USER MOD reduce.3.24.130724 H: found=0, std=0, add=1082, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1084 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 83 HIS : no HD1:sc= -0.0236 X(o=-0.024,f=-0.0089) USER MOD Set 1.2: A 89 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 34 ASN : amide:sc= -1.77 K(o=-5.4,f=-2.3!) USER MOD Set 2.2: A 57 ASN : amide:sc= -3.59! C(o=-5.4!,f=-2.3!) USER MOD Single : A 14 CYS SG : rot 110:sc= -0.236 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= -0.0238 K(o=-0.024,f=-4.2!) USER MOD Single : A 40 MET CE :methyl 152:sc= -6.64! (180deg=-8.74!) USER MOD Single : A 41 LYS NZ :NH3+ -170:sc= 0.148 (180deg=0.119) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 MET CE :methyl -130:sc= 0 (180deg=-0.227) USER MOD Single : A 56 GLN : amide:sc= -0.0325 X(o=-0.033,f=0) USER MOD Single : A 59 SER OG : rot -87:sc= 0.384 USER MOD Single : A 64 LYS NZ :NH3+ 157:sc= 0.0222 (180deg=0) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 TYR OH : rot 6:sc= 0.434 USER MOD Single : A 78 SER OG : rot 180:sc= -0.0969 USER MOD Single : A 79 TYR OH : rot -15:sc= -2.23 USER MOD Single : A 80 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00462) USER MOD Single : A 81 TYR OH : rot 130:sc= -0.0681 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 CYS SG : rot 60:sc= -4.06! USER MOD Single : A 97 SER OG : rot -150:sc= -0.0397 USER MOD Single : A 98 SER OG : rot 59:sc= 1.1 USER MOD Single : A 102 CYS SG : rot 180:sc= -2.11 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.695 X(o=-0.69,f=-0.45) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 MET CE :methyl -165:sc= 0 (180deg=-0.293) USER MOD Single : A 109 MET CE :methyl -171:sc= -1.72 (180deg=-1.98!) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 76:sc= 1.3 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 119 GLN : amide:sc= -0.111 K(o=-0.11,f=-1.4!) USER MOD Single : A 120 THR OG1 : rot 79:sc= 1.17 USER MOD Single : A 124 THR OG1 : rot -28:sc= 0.427! USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 132 THR OG1 : rot 180:sc= -0.0432 USER MOD Single : A 136 THR OG1 : rot -67:sc= 0.146 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 135 N VAL A 13 17.607 -1.596 -0.775 1.00 53.34 N ATOM 136 CA VAL A 13 17.063 -0.245 -0.701 1.00 13.40 C ATOM 137 C VAL A 13 17.023 0.409 -2.078 1.00 73.23 C ATOM 138 O VAL A 13 18.037 0.476 -2.773 1.00 73.14 O ATOM 139 CB VAL A 13 17.887 0.641 0.252 1.00 62.32 C ATOM 140 CG1 VAL A 13 19.230 0.990 -0.372 1.00 41.44 C ATOM 141 CG2 VAL A 13 17.114 1.900 0.611 1.00 14.51 C ATOM 0 HA VAL A 13 16.047 -0.334 -0.315 1.00 13.40 H new ATOM 0 HB VAL A 13 18.073 0.083 1.170 1.00 62.32 H new ATOM 0 HG11 VAL A 13 19.799 1.616 0.315 1.00 41.44 H new ATOM 0 HG12 VAL A 13 19.786 0.075 -0.574 1.00 41.44 H new ATOM 0 HG13 VAL A 13 19.068 1.529 -1.305 1.00 41.44 H new ATOM 0 HG21 VAL A 13 17.711 2.514 1.285 1.00 14.51 H new ATOM 0 HG22 VAL A 13 16.896 2.464 -0.296 1.00 14.51 H new ATOM 0 HG23 VAL A 13 16.180 1.626 1.102 1.00 14.51 H new ATOM 151 N CYS A 14 15.847 0.888 -2.465 1.00 74.25 N ATOM 152 CA CYS A 14 15.674 1.537 -3.760 1.00 32.24 C ATOM 153 C CYS A 14 15.211 2.980 -3.588 1.00 61.13 C ATOM 154 O CYS A 14 15.114 3.480 -2.468 1.00 50.21 O ATOM 155 CB CYS A 14 14.666 0.762 -4.611 1.00 40.41 C ATOM 156 SG CYS A 14 15.182 -0.923 -5.013 1.00 74.23 S ATOM 0 H CYS A 14 14.999 0.840 -1.901 1.00 74.25 H new ATOM 0 HA CYS A 14 16.638 1.543 -4.268 1.00 32.24 H new ATOM 0 HB2 CYS A 14 13.714 0.723 -4.082 1.00 40.41 H new ATOM 0 HB3 CYS A 14 14.493 1.309 -5.538 1.00 40.41 H new ATOM 0 HG CYS A 14 14.439 -1.771 -4.365 1.00 74.23 H new ATOM 162 N GLU A 15 14.927 3.642 -4.705 1.00 75.53 N ATOM 163 CA GLU A 15 14.475 5.028 -4.677 1.00 64.35 C ATOM 164 C GLU A 15 13.007 5.130 -5.077 1.00 71.41 C ATOM 165 O GLU A 15 12.429 4.184 -5.613 1.00 65.20 O ATOM 166 CB GLU A 15 15.331 5.885 -5.612 1.00 41.24 C ATOM 167 CG GLU A 15 15.300 5.424 -7.060 1.00 20.20 C ATOM 168 CD GLU A 15 16.641 5.578 -7.750 1.00 60.12 C ATOM 169 OE1 GLU A 15 16.962 6.706 -8.179 1.00 63.20 O ATOM 170 OE2 GLU A 15 17.369 4.569 -7.862 1.00 4.32 O ATOM 0 H GLU A 15 15.002 3.241 -5.640 1.00 75.53 H new ATOM 0 HA GLU A 15 14.582 5.398 -3.657 1.00 64.35 H new ATOM 0 HB2 GLU A 15 14.987 6.918 -5.561 1.00 41.24 H new ATOM 0 HB3 GLU A 15 16.362 5.875 -5.258 1.00 41.24 H new ATOM 0 HG2 GLU A 15 14.994 4.379 -7.098 1.00 20.20 H new ATOM 0 HG3 GLU A 15 14.548 5.996 -7.604 1.00 20.20 H new ATOM 177 N VAL A 16 12.406 6.286 -4.812 1.00 53.34 N ATOM 178 CA VAL A 16 11.005 6.514 -5.144 1.00 55.01 C ATOM 179 C VAL A 16 10.865 7.191 -6.503 1.00 34.40 C ATOM 180 O VAL A 16 11.060 8.400 -6.628 1.00 53.41 O ATOM 181 CB VAL A 16 10.309 7.379 -4.078 1.00 33.05 C ATOM 182 CG1 VAL A 16 10.972 8.745 -3.982 1.00 55.13 C ATOM 183 CG2 VAL A 16 8.826 7.518 -4.389 1.00 21.51 C ATOM 0 H VAL A 16 12.868 7.079 -4.368 1.00 53.34 H new ATOM 0 HA VAL A 16 10.525 5.536 -5.177 1.00 55.01 H new ATOM 0 HB VAL A 16 10.409 6.884 -3.112 1.00 33.05 H new ATOM 0 HG11 VAL A 16 10.466 9.342 -3.223 1.00 55.13 H new ATOM 0 HG12 VAL A 16 12.020 8.622 -3.708 1.00 55.13 H new ATOM 0 HG13 VAL A 16 10.905 9.250 -4.946 1.00 55.13 H new ATOM 0 HG21 VAL A 16 8.350 8.133 -3.625 1.00 21.51 H new ATOM 0 HG22 VAL A 16 8.701 7.990 -5.364 1.00 21.51 H new ATOM 0 HG23 VAL A 16 8.363 6.531 -4.401 1.00 21.51 H new ATOM 193 N ASP A 17 10.526 6.403 -7.518 1.00 12.31 N ATOM 194 CA ASP A 17 10.358 6.927 -8.869 1.00 50.41 C ATOM 195 C ASP A 17 9.764 8.332 -8.837 1.00 45.42 C ATOM 196 O ASP A 17 8.873 8.638 -8.045 1.00 3.21 O ATOM 197 CB ASP A 17 9.462 5.999 -9.691 1.00 0.20 C ATOM 198 CG ASP A 17 9.461 6.351 -11.165 1.00 43.42 C ATOM 199 OD1 ASP A 17 8.613 7.168 -11.580 1.00 0.21 O ATOM 200 OD2 ASP A 17 10.310 5.810 -11.905 1.00 20.12 O ATOM 0 H ASP A 17 10.362 5.400 -7.431 1.00 12.31 H new ATOM 0 HA ASP A 17 11.341 6.978 -9.337 1.00 50.41 H new ATOM 0 HB2 ASP A 17 9.799 4.970 -9.567 1.00 0.20 H new ATOM 0 HB3 ASP A 17 8.443 6.050 -9.308 1.00 0.20 H new ATOM 205 N PRO A 18 10.269 9.208 -9.718 1.00 45.42 N ATOM 206 CA PRO A 18 9.804 10.596 -9.811 1.00 34.32 C ATOM 207 C PRO A 18 8.390 10.696 -10.372 1.00 52.15 C ATOM 208 O PRO A 18 7.644 11.616 -10.038 1.00 50.12 O ATOM 209 CB PRO A 18 10.807 11.244 -10.768 1.00 60.43 C ATOM 210 CG PRO A 18 11.325 10.116 -11.593 1.00 52.12 C ATOM 211 CD PRO A 18 11.333 8.912 -10.692 1.00 2.21 C ATOM 0 HA PRO A 18 9.757 11.076 -8.834 1.00 34.32 H new ATOM 0 HB2 PRO A 18 10.329 12.002 -11.389 1.00 60.43 H new ATOM 0 HB3 PRO A 18 11.611 11.739 -10.223 1.00 60.43 H new ATOM 0 HG2 PRO A 18 10.692 9.947 -12.464 1.00 52.12 H new ATOM 0 HG3 PRO A 18 12.327 10.332 -11.964 1.00 52.12 H new ATOM 0 HD2 PRO A 18 11.128 7.995 -11.245 1.00 2.21 H new ATOM 0 HD3 PRO A 18 12.299 8.781 -10.205 1.00 2.21 H new ATOM 219 N GLU A 19 8.028 9.744 -11.227 1.00 3.02 N ATOM 220 CA GLU A 19 6.702 9.728 -11.835 1.00 23.43 C ATOM 221 C GLU A 19 5.651 9.255 -10.834 1.00 65.42 C ATOM 222 O GLU A 19 4.475 9.601 -10.942 1.00 13.51 O ATOM 223 CB GLU A 19 6.693 8.821 -13.067 1.00 64.31 C ATOM 224 CG GLU A 19 6.311 7.383 -12.762 1.00 65.14 C ATOM 225 CD GLU A 19 4.889 7.057 -13.175 1.00 10.14 C ATOM 226 OE1 GLU A 19 3.964 7.339 -12.385 1.00 34.21 O ATOM 227 OE2 GLU A 19 4.701 6.521 -14.287 1.00 13.21 O ATOM 0 H GLU A 19 8.633 8.975 -11.514 1.00 3.02 H new ATOM 0 HA GLU A 19 6.457 10.745 -12.140 1.00 23.43 H new ATOM 0 HB2 GLU A 19 5.995 9.226 -13.800 1.00 64.31 H new ATOM 0 HB3 GLU A 19 7.682 8.836 -13.526 1.00 64.31 H new ATOM 0 HG2 GLU A 19 6.998 6.711 -13.277 1.00 65.14 H new ATOM 0 HG3 GLU A 19 6.426 7.199 -11.694 1.00 65.14 H new ATOM 234 N LEU A 20 6.084 8.461 -9.862 1.00 21.22 N ATOM 235 CA LEU A 20 5.182 7.938 -8.841 1.00 51.03 C ATOM 236 C LEU A 20 5.057 8.912 -7.674 1.00 42.52 C ATOM 237 O LEU A 20 3.990 9.050 -7.076 1.00 20.43 O ATOM 238 CB LEU A 20 5.679 6.582 -8.337 1.00 74.23 C ATOM 239 CG LEU A 20 4.600 5.599 -7.881 1.00 44.12 C ATOM 240 CD1 LEU A 20 5.224 4.273 -7.476 1.00 11.03 C ATOM 241 CD2 LEU A 20 3.796 6.186 -6.730 1.00 62.21 C ATOM 0 H LEU A 20 7.055 8.165 -9.759 1.00 21.22 H new ATOM 0 HA LEU A 20 4.198 7.812 -9.292 1.00 51.03 H new ATOM 0 HB2 LEU A 20 6.258 6.112 -9.131 1.00 74.23 H new ATOM 0 HB3 LEU A 20 6.361 6.754 -7.504 1.00 74.23 H new ATOM 0 HG LEU A 20 3.923 5.419 -8.716 1.00 44.12 H new ATOM 0 HD11 LEU A 20 4.441 3.586 -7.154 1.00 11.03 H new ATOM 0 HD12 LEU A 20 5.755 3.846 -8.327 1.00 11.03 H new ATOM 0 HD13 LEU A 20 5.924 4.435 -6.656 1.00 11.03 H new ATOM 0 HD21 LEU A 20 3.033 5.473 -6.418 1.00 62.21 H new ATOM 0 HD22 LEU A 20 4.460 6.396 -5.892 1.00 62.21 H new ATOM 0 HD23 LEU A 20 3.318 7.110 -7.054 1.00 62.21 H new ATOM 253 N LYS A 21 6.155 9.589 -7.356 1.00 65.01 N ATOM 254 CA LYS A 21 6.170 10.554 -6.262 1.00 45.41 C ATOM 255 C LYS A 21 4.981 11.504 -6.359 1.00 52.11 C ATOM 256 O LYS A 21 4.303 11.766 -5.367 1.00 4.42 O ATOM 257 CB LYS A 21 7.476 11.351 -6.277 1.00 3.44 C ATOM 258 CG LYS A 21 7.733 12.120 -4.992 1.00 44.32 C ATOM 259 CD LYS A 21 8.368 13.473 -5.269 1.00 73.11 C ATOM 260 CE LYS A 21 9.852 13.472 -4.936 1.00 21.43 C ATOM 261 NZ LYS A 21 10.332 14.823 -4.536 1.00 21.21 N ATOM 0 H LYS A 21 7.047 9.487 -7.840 1.00 65.01 H new ATOM 0 HA LYS A 21 6.097 10.004 -5.324 1.00 45.41 H new ATOM 0 HB2 LYS A 21 8.307 10.668 -6.454 1.00 3.44 H new ATOM 0 HB3 LYS A 21 7.455 12.051 -7.112 1.00 3.44 H new ATOM 0 HG2 LYS A 21 6.794 12.261 -4.457 1.00 44.32 H new ATOM 0 HG3 LYS A 21 8.386 11.537 -4.342 1.00 44.32 H new ATOM 0 HD2 LYS A 21 8.230 13.733 -6.319 1.00 73.11 H new ATOM 0 HD3 LYS A 21 7.863 14.240 -4.682 1.00 73.11 H new ATOM 0 HE2 LYS A 21 10.042 12.765 -4.128 1.00 21.43 H new ATOM 0 HE3 LYS A 21 10.418 13.127 -5.801 1.00 21.43 H new ATOM 0 HZ1 LYS A 21 11.348 14.780 -4.317 1.00 21.21 H new ATOM 0 HZ2 LYS A 21 10.174 15.493 -5.316 1.00 21.21 H new ATOM 0 HZ3 LYS A 21 9.810 15.142 -3.695 1.00 21.21 H new ATOM 275 N GLU A 22 4.734 12.015 -7.561 1.00 72.44 N ATOM 276 CA GLU A 22 3.625 12.935 -7.786 1.00 0.21 C ATOM 277 C GLU A 22 2.286 12.237 -7.568 1.00 53.44 C ATOM 278 O GLU A 22 1.375 12.792 -6.952 1.00 41.43 O ATOM 279 CB GLU A 22 3.689 13.510 -9.203 1.00 64.42 C ATOM 280 CG GLU A 22 5.085 13.941 -9.623 1.00 33.14 C ATOM 281 CD GLU A 22 5.066 14.990 -10.716 1.00 52.45 C ATOM 282 OE1 GLU A 22 4.346 14.794 -11.717 1.00 34.00 O ATOM 283 OE2 GLU A 22 5.773 16.011 -10.571 1.00 64.53 O ATOM 0 H GLU A 22 5.286 11.808 -8.393 1.00 72.44 H new ATOM 0 HA GLU A 22 3.711 13.750 -7.067 1.00 0.21 H new ATOM 0 HB2 GLU A 22 3.322 12.763 -9.906 1.00 64.42 H new ATOM 0 HB3 GLU A 22 3.018 14.367 -9.269 1.00 64.42 H new ATOM 0 HG2 GLU A 22 5.616 14.334 -8.756 1.00 33.14 H new ATOM 0 HG3 GLU A 22 5.641 13.070 -9.970 1.00 33.14 H new ATOM 290 N THR A 23 2.172 11.015 -8.079 1.00 72.15 N ATOM 291 CA THR A 23 0.945 10.241 -7.943 1.00 54.12 C ATOM 292 C THR A 23 0.448 10.246 -6.503 1.00 24.44 C ATOM 293 O THR A 23 -0.729 10.494 -6.241 1.00 52.24 O ATOM 294 CB THR A 23 1.146 8.783 -8.400 1.00 54.55 C ATOM 295 OG1 THR A 23 1.163 8.717 -9.831 1.00 71.21 O ATOM 296 CG2 THR A 23 0.041 7.889 -7.859 1.00 62.13 C ATOM 0 H THR A 23 2.915 10.540 -8.591 1.00 72.15 H new ATOM 0 HA THR A 23 0.201 10.715 -8.583 1.00 54.12 H new ATOM 0 HB THR A 23 2.100 8.431 -8.009 1.00 54.55 H new ATOM 0 HG1 THR A 23 1.293 7.788 -10.114 1.00 71.21 H new ATOM 0 HG21 THR A 23 0.204 6.865 -8.195 1.00 62.13 H new ATOM 0 HG22 THR A 23 0.049 7.919 -6.769 1.00 62.13 H new ATOM 0 HG23 THR A 23 -0.924 8.241 -8.224 1.00 62.13 H new ATOM 304 N LEU A 24 1.353 9.970 -5.569 1.00 41.14 N ATOM 305 CA LEU A 24 1.007 9.943 -4.152 1.00 70.32 C ATOM 306 C LEU A 24 0.570 11.323 -3.672 1.00 52.04 C ATOM 307 O LEU A 24 -0.475 11.468 -3.037 1.00 62.20 O ATOM 308 CB LEU A 24 2.199 9.457 -3.326 1.00 23.51 C ATOM 309 CG LEU A 24 3.017 8.317 -3.932 1.00 74.54 C ATOM 310 CD1 LEU A 24 4.115 7.880 -2.976 1.00 64.23 C ATOM 311 CD2 LEU A 24 2.115 7.142 -4.283 1.00 74.44 C ATOM 0 H LEU A 24 2.332 9.762 -5.768 1.00 41.14 H new ATOM 0 HA LEU A 24 0.174 9.252 -4.019 1.00 70.32 H new ATOM 0 HB2 LEU A 24 2.865 10.303 -3.154 1.00 23.51 H new ATOM 0 HB3 LEU A 24 1.833 9.136 -2.351 1.00 23.51 H new ATOM 0 HG LEU A 24 3.484 8.678 -4.848 1.00 74.54 H new ATOM 0 HD11 LEU A 24 4.686 7.068 -3.425 1.00 64.23 H new ATOM 0 HD12 LEU A 24 4.778 8.721 -2.774 1.00 64.23 H new ATOM 0 HD13 LEU A 24 3.669 7.537 -2.042 1.00 64.23 H new ATOM 0 HD21 LEU A 24 2.714 6.339 -4.713 1.00 74.44 H new ATOM 0 HD22 LEU A 24 1.619 6.782 -3.381 1.00 74.44 H new ATOM 0 HD23 LEU A 24 1.365 7.462 -5.006 1.00 74.44 H new ATOM 323 N ARG A 25 1.374 12.334 -3.982 1.00 1.50 N ATOM 324 CA ARG A 25 1.070 13.703 -3.583 1.00 55.24 C ATOM 325 C ARG A 25 -0.317 14.115 -4.070 1.00 2.44 C ATOM 326 O ARG A 25 -0.989 14.934 -3.443 1.00 64.00 O ATOM 327 CB ARG A 25 2.123 14.665 -4.137 1.00 22.25 C ATOM 328 CG ARG A 25 1.903 16.112 -3.726 1.00 22.53 C ATOM 329 CD ARG A 25 3.197 16.909 -3.782 1.00 31.12 C ATOM 330 NE ARG A 25 3.457 17.437 -5.118 1.00 62.33 N ATOM 331 CZ ARG A 25 4.401 18.333 -5.383 1.00 63.21 C ATOM 332 NH1 ARG A 25 5.171 18.797 -4.409 1.00 41.24 N ATOM 333 NH2 ARG A 25 4.577 18.765 -6.625 1.00 43.02 N ATOM 0 H ARG A 25 2.242 12.231 -4.509 1.00 1.50 H new ATOM 0 HA ARG A 25 1.083 13.749 -2.494 1.00 55.24 H new ATOM 0 HB2 ARG A 25 3.109 14.346 -3.798 1.00 22.25 H new ATOM 0 HB3 ARG A 25 2.124 14.601 -5.225 1.00 22.25 H new ATOM 0 HG2 ARG A 25 1.164 16.570 -4.383 1.00 22.53 H new ATOM 0 HG3 ARG A 25 1.496 16.147 -2.715 1.00 22.53 H new ATOM 0 HD2 ARG A 25 3.146 17.733 -3.070 1.00 31.12 H new ATOM 0 HD3 ARG A 25 4.028 16.273 -3.475 1.00 31.12 H new ATOM 0 HE ARG A 25 2.882 17.099 -5.890 1.00 62.33 H new ATOM 0 HH11 ARG A 25 5.039 18.466 -3.453 1.00 41.24 H new ATOM 0 HH12 ARG A 25 5.895 19.485 -4.615 1.00 41.24 H new ATOM 0 HH21 ARG A 25 3.987 18.409 -7.377 1.00 43.02 H new ATOM 0 HH22 ARG A 25 5.302 19.453 -6.828 1.00 43.02 H new ATOM 347 N LYS A 26 -0.738 13.543 -5.193 1.00 1.43 N ATOM 348 CA LYS A 26 -2.044 13.849 -5.765 1.00 12.23 C ATOM 349 C LYS A 26 -3.133 12.998 -5.121 1.00 65.41 C ATOM 350 O LYS A 26 -4.253 13.462 -4.906 1.00 13.42 O ATOM 351 CB LYS A 26 -2.028 13.619 -7.277 1.00 71.22 C ATOM 352 CG LYS A 26 -0.737 14.056 -7.946 1.00 41.04 C ATOM 353 CD LYS A 26 -0.992 15.098 -9.023 1.00 31.21 C ATOM 354 CE LYS A 26 0.047 15.019 -10.132 1.00 21.13 C ATOM 355 NZ LYS A 26 -0.584 14.901 -11.475 1.00 2.31 N ATOM 0 H LYS A 26 -0.193 12.865 -5.725 1.00 1.43 H new ATOM 0 HA LYS A 26 -2.263 14.898 -5.566 1.00 12.23 H new ATOM 0 HB2 LYS A 26 -2.190 12.560 -7.476 1.00 71.22 H new ATOM 0 HB3 LYS A 26 -2.861 14.159 -7.727 1.00 71.22 H new ATOM 0 HG2 LYS A 26 -0.058 14.464 -7.197 1.00 41.04 H new ATOM 0 HG3 LYS A 26 -0.243 13.190 -8.386 1.00 41.04 H new ATOM 0 HD2 LYS A 26 -1.987 14.952 -9.444 1.00 31.21 H new ATOM 0 HD3 LYS A 26 -0.977 16.093 -8.579 1.00 31.21 H new ATOM 0 HE2 LYS A 26 0.677 15.908 -10.104 1.00 21.13 H new ATOM 0 HE3 LYS A 26 0.698 14.162 -9.960 1.00 21.13 H new ATOM 0 HZ1 LYS A 26 0.157 14.850 -12.203 1.00 2.31 H new ATOM 0 HZ2 LYS A 26 -1.165 14.039 -11.511 1.00 2.31 H new ATOM 0 HZ3 LYS A 26 -1.185 15.731 -11.650 1.00 2.31 H new ATOM 369 N PHE A 27 -2.797 11.749 -4.813 1.00 3.01 N ATOM 370 CA PHE A 27 -3.747 10.832 -4.193 1.00 0.51 C ATOM 371 C PHE A 27 -4.248 11.386 -2.862 1.00 41.33 C ATOM 372 O PHE A 27 -5.410 11.202 -2.500 1.00 44.40 O ATOM 373 CB PHE A 27 -3.099 9.463 -3.977 1.00 12.21 C ATOM 374 CG PHE A 27 -4.093 8.347 -3.828 1.00 20.51 C ATOM 375 CD1 PHE A 27 -5.147 8.217 -4.717 1.00 53.23 C ATOM 376 CD2 PHE A 27 -3.973 7.428 -2.798 1.00 33.01 C ATOM 377 CE1 PHE A 27 -6.063 7.190 -4.583 1.00 13.22 C ATOM 378 CE2 PHE A 27 -4.886 6.400 -2.659 1.00 21.53 C ATOM 379 CZ PHE A 27 -5.933 6.281 -3.551 1.00 1.21 C ATOM 0 H PHE A 27 -1.874 11.349 -4.983 1.00 3.01 H new ATOM 0 HA PHE A 27 -4.599 10.722 -4.864 1.00 0.51 H new ATOM 0 HB2 PHE A 27 -2.442 9.244 -4.819 1.00 12.21 H new ATOM 0 HB3 PHE A 27 -2.473 9.503 -3.086 1.00 12.21 H new ATOM 0 HD1 PHE A 27 -5.255 8.926 -5.524 1.00 53.23 H new ATOM 0 HD2 PHE A 27 -3.157 7.516 -2.096 1.00 33.01 H new ATOM 0 HE1 PHE A 27 -6.879 7.099 -5.284 1.00 13.22 H new ATOM 0 HE2 PHE A 27 -4.780 5.690 -1.852 1.00 21.53 H new ATOM 0 HZ PHE A 27 -6.649 5.479 -3.442 1.00 1.21 H new ATOM 389 N ARG A 28 -3.363 12.065 -2.140 1.00 63.25 N ATOM 390 CA ARG A 28 -3.714 12.644 -0.849 1.00 2.34 C ATOM 391 C ARG A 28 -4.634 13.849 -1.025 1.00 71.54 C ATOM 392 O ARG A 28 -5.538 14.074 -0.222 1.00 13.44 O ATOM 393 CB ARG A 28 -2.450 13.060 -0.093 1.00 54.53 C ATOM 394 CG ARG A 28 -1.304 12.072 -0.230 1.00 70.40 C ATOM 395 CD ARG A 28 -0.667 11.769 1.117 1.00 24.43 C ATOM 396 NE ARG A 28 -0.142 12.973 1.758 1.00 63.23 N ATOM 397 CZ ARG A 28 0.055 13.082 3.067 1.00 60.54 C ATOM 398 NH1 ARG A 28 -0.226 12.065 3.870 1.00 32.10 N ATOM 399 NH2 ARG A 28 0.536 14.210 3.574 1.00 34.33 N ATOM 0 H ARG A 28 -2.398 12.228 -2.427 1.00 63.25 H new ATOM 0 HA ARG A 28 -4.243 11.886 -0.271 1.00 2.34 H new ATOM 0 HB2 ARG A 28 -2.124 14.034 -0.457 1.00 54.53 H new ATOM 0 HB3 ARG A 28 -2.691 13.179 0.963 1.00 54.53 H new ATOM 0 HG2 ARG A 28 -1.670 11.148 -0.677 1.00 70.40 H new ATOM 0 HG3 ARG A 28 -0.552 12.477 -0.907 1.00 70.40 H new ATOM 0 HD2 ARG A 28 -1.405 11.303 1.770 1.00 24.43 H new ATOM 0 HD3 ARG A 28 0.140 11.049 0.983 1.00 24.43 H new ATOM 0 HE ARG A 28 0.086 13.773 1.168 1.00 63.23 H new ATOM 0 HH11 ARG A 28 -0.594 11.196 3.483 1.00 32.10 H new ATOM 0 HH12 ARG A 28 -0.074 12.151 4.875 1.00 32.10 H new ATOM 0 HH21 ARG A 28 0.754 14.993 2.958 1.00 34.33 H new ATOM 0 HH22 ARG A 28 0.687 14.294 4.579 1.00 34.33 H new ATOM 413 N PHE A 29 -4.397 14.617 -2.083 1.00 13.24 N ATOM 414 CA PHE A 29 -5.204 15.799 -2.364 1.00 43.33 C ATOM 415 C PHE A 29 -5.855 15.698 -3.740 1.00 71.00 C ATOM 416 O PHE A 29 -5.939 16.683 -4.474 1.00 12.03 O ATOM 417 CB PHE A 29 -4.342 17.061 -2.288 1.00 4.44 C ATOM 418 CG PHE A 29 -3.108 16.895 -1.447 1.00 70.14 C ATOM 419 CD1 PHE A 29 -3.194 16.388 -0.161 1.00 32.31 C ATOM 420 CD2 PHE A 29 -1.863 17.245 -1.943 1.00 63.44 C ATOM 421 CE1 PHE A 29 -2.061 16.234 0.615 1.00 21.23 C ATOM 422 CE2 PHE A 29 -0.726 17.093 -1.173 1.00 23.22 C ATOM 423 CZ PHE A 29 -0.825 16.586 0.109 1.00 50.22 C ATOM 0 H PHE A 29 -3.654 14.443 -2.759 1.00 13.24 H new ATOM 0 HA PHE A 29 -5.991 15.858 -1.612 1.00 43.33 H new ATOM 0 HB2 PHE A 29 -4.048 17.352 -3.297 1.00 4.44 H new ATOM 0 HB3 PHE A 29 -4.941 17.877 -1.883 1.00 4.44 H new ATOM 0 HD1 PHE A 29 -4.158 16.110 0.240 1.00 32.31 H new ATOM 0 HD2 PHE A 29 -1.780 17.642 -2.944 1.00 63.44 H new ATOM 0 HE1 PHE A 29 -2.142 15.839 1.617 1.00 21.23 H new ATOM 0 HE2 PHE A 29 0.239 17.370 -1.572 1.00 23.22 H new ATOM 0 HZ PHE A 29 0.062 16.465 0.713 1.00 50.22 H new ATOM 433 N ARG A 30 -6.315 14.499 -4.084 1.00 32.01 N ATOM 434 CA ARG A 30 -6.958 14.267 -5.371 1.00 62.05 C ATOM 435 C ARG A 30 -8.338 14.917 -5.415 1.00 43.52 C ATOM 436 O ARG A 30 -8.890 15.297 -4.383 1.00 2.11 O ATOM 437 CB ARG A 30 -7.080 12.766 -5.641 1.00 73.25 C ATOM 438 CG ARG A 30 -7.846 12.014 -4.566 1.00 12.13 C ATOM 439 CD ARG A 30 -7.487 10.537 -4.554 1.00 2.00 C ATOM 440 NE ARG A 30 -8.607 9.697 -4.970 1.00 41.32 N ATOM 441 CZ ARG A 30 -9.558 9.280 -4.144 1.00 34.23 C ATOM 442 NH1 ARG A 30 -9.527 9.623 -2.863 1.00 51.40 N ATOM 443 NH2 ARG A 30 -10.546 8.518 -4.597 1.00 53.33 N ATOM 0 H ARG A 30 -6.254 13.673 -3.488 1.00 32.01 H new ATOM 0 HA ARG A 30 -6.338 14.719 -6.145 1.00 62.05 H new ATOM 0 HB2 ARG A 30 -7.576 12.617 -6.600 1.00 73.25 H new ATOM 0 HB3 ARG A 30 -6.081 12.339 -5.729 1.00 73.25 H new ATOM 0 HG2 ARG A 30 -7.629 12.450 -3.591 1.00 12.13 H new ATOM 0 HG3 ARG A 30 -8.917 12.128 -4.734 1.00 12.13 H new ATOM 0 HD2 ARG A 30 -6.639 10.365 -5.217 1.00 2.00 H new ATOM 0 HD3 ARG A 30 -7.171 10.249 -3.551 1.00 2.00 H new ATOM 0 HE ARG A 30 -8.661 9.416 -5.949 1.00 41.32 H new ATOM 0 HH11 ARG A 30 -8.770 10.209 -2.510 1.00 51.40 H new ATOM 0 HH12 ARG A 30 -10.260 9.301 -2.231 1.00 51.40 H new ATOM 0 HH21 ARG A 30 -10.575 8.252 -5.581 1.00 53.33 H new ATOM 0 HH22 ARG A 30 -11.276 8.198 -3.961 1.00 53.33 H new ATOM 508 N ASN A 34 -14.264 9.081 -3.547 1.00 34.12 N ATOM 509 CA ASN A 34 -14.610 7.670 -3.422 1.00 64.00 C ATOM 510 C ASN A 34 -13.402 6.852 -2.974 1.00 33.23 C ATOM 511 O ASN A 34 -12.320 7.394 -2.751 1.00 52.01 O ATOM 512 CB ASN A 34 -15.136 7.133 -4.755 1.00 34.32 C ATOM 513 CG ASN A 34 -14.281 7.564 -5.931 1.00 24.31 C ATOM 514 OD1 ASN A 34 -14.036 8.753 -6.132 1.00 0.33 O ATOM 515 ND2 ASN A 34 -13.820 6.595 -6.714 1.00 34.52 N ATOM 0 HA ASN A 34 -15.390 7.578 -2.667 1.00 64.00 H new ATOM 0 HB2 ASN A 34 -15.172 6.044 -4.716 1.00 34.32 H new ATOM 0 HB3 ASN A 34 -16.158 7.481 -4.906 1.00 34.32 H new ATOM 0 HD21 ASN A 34 -13.238 6.824 -7.520 1.00 34.52 H new ATOM 0 HD22 ASN A 34 -14.048 5.622 -6.510 1.00 34.52 H new ATOM 522 N ASN A 35 -13.596 5.544 -2.844 1.00 61.34 N ATOM 523 CA ASN A 35 -12.523 4.650 -2.422 1.00 44.11 C ATOM 524 C ASN A 35 -11.674 4.219 -3.614 1.00 64.13 C ATOM 525 O ASN A 35 -12.199 3.784 -4.638 1.00 42.43 O ATOM 526 CB ASN A 35 -13.102 3.419 -1.722 1.00 63.13 C ATOM 527 CG ASN A 35 -13.571 3.722 -0.313 1.00 62.22 C ATOM 528 OD1 ASN A 35 -13.344 4.814 0.207 1.00 2.41 O ATOM 529 ND2 ASN A 35 -14.227 2.752 0.313 1.00 32.11 N ATOM 0 H ASN A 35 -14.486 5.079 -3.025 1.00 61.34 H new ATOM 0 HA ASN A 35 -11.887 5.192 -1.722 1.00 44.11 H new ATOM 0 HB2 ASN A 35 -13.938 3.033 -2.305 1.00 63.13 H new ATOM 0 HB3 ASN A 35 -12.346 2.634 -1.689 1.00 63.13 H new ATOM 0 HD21 ASN A 35 -14.565 2.897 1.264 1.00 32.11 H new ATOM 0 HD22 ASN A 35 -14.392 1.862 -0.157 1.00 32.11 H new ATOM 536 N ALA A 36 -10.357 4.342 -3.471 1.00 53.25 N ATOM 537 CA ALA A 36 -9.435 3.963 -4.535 1.00 11.33 C ATOM 538 C ALA A 36 -8.185 3.301 -3.966 1.00 42.32 C ATOM 539 O ALA A 36 -7.925 3.371 -2.766 1.00 14.53 O ATOM 540 CB ALA A 36 -9.060 5.181 -5.367 1.00 23.14 C ATOM 0 H ALA A 36 -9.906 4.701 -2.629 1.00 53.25 H new ATOM 0 HA ALA A 36 -9.936 3.240 -5.178 1.00 11.33 H new ATOM 0 HB1 ALA A 36 -8.371 4.883 -6.158 1.00 23.14 H new ATOM 0 HB2 ALA A 36 -9.959 5.609 -5.811 1.00 23.14 H new ATOM 0 HB3 ALA A 36 -8.581 5.924 -4.729 1.00 23.14 H new ATOM 546 N ALA A 37 -7.413 2.659 -4.838 1.00 14.05 N ATOM 547 CA ALA A 37 -6.189 1.986 -4.421 1.00 71.14 C ATOM 548 C ALA A 37 -5.082 2.174 -5.453 1.00 43.51 C ATOM 549 O ALA A 37 -5.351 2.364 -6.639 1.00 3.53 O ATOM 550 CB ALA A 37 -6.454 0.505 -4.193 1.00 5.31 C ATOM 0 H ALA A 37 -7.614 2.591 -5.836 1.00 14.05 H new ATOM 0 HA ALA A 37 -5.857 2.434 -3.484 1.00 71.14 H new ATOM 0 HB1 ALA A 37 -5.532 0.014 -3.882 1.00 5.31 H new ATOM 0 HB2 ALA A 37 -7.209 0.386 -3.415 1.00 5.31 H new ATOM 0 HB3 ALA A 37 -6.812 0.053 -5.118 1.00 5.31 H new ATOM 556 N ILE A 38 -3.836 2.123 -4.993 1.00 1.21 N ATOM 557 CA ILE A 38 -2.688 2.289 -5.876 1.00 32.12 C ATOM 558 C ILE A 38 -1.623 1.235 -5.594 1.00 44.31 C ATOM 559 O ILE A 38 -0.949 1.280 -4.565 1.00 0.41 O ATOM 560 CB ILE A 38 -2.063 3.688 -5.730 1.00 24.30 C ATOM 561 CG1 ILE A 38 -3.139 4.768 -5.855 1.00 73.24 C ATOM 562 CG2 ILE A 38 -0.975 3.894 -6.774 1.00 31.41 C ATOM 563 CD1 ILE A 38 -2.580 6.168 -5.976 1.00 74.23 C ATOM 0 H ILE A 38 -3.596 1.968 -4.014 1.00 1.21 H new ATOM 0 HA ILE A 38 -3.053 2.169 -6.896 1.00 32.12 H new ATOM 0 HB ILE A 38 -1.611 3.765 -4.741 1.00 24.30 H new ATOM 0 HG12 ILE A 38 -3.756 4.555 -6.728 1.00 73.24 H new ATOM 0 HG13 ILE A 38 -3.792 4.721 -4.984 1.00 73.24 H new ATOM 0 HG21 ILE A 38 -0.543 4.888 -6.658 1.00 31.41 H new ATOM 0 HG22 ILE A 38 -0.197 3.142 -6.642 1.00 31.41 H new ATOM 0 HG23 ILE A 38 -1.405 3.800 -7.771 1.00 31.41 H new ATOM 0 HD11 ILE A 38 -3.400 6.881 -6.061 1.00 74.23 H new ATOM 0 HD12 ILE A 38 -1.987 6.401 -5.092 1.00 74.23 H new ATOM 0 HD13 ILE A 38 -1.950 6.233 -6.863 1.00 74.23 H new ATOM 575 N ILE A 39 -1.474 0.291 -6.517 1.00 30.13 N ATOM 576 CA ILE A 39 -0.488 -0.772 -6.369 1.00 23.42 C ATOM 577 C ILE A 39 0.811 -0.420 -7.087 1.00 52.00 C ATOM 578 O ILE A 39 0.854 -0.356 -8.316 1.00 21.34 O ATOM 579 CB ILE A 39 -1.017 -2.111 -6.915 1.00 21.40 C ATOM 580 CG1 ILE A 39 -2.351 -2.465 -6.254 1.00 40.05 C ATOM 581 CG2 ILE A 39 0.003 -3.217 -6.685 1.00 41.02 C ATOM 582 CD1 ILE A 39 -3.446 -2.797 -7.244 1.00 63.41 C ATOM 0 H ILE A 39 -2.023 0.241 -7.375 1.00 30.13 H new ATOM 0 HA ILE A 39 -0.294 -0.876 -5.301 1.00 23.42 H new ATOM 0 HB ILE A 39 -1.179 -2.010 -7.988 1.00 21.40 H new ATOM 0 HG12 ILE A 39 -2.203 -3.316 -5.589 1.00 40.05 H new ATOM 0 HG13 ILE A 39 -2.674 -1.628 -5.634 1.00 40.05 H new ATOM 0 HG21 ILE A 39 -0.385 -4.157 -7.076 1.00 41.02 H new ATOM 0 HG22 ILE A 39 0.932 -2.967 -7.197 1.00 41.02 H new ATOM 0 HG23 ILE A 39 0.194 -3.320 -5.617 1.00 41.02 H new ATOM 0 HD11 ILE A 39 -4.363 -3.038 -6.706 1.00 63.41 H new ATOM 0 HD12 ILE A 39 -3.622 -1.939 -7.894 