355 3.129 15.258 1.00 10.12 C ATOM 1407 O LEU A 89 20.268 4.326 15.532 1.00 45.54 O ATOM 1408 CB LEU A 89 21.479 2.221 17.300 1.00 10.00 C ATOM 1409 CG LEU A 89 20.191 1.687 17.929 1.00 43.44 C ATOM 1410 CD1 LEU A 89 19.972 0.233 17.542 1.00 34.04 C ATOM 1411 CD2 LEU A 89 20.234 1.839 19.442 1.00 21.32 C ATOM 0 H LEU A 89 23.131 3.602 15.832 1.00 70.33 H new ATOM 0 HA LEU A 89 21.392 1.263 15.378 1.00 55.35 H new ATOM 0 HB2 LEU A 89 22.309 1.601 17.639 1.00 10.00 H new ATOM 0 HB3 LEU A 89 21.656 3.227 17.681 1.00 10.00 H new ATOM 0 HG LEU A 89 19.353 2.272 17.550 1.00 43.44 H new ATOM 0 HD11 LEU A 89 19.051 -0.130 17.998 1.00 34.04 H new ATOM 0 HD12 LEU A 89 19.896 0.153 16.458 1.00 34.04 H new ATOM 0 HD13 LEU A 89 20.812 -0.367 17.892 1.00 34.04 H new ATOM 0 HD21 LEU A 89 19.310 1.454 19.873 1.00 21.32 H new ATOM 0 HD22 LEU A 89 21.080 1.279 19.840 1.00 21.32 H new ATOM 0 HD23 LEU A 89 20.343 2.893 19.699 1.00 21.32 H new ATOM 1423 N PRO A 90 19.445 2.502 14.498 1.00 43.02 N ATOM 1424 CA PRO A 90 18.279 3.186 13.933 1.00 53.54 C ATOM 1425 C PRO A 90 17.262 3.576 15.000 1.00 52.10 C ATOM 1426 O PRO A 90 16.809 2.735 15.777 1.00 3.20 O ATOM 1427 CB PRO A 90 17.683 2.146 12.981 1.00 22.42 C ATOM 1428 CG PRO A 90 18.130 0.834 13.528 1.00 73.43 C ATOM 1429 CD PRO A 90 19.485 1.076 14.132 1.00 43.34 C ATOM 0 HA PRO A 90 18.553 4.122 13.446 1.00 53.54 H new ATOM 0 HB2 PRO A 90 16.595 2.213 12.951 1.00 22.42 H new ATOM 0 HB3 PRO A 90 18.039 2.292 11.961 1.00 22.42 H new ATOM 0 HG2 PRO A 90 17.429 0.465 14.277 1.00 73.43 H new ATOM 0 HG3 PRO A 90 18.182 0.081 12.742 1.00 73.43 H new ATOM 0 HD2 PRO A 90 19.656 0.442 15.002 1.00 43.34 H new ATOM 0 HD3 PRO A 90 20.285 0.865 13.422 1.00 43.34 H new ATOM 1437 N VAL A 91 16.906 4.856 15.032 1.00 14.44 N ATOM 1438 CA VAL A 91 15.941 5.357 16.004 1.00 55.12 C ATOM 1439 C VAL A 91 15.006 6.382 15.372 1.00 53.15 C ATOM 1440 O VAL A 91 15.422 7.488 15.026 1.00 71.13 O ATOM 1441 CB VAL A 91 16.644 5.998 17.215 1.00 41.33 C ATOM 1442 CG1 VAL A 91 15.621 6.513 18.216 1.00 62.20 C ATOM 1443 CG2 VAL A 91 17.590 5.003 17.870 1.00 74.24 C ATOM 0 H VAL A 91 17.271 5.565 14.396 1.00 14.44 H new ATOM 0 HA VAL A 91 15.360 4.499 16.343 1.00 55.12 H new ATOM 0 HB VAL A 91 17.232 6.846 16.865 1.00 41.33 H new ATOM 0 HG11 VAL A 91 16.137 6.962 19.065 1.00 62.20 H new ATOM 0 HG12 VAL A 91 14.989 7.261 17.738 1.00 62.20 H new ATOM 0 HG13 VAL A 91 15.003 5.685 18.564 1.00 62.20 H new ATOM 0 HG21 VAL A 91 18.078 5.473 18.724 1.00 74.24 H new ATOM 0 HG22 VAL A 91 17.026 4.133 18.208 1.00 74.24 H new ATOM 0 HG23 VAL A 91 18.344 4.689 17.149 1.00 74.24 H new ATOM 1453 N VAL A 92 13.739 6.008 15.223 1.00 31.54 N ATOM 1454 CA VAL A 92 12.743 6.895 14.634 1.00 23.31 C ATOM 1455 C VAL A 92 12.117 7.797 15.691 1.00 1.31 C ATOM 1456 O VAL A 92 11.485 7.322 16.635 1.00 73.21 O ATOM 1457 CB VAL A 92 11.629 6.098 13.929 1.00 0.43 C ATOM 1458 CG1 VAL A 92 10.580 7.040 13.357 1.00 64.35 C ATOM 1459 CG2 VAL A 92 12.215 5.213 12.840 1.00 51.33 C ATOM 0 H VAL A 92 13.378 5.096 15.502 1.00 31.54 H new ATOM 0 HA VAL A 92 13.262 7.509 13.898 1.00 23.31 H new ATOM 0 HB VAL A 92 11.144 5.456 14.664 1.00 0.43 H new ATOM 0 HG11 VAL A 92 9.801 6.460 12.863 1.00 64.35 H new ATOM 0 HG12 VAL A 92 10.139 7.627 14.163 1.00 64.35 H new ATOM 0 HG13 VAL A 92 11.047 7.709 12.635 1.00 64.35 H new ATOM 0 HG21 VAL A 92 11.414 4.657 12.353 1.00 51.33 H new ATOM 0 HG22 VAL A 92 12.727 5.833 12.104 1.00 51.33 H new ATOM 0 HG23 VAL A 92 12.925 4.514 13.282 1.00 51.33 H new ATOM 1469 N THR A 93 12.297 9.104 15.527 1.00 15.41 N ATOM 1470 CA THR A 93 11.750 10.075 16.467 1.00 21.22 C ATOM 1471 C THR A 93 10.254 10.270 16.249 1.00 61.41 C ATOM 1472 O THR A 93 9.768 10.204 15.120 1.00 42.44 O ATOM 1473 CB THR A 93 12.457 11.437 16.343 1.00 43.54 C ATOM 1474 OG1 THR A 93 12.864 11.656 14.987 1.00 11.31 O ATOM 1475 CG2 THR A 93 13.670 11.503 17.258 1.00 4.41 C ATOM 0 H THR A 93 12.817 9.515 14.752 1.00 15.41 H new ATOM 0 HA THR A 93 11.919 9.676 17.467 1.00 21.22 H new ATOM 0 HB THR A 93 11.754 12.215 16.642 1.00 43.54 H new ATOM 0 HG1 THR A 93 13.568 12.338 14.963 1.00 11.31 H new ATOM 0 HG21 THR A 93 14.153 12.475 17.153 1.00 4.41 H new ATOM 0 HG22 THR A 93 13.354 11.365 18.292 1.00 4.41 H new ATOM 0 HG23 THR A 93 14.374 10.717 16.986 1.00 4.41 H new ATOM 1483 N ASP A 94 9.529 10.509 17.336 1.00 52.53 N ATOM 1484 CA ASP A 94 8.087 10.716 17.263 1.00 70.15 C ATOM 1485 C ASP A 94 7.651 11.841 18.196 1.00 41.24 C ATOM 1486 O ASP A 94 7.299 11.602 19.350 1.00 51.32 O ATOM 1487 CB ASP A 94 7.347 9.426 17.619 1.00 71.31 C ATOM 1488 CG ASP A 94 6.558 8.869 16.450 1.00 50.10 C ATOM 1489 OD1 ASP A 94 5.864 9.657 15.773 1.00 22.11 O ATOM 1490 OD2 ASP A 94 6.635 7.646 16.212 1.00 70.15 O ATOM 0 H ASP A 94 9.916 10.564 18.278 1.00 52.53 H new ATOM 0 HA ASP A 94 7.837 10.999 16.241 1.00 70.15 H new ATOM 0 HB2 ASP A 94 8.066 8.680 17.957 1.00 71.31 H new ATOM 0 HB3 ASP A 94 6.671 9.617 18.452 1.00 71.31 H new ATOM 1495 N ASN A 95 7.679 13.069 17.687 1.00 32.11 N ATOM 1496 CA ASN A 95 7.288 14.232 18.476 1.00 62.13 C ATOM 1497 C ASN A 95 5.848 14.100 18.962 1.00 2.34 C ATOM 1498 O ASN A 95 4.910 14.502 18.275 1.00 63.41 O ATOM 1499 CB ASN A 95 7.444 15.510 17.649 1.00 3.15 C ATOM 1500 CG ASN A 95 7.779 16.715 18.507 1.00 53.51 C ATOM 1501 OD1 ASN A 95 8.589 16.629 19.430 1.00 52.11 O ATOM 1502 ND2 ASN A 95 7.154 17.848 18.205 1.00 62.22 N ATOM 0 H ASN A 95 7.968 13.284 16.733 1.00 32.11 H new ATOM 0 HA ASN A 95 7.943 14.287 19.346 1.00 62.13 H new ATOM 0 HB2 ASN A 95 8.229 15.366 16.907 1.00 3.15 H new ATOM 0 HB3 ASN A 95 6.520 15.701 17.103 1.00 3.15 H new ATOM 0 HD21 ASN A 95 7.338 18.692 18.747 1.00 62.22 H new ATOM 0 HD22 ASN A 95 6.490 17.874 17.431 1.00 62.22 H new ATOM 1509 N GLY A 96 5.681 13.535 20.154 1.00 3.14 N ATOM 1510 CA GLY A 96 4.353 13.361 20.713 1.00 5.25 C ATOM 1511 C GLY A 96 3.855 11.935 20.591 1.00 22.22 C ATOM 1512 O GLY A 96 2.694 11.649 20.879 1.00 73.23 O ATOM 0 H GLY A 96 6.442 13.195 20.742 1.00 3.14 H new ATOM 0 HA2 GLY A 96 4.364 13.650 21.764 1.00 5.25 H new ATOM 0 HA3 GLY A 96 3.658 14.030 20.205 1.00 5.25 H new ATOM 1516 N GLY A 97 4.736 11.036 20.161 1.00 1.41 N ATOM 1517 CA GLY A 97 4.360 9.643 20.007 1.00 51.41 C ATOM 1518 C GLY A 97 3.247 9.452 18.996 1.00 71.12 C ATOM 1519 O GLY A 97 2.185 8.920 19.322 1.00 1.12 O ATOM 0 H GLY A 97 5.703 11.248 19.917 1.00 1.41 H new ATOM 0 HA2 GLY A 97 5.232 9.067 19.697 1.00 51.41 H new ATOM 0 HA3 GLY A 97 4.043 9.247 20.972 1.00 51.41 H new ATOM 1523 N THR A 98 3.488 9.888 17.763 1.00 33.31 N ATOM 1524 CA THR A 98 2.497 9.764 16.702 1.00 53.44 C ATOM 1525 C THR A 98 2.269 8.304 16.329 1.00 34.14 C ATOM 1526 O THR A 98 1.128 7.854 16.216 1.00 61.45 O ATOM 1527 CB THR A 98 2.922 10.543 15.442 1.00 24.15 C ATOM 1528 OG1 THR A 98 3.995 11.438 15.759 1.00 73.52 O ATOM 1529 CG2 THR A 98 1.752 11.328 14.870 1.00 11.34 C ATOM 0 H THR A 98 4.361 10.330 17.475 1.00 33.31 H new ATOM 0 HA THR A 98 1.569 10.187 17.087 1.00 53.44 H new ATOM 0 HB THR A 98 3.257 9.825 14.693 1.00 24.15 H new ATOM 0 HG1 THR A 98 4.851 10.971 15.659 1.00 73.52 H new ATOM 0 HG21 THR A 98 2.077 11.869 13.981 1.00 11.34 H new ATOM 0 HG22 THR A 98 0.949 10.641 14.603 1.00 11.34 H new ATOM 0 HG23 THR A 98 1.391 12.037 15.615 1.00 11.34 H new ATOM 1537 N ILE A 99 3.359 7.569 16.142 1.00 63.34 N ATOM 1538 CA ILE A 99 3.277 6.158 15.784 1.00 51.11 C ATOM 1539 C ILE A 99 2.797 5.319 16.963 1.00 25.05 C ATOM 1540 O ILE A 99 1.865 4.526 16.836 1.00 13.40 O ATOM 1541 CB ILE A 99 4.637 5.619 15.304 1.00 63.41 C ATOM 1542 CG1 ILE A 99 5.119 6.403 14.081 1.00 32.34 C ATOM 1543 CG2 ILE A 99 4.535 4.135 14.982 1.00 1.20 C ATOM 1544 CD1 ILE A 99 4.197 6.286 12.888 1.00 41.44 C ATOM 0 H ILE A 99 4.310 7.927 16.232 1.00 63.34 H new ATOM 0 HA ILE A 99 2.557 6.080 14.969 1.00 51.11 H new ATOM 0 HB ILE A 99 5.365 5.748 16.105 1.00 63.41 H new ATOM 0 HG12 ILE A 99 5.220 7.454 14.350 1.00 32.34 H new ATOM 0 HG13 ILE A 99 6.111 6.049 13.800 1.00 32.34 H new ATOM 0 HG21 ILE A 99 5.504 3.769 14.644 1.00 1.20 H new ATOM 0 HG22 ILE A 99 4.232 3.589 15.875 1.00 1.20 H new ATOM 0 HG23 ILE A 99 3.796 3.983 14.196 1.00 1.20 H new ATOM 0 HD11 ILE A 99 4.600 6.866 12.058 1.00 41.44 H new ATOM 0 HD12 ILE A 99 4.115 5.240 12.593 1.00 41.44 H new ATOM 0 HD13 ILE A 99 3.211 6.667 13.152 1.00 41.44 H new ATOM 1556 N ALA A 100 3.441 5.500 18.112 1.00 0.40 N ATOM 1557 CA ALA A 100 3.078 4.763 19.316 1.00 50.12 C ATOM 1558 C ALA A 100 1.584 4.876 19.599 1.00 11.22 C ATOM 1559 O ALA A 100 0.910 3.873 19.832 1.00 50.15 O ATOM 1560 CB ALA A 100 3.882 5.266 20.505 1.00 24.14 C ATOM 0 H ALA A 100 4.217 6.151 18.234 1.00 0.40 H new ATOM 0 HA ALA A 100 3.312 3.711 19.153 1.00 50.12 H new ATOM 0 HB1 ALA A 100 3.601 4.707 21.397 1.00 24.14 H new ATOM 0 HB2 ALA A 100 4.945 5.127 20.310 1.00 24.14 H new ATOM 0 HB3 ALA A 100 3.677 6.325 20.661 1.00 24.14 H new ATOM 1566 N GLN A 101 1.074 6.103 19.579 1.00 13.30 N ATOM 1567 CA GLN A 101 -0.341 6.346 19.836 1.00 40.24 C ATOM 1568 C GLN A 101 -1.210 5.658 18.788 1.00 31.13 C ATOM 1569 O GLN A 101 -2.302 5.178 19.092 1.00 53.22 O ATOM 1570 CB GLN A 101 -0.628 7.849 19.847 1.00 73.44 C ATOM 1571 CG GLN A 101 -1.907 8.218 20.581 1.00 53.05 C ATOM 1572 CD GLN A 101 -3.063 8.492 19.638 1.00 23.01 C ATOM 1573 OE1 GLN A 101 -2.912 9.201 18.643 1.00 53.41 O ATOM 1574 NE2 GLN A 101 -4.225 7.929 19.947 1.00 12.51 N ATOM 0 H GLN A 101 1.619 6.944 19.388 1.00 13.30 H new ATOM 0 HA GLN A 101 -0.584 5.930 20.814 1.00 40.24 H new ATOM 0 HB2 GLN A 101 0.211 8.367 20.312 1.00 73.44 H new ATOM 0 HB3 GLN A 101 -0.693 8.206 18.819 1.00 73.44 H new ATOM 0 HG2 GLN A 101 -2.179 7.408 21.258 1.00 53.05 H new ATOM 0 HG3 GLN A 101 -1.727 9.100 21.195 1.00 53.05 H new ATOM 0 HE21 GLN A 101 -4.304 7.349 20.782 1.00 12.51 H new ATOM 0 HE22 GLN A 101 -5.038 8.077 19.349 1.00 12.51 H new ATOM 1583 N SER A 102 -0.718 5.614 17.554 1.00 20.43 N ATOM 1584 CA SER A 102 -1.452 4.988 16.461 1.00 62.43 C ATOM 1585 C SER A 102 -1.474 3.470 16.620 1.00 43.45 C ATOM 1586 O SER A 102 -2.396 2.799 16.156 1.00 73.14 O ATOM 1587 CB SER A 102 -0.824 5.362 15.117 1.00 41.12 C ATOM 1588 OG SER A 102 -1.274 6.633 14.680 1.00 72.31 O ATOM 0 H SER A 102 0.186 6.004 17.286 1.00 20.43 H new ATOM 0 HA SER A 102 -2.478 5.354 16.489 1.00 62.43 H new ATOM 0 HB2 SER A 102 0.262 5.369 15.209 1.00 41.12 H new ATOM 0 HB3 SER A 102 -1.076 4.608 14.372 1.00 41.12 H new ATOM 0 HG SER A 102 -0.676 7.328 15.026 1.00 72.31 H new ATOM 1594 N LEU A 103 -0.451 2.936 17.278 1.00 12.22 N ATOM 1595 CA LEU A 103 -0.351 1.498 17.500 1.00 73.34 C ATOM 1596 C LEU A 103 -0.818 1.129 18.904 1.00 5.34 C ATOM 1597 O LEU A 103 -0.823 -0.042 19.280 1.00 62.22 O ATOM 1598 CB LEU A 103 1.089 1.028 17.288 1.00 1.13 C ATOM 1599 CG LEU A 103 1.427 0.506 15.891 1.00 12.14 C ATOM 1600 CD1 LEU A 103 0.555 -0.691 15.544 1.00 43.23 C ATOM 1601 CD2 LEU A 103 1.260 1.608 14.855 1.00 3.34 C ATOM 0 H LEU A 103 0.321 3.477 17.667 1.00 12.22 H new ATOM 0 HA LEU A 103 -0.999 0.999 16.780 1.00 73.34 H new ATOM 0 HB2 LEU A 103 1.758 1.858 17.515 1.00 1.13 H new ATOM 0 HB3 LEU A 103 1.303 0.240 18.010 1.00 1.13 H new ATOM 0 HG LEU A 103 2.469 0.185 15.886 1.00 12.14 H new ATOM 0 HD11 LEU A 103 0.809 -1.049 14.546 1.00 43.23 H new ATOM 0 HD12 LEU A 103 0.724 -1.487 16.269 1.00 43.23 H new ATOM 0 HD13 LEU A 103 -0.494 -0.396 15.567 1.00 43.23 H new ATOM 0 HD21 LEU A 103 1.505 1.219 13.867 1.00 3.34 H new