1.00 63.41 H new ATOM 0 HD13 ILE A 39 -3.144 -3.653 -7.847 1.00 63.41 H new ATOM 594 N MET A 40 1.867 -0.195 -6.312 1.00 43.03 N ATOM 595 CA MET A 40 3.168 0.147 -6.876 1.00 31.22 C ATOM 596 C MET A 40 4.156 -1.002 -6.699 1.00 42.03 C ATOM 597 O MET A 40 4.071 -1.765 -5.737 1.00 34.12 O ATOM 598 CB MET A 40 3.717 1.413 -6.215 1.00 15.43 C ATOM 599 CG MET A 40 2.668 2.494 -6.007 1.00 65.43 C ATOM 600 SD MET A 40 2.876 3.371 -4.447 1.00 2.32 S ATOM 601 CE MET A 40 1.461 2.770 -3.528 1.00 71.44 C ATOM 0 H MET A 40 1.848 -0.243 -5.293 1.00 43.03 H new ATOM 0 HA MET A 40 3.037 0.330 -7.943 1.00 31.22 H new ATOM 0 HB2 MET A 40 4.152 1.150 -5.251 1.00 15.43 H new ATOM 0 HB3 MET A 40 4.523 1.814 -6.830 1.00 15.43 H new ATOM 0 HG2 MET A 40 2.718 3.207 -6.830 1.00 65.43 H new ATOM 0 HG3 MET A 40 1.676 2.043 -6.036 1.00 65.43 H new ATOM 0 HE1 MET A 40 1.684 2.791 -2.461 1.00 71.44 H new ATOM 0 HE2 MET A 40 0.599 3.405 -3.731 1.00 71.44 H new ATOM 0 HE3 MET A 40 1.238 1.747 -3.832 1.00 71.44 H new ATOM 611 N LYS A 41 5.092 -1.120 -7.634 1.00 5.05 N ATOM 612 CA LYS A 41 6.098 -2.175 -7.581 1.00 44.32 C ATOM 613 C LYS A 41 7.503 -1.592 -7.695 1.00 24.24 C ATOM 614 O LYS A 41 7.674 -0.396 -7.929 1.00 74.33 O ATOM 615 CB LYS A 41 5.862 -3.188 -8.703 1.00 45.30 C ATOM 616 CG LYS A 41 6.273 -2.682 -10.076 1.00 23.42 C ATOM 617 CD LYS A 41 6.113 -3.758 -11.137 1.00 64.33 C ATOM 618 CE LYS A 41 5.725 -3.161 -12.481 1.00 42.13 C ATOM 619 NZ LYS A 41 6.769 -3.400 -13.516 1.00 71.21 N ATOM 0 H LYS A 41 5.175 -0.498 -8.438 1.00 5.05 H new ATOM 0 HA LYS A 41 6.010 -2.680 -6.619 1.00 44.32 H new ATOM 0 HB2 LYS A 41 6.416 -4.100 -8.480 1.00 45.30 H new ATOM 0 HB3 LYS A 41 4.805 -3.454 -8.724 1.00 45.30 H new ATOM 0 HG2 LYS A 41 5.668 -1.815 -10.341 1.00 23.42 H new ATOM 0 HG3 LYS A 41 7.311 -2.350 -10.047 1.00 23.42 H new ATOM 0 HD2 LYS A 41 7.046 -4.312 -11.239 1.00 64.33 H new ATOM 0 HD3 LYS A 41 5.352 -4.472 -10.821 1.00 64.33 H new ATOM 0 HE2 LYS A 41 4.780 -3.593 -12.811 1.00 42.13 H new ATOM 0 HE3 LYS A 41 5.563 -2.089 -12.369 1.00 42.13 H new ATOM 0 HZ1 LYS A 41 6.552 -2.839 -14.364 1.00 71.21 H new ATOM 0 HZ2 LYS A 41 7.698 -3.118 -13.143 1.00 71.21 H new ATOM 0 HZ3 LYS A 41 6.787 -4.410 -13.764 1.00 71.21 H new ATOM 633 N VAL A 42 8.509 -2.447 -7.527 1.00 14.32 N ATOM 634 CA VAL A 42 9.899 -2.018 -7.612 1.00 71.03 C ATOM 635 C VAL A 42 10.659 -2.824 -8.658 1.00 64.35 C ATOM 636 O VAL A 42 10.804 -4.041 -8.535 1.00 21.13 O ATOM 637 CB VAL A 42 10.613 -2.155 -6.255 1.00 24.13 C ATOM 638 CG1 VAL A 42 10.049 -3.331 -5.471 1.00 24.11 C ATOM 639 CG2 VAL A 42 12.114 -2.308 -6.455 1.00 52.14 C ATOM 0 H VAL A 42 8.386 -3.440 -7.331 1.00 14.32 H new ATOM 0 HA VAL A 42 9.889 -0.968 -7.904 1.00 71.03 H new ATOM 0 HB VAL A 42 10.437 -1.247 -5.679 1.00 24.13 H new ATOM 0 HG11 VAL A 42 10.566 -3.412 -4.515 1.00 24.11 H new ATOM 0 HG12 VAL A 42 8.985 -3.175 -5.296 1.00 24.11 H new ATOM 0 HG13 VAL A 42 10.192 -4.250 -6.040 1.00 24.11 H new ATOM 0 HG21 VAL A 42 12.602 -2.404 -5.485 1.00 52.14 H new ATOM 0 HG22 VAL A 42 12.313 -3.199 -7.051 1.00 52.14 H new ATOM 0 HG23 VAL A 42 12.503 -1.431 -6.973 1.00 52.14 H new ATOM 649 N ASP A 43 11.145 -2.140 -9.688 1.00 55.53 N ATOM 650 CA ASP A 43 11.892 -2.792 -10.757 1.00 25.43 C ATOM 651 C ASP A 43 13.319 -3.099 -10.313 1.00 31.44 C ATOM 652 O ASP A 43 14.089 -2.194 -9.989 1.00 31.32 O ATOM 653 CB ASP A 43 11.913 -1.911 -12.006 1.00 73.34 C ATOM 654 CG ASP A 43 10.674 -2.091 -12.862 1.00 24.14 C ATOM 655 OD1 ASP A 43 9.627 -2.495 -12.313 1.00 42.33 O ATOM 656 OD2 ASP A 43 10.752 -1.827 -14.080 1.00 74.33 O ATOM 0 H ASP A 43 11.035 -1.133 -9.805 1.00 55.53 H new ATOM 0 HA ASP A 43 11.393 -3.732 -10.994 1.00 25.43 H new ATOM 0 HB2 ASP A 43 11.997 -0.866 -11.709 1.00 73.34 H new ATOM 0 HB3 ASP A 43 12.798 -2.146 -12.598 1.00 73.34 H new ATOM 661 N LYS A 44 13.666 -4.382 -10.297 1.00 43.12 N ATOM 662 CA LYS A 44 15.000 -4.810 -9.893 1.00 41.42 C ATOM 663 C LYS A 44 16.049 -4.339 -10.895 1.00 21.20 C ATOM 664 O LYS A 44 17.235 -4.256 -10.574 1.00 62.42 O ATOM 665 CB LYS A 44 15.051 -6.334 -9.761 1.00 42.31 C ATOM 666 CG LYS A 44 16.318 -6.844 -9.097 1.00 33.21 C ATOM 667 CD LYS A 44 16.811 -8.127 -9.745 1.00 53.21 C ATOM 668 CE LYS A 44 17.819 -8.846 -8.864 1.00 1.14 C ATOM 669 NZ LYS A 44 19.218 -8.455 -9.189 1.00 3.52 N ATOM 0 H LYS A 44 13.041 -5.144 -10.560 1.00 43.12 H new ATOM 0 HA LYS A 44 15.221 -4.361 -8.925 1.00 41.42 H new ATOM 0 HB2 LYS A 44 14.188 -6.670 -9.185 1.00 42.31 H new ATOM 0 HB3 LYS A 44 14.965 -6.779 -10.752 1.00 42.31 H new ATOM 0 HG2 LYS A 44 17.095 -6.082 -9.160 1.00 33.21 H new ATOM 0 HG3 LYS A 44 16.129 -7.020 -8.038 1.00 33.21 H new ATOM 0 HD2 LYS A 44 15.964 -8.785 -9.942 1.00 53.21 H new ATOM 0 HD3 LYS A 44 17.267 -7.897 -10.708 1.00 53.21 H new ATOM 0 HE2 LYS A 44 17.613 -8.621 -7.818 1.00 1.14 H new ATOM 0 HE3 LYS A 44 17.705 -9.923 -8.986 1.00 1.14 H new ATOM 0 HZ1 LYS A 44 19.875 -8.967 -8.566 1.00 3.52 H new ATOM 0 HZ2 LYS A 44 19.424 -8.693 -10.180 1.00 3.52 H new ATOM 0 HZ3 LYS A 44 19.334 -7.431 -9.048 1.00 3.52 H new ATOM 683 N ASP A 45 15.606 -4.031 -12.108 1.00 54.01 N ATOM 684 CA ASP A 45 16.507 -3.566 -13.157 1.00 15.21 C ATOM 685 C ASP A 45 16.880 -2.103 -12.943 1.00 43.01 C ATOM 686 O ASP A 45 17.994 -1.684 -13.257 1.00 44.41 O ATOM 687 CB ASP A 45 15.859 -3.745 -14.531 1.00 12.21 C ATOM 688 CG ASP A 45 16.789 -4.408 -15.527 1.00 73.01 C ATOM 689 OD1 ASP A 45 17.141 -5.588 -15.316 1.00 73.33 O ATOM 690 OD2 ASP A 45 17.164 -3.749 -16.519 1.00 21.11 O ATOM 0 H ASP A 45 14.628 -4.095 -12.390 1.00 54.01 H new ATOM 0 HA ASP A 45 17.417 -4.164 -13.113 1.00 15.21 H new ATOM 0 HB2 ASP A 45 14.955 -4.345 -14.428 1.00 12.21 H new ATOM 0 HB3 ASP A 45 15.554 -2.772 -14.915 1.00 12.21 H new ATOM 695 N ARG A 46 15.941 -1.330 -12.407 1.00 43.14 N ATOM 696 CA ARG A 46 16.171 0.087 -12.154 1.00 4.32 C ATOM 697 C ARG A 46 16.240 0.367 -10.655 1.00 71.03 C ATOM 698 O ARG A 46 16.455 1.504 -10.237 1.00 14.44 O ATOM 699 CB ARG A 46 15.063 0.927 -12.789 1.00 54.41 C ATOM 700 CG ARG A 46 14.834 0.623 -14.261 1.00 4.23 C ATOM 701 CD ARG A 46 13.638 1.383 -14.809 1.00 62.11 C ATOM 702 NE ARG A 46 14.041 2.560 -15.575 1.00 72.54 N ATOM 703 CZ ARG A 46 13.185 3.464 -16.036 1.00 12.43 C ATOM 704 NH1 ARG A 46 11.885 3.330 -15.808 1.00 71.12 N ATOM 705 NH2 ARG A 46 13.628 4.508 -16.726 1.00 13.14 N ATOM 0 H ARG A 46 15.014 -1.661 -12.140 1.00 43.14 H new ATOM 0 HA ARG A 46 17.126 0.360 -12.602 1.00 4.32 H new ATOM 0 HB2 ARG A 46 14.134 0.760 -12.244 1.00 54.41 H new ATOM 0 HB3 ARG A 46 15.311 1.983 -12.679 1.00 54.41 H new ATOM 0 HG2 ARG A 46 15.725 0.886 -14.831 1.00 4.23 H new ATOM 0 HG3 ARG A 46 14.677 -0.448 -14.392 1.00 4.23 H new ATOM 0 HD2 ARG A 46 13.048 0.722 -15.444 1.00 62.11 H new ATOM 0 HD3 ARG A 46 12.995 1.690 -13.984 1.00 62.11 H new ATOM 0 HE ARG A 46 15.034 2.694 -15.766 1.00 72.54 H new ATOM 0 HH11 ARG A 46 11.540 2.530 -15.277 1.00 71.12 H new ATOM 0 HH12 ARG A 46 11.230 4.027 -16.164 1.00 71.12 H new ATOM 0 HH21 ARG A 46 14.627 4.616 -16.902 1.00 13.14 H new ATOM 0 HH22 ARG A 46 12.970 5.202 -17.080 1.00 13.14 H new ATOM 719 N GLN A 47 16.057 -0.678 -9.854 1.00 3.13 N ATOM 720 CA GLN A 47 16.098 -0.543 -8.403 1.00 41.30 C ATOM 721 C GLN A 47 15.350 0.706 -7.951 1.00 15.02 C ATOM 722 O GLN A 47 15.899 1.548 -7.240 1.00 25.55 O ATOM 723 CB GLN A 47 17.547 -0.488 -7.915 1.00 21.44 C ATOM 724 CG GLN A 47 18.397 -1.652 -8.400 1.00 50.45 C ATOM 725 CD GLN A 47 18.721 -2.638 -7.296 1.00 12.11 C ATOM 726 OE1 GLN A 47 19.515 -2.347 -6.401 1.00 0.53 O ATOM 727 NE2 GLN A 47 18.108 -3.814 -7.354 1.00 32.44 N ATOM 0 H GLN A 47 15.879 -1.626 -10.185 1.00 3.13 H new ATOM 0 HA GLN A 47 15.608 -1.415 -7.969 1.00 41.30 H new ATOM 0 HB2 GLN A 47 17.999 0.446 -8.250 1.00 21.44 H new ATOM 0 HB3 GLN A 47 17.554 -0.473 -6.825 1.00 21.44 H new ATOM 0 HG2 GLN A 47 17.872 -2.171 -9.202 1.00 50.45 H new ATOM 0 HG3 GLN A 47 19.325 -1.268 -8.823 1.00 50.45 H new ATOM 0 HE21 GLN A 47 17.457 -4.013 -8.114 1.00 32.44 H new ATOM 0 HE22 GLN A 47 18.288 -4.519 -6.639 1.00 32.44 H new ATOM 736 N MET A 48 14.093 0.821 -8.368 1.00 71.34 N ATOM 737 CA MET A 48 13.270 1.968 -8.005 1.00 33.40 C ATOM 738 C MET A 48 11.795 1.583 -7.957 1.00 33.30 C ATOM 739 