ATOM 0 HD22 LEU A 103 0.228 1.960 14.861 1.00 3.34 H new ATOM 0 HD23 LEU A 103 1.927 2.436 15.094 1.00 3.34 H new ATOM 1613 N ASN A 104 -1.210 2.138 19.676 1.00 53.04 N ATOM 1614 CA ASN A 104 -1.680 1.920 21.039 1.00 71.11 C ATOM 1615 C ASN A 104 -0.565 1.358 21.915 1.00 21.32 C ATOM 1616 O ASN A 104 -0.806 0.515 22.780 1.00 75.01 O ATOM 1617 CB ASN A 104 -2.876 0.966 21.042 1.00 73.12 C ATOM 1618 CG ASN A 104 -3.871 1.289 22.140 1.00 23.23 C ATOM 1619 OD1 ASN A 104 -4.063 0.504 23.069 1.00 20.01 O ATOM 1620 ND2 ASN A 104 -4.508 2.449 22.038 1.00 14.14 N ATOM 0 H ASN A 104 -1.211 3.114 19.381 1.00 53.04 H new ATOM 0 HA ASN A 104 -1.990 2.882 21.448 1.00 71.11 H new ATOM 0 HB2 ASN A 104 -3.378 1.014 20.075 1.00 73.12 H new ATOM 0 HB3 ASN A 104 -2.521 -0.057 21.167 1.00 73.12 H new ATOM 0 HD21 ASN A 104 -5.189 2.721 22.747 1.00 14.14 H new ATOM 0 HD22 ASN A 104 -4.317 3.068 21.250 1.00 14.14 H new ATOM 1627 N ILE A 105 0.656 1.830 21.686 1.00 54.24 N ATOM 1628 CA ILE A 105 1.807 1.376 22.455 1.00 2.11 C ATOM 1629 C ILE A 105 1.948 2.166 23.752 1.00 60.11 C ATOM 1630 O ILE A 105 2.569 3.229 23.779 1.00 33.43 O ATOM 1631 CB ILE A 105 3.111 1.504 21.645 1.00 21.33 C ATOM 1632 CG1 ILE A 105 2.993 0.741 20.324 1.00 24.33 C ATOM 1633 CG2 ILE A 105 4.291 0.990 22.457 1.00 71.02 C ATOM 1634 CD1 ILE A 105 2.821 -0.752 20.502 1.00 53.52 C ATOM 0 H ILE A 105 0.873 2.527 20.974 1.00 54.24 H new ATOM 0 HA ILE A 105 1.636 0.325 22.689 1.00 2.11 H new ATOM 0 HB ILE A 105 3.281 2.557 21.420 1.00 21.33 H new ATOM 0 HG12 ILE A 105 2.145 1.132 19.762 1.00 24.33 H new ATOM 0 HG13 ILE A 105 3.885 0.927 19.725 1.00 24.33 H new ATOM 0 HG21 ILE A 105 5.205 1.087 21.872 1.00 71.02 H new ATOM 0 HG22 ILE A 105 4.383 1.573 23.373 1.00 71.02 H new ATOM 0 HG23 ILE A 105 4.131 -0.058 22.708 1.00 71.02 H new ATOM 0 HD11 ILE A 105 2.744 -1.228 19.525 1.00 53.52 H new ATOM 0 HD12 ILE A 105 3.681 -1.156 21.036 1.00 53.52 H new ATOM 0 HD13 ILE A 105 1.914 -0.948 21.074 1.00 53.52 H new ATOM 1646 N SER A 106 1.369 1.638 24.826 1.00 51.24 N ATOM 1647 CA SER A 106 1.428 2.295 26.126 1.00 33.23 C ATOM 1648 C SER A 106 2.454 1.619 27.030 1.00 20.52 C ATOM 1649 O SER A 106 2.963 2.225 27.973 1.00 63.20 O ATOM 1650 CB SER A 106 0.051 2.275 26.794 1.00 24.31 C ATOM 1651 OG SER A 106 -0.846 1.436 26.087 1.00 12.52 O ATOM 0 H SER A 106 0.854 0.758 24.821 1.00 51.24 H new ATOM 0 HA SER A 106 1.733 3.330 25.969 1.00 33.23 H new ATOM 0 HB2 SER A 106 0.147 1.926 27.822 1.00 24.31 H new ATOM 0 HB3 SER A 106 -0.350 3.287 26.837 1.00 24.31 H new ATOM 0 HG SER A 106 -1.718 1.439 26.534 1.00 12.52 H new ATOM 1657 N VAL A 107 2.753 0.357 26.735 1.00 1.34 N ATOM 1658 CA VAL A 107 3.719 -0.403 27.520 1.00 41.34 C ATOM 1659 C VAL A 107 5.002 -0.639 26.731 1.00 24.24 C ATOM 1660 O VAL A 107 4.964 -1.037 25.567 1.00 74.41 O ATOM 1661 CB VAL A 107 3.141 -1.761 27.958 1.00 22.42 C ATOM 1662 CG1 VAL A 107 2.128 -1.575 29.078 1.00 45.23 C ATOM 1663 CG2 VAL A 107 2.513 -2.480 26.774 1.00 54.22 C ATOM 0 H VAL A 107 2.340 -0.160 25.959 1.00 1.34 H new ATOM 0 HA VAL A 107 3.945 0.190 28.406 1.00 41.34 H new ATOM 0 HB VAL A 107 3.956 -2.377 28.337 1.00 22.42 H new ATOM 0 HG11 VAL A 107 1.731 -2.546 29.374 1.00 45.23 H new ATOM 0 HG12 VAL A 107 2.614 -1.105 29.933 1.00 45.23 H new ATOM 0 HG13 VAL A 107 1.313 -0.940 28.730 1.00 45.23 H new ATOM 0 HG21 VAL A 107 2.110 -3.438 27.102 1.00 54.22 H new ATOM 0 HG22 VAL A 107 1.709 -1.870 26.362 1.00 54.22 H new ATOM 0 HG23 VAL A 107 3.270 -2.648 26.008 1.00 54.22 H new ATOM 1673 N TYR A 108 6.139 -0.392 27.374 1.00 55.04 N ATOM 1674 CA TYR A 108 7.435 -0.576 26.732 1.00 31.11 C ATOM 1675 C TYR A 108 8.303 -1.547 27.527 1.00 51.03 C ATOM 1676 O TYR A 108 8.157 -1.701 28.739 1.00 1.25 O ATOM 1677 CB TYR A 108 8.152 0.767 26.589 1.00 2.33 C ATOM 1678 CG TYR A 108 7.284 1.858 26.004 1.00 11.25 C ATOM 1679 CD1 TYR A 108 7.145 2.001 24.630 1.00 60.05 C ATOM 1680 CD2 TYR A 108 6.601 2.746 26.827 1.00 24.24 C ATOM 1681 CE1 TYR A 108 6.353 2.997 24.091 1.00 24.31 C ATOM 1682 CE2 TYR A 108 5.806 3.744 26.298 1.00 63.22 C ATOM 1683 CZ TYR A 108 5.686 3.865 24.929 1.00 11.41 C ATOM 1684 OH TYR A 108 4.895 4.858 24.397 1.00 62.24 O ATOM 0 H TYR A 108 6.189 -0.064 28.339 1.00 55.04 H new ATOM 0 HA TYR A 108 7.265 -0.996 25.741 1.00 31.11 H new ATOM 0 HB2 TYR A 108 8.509 1.085 27.569 1.00 2.33 H new ATOM 0 HB3 TYR A 108 9.030 0.635 25.957 1.00 2.33 H new ATOM 0 HD1 TYR A 108 7.665 1.322 23.971 1.00 60.05 H new ATOM 0 HD2 TYR A 108 6.694 2.654 27.899 1.00 24.24 H new ATOM 0 HE1 TYR A 108 6.257 3.095 23.020 1.00 24.31 H new ATOM 0 HE2 TYR A 108 5.282 4.425 26.952 1.00 63.22 H new ATOM 0 HH TYR A 108 4.035 4.478 24.121 1.00 62.24 H new ATOM 1694 N PRO A 109 9.230 -2.219 26.827 1.00 11.54 N ATOM 1695 CA PRO A 109 9.412 -2.044 25.383 1.00 23.14 C ATOM 1696 C PRO A 109 8.250 -2.616 24.579 1.00 31.00 C ATOM 1697 O PRO A 109 7.296 -3.152 25.143 1.00 24.14 O ATOM 1698 CB PRO A 109 10.698 -2.822 25.092 1.00 41.22 C ATOM 1699 CG PRO A 109 10.778 -3.841 26.175 1.00 23.04 C ATOM 1700 CD PRO A 109 10.171 -3.200 27.393 1.00 72.15 C ATOM 0 HA PRO A 109 9.461 -0.992 25.102 1.00 23.14 H new ATOM 0 HB2 PRO A 109 10.663 -3.291 24.109 1.00 41.22 H new ATOM 0 HB3 PRO A 109 11.568 -2.166 25.101 1.00 41.22 H new ATOM 0 HG2 PRO A 109 10.237 -4.746 25.900 1.00 23.04 H new ATOM 0 HG3 PRO A 109 11.812 -4.132 26.361 1.00 23.04 H new ATOM 0 HD2 PRO A 109 9.661 -3.931 28.020 1.00 72.15 H new ATOM 0 HD3 PRO A 109 10.927 -2.720 28.014 1.00 72.15 H new ATOM 1708 N SER A 110 8.336 -2.499 23.258 1.00 41.42 N ATOM 1709 CA SER A 110 7.289 -3.001 22.376 1.00 63.32 C ATOM 1710 C SER A 110 7.836 -3.258 20.975 1.00 62.30 C ATOM 1711 O SER A 110 8.936 -2.820 20.636 1.00 35.01 O ATOM 1712 CB SER A 110 6.129 -2.007 22.308 1.00 11.50 C ATOM 1713 OG SER A 110 5.146 -2.302 23.285 1.00 71.31 O ATOM 0 H SER A 110 9.120 -2.061 22.775 1.00 41.42 H new ATOM 0 HA SER A 110 6.926 -3.944 22.785 1.00 63.32 H new ATOM 0 HB2 SER A 110 6.504 -0.995 22.459 1.00 11.50 H new ATOM 0 HB3 SER A 110 5.680 -2.035 21.315 1.00 11.50 H new ATOM 0 HG SER A 110 5.224 -1.669 24.029 1.00 71.31 H new ATOM 1719 N TRP A 111 7.061 -3.971 20.166 1.00 21.41 N ATOM 1720 CA TRP A 111 7.467 -4.288 18.801 1.00 1.53 C ATOM 1721 C TRP A 111 6.276 -4.228 17.851 1.00 31.45 C ATOM 1722 O TRP A 111 5.132 -4.417 18.264 1.00 72.23 O ATOM 1723 CB TRP A 111 8.110 -5.674 18.747 1.00 61.31 C ATOM 1724 CG TRP A 111 9.513 -5.700 19.273 1.00 2.53 C ATOM 1725 CD1 TRP A 111 9.896 -5.753 20.583 1.00 23.30 C ATOM 1726 CD2 TRP A 111 10.719 -5.670 18.501 1.00 13.14 C ATOM 1727 NE1 TRP A 111 11.268 -5.759 20.672 1.00 55.11 N ATOM 1728 CE2 TRP A 111 11.795 -5.709 19.409 1.00 64.21 C ATOM 1729 CE3 TRP A 111 10.993 -5.616 17.132 1.00 24.14 C ATOM 1730 CZ2 TRP A 111 13.123 -5.695 18.989 1.00 31.13 C ATOM 1731 CZ3 TRP A 111 12.311 -5.602 16.718 1.00 45.24 C ATOM 1732 CH2 TRP A 111 13.363 -5.642 17.643 1.00 12.01 C ATOM 0 H TRP A 111 6.148 -4.341 20.431 1.00 21.41 H new ATOM 0 HA TRP A 111 8.198 -3.544 18.484 1.00 1.53 H new ATOM 0 HB2 TRP A 111 7.501 -6.371 19.322 1.00 61.31 H new ATOM 0 HB3 TRP A 111 8.110 -6.027 17.716 1.00 61.31 H new ATOM 0 HD1 TRP A 111 9.220 -5.785 21.425 1.00 23.30 H new ATOM 0 HE1 TRP A 111 11.806 -5.795 21.538 1.00 55.11 H new ATOM 0 HE3 TRP A 111 10.190 -5.586 16.411 1.00 24.14 H new ATOM 0 HZ2 TRP A 111 13.935 -5.725 19.701 1.00 31.13 H new ATOM 0 HZ3 TRP A 111 12.535 -5.559 15.662 1.00 45.24 H new ATOM 0 HH2 TRP A 111 14.382 -5.631 17.287 1.00 12.01 H new ATOM 1743 N ALA A 112 6.552 -3.965 16.578 1.00 20.34 N ATOM 1744 CA ALA A 112 5.503 -3.884 15.570 1.00 14.31 C ATOM 1745 C ALA A 112 6.057 -4.162 14.177 1.00 51.40 C ATOM 1746 O ALA A 112 6.938 -3.449 13.695 1.00 42.23 O ATOM 1747 CB ALA A 112 4.836 -2.517 15.612 1.00 54.20 C ATOM 0 H ALA A 112 7.494 -3.804 16.221 1.00 20.34 H new ATOM 0 HA ALA A 112 4.758 -4.647 15.794 1.00 14.31 H new ATOM 0 HB1 ALA A 112 4.054 -2.470 14.854 1.00 54.20 H new ATOM 0 HB2 ALA A 112 4.397 -2.357 16.597 1.00 54.20 H new ATOM 0 HB3 ALA A 112 5.579 -1.744 15.416 1.00 54.20 H new ATOM 1753 N LEU A 113 5.536 -5.202 13.535 1.00 45.50 N ATOM 1754 CA LEU A 113 5.980 -5.574 12.196 1.00 22.42 C ATOM 1755 C LEU A 113 5.386 -4.642 11.146 1.00 54.50 C ATOM 1756 O LEU A 113 4.346 -4.021 11.370 1.00 2.55 O ATOM 1757 CB LEU A 113 5.587 -7.021 11.891 1.00 15.24 C ATOM 1758 CG LEU A 113 6.234 -7.646 10.656 1.00 61.54 C ATOM 1759 CD1 LEU A 113 6.931 -8.949 11.019 1.00 15.43 C ATOM 1760 CD2 LEU A 113 5.194 -7.881 9.570 1.00 43.15 C ATOM 0 H LEU A 113 4.806 -5.802 13.920 1.00 45.50 H new ATOM 0 HA LEU A 113 7.066 -5.483 12.162 1.00 22.42 H new ATOM 0 HB2 LEU A 113 5.837 -7.634 12.757 1.00 15.24 H new ATOM 0 HB3 LEU A 113 4.505 -7.065 11.771 1.00 15.24 H new ATOM 0 HG LEU A 113 6.982 -6.952 10.272 1.00 61.54 H new ATOM 0 HD11 LEU A 113 7.386 -9.379 10.127 1.00 15.43 H new ATOM 0 HD12 LEU A 113 7.704 -8.753 11.762 1.00 15.43 H new ATOM 0 HD13 LEU A 113 6.203 -9.649 11.429 1.00 15.43 H new ATOM 0 HD21 LEU A 113 5.673 -8.327 8.698 1.00 43.15 H new ATOM 0 HD22 LEU A 113 4.423 -8.554 9.944 1.00 43.15 H new ATOM 0 HD23 LEU A 113 4.740 -6.931 9.289 1.00 43.15 H new ATOM 1772 N ILE A 114 6.050 -4.550 9.999 1.00 5.23 N ATOM 1773 CA ILE A 114 5.586 -3.696 8.914 1.00 53.45 C ATOM 1774 C ILE A 114 5.838 -4.345 7.557 1.00 53.31 C ATOM 1775 O ILE A 114 6.951 -4.303 7.034 1.00 33.44 O ATOM 1776 CB ILE A 114 6.274 -2.318 8.947 1.00 71.22 C ATOM 1777 CG1 ILE A 114 5.996 -1.617 10.278 1.00 21.11 C ATOM 1778 CG2 ILE A 114 5.801 -1.462 7.782 1.00 51.51 C ATOM 1779 CD1 ILE A 114 4.538 -1.270 10.486 1.00 64.42 C ATOM 0 H ILE A 114 6.912 -5.057 9.797 1.00 5.23 H new ATOM 0 HA ILE A 114 4.514 -3.561 9.056 1.00 53.45 H new ATOM 0 HB ILE A 114 7.350 -2.463 8.852 1.00 71.22 H new ATOM 0 HG12 ILE A 114 6.328 -2.259 11.094 1.00 21.11 H new ATOM 0 HG13 ILE A 114 6.589 -0.704 10.329 1.00 21.11 H new ATOM 0 HG21 ILE A 114 6.296 -0.492 7.819 1.00 51.51 H new ATOM 0 HG22 ILE A 114 6.045 -1.958 6.843 1.00 51.51 H new ATOM 0 HG23 ILE A 114 4.722 -1.322 7.848 1.00 51.51 H new ATOM 0 HD11 ILE A 114 4.416 -0.776 11.450 1.00 64.42 H new ATOM 0 HD12 ILE A 114 4.206 -0.602 9.691 1.00 64.42 H new ATOM 0 HD13 ILE A 114 3.941 -2.182 10.467 1.00 64.42 H new ATOM 1791 N GLY A 115 4.794 -4.943 6.990 1.00 24.31 N ATOM 1792 CA GLY A 115 4.923 -5.591 5.698 1.00 33.40 C ATOM 1793 C GLY A 115 5.608 -4.710 4.673 1.00 51.13 C ATOM 1794 O GLY A 115 5.707 -3.496 4.853 1.00 54.11 O ATOM 0 H GLY A 115 3.862 -4.990 7.402 1.00 24.31 H new ATOM 0 HA2 GLY A 115 5.489 -6.516 5.814 1.00 33.40 H new ATOM 0 HA3 GLY A 115 3.934 -5.866 5.333 1.00 33.40 H new ATOM 1798 N LYS A 116 6.085 -5.321 3.594 1.00 72.14 N ATOM 1799 CA LYS A 116 6.765 -4.585 2.535 1.00 63.12 C ATOM 1800 C LYS A 116 5.879 -3.469 1.992 1.00 50.31 C ATOM 1801 O LYS A 116 6.370 -2.416 1.585 1.00 1.41 O ATOM 1802 CB LYS A 116 7.162 -5.533 1.401 1.00 43.23 C ATOM 1803 CG LYS A 116 5.993 -5.971 0.537 1.00 55.25 C ATOM 1804 CD LYS A 116 5.818 -5.062 -0.668 1.00 42.34 C ATOM 1805 CE LYS A 116 6.296 -5.733 -1.947 1.00 34.10 C ATOM 1806 NZ LYS A 116 5.169 -6.338 -2.710 1.00 51.10 N ATOM 0 H LYS A 116 6.013 -6.325 3.430 1.00 72.14 H new ATOM 0 HA LYS A 116 7.664 -4.137 2.958 1.00 63.12 H new ATOM 0 HB2 LYS A 116 7.904 -5.042 0.772 1.00 43.23 H new ATOM 0 HB3 LYS A 116 7.639 -6.416 1.827 1.00 43.23 H new ATOM 0 HG2 LYS A 116 6.152 -6.996 0.201 1.00 55.25 H new ATOM 0 HG3 LYS A 116 5.079 -5.969 1.131 1.00 