O MET A 48 11.346 0.707 -8.696 1.00 61.40 O ATOM 740 CB MET A 48 13.480 3.109 -9.001 1.00 54.33 C ATOM 741 CG MET A 48 12.465 3.122 -10.133 1.00 11.23 C ATOM 742 SD MET A 48 13.161 3.724 -11.684 1.00 3.11 S ATOM 743 CE MET A 48 13.479 5.437 -11.270 1.00 60.15 C ATOM 0 H MET A 48 13.623 0.134 -8.957 1.00 71.34 H new ATOM 0 HA MET A 48 13.573 2.303 -7.013 1.00 33.40 H new ATOM 0 HB2 MET A 48 13.430 4.059 -8.469 1.00 54.33 H new ATOM 0 HB3 MET A 48 14.482 3.032 -9.423 1.00 54.33 H new ATOM 0 HG2 MET A 48 12.078 2.114 -10.280 1.00 11.23 H new ATOM 0 HG3 MET A 48 11.620 3.750 -9.851 1.00 11.23 H new ATOM 0 HE1 MET A 48 13.059 6.082 -12.042 1.00 60.15 H new ATOM 0 HE2 MET A 48 13.017 5.671 -10.311 1.00 60.15 H new ATOM 0 HE3 MET A 48 14.554 5.602 -11.205 1.00 60.15 H new ATOM 753 N VAL A 49 11.043 2.245 -7.083 1.00 35.12 N ATOM 754 CA VAL A 49 9.618 1.974 -6.939 1.00 71.40 C ATOM 755 C VAL A 49 8.810 2.695 -8.013 1.00 34.44 C ATOM 756 O VAL A 49 8.698 3.920 -8.000 1.00 14.52 O ATOM 757 CB VAL A 49 9.103 2.397 -5.551 1.00 54.20 C ATOM 758 CG1 VAL A 49 7.666 1.940 -5.352 1.00 74.35 C ATOM 759 CG2 VAL A 49 10.002 1.845 -4.457 1.00 64.11 C ATOM 0 H VAL A 49 11.398 2.974 -6.464 1.00 35.12 H new ATOM 0 HA VAL A 49 9.487 0.898 -7.053 1.00 71.40 H new ATOM 0 HB VAL A 49 9.125 3.485 -5.492 1.00 54.20 H new ATOM 0 HG11 VAL A 49 7.320 2.248 -4.366 1.00 74.35 H new ATOM 0 HG12 VAL A 49 7.032 2.390 -6.116 1.00 74.35 H new ATOM 0 HG13 VAL A 49 7.615 0.854 -5.432 1.00 74.35 H new ATOM 0 HG21 VAL A 49 9.622 2.154 -3.483 1.00 64.11 H new ATOM 0 HG22 VAL A 49 10.016 0.756 -4.512 1.00 64.11 H new ATOM 0 HG23 VAL A 49 11.014 2.228 -4.590 1.00 64.11 H new ATOM 769 N VAL A 50 8.248 1.926 -8.939 1.00 70.25 N ATOM 770 CA VAL A 50 7.448 2.492 -10.019 1.00 41.14 C ATOM 771 C VAL A 50 6.020 1.960 -9.982 1.00 72.35 C ATOM 772 O VAL A 50 5.792 0.776 -9.732 1.00 20.42 O ATOM 773 CB VAL A 50 8.065 2.181 -11.396 1.00 54.24 C ATOM 774 CG1 VAL A 50 9.460 2.778 -11.504 1.00 61.41 C ATOM 775 CG2 VAL A 50 8.097 0.680 -11.638 1.00 21.15 C ATOM 0 H VAL A 50 8.331 0.910 -8.964 1.00 70.25 H new ATOM 0 HA VAL A 50 7.434 3.572 -9.871 1.00 41.14 H new ATOM 0 HB VAL A 50 7.442 2.636 -12.166 1.00 54.24 H new ATOM 0 HG11 VAL A 50 9.879 2.548 -12.483 1.00 61.41 H new ATOM 0 HG12 VAL A 50 9.404 3.859 -11.378 1.00 61.41 H new ATOM 0 HG13 VAL A 50 10.098 2.355 -10.728 1.00 61.41 H new ATOM 0 HG21 VAL A 50 8.536 0.478 -12.615 1.00 21.15 H new ATOM 0 HG22 VAL A 50 8.696 0.199 -10.865 1.00 21.15 H new ATOM 0 HG23 VAL A 50 7.082 0.285 -11.608 1.00 21.15 H new ATOM 785 N LEU A 51 5.060 2.842 -10.235 1.00 12.12 N ATOM 786 CA LEU A 51 3.651 2.462 -10.231 1.00 63.51 C ATOM 787 C LEU A 51 3.431 1.181 -11.029 1.00 64.53 C ATOM 788 O LEU A 51 4.062 0.967 -12.063 1.00 61.03 O ATOM 789 CB LEU A 51 2.796 3.591 -10.810 1.00 22.30 C ATOM 790 CG LEU A 51 1.291 3.330 -10.870 1.00 34.25 C ATOM 791 CD1 LEU A 51 0.578 4.062 -9.743 1.00 53.02 C ATOM 792 CD2 LEU A 51 0.729 3.749 -12.220 1.00 63.24 C ATOM 0 H LEU A 51 5.231 3.825 -10.446 1.00 12.12 H new ATOM 0 HA LEU A 51 3.351 2.281 -9.199 1.00 63.51 H new ATOM 0 HB2 LEU A 51 2.965 4.489 -10.216 1.00 22.30 H new ATOM 0 HB3 LEU A 51 3.148 3.805 -11.819 1.00 22.30 H new ATOM 0 HG LEU A 51 1.122 2.260 -10.746 1.00 34.25 H new ATOM 0 HD11 LEU A 51 -0.492 3.865 -9.801 1.00 53.02 H new ATOM 0 HD12 LEU A 51 0.960 3.713 -8.784 1.00 53.02 H new ATOM 0 HD13 LEU A 51 0.755 5.133 -9.836 1.00 53.02 H new ATOM 0 HD21 LEU A 51 -0.343 3.556 -12.244 1.00 63.24 H new ATOM 0 HD22 LEU A 51 0.909 4.813 -12.375 1.00 63.24 H new ATOM 0 HD23 LEU A 51 1.218 3.179 -13.010 1.00 63.24 H new ATOM 804 N GLU A 52 2.528 0.334 -10.544 1.00 13.31 N ATOM 805 CA GLU A 52 2.224 -0.925 -11.213 1.00 53.45 C ATOM 806 C GLU A 52 0.780 -0.944 -11.707 1.00 1.30 C ATOM 807 O GLU A 52 0.504 -1.344 -12.838 1.00 44.32 O ATOM 808 CB GLU A 52 2.466 -2.103 -10.267 1.00 30.00 C ATOM 809 CG GLU A 52 2.226 -3.459 -10.909 1.00 54.44 C ATOM 810 CD GLU A 52 2.869 -4.593 -10.137 1.00 72.23 C ATOM 811 OE1 GLU A 52 2.824 -4.562 -8.889 1.00 61.05 O ATOM 812 OE2 GLU A 52 3.418 -5.512 -10.780 1.00 42.24 O ATOM 0 H GLU A 52 1.994 0.497 -9.690 1.00 13.31 H new ATOM 0 HA GLU A 52 2.886 -1.018 -12.074 1.00 53.45 H new ATOM 0 HB2 GLU A 52 3.492 -2.060 -9.902 1.00 30.00 H new ATOM 0 HB3 GLU A 52 1.814 -2.001 -9.399 1.00 30.00 H new ATOM 0 HG2 GLU A 52 1.153 -3.637 -10.982 1.00 54.44 H new ATOM 0 HG3 GLU A 52 2.618 -3.449 -11.926 1.00 54.44 H new ATOM 819 N ASP A 53 -0.137 -0.508 -10.851 1.00 54.23 N ATOM 820 CA ASP A 53 -1.553 -0.474 -11.199 1.00 61.12 C ATOM 821 C ASP A 53 -2.292 0.570 -10.368 1.00 21.22 C ATOM 822 O ASP A 53 -1.801 1.011 -9.329 1.00 21.12 O ATOM 823 CB ASP A 53 -2.185 -1.851 -10.990 1.00 13.35 C ATOM 824 CG ASP A 53 -2.005 -2.759 -12.191 1.00 45.00 C ATOM 825 OD1 ASP A 53 -2.476 -2.393 -13.287 1.00 45.55 O ATOM 826 OD2 ASP A 53 -1.393 -3.835 -12.033 1.00 23.42 O ATOM 0 H ASP A 53 0.074 -0.173 -9.911 1.00 54.23 H new ATOM 0 HA ASP A 53 -1.637 -0.201 -12.251 1.00 61.12 H new ATOM 0 HB2 ASP A 53 -1.741 -2.322 -10.113 1.00 13.35 H new ATOM 0 HB3 ASP A 53 -3.249 -1.732 -10.784 1.00 13.35 H new ATOM 831 N GLU A 54 -3.474 0.962 -10.833 1.00 64.30 N ATOM 832 CA GLU A 54 -4.278 1.955 -10.133 1.00 2.12 C ATOM 833 C GLU A 54 -5.766 1.720 -10.376 1.00 44.32 C ATOM 834 O GLU A 54 -6.260 1.899 -11.490 1.00 52.30 O ATOM 835 CB GLU A 54 -3.893 3.366 -10.584 1.00 32.44 C ATOM 836 CG GLU A 54 -3.016 4.105 -9.587 1.00 62.12 C ATOM 837 CD GLU A 54 -2.994 5.602 -9.827 1.00 72.15 C ATOM 838 OE1 GLU A 54 -4.011 6.265 -9.537 1.00 3.42 O ATOM 839 OE2 GLU A 54 -1.958 6.110 -10.307 1.00 61.33 O ATOM 0 H GLU A 54 -3.895 0.607 -11.691 1.00 64.30 H new ATOM 0 HA GLU A 54 -4.082 1.856 -9.065 1.00 2.12 H new ATOM 0 HB2 GLU A 54 -3.370 3.303 -11.538 1.00 32.44 H new ATOM 0 HB3 GLU A 54 -4.801 3.944 -10.755 1.00 32.44 H new ATOM 0 HG2 GLU A 54 -3.375 3.908 -8.577 1.00 62.12 H new ATOM 0 HG3 GLU A 54 -1.999 3.716 -9.645 1.00 62.12 H new ATOM 846 N LEU A 55 -6.475 1.316 -9.327 1.00 3.40 N ATOM 847 CA LEU A 55 -7.907 1.056 -9.426 1.00 73.33 C ATOM 848 C LEU A 55 -8.701 2.055 -8.591 1.00 52.32 C ATOM 849 O LEU A 55 -8.358 2.328 -7.441 1.00 72.23 O ATOM 850 CB LEU A 55 -8.219 -0.370 -8.969 1.00 33.44 C ATOM 851 CG LEU A 55 -7.317 -1.468 -9.533 1.00 72.21 C ATOM 852 CD1 LEU A 55 -7.117 -2.574 -8.509 1.00 34.32 C ATOM 853 CD2 LEU A 55 -7.904 -2.031 -10.820 1.00 52.42 C ATOM 0 H LEU A 55 -6.082 1.162 -8.399 1.00 3.40 H new ATOM 0 HA LEU A 55 -8.200 1.169 -10.470 1.00 73.33 H new ATOM 0 HB2 LEU A 55 -8.160 -0.402 -7.881 1.00 33.44 H new ATOM 0 HB3 LEU A 55 -9.250 -0.600 -9.240 1.00 33.44 H new ATOM 0 HG LEU A 55 -6.344 -1.031 -9.760 1.00 72.21 H new ATOM 0 HD11 LEU A 55 -6.472 -3.346 -8.929 1.00 34.32 H new ATOM 0 HD12 LEU A 55 -6.653 -2.161 -7.613 1.00 34.32 H new ATOM 0 HD13 LEU A 55 -8.082 -3.009 -8.250 1.00 34.32 H new ATOM 0 HD21 LEU A 55 -7.249 -2.811 -11.208 1.00 52.42 H new ATOM 0 HD22 LEU A 55 -8.889 -2.451 -10.617 1.00 52.42 H new ATOM 0 HD23 LEU A 55 -7.995 -1.234 -11.558 1.00 52.42 H new ATOM 865 N GLN A 56 -9.764 2.596 -9.177 1.00 72.22 N ATOM 866 CA GLN A 56 -10.608 3.563 -8.486 1.00 33.01 C ATOM 867 C GLN A 56 -11.965 2.956 -8.145 1.00 44.34 C ATOM 868 O GLN A 56 -12.323 1.891 -8.646 1.00 54.30 O ATOM 869 CB GLN A 56 -10.797 4.814 -9.347 1.00 71.50 C ATOM 870 CG GLN A 56 -9.585 5.732 -9.361 1.00 30.51 C ATOM 871 CD GLN A 56 -8.631 5.421 -10.498 1.00 40.31 C ATOM 872 OE1 GLN A 56 -8.936 5.670 -11.664 1.00 72.32 O ATOM 873 NE2 GLN A 56 -7.468 4.875 -10.163 1.00 13.43 N ATOM 0 H GLN A 56 -10.061 2.381 -10.129 1.00 72.22 H new ATOM 0 HA GLN A 56 -10.112 3.842 -7.557 1.00 33.01 H new ATOM 0 HB2 GLN A 56 -11.024 4.511 -10.369 1.00 71.50 H new ATOM 0 HB3 GLN A 56 -11.660 5.370 -8.980 1.00 71.50 H new ATOM 0 HG2 GLN A 56 -9.918 6.766 -9.444 1.00 30.51 H new ATOM 0 HG3 GLN A 56 -9.055 5.643 -8.413 1.00 30.51 H new ATOM 0 HE21 GLN A 56 -7.257 4.686 -9.183 1.00 13.43 H new ATOM 0 HE22 GLN A 56 -6.786 4.645 -10.885 1.00 13.43 H new ATOM 882 N ASN A 57 -12.716 3.642 -7.289 1.00 24.10 N ATOM 883 CA ASN A 57 -14.034 3.170 -6.879 1.00 62.54 C ATOM 884 C ASN A 57 -14.023 1.662 -6.647 1.00 25.32 C ATOM 885 O ASN A 57 -14.792 0.923 -7.263 1.00 30.21 O ATOM 886 CB ASN A 57 -15.077 