55.25 H new ATOM 0 HD2 LYS A 116 4.768 -4.789 -0.770 1.00 42.34 H new ATOM 0 HD3 LYS A 116 6.374 -4.137 -0.511 1.00 42.34 H new ATOM 0 HE2 LYS A 116 6.806 -5.001 -2.573 1.00 34.10 H new ATOM 0 HE3 LYS A 116 7.025 -6.506 -1.701 1.00 34.10 H new ATOM 0 HZ1 LYS A 116 5.536 -6.785 -3.574 1.00 51.10 H new ATOM 0 HZ2 LYS A 116 4.697 -7.055 -2.123 1.00 51.10 H new ATOM 0 HZ3 LYS A 116 4.486 -5.597 -2.967 1.00 51.10 H new ATOM 1820 N ASP A 117 4.572 -3.706 1.990 1.00 52.41 N ATOM 1821 CA ASP A 117 3.617 -2.719 1.499 1.00 13.34 C ATOM 1822 C ASP A 117 3.606 -1.482 2.393 1.00 73.32 C ATOM 1823 O ASP A 117 3.101 -0.429 2.006 1.00 32.13 O ATOM 1824 CB ASP A 117 2.214 -3.325 1.430 1.00 65.42 C ATOM 1825 CG ASP A 117 2.110 -4.425 0.391 1.00 23.03 C ATOM 1826 OD1 ASP A 117 2.436 -4.163 -0.786 1.00 14.32 O ATOM 1827 OD2 ASP A 117 1.704 -5.548 0.756 1.00 63.13 O ATOM 0 H ASP A 117 4.149 -4.573 2.323 1.00 52.41 H new ATOM 0 HA ASP A 117 3.925 -2.419 0.497 1.00 13.34 H new ATOM 0 HB2 ASP A 117 1.946 -3.726 2.408 1.00 65.42 H new ATOM 0 HB3 ASP A 117 1.493 -2.541 1.198 1.00 65.42 H new ATOM 1832 N GLY A 118 4.166 -1.619 3.591 1.00 13.11 N ATOM 1833 CA GLY A 118 4.209 -0.506 4.521 1.00 14.22 C ATOM 1834 C GLY A 118 3.004 -0.471 5.440 1.00 34.42 C ATOM 1835 O GLY A 118 2.432 0.591 5.686 1.00 70.10 O ATOM 0 H GLY A 118 4.591 -2.481 3.934 1.00 13.11 H new ATOM 0 HA2 GLY A 118 5.117 -0.572 5.120 1.00 14.22 H new ATOM 0 HA3 GLY A 118 4.263 0.428 3.962 1.00 14.22 H new ATOM 1839 N ASP A 119 2.615 -1.636 5.948 1.00 64.03 N ATOM 1840 CA ASP A 119 1.470 -1.735 6.844 1.00 33.45 C ATOM 1841 C ASP A 119 1.765 -2.687 8.000 1.00 51.21 C ATOM 1842 O ASP A 119 2.553 -3.622 7.862 1.00 62.23 O ATOM 1843 CB ASP A 119 0.235 -2.212 6.078 1.00 12.10 C ATOM 1844 CG ASP A 119 -1.029 -2.136 6.912 1.00 51.02 C ATOM 1845 OD1 ASP A 119 -1.659 -1.058 6.938 1.00 1.34 O ATOM 1846 OD2 ASP A 119 -1.389 -3.155 7.537 1.00 60.11 O ATOM 0 H ASP A 119 3.077 -2.525 5.754 1.00 64.03 H new ATOM 0 HA ASP A 119 1.274 -0.744 7.253 1.00 33.45 H new ATOM 0 HB2 ASP A 119 0.111 -1.606 5.180 1.00 12.10 H new ATOM 0 HB3 ASP A 119 0.389 -3.240 5.750 1.00 12.10 H new ATOM 1851 N VAL A 120 1.127 -2.441 9.140 1.00 4.31 N ATOM 1852 CA VAL A 120 1.322 -3.275 10.320 1.00 74.00 C ATOM 1853 C VAL A 120 0.825 -4.696 10.076 1.00 11.43 C ATOM 1854 O VAL A 120 -0.273 -4.899 9.559 1.00 12.12 O ATOM 1855 CB VAL A 120 0.594 -2.692 11.546 1.00 51.32 C ATOM 1856 CG1 VAL A 120 1.376 -1.523 12.125 1.00 24.34 C ATOM 1857 CG2 VAL A 120 -0.818 -2.266 11.174 1.00 74.02 C ATOM 0 H VAL A 120 0.471 -1.671 9.271 1.00 4.31 H new ATOM 0 HA VAL A 120 2.393 -3.296 10.519 1.00 74.00 H new ATOM 0 HB VAL A 120 0.526 -3.467 12.309 1.00 51.32 H new ATOM 0 HG11 VAL A 120 0.847 -1.124 12.990 1.00 24.34 H new ATOM 0 HG12 VAL A 120 2.366 -1.863 12.430 1.00 24.34 H new ATOM 0 HG13 VAL A 120 1.477 -0.743 11.370 1.00 24.34 H new ATOM 0 HG21 VAL A 120 -1.318 -1.857 12.052 1.00 74.02 H new ATOM 0 HG22 VAL A 120 -0.775 -1.506 10.394 1.00 74.02 H new ATOM 0 HG23 VAL A 120 -1.374 -3.130 10.810 1.00 74.02 H new ATOM 1867 N GLN A 121 1.641 -5.675 10.453 1.00 41.33 N ATOM 1868 CA GLN A 121 1.284 -7.077 10.274 1.00 20.24 C ATOM 1869 C GLN A 121 1.570 -7.877 11.541 1.00 1.01 C ATOM 1870 O GLN A 121 1.405 -9.097 11.567 1.00 13.43 O ATOM 1871 CB GLN A 121 2.053 -7.675 9.095 1.00 72.11 C ATOM 1872 CG GLN A 121 1.155 -8.174 7.974 1.00 65.20 C ATOM 1873 CD GLN A 121 1.671 -7.793 6.600 1.00 13.32 C ATOM 1874 OE1 GLN A 121 1.572 -6.637 6.186 1.00 32.22 O ATOM 1875 NE2 GLN A 121 2.225 -8.764 5.885 1.00 61.33 N ATOM 0 H GLN A 121 2.553 -5.523 10.884 1.00 41.33 H new ATOM 0 HA GLN A 121 0.215 -7.130 10.066 1.00 20.24 H new ATOM 0 HB2 GLN A 121 2.734 -6.923 8.697 1.00 72.11 H new ATOM 0 HB3 GLN A 121 2.666 -8.502 9.454 1.00 72.11 H new ATOM 0 HG2 GLN A 121 1.069 -9.259 8.038 1.00 65.20 H new ATOM 0 HG3 GLN A 121 0.153 -7.767 8.108 1.00 65.20 H new ATOM 0 HE21 GLN A 121 2.286 -9.708 6.267 1.00 61.33 H new ATOM 0 HE22 GLN A 121 2.590 -8.567 4.953 1.00 61.33 H new ATOM 1884 N ARG A 122 2.001 -7.182 12.589 1.00 35.21 N ATOM 1885 CA ARG A 122 2.311 -7.828 13.859 1.00 62.24 C ATOM 1886 C ARG A 122 2.563 -6.791 14.949 1.00 23.00 C ATOM 1887 O ARG A 122 3.088 -5.710 14.681 1.00 2.23 O ATOM 1888 CB ARG A 122 3.535 -8.734 13.708 1.00 10.34 C ATOM 1889 CG ARG A 122 3.298 -10.161 14.175 1.00 53.31 C ATOM 1890 CD ARG A 122 4.240 -11.136 13.487 1.00 3.30 C ATOM 1891 NE ARG A 122 4.093 -11.106 12.034 1.00 24.53 N ATOM 1892 CZ ARG A 122 3.031 -11.581 11.393 1.00 20.04 C ATOM 1893 NH1 ARG A 122 2.028 -12.118 12.073 1.00 34.15 N ATOM 1894 NH2 ARG A 122 2.971 -11.518 10.069 1.00 33.33 N ATOM 0 H ARG A 122 2.143 -6.172 12.584 1.00 35.21 H new ATOM 0 HA ARG A 122 1.453 -8.433 14.150 1.00 62.24 H new ATOM 0 HB2 ARG A 122 3.838 -8.749 12.661 1.00 10.34 H new ATOM 0 HB3 ARG A 122 4.364 -8.308 14.274 1.00 10.34 H new ATOM 0 HG2 ARG A 122 3.437 -10.219 15.255 1.00 53.31 H new ATOM 0 HG3 ARG A 122 2.266 -10.445 13.971 1.00 53.31 H new ATOM 0 HD2 ARG A 122 5.269 -10.894 13.752 1.00 3.30 H new ATOM 0 HD3 ARG A 122 4.046 -12.145 13.850 1.00 3.30 H new ATOM 0 HE ARG A 122 4.847 -10.698 11.481 1.00 24.53 H new ATOM 0 HH11 ARG A 122 2.071 -12.167 13.091 1.00 34.15 H new ATOM 0 HH12 ARG A 122 1.214 -12.482 11.578 1.00 34.15 H new ATOM 0 HH21 ARG A 122 3.741 -11.105 9.543 1.00 33.33 H new ATOM 0 HH22 ARG A 122 2.155 -11.883 9.578 1.00 33.33 H new ATOM 1908 N ILE A 123 2.186 -7.128 16.178 1.00 55.05 N ATOM 1909 CA ILE A 123 2.371 -6.226 17.308 1.00 63.34 C ATOM 1910 C ILE A 123 2.684 -7.001 18.583 1.00 14.04 C ATOM 1911 O ILE A 123 2.135 -8.078 18.819 1.00 40.41 O ATOM 1912 CB ILE A 123 1.124 -5.354 17.543 1.00 41.34 C ATOM 1913 CG1 ILE A 123 0.867 -4.457 16.330 1.00 55.10 C ATOM 1914 CG2 ILE A 123 1.293 -4.516 18.801 1.00 22.23 C ATOM 1915 CD1 ILE A 123 -0.450 -3.715 16.396 1.00 73.43 C ATOM 0 H ILE A 123 1.751 -8.019 16.416 1.00 55.05 H new ATOM 0 HA ILE A 123 3.214 -5.580 17.062 1.00 63.34 H new ATOM 0 HB ILE A 123 0.262 -6.007 17.678 1.00 41.34 H new ATOM 0 HG12 ILE A 123 1.678 -3.734 16.244 1.00 55.10 H new ATOM 0 HG13 ILE A 123 0.887 -5.067 15.427 1.00 55.10 H new ATOM 0 HG21 ILE A 123 0.403 -3.905 18.953 1.00 22.23 H new ATOM 0 HG22 ILE A 123 1.434 -5.173 19.659 1.00 22.23 H new ATOM 0 HG23 ILE A 123 2.163 -3.869 18.693 1.00 22.23 H new ATOM 0 HD11 ILE A 123 -0.566 -3.099 15.504 1.00 73.43 H new ATOM 0 HD12 ILE A 123 -1.269 -4.432 16.451 1.00 73.43 H new ATOM 0 HD13 ILE A 123 -0.465 -3.079 17.281 1.00 73.43 H new ATOM 1927 N VAL A 124 3.568 -6.445 19.406 1.00 52.25 N ATOM 1928 CA VAL A 124 3.952 -7.082 20.660 1.00 54.43 C ATOM 1929 C VAL A 124 4.257 -6.043 21.733 1.00 54.52 C ATOM 1930 O VAL A 124 4.813 -4.982 21.446 1.00 21.31 O ATOM 1931 CB VAL A 124 5.182 -7.989 20.475 1.00 62.21 C ATOM 1932 CG1 VAL A 124 5.686 -8.487 21.821 1.00 12.10 C ATOM 1933 CG2 VAL A 124 4.850 -9.155 19.556 1.00 24.41 C ATOM 0 H VAL A 124 4.032 -5.554 19.226 1.00 52.25 H new ATOM 0 HA VAL A 124 3.106 -7.691 20.978 1.00 54.43 H new ATOM 0 HB VAL A 124 5.976 -7.405 20.011 1.00 62.21 H new ATOM 0 HG11 VAL A 124 6.556 -9.127 21.670 1.00 12.10 H new ATOM 0 HG12 VAL A 124 5.965 -7.636 22.443 1.00 12.10 H new ATOM 0 HG13 VAL A 124 4.899 -9.056 22.316 1.00 12.10 H new ATOM 0 HG21 VAL A 124 5.731 -9.786 19.436 1.00 24.41 H new ATOM 0 HG22 VAL A 124 4.040 -9.741 19.990 1.00 24.41 H new ATOM 0 HG23 VAL A 124 4.541 -8.774 18.582 1.00 24.41 H new ATOM 1943 N LYS A 125 3.889 -6.354 22.971 1.00 1.42 N ATOM 1944 CA LYS A 125 4.124 -5.448 24.090 1.00 64.42 C ATOM 1945 C LYS A 125 5.218 -5.988 25.006 1.00 64.15 C ATOM 1946 O LYS A 125 4.947 -6.423 26.124 1.00 72.13 O ATOM 1947 CB LYS A 125 2.834 -5.242 24.886 1.00 72.40 C ATOM 1948 CG LYS A 125 1.854 -4.292 24.220 1.00 34.22 C ATOM 1949 CD LYS A 125 1.153 -4.949 23.042 1.00 1.34 C ATOM 1950 CE LYS A 125 -0.155 -4.247 22.710 1.00 20.23 C ATOM 1951 NZ LYS A 125 -1.303 -5.195 22.692 1.00 74.03 N ATOM 0 H LYS A 125 3.427 -7.227 23.225 1.00 1.42 H new ATOM 0 HA LYS A 125 4.452 -4.490 23.687 1.00 64.42 H new ATOM 0 HB2 LYS A 125 2.349 -6.207 25.032 1.00 72.40 H new ATOM 0 HB3 LYS A 125 3.084 -4.858 25.875 1.00 72.40 H new ATOM 0 HG2 LYS A 125 1.113 -3.963 24.948 1.00 34.22 H new ATOM 0 HG3 LYS A 125 2.383 -3.402 23.879 1.00 34.22 H new ATOM 0 HD2 LYS A 125 1.808 -4.931 22.171 1.00 1.34 H new ATOM 0 HD3 LYS A 125 0.957 -5.996 23.272 1.00 1.34 H new ATOM 0 HE2 LYS A 125 -0.343 -3.463 23.443 1.00 20.23 H new ATOM 0 HE3 LYS A 125 -0.070 -3.761 21.738 1.00 20.23 H new ATOM 0 HZ1 LYS A 125 -2.176 -4.679 22.462 1.00 74.03 H new ATOM 0 HZ2 LYS A 125 -1.136 -5.929 21.975 1.00 74.03 H new ATOM 0 HZ3 LYS A 125 -1.400 -5.640 23.627 1.00 74.03 H new ATOM 1965 N GLY A 126 6.457 -5.955 24.524 1.00 63.25 N ATOM 1966 CA GLY A 126 7.573 -6.443 25.313 1.00 44.34 C ATOM 1967 C GLY A 126 8.894 -6.340 24.575 1.00 74.33 C ATOM 1968 O GLY A 126 9.042 -5.525 23.664 1.00 21.14 O ATOM 0 H GLY A 126 6.707 -5.599 23.602 1.00 63.25 H new ATOM 0 HA2 GLY A 126 7.634 -5.875 26.241 1.00 44.34 H new ATOM 0 HA3 GLY A 126 7.393 -7.483 25.587 1.00 44.34 H new ATOM 1972 N SER A 127 9.856 -7.168 24.969 1.00 73.43 N ATOM 1973 CA SER A 127 11.172 -7.164 24.342 1.00 44.20 C ATOM 1974 C SER A 127 11.597 -8.578 23.960 1.00 61.42 C ATOM 1975 O SER A 127 12.131 -9.321 24.784 1.00 65.44 O ATOM 1976 CB SER A 127 12.207 -6.545 25.284 1.00 31.53 C ATOM 1977 OG SER A 127 13.459 -7.198 25.166 1.00 62.14 O ATOM 0 H SER A 127 9.749 -7.850 25.720 1.00 73.43 H new ATOM 0 HA SER A 127 11.112 -6.564 23.434 1.00 44.20 H new ATOM 0 HB2 SER A 127 12.323 -5.485 25.056 1.00 31.53 H new ATOM 0 HB3 SER A 127 11.853 -6.613 26.313 1.00 31.53 H new ATOM 0 HG SER A 127 13.353 -8.149 25.378 1.00 62.14 H new ATOM 1983 N ILE A 128 11.355 -8.943 22.705 1.00 25.33 N ATOM 1984 CA ILE A 128 11.713 -10.268 22.213 1.00 44.30 C ATOM 1985 C ILE A 128 13.227 -10.455 22.189 1.00 14.11 C ATOM 1986 O ILE A 128 13.983 -9.488 22.269 1.00 40.03 O ATOM 1987 CB ILE A 128 11.155 -10.513 20.799 1.00 52.42 C ATOM 1988 CG1 ILE A 128 11.528 -9.354 19.872 1.00 64.35 C ATOM 1989 CG2 ILE A 128 9.645 -10.692 20.849 1.00 11.25 C ATOM 1990 CD1 ILE A 128 11.940 -9.798 18.485 1.00 35.52 C ATOM 0 H ILE A 128 10.913 -8.340 22.011 1.00 25.33 H new ATOM 0 HA ILE A 128 11.271 -10.990 22.900 1.00 44.30 H new ATOM 0 HB ILE A 128 11.597 -11.427 20.404 1.00 52.42 H new ATOM 0 HG12 ILE A 128 10.678 -8.677 19.790 1.00 64.35 H new ATOM 0 HG13 ILE A 128 12.344 -8.788 20.321 1.00 64.35 H new ATOM 0 HG21 ILE A 128 9.265 -10.864 19.842 1.00 11.25 H new ATOM 0 HG22 ILE A 128 9.401 -11.547 21.480 1.00 11.25 H new ATOM 0 HG23 ILE A 128 9.186 -9.794 21.261 1.00 11.25 H new ATOM 0 HD11 ILE A 128 12.190 -8.925 17.883 1.00 35.52 H new ATOM 0 HD12 ILE A 128 12.809 -10.452 18.555 1.00 35.52 H new ATOM 0 HD13 ILE A 128 11.117 -10.338 18.016 1.00 35.52 H new ATOM 2002 N ASN A 129 13.661 -11.706 22.077 1.00 11.02 N ATOM 2003 CA ASN A 129 15.085 -12.021 22.041 1.00 14.52 C ATOM 2004 C ASN A 129 15.538 -12.327 20.617 1.00 2.21 C ATOM 2005 O ASN A 129 14.759 -12.220 19.671 1.00 51.41 O ATOM 2006 CB ASN A 129 15.388 -13.212 22.952 1.00 1.54 C ATOM 2007 CG ASN A 129 14.194 -13.613 23.797 1.00 50.33 C ATOM 2008 OD1 ASN A 129 13.705 -12.830 24.612 1.00 72.15 O ATOM 2009 ND2 ASN A 129 13.719 -14.838 23.605 1.00 0.12 N ATOM 0 H ASN A 129 13.048 -12.518 22.010 1.00 11.02 H new ATOM 0 HA ASN A 129 15.634 -11.150 22.399 1.00 14.52 H new ATOM 0 HB2 ASN A 129 15.700 -14.061 22.344 1.00 1.54 