3.525 -7.940 1.00 55.32 C ATOM 887 CG ASN A 57 -14.465 3.717 -9.314 1.00 5.44 C ATOM 888 OD1 ASN A 57 -14.491 2.814 -10.150 1.00 55.41 O ATOM 889 ND2 ASN A 57 -13.906 4.899 -9.553 1.00 24.43 N ATOM 0 H ASN A 57 -12.434 4.526 -6.866 1.00 24.10 H new ATOM 0 HA ASN A 57 -14.295 3.663 -5.942 1.00 62.54 H new ATOM 0 HB2 ASN A 57 -15.827 2.735 -7.987 1.00 55.32 H new ATOM 0 HB3 ASN A 57 -15.594 4.438 -7.645 1.00 55.32 H new ATOM 0 HD21 ASN A 57 -13.476 5.086 -10.459 1.00 24.43 H new ATOM 0 HD22 ASN A 57 -13.907 5.619 -8.831 1.00 24.43 H new ATOM 896 N ILE A 58 -13.150 1.213 -5.752 1.00 43.14 N ATOM 897 CA ILE A 58 -13.041 -0.205 -5.436 1.00 23.32 C ATOM 898 C ILE A 58 -13.104 -0.440 -3.930 1.00 53.03 C ATOM 899 O ILE A 58 -12.526 0.316 -3.149 1.00 23.40 O ATOM 900 CB ILE A 58 -11.731 -0.805 -5.982 1.00 54.34 C ATOM 901 CG1 ILE A 58 -11.100 -1.737 -4.946 1.00 72.43 C ATOM 902 CG2 ILE A 58 -10.761 0.303 -6.366 1.00 72.10 C ATOM 903 CD1 ILE A 58 -10.393 -1.006 -3.827 1.00 70.23 C ATOM 0 H ILE A 58 -12.508 1.811 -5.233 1.00 43.14 H new ATOM 0 HA ILE A 58 -13.886 -0.700 -5.915 1.00 23.32 H new ATOM 0 HB ILE A 58 -11.960 -1.387 -6.875 1.00 54.34 H new ATOM 0 HG12 ILE A 58 -11.876 -2.373 -4.520 1.00 72.43 H new ATOM 0 HG13 ILE A 58 -10.389 -2.394 -5.446 1.00 72.43 H new ATOM 0 HG21 ILE A 58 -9.840 -0.136 -6.750 1.00 72.10 H new ATOM 0 HG22 ILE A 58 -11.212 0.931 -7.135 1.00 72.10 H new ATOM 0 HG23 ILE A 58 -10.535 0.909 -5.489 1.00 72.10 H new ATOM 0 HD11 ILE A 58 -9.970 -1.729 -3.130 1.00 70.23 H new ATOM 0 HD12 ILE A 58 -9.594 -0.391 -4.242 1.00 70.23 H new ATOM 0 HD13 ILE A 58 -11.105 -0.369 -3.302 1.00 70.23 H new ATOM 915 N SER A 59 -13.810 -1.493 -3.531 1.00 12.21 N ATOM 916 CA SER A 59 -13.952 -1.826 -2.118 1.00 54.32 C ATOM 917 C SER A 59 -12.754 -2.633 -1.628 1.00 34.13 C ATOM 918 O SER A 59 -11.920 -3.090 -2.409 1.00 65.53 O ATOM 919 CB SER A 59 -15.243 -2.614 -1.886 1.00 24.42 C ATOM 920 OG SER A 59 -14.962 -3.945 -1.485 1.00 51.44 O ATOM 0 H SER A 59 -14.292 -2.130 -4.165 1.00 12.21 H new ATOM 0 HA SER A 59 -13.997 -0.895 -1.552 1.00 54.32 H new ATOM 0 HB2 SER A 59 -15.843 -2.119 -1.122 1.00 24.42 H new ATOM 0 HB3 SER A 59 -15.836 -2.624 -2.800 1.00 24.42 H new ATOM 0 HG SER A 59 -14.848 -4.509 -2.279 1.00 51.44 H new ATOM 926 N PRO A 60 -12.666 -2.813 -0.302 1.00 33.21 N ATOM 927 CA PRO A 60 -11.574 -3.566 0.324 1.00 50.13 C ATOM 928 C PRO A 60 -11.656 -5.060 0.028 1.00 4.00 C ATOM 929 O PRO A 60 -10.838 -5.842 0.510 1.00 4.00 O ATOM 930 CB PRO A 60 -11.776 -3.305 1.819 1.00 33.40 C ATOM 931 CG PRO A 60 -13.227 -2.999 1.958 1.00 33.24 C ATOM 932 CD PRO A 60 -13.625 -2.297 0.689 1.00 52.03 C ATOM 0 HA PRO A 60 -10.598 -3.256 -0.049 1.00 50.13 H new ATOM 0 HB2 PRO A 60 -11.496 -4.174 2.414 1.00 33.40 H new ATOM 0 HB3 PRO A 60 -11.161 -2.473 2.162 1.00 33.40 H new ATOM 0 HG2 PRO A 60 -13.807 -3.911 2.098 1.00 33.24 H new ATOM 0 HG3 PRO A 60 -13.411 -2.368 2.827 1.00 33.24 H new ATOM 0 HD2 PRO A 60 -14.654 -2.525 0.409 1.00 52.03 H new ATOM 0 HD3 PRO A 60 -13.555 -1.214 0.790 1.00 52.03 H new ATOM 940 N GLU A 61 -12.647 -5.447 -0.768 1.00 63.14 N ATOM 941 CA GLU A 61 -12.833 -6.848 -1.128 1.00 72.04 C ATOM 942 C GLU A 61 -12.307 -7.123 -2.534 1.00 23.51 C ATOM 943 O GLU A 61 -11.935 -8.251 -2.857 1.00 44.31 O ATOM 944 CB GLU A 61 -14.313 -7.226 -1.043 1.00 33.11 C ATOM 945 CG GLU A 61 -14.660 -8.056 0.181 1.00 31.44 C ATOM 946 CD GLU A 61 -16.028 -8.703 0.080 1.00 63.15 C ATOM 947 OE1 GLU A 61 -16.304 -9.351 -0.952 1.00 5.10 O ATOM 948 OE2 GLU A 61 -16.823 -8.562 1.033 1.00 61.14 O ATOM 0 H GLU A 61 -13.333 -4.811 -1.176 1.00 63.14 H new ATOM 0 HA GLU A 61 -12.268 -7.457 -0.422 1.00 72.04 H new ATOM 0 HB2 GLU A 61 -14.912 -6.315 -1.036 1.00 33.11 H new ATOM 0 HB3 GLU A 61 -14.589 -7.782 -1.939 1.00 33.11 H new ATOM 0 HG2 GLU A 61 -13.905 -8.831 0.316 1.00 31.44 H new ATOM 0 HG3 GLU A 61 -14.627 -7.421 1.067 1.00 31.44 H new ATOM 955 N GLU A 62 -12.279 -6.086 -3.363 1.00 53.12 N ATOM 956 CA GLU A 62 -11.800 -6.217 -4.734 1.00 62.12 C ATOM 957 C GLU A 62 -10.280 -6.091 -4.793 1.00 53.25 C ATOM 958 O GLU A 62 -9.611 -6.838 -5.508 1.00 20.41 O ATOM 959 CB GLU A 62 -12.446 -5.156 -5.627 1.00 53.55 C ATOM 960 CG GLU A 62 -13.797 -5.569 -6.185 1.00 73.52 C ATOM 961 CD GLU A 62 -13.679 -6.568 -7.322 1.00 1.54 C ATOM 962 OE1 GLU A 62 -13.565 -6.130 -8.486 1.00 72.13 O ATOM 963 OE2 GLU A 62 -13.699 -7.785 -7.046 1.00 0.22 O ATOM 0 H GLU A 62 -12.582 -5.146 -3.110 1.00 53.12 H new ATOM 0 HA GLU A 62 -12.080 -7.206 -5.097 1.00 62.12 H new ATOM 0 HB2 GLU A 62 -12.565 -4.236 -5.055 1.00 53.55 H new ATOM 0 HB3 GLU A 62 -11.774 -4.932 -6.455 1.00 53.55 H new ATOM 0 HG2 GLU A 62 -14.399 -6.003 -5.386 1.00 73.52 H new ATOM 0 HG3 GLU A 62 -14.326 -4.684 -6.538 1.00 73.52 H new ATOM 970 N LEU A 63 -9.742 -5.139 -4.039 1.00 33.31 N ATOM 971 CA LEU A 63 -8.301 -4.913 -4.005 1.00 35.54 C ATOM 972 C LEU A 63 -7.555 -6.207 -3.695 1.00 4.13 C ATOM 973 O LEU A 63 -6.577 -6.548 -4.361 1.00 41.12 O ATOM 974 CB LEU A 63 -7.957 -3.849 -2.961 1.00 21.12 C ATOM 975 CG LEU A 63 -6.953 -2.782 -3.398 1.00 63.01 C ATOM 976 CD1 LEU A 63 -6.249 -2.185 -2.189 1.00 64.40 C ATOM 977 CD2 LEU A 63 -5.941 -3.367 -4.372 1.00 71.20 C ATOM 0 H LEU A 63 -10.281 -4.511 -3.443 1.00 33.31 H new ATOM 0 HA LEU A 63 -7.989 -4.562 -4.989 1.00 35.54 H new ATOM 0 HB2 LEU A 63 -8.879 -3.351 -2.661 1.00 21.12 H new ATOM 0 HB3 LEU A 63 -7.563 -4.350 -2.077 1.00 21.12 H new ATOM 0 HG LEU A 63 -7.497 -1.986 -3.906 1.00 63.01 H new ATOM 0 HD11 LEU A 63 -5.538 -1.428 -2.519 1.00 64.40 H new ATOM 0 HD12 LEU A 63 -6.985 -1.728 -1.528 1.00 64.40 H new ATOM 0 HD13 LEU A 63 -5.718 -2.971 -1.652 1.00 64.40 H new ATOM 0 HD21 LEU A 63 -5.235 -2.593 -4.672 1.00 71.20 H new ATOM 0 HD22 LEU A 63 -5.402 -4.183 -3.890 1.00 71.20 H new ATOM 0 HD23 LEU A 63 -6.460 -3.745 -5.253 1.00 71.20 H new ATOM 989 N LYS A 64 -8.022 -6.926 -2.679 1.00 55.43 N ATOM 990 CA LYS A 64 -7.403 -8.183 -2.282 1.00 23.13 C ATOM 991 C LYS A 64 -7.349 -9.158 -3.453 1.00 41.15 C ATOM 992 O LYS A 64 -6.360 -9.868 -3.640 1.00 20.32 O ATOM 993 CB LYS A 64 -8.174 -8.811 -1.118 1.00 51.30 C ATOM 994 CG LYS A 64 -8.512 -10.276 -1.332 1.00 2.00 C ATOM 995 CD LYS A 64 -8.846 -10.968 -0.020 1.00 55.15 C ATOM 996 CE LYS A 64 -10.300 -11.414 0.018 1.00 52.14 C ATOM 997 NZ LYS A 64 -10.427 -12.897 -0.042 1.00 4.25 N ATOM 0 H LYS A 64 -8.829 -6.658 -2.115 1.00 55.43 H new ATOM 0 HA LYS A 64 -6.383 -7.970 -1.962 1.00 23.13 H new ATOM 0 HB2 LYS A 64 -7.584 -8.712 -0.207 1.00 51.30 H new ATOM 0 HB3 LYS A 64 -9.097 -8.253 -0.962 1.00 51.30 H new ATOM 0 HG2 LYS A 64 -9.358 -10.359 -2.014 1.00 2.00 H new ATOM 0 HG3 LYS A 64 -7.669 -10.779 -1.806 1.00 2.00 H new ATOM 0 HD2 LYS A 64 -8.195 -11.832 0.113 1.00 55.15 H new ATOM 0 HD3 LYS A 64 -8.650 -10.290 0.811 1.00 55.15 H new ATOM 0 HE2 LYS A 64 -10.769 -11.046 0.930 1.00 52.14 H new ATOM 0 HE3 LYS A 64 -10.838 -10.969 -0.819 1.00 52.14 H new ATOM 0 HZ1 LYS A 64 -11.340 -13.184 0.365 1.00 4.25 H new ATOM 0 HZ2 LYS A 64 -10.376 -13.210 -1.032 1.00 4.25 H new ATOM 0 HZ3 LYS A 64 -9.654 -13.334 0.499 1.00 4.25 H new ATOM 1011 N LEU A 65 -8.418 -9.186 -4.244 1.00 21.23 N ATOM 1012 CA LEU A 65 -8.492 -10.073 -5.399 1.00 43.41 C ATOM 1013 C LEU A 65 -7.505 -9.642 -6.480 1.00 30.10 C ATOM 1014 O LEU A 65 -6.883 -10.478 -7.133 1.00 65.55 O ATOM 1015 CB LEU A 65 -9.913 -10.086 -5.966 1.00 25.22 C ATOM 1016 CG LEU A 65 -11.027 -10.422 -4.975 1.00 34.43 C ATOM 1017 CD1 LEU A 65 -12.391 -10.214 -5.614 1.00 60.13 C ATOM 1018 CD2 LEU A 65 -10.884 -11.852 -4.475 1.00 63.30 C ATOM 0 H LEU A 65 -9.244 -8.604 -4.106 1.00 21.23 H new ATOM 0 HA LEU A 65 -8.228 -11.079 -5.072 1.00 43.41 H new ATOM 0 HB2 LEU A 65 -10.120 -9.106 -6.396 1.00 25.22 H new ATOM 0 HB3 LEU A 65 -9.950 -10.807 -6.782 1.00 25.22 H new ATOM 0 HG LEU A 65 -10.941 -9.749 -4.122 1.00 34.43 H new ATOM 0 HD11 LEU A 65 -13.171 -10.458 -4.893 1.00 60.13 H new ATOM 0 HD12 LEU A 65 -12.494 -9.173 -5.922 1.00 60.13 H new ATOM 0 HD13 LEU A 65 -12.487 -10.861 -6.486 1.00 60.13 H new ATOM 0 HD21 LEU A 65 -11.686 -12.073 -3.771 1.00 63.30 H new ATOM 0 HD22 LEU A 65 -10.942 -12.540 -5.319 1.00 63.30 H new ATOM 0 HD23 LEU A 65 -9.921 -11.969 -3.977 1.00 63.30 H new ATOM 1030 N GLU A 66 -7.366 -8.332 -6.660 1.00 23.43 N ATOM 1031 CA GLU A 66 -6.454 -7.792 -7.661 1.00 23.14 C ATOM 1032 C GLU A 66 -5.003 -8.082 -7.286 1.00 52.01 C ATOM 1033 O GLU A 66 -4.137 -8.196 -8.155 1.00 25.11 O ATOM 1034 CB GLU A 66 -6.661 -6.284 -7.810 1.00 11.52 C ATOM 1035 CG GLU A 66 -8.046 -5.906 -8.309 1.00 15.13 C ATOM 1036 CD GLU A 66 -8.422 -6.627 -9.588 1.00 22.30 C ATOM 1037 OE1 GLU A 66 -8.810 -7.812 -9.509 1.00 51.43 O ATOM 1038 OE2 GLU A 66 -8.328 -6.008 -10.669 1.00 32.05 O ATOM 0 H GLU A 66 -7.873 -7.626 -6.126 1.00 23.43 H new ATOM 0 HA GLU A 66 -6.670 -8.277 -8.613 1.00 23.14 H new ATOM 0 HB2 GLU A 66 -6.488 -5.805 -6.846 1.00 11.52 H new ATOM 0 HB3 GLU A 66 -5.915 -5.890 -8.500 1.00 11.52 H new ATOM 0 HG2 GLU A 66 -8.781 -6.135 -7.538 1.00 15.13 H new ATOM 0 HG3 GLU A 66 -8.086 -4.830 -8.478 1.00 15.13 H new ATOM 1045 N LEU A 67 -4.745 -8.198 -5.989 1.00 30.53 N ATOM 1046 CA LEU A 67 -3.399 -8.474 -5.498 1.00 25.41 C ATOM 1047 C LEU A 67 -2.956 -9.881 -5.887 1.00 62.02 C ATOM 1048 O LEU A 67 -3.771 -10.778 -6.104 1.00 43.51 O ATOM 1049 CB LEU A 67 -3.345 -8.312 -3.978 1.00 35.50 C ATOM 1050 CG LEU A 67 -3.284 -6.877 -3.458 1.00 1.21 C ATOM 1051 CD1 LEU A 67 -3.374 -6.855 -1.940 1.00 1.43 C ATOM 1052 CD2 LEU A 67 -2.009 -6.192 -3.929 1.00 55.00 C ATOM 0 H LEU A 67 -5.450 -8.105 -5.258 1.00 30.53 H new ATOM 0 HA LEU A 67 -2.718 -7.758 -5.957 1.00 25.41 H new ATOM 0 HB2 LEU A 67 -4.223 -8.795 -3.550 1.00 35.50 H new ATOM 0 HB3 LEU A 67 -2.472 -8.849 -3.606 1.00 35.50 H new ATOM 0 HG LEU A 67 -4.136 -6.329 -3.860 1.00 1.21 H new ATOM 0 HD11 LEU A 67 -3.329 -5.824 -1.588 1.00 1.43 H new ATOM 0 HD12 LEU A 67 -4.315 -7.305 -1.625 1.00 1.43 H new ATOM 0 HD13 LEU A 67 -2.542 -7.419 -1.518 1.00 1.43 H new ATOM 0 HD21 LEU A 67 -1.983 -5.171 -3.549 1.00 55.00 H new ATOM 0 HD22 LEU A 67 -1.143 -6.740 -3.557 1.00 55.00 H new ATOM 0 HD23 LEU A 67 -1.987 -6.174 -5.019 1.00 55.00 H new ATOM 1064 N PRO A 68 -1.632 -10.082 -5.976 1.00 21.03 N ATOM 1065 CA PRO A 68 -1.050 -11.379 -6.335 1.00 4.40 C ATOM 1066 C PRO A 68 -1.233 -12.421 -5.238 1.00 54.24 C ATOM 1067 O PRO A 68 -2.041 -12.240 -4.327 1.00 4.11 O ATOM 1068 CB PRO A 68 0.435 -11.060 -6.527 1.00 14.40 C ATOM 1069 CG PRO A 68 0.675 -9.852 -5.688 1.00 32.54 C ATOM 1070 CD PRO A 68 -0.602 -9.059 -5.730 1.00 52.10 C ATOM 0 HA PRO A 68 -1.526 -11.809 -7.216 1.00 4.40 H new ATOM 0 HB2 PRO A 68 1.063 -11.893 -6.210 1.00 14.40 H new ATOM 0 HB3 PRO A 68 0.666 -10.867 -7.575 1.00 14.40 H new ATOM 0 HG2 PRO A 68 0.928 -10.131 -4.665 1.00 32.54 H new ATOM 0 HG3 PRO A 68 1.510 -9.268 -6.075 1.00 32.54 H new ATOM 0 HD2 PRO A 68 -0.777 -8.530 -4.793 1.00 52.10 H new ATOM 0 HD3 PRO A 68 -0.583 -8.309 -6.521 1.00 52.10 H new ATOM 1078 N GLU A 69 -0.480 -13.512 -5.333 1.00 3.01 N ATOM 1079 CA GLU A 69 -0.561 -14.583 -4.347 1.00 73.21 C ATOM 1080 C GLU A 69 0.814 -14.887 -3.760 1.00 21.54 C ATOM 1081 O GLU A 69 0.927 -15.355 -2.626 1.00 52.13 O ATOM 1082 CB GLU A 69 -1.147 -15.847 -4.981 1.00 11.41 C ATOM 1083 CG GLU A 69 -0.474 -16.242 -6.284 1.00 30.41 C ATOM 1084 CD GLU A 69 -1.404 -16.992 -7.218 1.00 12.31 C ATOM 1085 OE1 GLU A 69 -2.240 -16.334 -7.872 1.00 72.12 O ATOM 1086 OE2 GLU A 69 -1.297 -18.233 -7.293 1.00 41.12 O ATOM 0 H GLU A 69 0.192 -13.677 -6.082 1.00 3.01 H new ATOM 0 HA GLU A 69 -1.216 -14.251 -3.541 1.00 73.21 H new ATOM 0 HB2 GLU A 69 -1.062 -16.671 -4.273 1.00 11.41 H new ATOM 0 HB3 GLU A 69 -2.210 -15.692 -5.163 1.00 11.41 H new ATOM 0 HG2 GLU A 69 -0.107 -15.346 -6.785 1.00 30.41 H new ATOM 0 HG3 GLU A 69 0.394 -16.864 -6.066 1.00 30.41 H new ATOM 1093 N ARG A 70 1.857 -14.619 -4.538 1.00 53.24 N ATOM 1094 CA ARG A 70 3.225 -14.865 -4.097 1.00 14.42 C ATOM 1095 C ARG A 70 4.168 -13.787 -4.623 1.00 33.40 C ATOM 1096 O ARG A 70 5.322 -14.065 -4.947 1.00 63.30 O ATOM 1097 CB ARG A 70 3.694 -16.243 -4.567 1.00 11.14 C ATOM 1098 CG ARG A 70 2.671 -17.345 -4.341 1.00 45.41 C ATOM 1099 CD ARG A 70 2.760 -17.907 -2.931 1.00 3.14 C ATOM 1100 NE ARG A 70 2.727 -19.367 -2.921 1.00 52.04 N ATOM 1101 CZ ARG A 70 2.363 -20.087 -1.866 1.00 35.53 C ATOM 1102 NH1 ARG A 70 2.002 -19.486 -0.741 1.00 12.54 N ATOM 1103 NH2 ARG A 70 2.358 -21.412 -1.935 1.00 21.15 N ATOM 0 H ARG A 70 1.781 -14.231 -5.478 1.00 53.24 H new ATOM 0 HA ARG A 70 3.240 -14.836 -3.008 1.00 14.42 H new ATOM 0 HB2 ARG A 70 3.933 -16.193 -5.629 1.00 11.14 H new ATOM 0 HB3 ARG A 70 4.615 -16.501 -4.045 1.00 11.14 H new ATOM 0 HG2 ARG A 70 1.669 -16.954 -4.515 1.00 45.41 H new ATOM 0 HG3 ARG A 70 2.831 -18.145 -5.064 1.00 45.41 H new ATOM 0 HD2 ARG A 70 3.681 -17.562 -2.461 1.00 3.14 H new ATOM 0 HD3 ARG A 70 1.933 -17.522 -2.334 1.00 3.14 H new ATOM 0 HE ARG A 70 2.998 -19.861 -3.771 1.00 52.04 H new ATOM 0 HH11 ARG A 70 2.003 -18.468 -0.684 1.00 12.54 H new ATOM 0 HH12 ARG A 70 1.723 -20.042 0.067 1.00 12.54 H new ATOM 0 HH21 ARG A 70 2.634 -21.879 -2.799 1.00 21.15 H new ATOM 0 HH22 ARG A 70 2.078 -21.964 -1.124 1.00 21.15 H new ATOM 1117 N GLN A 71 3.668 -12.559 -4.707 1.00 11.51 N ATOM 1118 CA GLN A 71 4.466 -11.441 -5.194 1.00 52.14 C ATOM 1119 C GLN A 71 4.298 -10.219 -4.297 1.00 42.32 C ATOM 1120 O GLN A 71 3.243 -9.585 -4.261 1.00 61.44 O ATOM 1121 CB GLN A 71 4.069 -11.092 -6.631 1.00 21.53 C ATOM 1122 CG GLN A 71 4.733 -11.974 -7.676 1.00 43.33 C ATOM 1123 CD GLN A 71 3.736 -12.589 -8.638 1.00 43.35 C ATOM 1124 OE1 GLN A 71 3.188 -13.661 -8.382 1.00 10.04 O ATOM 1125 NE2 GLN A 71 3.497 -11.912 -9.756 1.00 72.22 N ATOM 0 H GLN A 71 2.714 -12.313 -4.444 1.00 11.51 H new ATOM 0 HA GLN A 71 5.514 -11.740 -5.175 1.00 52.14 H new ATOM 0 HB2 GLN A 71 2.987 -11.176 -6.731 1.00 21.53 H new ATOM 0 HB3 GLN A 71 4.327 -10.052 -6.828 1.00 21.53 H new ATOM 0 HG2 GLN A 71 5.457 -11.384 -8.237 1.00 43.33 H new ATOM 0 HG3 GLN A 71 5.288 -12.768 -7.176 1.00 43.33 H new ATOM 0 HE21 GLN A 71 3.974 -11.027 -9.928 1.00 72.22 H new ATOM 0 HE22 GLN A 71 2.837 -12.278 -10.442 1.00 72.22 H new ATOM 1134 N PRO A 72 5.362 -9.879 -3.555 1.00 61.43 N ATOM 1135 CA PRO A 72 5.357 -8.731 -2.644 1.00 24.03 C ATOM 1136 C PRO A 72 5.329 -7.400 -3.388 1.00 34.31 C ATOM 1137 O PRO A 72 6.068 -7.202 -4.352 1.00 42.31 O ATOM 1138 CB PRO A 72 6.671 -8.885 -1.873 1.00 11.43 C ATOM 1139 CG PRO A 72 7.556 -9.662 -2.784 1.00 62.43 C ATOM 1140 CD PRO A 72 6.652 -10.590 -3.548 1.00 32.14 C ATOM 0 HA PRO A 72 4.472 -8.719 -2.008 1.00 24.03 H new ATOM 0 HB2 PRO A 72 7.105 -7.914 -1.632 1.00 11.43 H new ATOM 0 HB3 PRO A 72 6.517 -9.408 -0.929 1.00 11.43 H new ATOM 0 HG2 PRO A 72 8.097 -9.000 -3.460 1.00 62.43 H new ATOM 0 HG3 PRO A 72 8.302 -10.221 -2.220 1.00 62.43 H new ATOM 0 HD2 PRO A 72 7.019 -10.767 -4.559 1.00 32.14 H new ATOM 0 HD3 PRO A 72 6.572 -11.563 -3.063 1.00 32.14 H new ATOM 1148 N ARG A 73 4.472 -6.492 -2.934 1.00 11.32 N ATOM 1149 CA ARG A 73 4.346 -5.180 -3.558 1.00 4.01 C ATOM 1150 C ARG A 73 3.676 -4.189 -2.611 1.00 51.23 C ATOM 1151 O ARG A 73 3.181 -4.568 -1.550 1.00 0.44 O ATOM 1152 CB ARG A 73 3.545 -5.284 -4.857 1.00 10.50 C ATOM 1153 CG ARG A 73 2.201 -5.974 -4.689 1.00 51.20 C ATOM 1154 CD ARG A 73 1.541 -6.242 -6.033 1.00 63.12 C ATOM 1155 NE ARG A 73 2.365 -7.092 -6.888 1.00 21.43 N ATOM 1156 CZ ARG A 73 2.131 -7.282 -8.181 1.00 25.22 C ATOM 1157 NH1 ARG A 73 1.103 -6.683 -8.766 1.00 63.14 N ATOM 1158 NH2 ARG A 73 2.927 -8.070 -8.892 1.00 74.12 N ATOM 0 H ARG A 73 3.854 -6.640 -2.136 1.00 11.32 H new ATOM 0 HA ARG A 73 5.348 -4.816 -3.786 1.00 4.01 H new ATOM 0 HB2 ARG A 73 3.383 -4.282 -5.255 1.00 10.50 H new ATOM 0 HB3 ARG A 73 4.134 -5.829 -5.595 1.00 10.50 H new ATOM 0 HG2 ARG A 73 2.338 -6.915 -4.155 1.00 51.20 H new ATOM 0 HG3 ARG A 73 1.546 -5.353 -4.078 1.00 51.20 H new ATOM 0 HD2 ARG A 73 0.574 -6.718 -5.873 1.00 63.12 H new ATOM 0 HD3 ARG A 73 1.351 -5.295 -6.539 1.00 63.12 H new ATOM 0 HE ARG A 73 3.165 -7.566 -6.469 1.00 21.43 H new ATOM 0 HH11 ARG A 73 0.490 -6.075 -8.223 1.00 63.14 H new ATOM 0 HH12 ARG A 73 0.925 -6.830 -9.759 1.00 63.14 H new ATOM 0 HH21 ARG A 73 3.720 -8.531 -8.445 1.00 74.12 H new ATOM 0 HH22 ARG A 73 2.746 -8.215 -9.885 1.00 74.12 H new ATOM 1172 N PHE A 74 3.665 -2.919 -3.003 1.00 60.34 N ATOM 1173 CA PHE A 74 3.057 -1.873 -2.189 1.00 21.11 C ATOM 1174 C PHE A 74 1.650 -1.548 -2.683 1.00 65.34 C ATOM 1175 O PHE A 74 1.347 -1.694 -3.867 