H new ATOM 0 HB3 ASN A 129 16.224 -12.963 23.605 1.00 1.54 H new ATOM 0 HD21 ASN A 129 12.917 -15.164 24.144 1.00 0.12 H new ATOM 0 HD22 ASN A 129 14.156 -15.453 22.919 1.00 0.12 H new ATOM 2016 N GLU A 130 16.803 -12.709 20.474 1.00 5.11 N ATOM 2017 CA GLU A 130 17.360 -13.030 19.165 1.00 23.44 C ATOM 2018 C GLU A 130 16.500 -14.066 18.447 1.00 14.13 C ATOM 2019 O GLU A 130 15.713 -13.729 17.563 1.00 41.01 O ATOM 2020 CB GLU A 130 18.791 -13.552 19.310 1.00 64.34 C ATOM 2021 CG GLU A 130 19.842 -12.454 19.320 1.00 34.31 C ATOM 2022 CD GLU A 130 20.306 -12.077 17.926 1.00 35.54 C ATOM 2023 OE1 GLU A 130 19.446 -11.955 17.029 1.00 70.04 O ATOM 2024 OE2 GLU A 130 21.527 -11.905 17.733 1.00 21.44 O ATOM 0 H GLU A 130 17.461 -12.804 21.248 1.00 5.11 H new ATOM 0 HA GLU A 130 17.372 -12.117 18.570 1.00 23.44 H new ATOM 0 HB2 GLU A 130 18.868 -14.125 20.234 1.00 64.34 H new ATOM 0 HB3 GLU A 130 19.003 -14.239 18.490 1.00 64.34 H new ATOM 0 HG2 GLU A 130 19.435 -11.572 19.814 1.00 34.31 H new ATOM 0 HG3 GLU A 130 20.699 -12.782 19.908 1.00 34.31 H new ATOM 2031 N ALA A 131 16.656 -15.328 18.835 1.00 52.44 N ATOM 2032 CA ALA A 131 15.893 -16.412 18.230 1.00 72.32 C ATOM 2033 C ALA A 131 14.416 -16.049 18.117 1.00 1.35 C ATOM 2034 O ALA A 131 13.787 -16.286 17.087 1.00 54.40 O ATOM 2035 CB ALA A 131 16.064 -17.691 19.036 1.00 34.21 C ATOM 0 H ALA A 131 17.304 -15.624 19.565 1.00 52.44 H new ATOM 0 HA ALA A 131 16.277 -16.575 17.223 1.00 72.32 H new ATOM 0 HB1 ALA A 131 15.489 -18.493 18.573 1.00 34.21 H new ATOM 0 HB2 ALA A 131 17.118 -17.968 19.060 1.00 34.21 H new ATOM 0 HB3 ALA A 131 15.708 -17.530 20.054 1.00 34.21 H new ATOM 2041 N GLN A 132 13.870 -15.473 19.184 1.00 24.30 N ATOM 2042 CA GLN A 132 12.467 -15.079 19.204 1.00 12.23 C ATOM 2043 C GLN A 132 12.124 -14.224 17.989 1.00 40.04 C ATOM 2044 O GLN A 132 11.072 -14.396 17.373 1.00 23.23 O ATOM 2045 CB GLN A 132 12.150 -14.311 20.488 1.00 14.45 C ATOM 2046 CG GLN A 132 11.250 -15.074 21.447 1.00 10.33 C ATOM 2047 CD GLN A 132 10.656 -14.185 22.523 1.00 62.14 C ATOM 2048 OE1 GLN A 132 11.345 -13.340 23.096 1.00 35.40 O ATOM 2049 NE2 GLN A 132 9.371 -14.371 22.802 1.00 65.21 N ATOM 0 H GLN A 132 14.378 -15.269 20.045 1.00 24.30 H new ATOM 0 HA GLN A 132 11.861 -15.984 19.171 1.00 12.23 H new ATOM 0 HB2 GLN A 132 13.083 -14.067 20.995 1.00 14.45 H new ATOM 0 HB3 GLN A 132 11.672 -13.367 20.228 1.00 14.45 H new ATOM 0 HG2 GLN A 132 10.444 -15.546 20.885 1.00 10.33 H new ATOM 0 HG3 GLN A 132 11.822 -15.874 21.917 1.00 10.33 H new ATOM 0 HE21 GLN A 132 8.838 -15.083 22.302 1.00 65.21 H new ATOM 0 HE22 GLN A 132 8.917 -13.802 23.516 1.00 65.21 H new ATOM 2058 N ALA A 133 13.019 -13.302 17.649 1.00 54.14 N ATOM 2059 CA ALA A 133 12.811 -12.421 16.506 1.00 64.44 C ATOM 2060 C ALA A 133 12.849 -13.203 15.197 1.00 51.13 C ATOM 2061 O ALA A 133 12.006 -13.007 14.320 1.00 34.24 O ATOM 2062 CB ALA A 133 13.858 -11.317 16.493 1.00 20.14 C ATOM 0 H ALA A 133 13.895 -13.146 18.148 1.00 54.14 H new ATOM 0 HA ALA A 133 11.824 -11.969 16.602 1.00 64.44 H new ATOM 0 HB1 ALA A 133 13.691 -10.667 15.634 1.00 20.14 H new ATOM 0 HB2 ALA A 133 13.783 -10.733 17.410 1.00 20.14 H new ATOM 0 HB3 ALA A 133 14.852 -11.759 16.425 1.00 20.14 H new ATOM 2068 N LEU A 134 13.831 -14.088 15.070 1.00 44.14 N ATOM 2069 CA LEU A 134 13.979 -14.899 13.866 1.00 24.12 C ATOM 2070 C LEU A 134 12.670 -15.598 13.516 1.00 33.33 C ATOM 2071 O LEU A 134 12.273 -15.649 12.352 1.00 25.13 O ATOM 2072 CB LEU A 134 15.088 -15.935 14.059 1.00 62.11 C ATOM 2073 CG LEU A 134 16.521 -15.420 13.916 1.00 53.32 C ATOM 2074 CD1 LEU A 134 16.711 -14.738 12.570 1.00 72.13 C ATOM 2075 CD2 LEU A 134 16.860 -14.465 15.052 1.00 60.35 C ATOM 0 H LEU A 134 14.537 -14.263 15.785 1.00 44.14 H new ATOM 0 HA LEU A 134 14.247 -14.237 13.042 1.00 24.12 H new ATOM 0 HB2 LEU A 134 14.979 -16.374 15.051 1.00 62.11 H new ATOM 0 HB3 LEU A 134 14.938 -16.737 13.337 1.00 62.11 H new ATOM 0 HG LEU A 134 17.200 -16.271 13.968 1.00 53.32 H new ATOM 0 HD11 LEU A 134 17.736 -14.378 12.486 1.00 72.13 H new ATOM 0 HD12 LEU A 134 16.510 -15.450 11.770 1.00 72.13 H new ATOM 0 HD13 LEU A 134 16.023 -13.896 12.488 1.00 72.13 H new ATOM 0 HD21 LEU A 134 17.883 -14.108 14.934 1.00 60.35 H new ATOM 0 HD22 LEU A 134 16.175 -13.617 15.031 1.00 60.35 H new ATOM 0 HD23 LEU A 134 16.764 -14.985 16.005 1.00 60.35 H new ATOM 2087 N ALA A 135 12.001 -16.134 14.532 1.00 23.32 N ATOM 2088 CA ALA A 135 10.734 -16.827 14.333 1.00 42.44 C ATOM 2089 C ALA A 135 9.597 -15.836 14.106 1.00 43.03 C ATOM 2090 O ALA A 135 8.620 -16.143 13.422 1.00 35.24 O ATOM 2091 CB ALA A 135 10.428 -17.721 15.525 1.00 53.40 C ATOM 0 H ALA A 135 12.316 -16.101 15.502 1.00 23.32 H new ATOM 0 HA ALA A 135 10.824 -17.448 13.442 1.00 42.44 H new ATOM 0 HB1 ALA A 135 9.479 -18.232 15.362 1.00 53.40 H new ATOM 0 HB2 ALA A 135 11.222 -18.459 15.640 1.00 53.40 H new ATOM 0 HB3 ALA A 135 10.363 -17.114 16.428 1.00 53.40 H new ATOM 2097 N LEU A 136 9.731 -14.647 14.683 1.00 71.01 N ATOM 2098 CA LEU A 136 8.714 -13.610 14.544 1.00 32.51 C ATOM 2099 C LEU A 136 8.606 -13.144 13.096 1.00 73.22 C ATOM 2100 O LEU A 136 7.524 -12.786 12.628 1.00 4.10 O ATOM 2101 CB LEU A 136 9.041 -12.423 15.451 1.00 14.11 C ATOM 2102 CG LEU A 136 7.995 -11.308 15.500 1.00 21.12 C ATOM 2103 CD1 LEU A 136 8.082 -10.552 16.817 1.00 21.30 C ATOM 2104 CD2 LEU A 136 8.173 -10.358 14.325 1.00 42.10 C ATOM 0 H LEU A 136 10.534 -14.377 15.251 1.00 71.01 H new ATOM 0 HA LEU A 136 7.755 -14.034 14.842 1.00 32.51 H new ATOM 0 HB2 LEU A 136 9.193 -12.796 16.464 1.00 14.11 H new ATOM 0 HB3 LEU A 136 9.988 -11.992 15.125 1.00 14.11 H new ATOM 0 HG LEU A 136 7.006 -11.760 15.429 1.00 21.12 H new ATOM 0 HD11 LEU A 136 7.330 -9.763 16.834 1.00 21.30 H new ATOM 0 HD12 LEU A 136 7.904 -11.240 17.644 1.00 21.30 H new ATOM 0 HD13 LEU A 136 9.074 -10.111 16.919 1.00 21.30 H new ATOM 0 HD21 LEU A 136 7.420 -9.571 14.376 1.00 42.10 H new ATOM 0 HD22 LEU A 136 9.167 -9.912 14.365 1.00 42.10 H new ATOM 0 HD23 LEU A 136 8.059 -10.909 13.391 1.00 42.10 H new ATOM 2116 N ILE A 137 9.732 -13.153 12.391 1.00 20.51 N ATOM 2117 CA ILE A 137 9.763 -12.735 10.995 1.00 13.33 C ATOM 2118 C ILE A 137 9.507 -13.913 10.062 1.00 63.20 C ATOM 2119 O ILE A 137 8.703 -13.821 9.135 1.00 53.22 O ATOM 2120 CB ILE A 137 11.113 -12.089 10.631 1.00 54.12 C ATOM 2121 CG1 ILE A 137 11.358 -10.848 11.492 1.00 61.12 C ATOM 2122 CG2 ILE A 137 11.146 -11.730 9.153 1.00 40.22 C ATOM 2123 CD1 ILE A 137 12.647 -10.906 12.281 1.00 10.04 C ATOM 0 H ILE A 137 10.635 -13.445 12.764 1.00 20.51 H new ATOM 0 HA ILE A 137 8.971 -11.997 10.869 1.00 13.33 H new ATOM 0 HB ILE A 137 11.908 -12.808 10.829 1.00 54.12 H new ATOM 0 HG12 ILE A 137 11.374 -9.967 10.850 1.00 61.12 H new ATOM 0 HG13 ILE A 137 10.524 -10.724 12.183 1.00 61.12 H new ATOM 0 HG21 ILE A 137 12.106 -11.274 8.911 1.00 40.22 H new ATOM 0 HG22 ILE A 137 11.012 -12.632 8.556 1.00 40.22 H new ATOM 0 HG23 ILE A 137 10.344 -11.026 8.932 1.00 40.22 H new ATOM 0 HD11 ILE A 137 12.756 -9.994 12.868 1.00 10.04 H new ATOM 0 HD12 ILE A 137 12.626 -11.767 12.949 1.00 10.04 H new ATOM 0 HD13 ILE A 137 13.489 -10.999 11.595 1.00 10.04 H new ATOM 2135 N ARG A 138 10.196 -15.021 10.315 1.00 63.24 N ATOM 2136 CA ARG A 138 10.044 -16.219 9.497 1.00 11.24 C ATOM 2137 C ARG A 138 8.600 -16.711 9.519 1.00 72.34 C ATOM 2138 O ARG A 138 8.125 -17.316 8.557 1.00 43.33 O ATOM 2139 CB ARG A 138 10.978 -17.324 9.994 1.00 0.44 C ATOM 2140 CG ARG A 138 10.964 -18.570 9.125 1.00 72.21 C ATOM 2141 CD ARG A 138 12.259 -19.356 9.256 1.00 44.52 C ATOM 2142 NE ARG A 138 12.108 -20.739 8.812 1.00 1.25 N ATOM 2143 CZ ARG A 138 11.505 -21.679 9.531 1.00 23.24 C ATOM 2144 NH1 ARG A 138 11.000 -21.386 10.722 1.00 73.45 N ATOM 2145 NH2 ARG A 138 11.407 -22.916 9.060 1.00 50.43 N ATOM 0 H ARG A 138 10.865 -15.114 11.080 1.00 63.24 H new ATOM 0 HA ARG A 138 10.308 -15.964 8.471 1.00 11.24 H new ATOM 0 HB2 ARG A 138 11.995 -16.935 10.040 1.00 0.44 H new ATOM 0 HB3 ARG A 138 10.695 -17.597 11.011 1.00 0.44 H new ATOM 0 HG2 ARG A 138 10.123 -19.203 9.408 1.00 72.21 H new ATOM 0 HG3 ARG A 138 10.813 -18.287 8.083 1.00 72.21 H new ATOM 0 HD2 ARG A 138 13.039 -18.870 8.669 1.00 44.52 H new ATOM 0 HD3 ARG A 138 12.587 -19.343 10.295 1.00 44.52 H new ATOM 0 HE ARG A 138 12.486 -20.997 7.900 1.00 1.25 H new ATOM 0 HH11 ARG A 138 11.074 -20.437 11.088 1.00 73.45 H new ATOM 0 HH12 ARG A 138 10.537 -22.110 11.272 1.00 73.45 H new ATOM 0 HH21 ARG A 138 11.795 -23.146 8.145 1.00 50.43 H new ATOM 0 HH22 ARG A 138 10.944 -23.637 9.613 1.00 50.43 H new ATOM 2159 N ASP A 139 7.907 -16.449 10.621 1.00 20.03 N ATOM 2160 CA ASP A 139 6.517 -16.865 10.768 1.00 51.20 C ATOM 2161 C ASP A 139 5.568 -15.760 10.313 1.00 64.11 C ATOM 2162 O ASP A 139 5.513 -14.677 10.895 1.00 45.52 O ATOM 2163 CB ASP A 139 6.225 -17.238 12.222 1.00 13.01 C ATOM 2164 CG ASP A 139 5.014 -18.140 12.356 1.00 32.31 C ATOM 2165 OD1 ASP A 139 3.956 -17.803 11.784 1.00 12.15 O ATOM 2166 OD2 ASP A 139 5.124 -19.184 13.032 1.00 64.41 O ATOM 0 H ASP A 139 8.285 -15.950 11.426 1.00 20.03 H new ATOM 0 HA ASP A 139 6.357 -17.740 10.137 1.00 51.20 H new ATOM 0 HB2 ASP A 139 7.095 -17.737 12.648 1.00 13.01 H new ATOM 0 HB3 ASP A 139 6.064 -16.329 12.802 1.00 13.01 H new ATOM 2171 N PRO A 140 4.804 -16.038 9.247 1.00 74.43 N ATOM 2172 CA PRO A 140 3.844 -15.081 8.689 1.00 12.23 C ATOM 2173 C PRO A 140 2.649 -14.855 9.610 1.00 44.21 C ATOM 2174 O PRO A 140 1.830 -13.969 9.372 1.00 14.12 O ATOM 2175 CB PRO A 140 3.396 -15.746 7.385 1.00 12.24 C ATOM 2176 CG PRO A 140 3.612 -17.203 7.609 1.00 5.43 C ATOM 2177 CD PRO A 140 4.817 -17.310 8.503 1.00 13.55 C ATOM 0 HA PRO A 140 4.286 -14.095 8.550 1.00 12.23 H new ATOM 0 HB2 PRO A 140 2.350 -15.529 7.169 1.00 12.24 H new ATOM 0 HB3 PRO A 140 3.978 -15.385 6.537 1.00 12.24 H new ATOM 0 HG2 PRO A 140 2.739 -17.660 8.075 1.00 5.43 H new ATOM 0 HG3 PRO A 140 3.779 -17.723 6.665 1.00 5.43 H new ATOM 0 HD2 PRO A 140 4.746 -18.168 9.172 1.00 13.55 H new ATOM 0 HD3 PRO A 140 5.735 -17.430 7.928 1.00 13.55 H new ATOM 2185 N ASN A 141 2.558 -15.662 10.662 1.00 51.11 N ATOM 2186 CA ASN A 141 1.463 -15.549 11.619 1.00 72.44 C ATOM 2187 C ASN A 141 1.985 -15.596 13.051 1.00 2.53 C ATOM 2188 O ASN A 141 1.269 -15.989 13.971 1.00 23.44 O ATOM 2189 CB ASN A 141 0.448 -16.673 11.398 1.00 54.54 C ATOM 2190 CG ASN A 141 -0.102 -16.685 9.984 1.00 21.42 C ATOM 2191 OD1 ASN A 141 0.616 -16.983 9.030 1.00 45.23 O ATOM 2192 ND2 ASN A 141 -1.382 -16.361 9.844 1.00 31.44 N ATOM 0 H ASN A 141 3.229 -16.401 10.873 1.00 51.11 H new ATOM 0 HA ASN A 141 0.973 -14.588 11.461 1.00 72.44 H new ATOM 0 HB2 ASN A 141 0.920 -17.632 11.609 1.00 54.54 H new ATOM 0 HB3 ASN A 141 -0.375 -16.560 12.104 1.00 54.54 H new ATOM 0 HD21 ASN A 141 -1.807 -16.352 8.917 1.00 31.44 H new ATOM 0 HD22 ASN A 141 -1.940 -16.121 10.663 1.00 31.44 H new ATOM 2199 N ALA A 142 3.238 -15.190 13.232 1.00 52.41 N ATOM 2200 CA ALA A 142 3.855 -15.182 14.552 1.00 3.22 C ATOM 2201 C ALA A 142 2.979 -14.451 15.564 1.00 41.22 C ATOM 2202 O ALA A 142 2.917 -13.221 15.572 1.00 60.35 O ATOM 2203 CB ALA A 142 5.234 -14.542 14.486 1.00 24.31 C ATOM 0 H ALA A 142 3.845 -14.862 12.481 1.00 52.41 H new ATOM 0 HA ALA A 142 3.961 -16.215 14.882 1.00 3.22 H new ATOM 0 HB1 ALA A 142 5.683 -14.543 15.479 1.00 24.31 H new ATOM 0 HB2 ALA A 142 5.866 -15.108 13.802 1.00 24.31 H new ATOM 0 HB3 ALA A 142 5.142 -13.516 14.130 1.00 24.31 H new