1.00 72.14 O ATOM 1176 CB PHE A 74 3.923 -0.612 -2.212 1.00 34.13 C ATOM 1177 CG PHE A 74 5.344 -0.852 -1.790 1.00 34.44 C ATOM 1178 CD1 PHE A 74 5.627 -1.610 -0.665 1.00 63.13 C ATOM 1179 CD2 PHE A 74 6.396 -0.320 -2.519 1.00 1.25 C ATOM 1180 CE1 PHE A 74 6.935 -1.832 -0.275 1.00 15.05 C ATOM 1181 CE2 PHE A 74 7.705 -0.539 -2.133 1.00 14.54 C ATOM 1182 CZ PHE A 74 7.975 -1.297 -1.009 1.00 40.43 C ATOM 0 H PHE A 74 4.070 -2.590 -3.879 1.00 60.34 H new ATOM 0 HA PHE A 74 2.987 -2.238 -1.164 1.00 21.11 H new ATOM 0 HB2 PHE A 74 3.917 -0.195 -3.219 1.00 34.13 H new ATOM 0 HB3 PHE A 74 3.479 0.136 -1.555 1.00 34.13 H new ATOM 0 HD1 PHE A 74 4.818 -2.032 -0.087 1.00 63.13 H new ATOM 0 HD2 PHE A 74 6.191 0.272 -3.398 1.00 1.25 H new ATOM 0 HE1 PHE A 74 7.143 -2.424 0.604 1.00 15.05 H new ATOM 0 HE2 PHE A 74 8.516 -0.118 -2.709 1.00 14.54 H new ATOM 0 HZ PHE A 74 8.997 -1.470 -0.706 1.00 40.43 H new ATOM 1192 N VAL A 75 0.795 -1.107 -1.766 1.00 63.25 N ATOM 1193 CA VAL A 75 -0.580 -0.760 -2.108 1.00 24.33 C ATOM 1194 C VAL A 75 -1.127 0.307 -1.167 1.00 44.52 C ATOM 1195 O VAL A 75 -1.107 0.144 0.053 1.00 44.21 O ATOM 1196 CB VAL A 75 -1.499 -1.995 -2.055 1.00 54.11 C ATOM 1197 CG1 VAL A 75 -2.959 -1.571 -2.017 1.00 34.32 C ATOM 1198 CG2 VAL A 75 -1.232 -2.909 -3.242 1.00 4.40 C ATOM 0 H VAL A 75 1.030 -0.981 -0.781 1.00 63.25 H new ATOM 0 HA VAL A 75 -0.565 -0.370 -3.126 1.00 24.33 H new ATOM 0 HB VAL A 75 -1.282 -2.550 -1.142 1.00 54.11 H new ATOM 0 HG11 VAL A 75 -3.594 -2.456 -1.980 1.00 34.32 H new ATOM 0 HG12 VAL A 75 -3.137 -0.959 -1.133 1.00 34.32 H new ATOM 0 HG13 VAL A 75 -3.194 -0.994 -2.911 1.00 34.32 H new ATOM 0 HG21 VAL A 75 -1.890 -3.776 -3.189 1.00 4.40 H new ATOM 0 HG22 VAL A 75 -1.421 -2.367 -4.168 1.00 4.40 H new ATOM 0 HG23 VAL A 75 -0.194 -3.239 -3.220 1.00 4.40 H new ATOM 1208 N VAL A 76 -1.615 1.401 -1.743 1.00 12.40 N ATOM 1209 CA VAL A 76 -2.169 2.497 -0.956 1.00 21.41 C ATOM 1210 C VAL A 76 -3.682 2.583 -1.126 1.00 4.14 C ATOM 1211 O VAL A 76 -4.176 3.181 -2.081 1.00 55.12 O ATOM 1212 CB VAL A 76 -1.541 3.846 -1.351 1.00 53.41 C ATOM 1213 CG1 VAL A 76 -2.191 4.985 -0.580 1.00 72.33 C ATOM 1214 CG2 VAL A 76 -0.038 3.822 -1.117 1.00 54.11 C ATOM 0 H VAL A 76 -1.638 1.552 -2.751 1.00 12.40 H new ATOM 0 HA VAL A 76 -1.934 2.289 0.088 1.00 21.41 H new ATOM 0 HB VAL A 76 -1.718 4.012 -2.414 1.00 53.41 H new ATOM 0 HG11 VAL A 76 -1.734 5.930 -0.873 1.00 72.33 H new ATOM 0 HG12 VAL A 76 -3.258 5.013 -0.803 1.00 72.33 H new ATOM 0 HG13 VAL A 76 -2.048 4.829 0.489 1.00 72.33 H new ATOM 0 HG21 VAL A 76 0.390 4.783 -1.401 1.00 54.11 H new ATOM 0 HG22 VAL A 76 0.163 3.633 -0.063 1.00 54.11 H new ATOM 0 HG23 VAL A 76 0.411 3.032 -1.719 1.00 54.11 H new ATOM 1224 N TYR A 77 -4.412 1.985 -0.191 1.00 23.11 N ATOM 1225 CA TYR A 77 -5.869 1.992 -0.237 1.00 53.34 C ATOM 1226 C TYR A 77 -6.431 3.196 0.513 1.00 30.42 C ATOM 1227 O TYR A 77 -6.002 3.505 1.624 1.00 3.24 O ATOM 1228 CB TYR A 77 -6.427 0.699 0.360 1.00 52.32 C ATOM 1229 CG TYR A 77 -7.915 0.530 0.155 1.00 53.50 C ATOM 1230 CD1 TYR A 77 -8.507 0.827 -1.067 1.00 32.01 C ATOM 1231 CD2 TYR A 77 -8.732 0.075 1.184 1.00 4.04 C ATOM 1232 CE1 TYR A 77 -9.866 0.675 -1.258 1.00 74.25 C ATOM 1233 CE2 TYR A 77 -10.091 -0.082 1.001 1.00 35.01 C ATOM 1234 CZ TYR A 77 -10.654 0.220 -0.222 1.00 31.13 C ATOM 1235 OH TYR A 77 -12.010 0.066 -0.408 1.00 4.24 O ATOM 0 H TYR A 77 -4.018 1.489 0.608 1.00 23.11 H new ATOM 0 HA TYR A 77 -6.174 2.062 -1.281 1.00 53.34 H new ATOM 0 HB2 TYR A 77 -5.909 -0.150 -0.085 1.00 52.32 H new ATOM 0 HB3 TYR A 77 -6.211 0.679 1.428 1.00 52.32 H new ATOM 0 HD1 TYR A 77 -7.893 1.183 -1.881 1.00 32.01 H new ATOM 0 HD2 TYR A 77 -8.295 -0.160 2.144 1.00 4.04 H new ATOM 0 HE1 TYR A 77 -10.310 0.911 -2.214 1.00 74.25 H new ATOM 0 HE2 TYR A 77 -10.710 -0.439 1.811 1.00 35.01 H new ATOM 0 HH TYR A 77 -12.232 0.229 -1.348 1.00 4.24 H new ATOM 1245 N SER A 78 -7.396 3.871 -0.103 1.00 4.43 N ATOM 1246 CA SER A 78 -8.016 5.043 0.504 1.00 13.22 C ATOM 1247 C SER A 78 -9.478 4.767 0.847 1.00 4.45 C ATOM 1248 O SER A 78 -10.359 4.881 -0.004 1.00 60.52 O ATOM 1249 CB SER A 78 -7.920 6.244 -0.439 1.00 62.14 C ATOM 1250 OG SER A 78 -8.365 7.429 0.196 1.00 31.11 O ATOM 0 H SER A 78 -7.765 3.627 -1.022 1.00 4.43 H new ATOM 0 HA SER A 78 -7.480 5.271 1.426 1.00 13.22 H new ATOM 0 HB2 SER A 78 -6.889 6.370 -0.768 1.00 62.14 H new ATOM 0 HB3 SER A 78 -8.519 6.059 -1.331 1.00 62.14 H new ATOM 0 HG SER A 78 -8.292 8.182 -0.428 1.00 31.11 H new ATOM 1256 N TYR A 79 -9.725 4.406 2.101 1.00 2.02 N ATOM 1257 CA TYR A 79 -11.078 4.112 2.558 1.00 4.20 C ATOM 1258 C TYR A 79 -11.816 5.393 2.937 1.00 73.02 C ATOM 1259 O TYR A 79 -11.214 6.461 3.048 1.00 63.14 O ATOM 1260 CB TYR A 79 -11.038 3.160 3.755 1.00 15.53 C ATOM 1261 CG TYR A 79 -12.402 2.867 4.341 1.00 63.33 C ATOM 1262 CD1 TYR A 79 -13.203 1.859 3.817 1.00 24.25 C ATOM 1263 CD2 TYR A 79 -12.889 3.597 5.418 1.00 42.42 C ATOM 1264 CE1 TYR A 79 -14.449 1.588 4.348 1.00 11.13 C ATOM 1265 CE2 TYR A 79 -14.133 3.332 5.956 1.00 4.23 C ATOM 1266 CZ TYR A 79 -14.910 2.327 5.418 1.00 31.33 C ATOM 1267 OH TYR A 79 -16.150 2.059 5.951 1.00 23.10 O ATOM 0 H TYR A 79 -9.007 4.310 2.819 1.00 2.02 H new ATOM 0 HA TYR A 79 -11.615 3.634 1.739 1.00 4.20 H new ATOM 0 HB2 TYR A 79 -10.575 2.222 3.448 1.00 15.53 H new ATOM 0 HB3 TYR A 79 -10.404 3.590 4.530 1.00 15.53 H new ATOM 0 HD1 TYR A 79 -12.845 1.278 2.980 1.00 24.25 H new ATOM 0 HD2 TYR A 79 -12.284 4.385 5.842 1.00 42.42 H new ATOM 0 HE1 TYR A 79 -15.059 0.802 3.928 1.00 11.13 H new ATOM 0 HE2 TYR A 79 -14.496 3.909 6.794 1.00 4.23 H new ATOM 0 HH TYR A 79 -16.661 1.503 5.327 1.00 23.10 H new ATOM 1277 N LYS A 80 -13.125 5.278 3.134 1.00 74.45 N ATOM 1278 CA LYS A 80 -13.948 6.424 3.501 1.00 34.42 C ATOM 1279 C LYS A 80 -14.662 6.178 4.827 1.00 61.22 C ATOM 1280 O LYS A 80 -15.622 5.409 4.892 1.00 4.04 O ATOM 1281 CB LYS A 80 -14.973 6.714 2.403 1.00 74.42 C ATOM 1282 CG LYS A 80 -15.829 7.938 2.678 1.00 35.44 C ATOM 1283 CD LYS A 80 -16.993 8.035 1.707 1.00 54.13 C ATOM 1284 CE LYS A 80 -18.292 7.564 2.342 1.00 31.42 C ATOM 1285 NZ LYS A 80 -18.504 6.102 2.153 1.00 0.13 N ATOM 0 H LYS A 80 -13.639 4.401 3.045 1.00 74.45 H new ATOM 0 HA LYS A 80 -13.294 7.288 3.616 1.00 34.42 H new ATOM 0 HB2 LYS A 80 -14.450 6.852 1.457 1.00 74.42 H new ATOM 0 HB3 LYS A 80 -15.622 5.846 2.285 1.00 74.42 H new ATOM 0 HG2 LYS A 80 -16.208 7.896 3.699 1.00 35.44 H new ATOM 0 HG3 LYS A 80 -15.216 8.836 2.603 1.00 35.44 H new ATOM 0 HD2 LYS A 80 -17.104 9.067 1.373 1.00 54.13 H new ATOM 0 HD3 LYS A 80 -16.781 7.434 0.823 1.00 54.13 H new ATOM 0 HE2 LYS A 80 -18.280 7.794 3.407 1.00 31.42 H new ATOM 0 HE3 LYS A 80 -19.128 8.111 1.907 1.00 31.42 H new ATOM 0 HZ1 LYS A 80 -19.408 5.824 2.585 1.00 0.13 H new ATOM 0 HZ2 LYS A 80 -18.524 5.883 1.137 1.00 0.13 H new ATOM 0 HZ3 LYS A 80 -17.728 5.577 2.605 1.00 0.13 H new ATOM 1299 N TYR A 81 -14.188 6.836 5.879 1.00 75.14 N ATOM 1300 CA TYR A 81 -14.782 6.688 7.203 1.00 2.30 C ATOM 1301 C TYR A 81 -15.675 7.879 7.536 1.00 64.44 C ATOM 1302 O TYR A 81 -15.306 9.030 7.307 1.00 2.31 O ATOM 1303 CB TYR A 81 -13.687 6.546 8.261 1.00 70.40 C ATOM 1304 CG TYR A 81 -14.003 5.520 9.326 1.00 71.11 C ATOM 1305 CD1 TYR A 81 -15.099 5.676 10.165 1.00 13.24 C ATOM 1306 CD2 TYR A 81 -13.206 4.394 9.493 1.00 52.13 C ATOM 1307 CE1 TYR A 81 -15.392 4.741 11.140 1.00 42.54 C ATOM 1308 CE2 TYR A 81 -13.492 3.454 10.463 1.00 61.32 C ATOM 1309 CZ TYR A 81 -14.585 3.631 11.284 1.00 14.51 C ATOM 1310 OH TYR A 81 -14.874 2.698 12.253 1.00 74.20 O ATOM 0 H TYR A 81 -13.395 7.476 5.841 1.00 75.14 H new ATOM 0 HA TYR A 81 -15.396 5.787 7.200 1.00 2.30 H new ATOM 0 HB2 TYR A 81 -12.753 6.272 7.770 1.00 70.40 H new ATOM 0 HB3 TYR A 81 -13.526 7.513 8.737 1.00 70.40 H new ATOM 0 HD1 TYR A 81 -15.733 6.543 10.054 1.00 13.24 H new ATOM 0 HD2 TYR A 81 -12.348 4.252 8.853 1.00 52.13 H new ATOM 0 HE1 TYR A 81 -16.247 4.878 11.785 1.00 42.54 H new ATOM 0 HE2 TYR A 81 -12.862 2.584 10.578 1.00 61.32 H new ATOM 0 HH TYR A 81 -14.876 1.803 11.855 1.00 74.20 H new ATOM 1320 N VAL A 82 -16.855 7.592 8.078 1.00 64.34 N ATOM 1321 CA VAL A 82 -17.802 8.638 8.445 1.00 31.00 C ATOM 1322 C VAL A 82 -17.711 8.965 9.931 1.00 13.31 C ATOM 1323 O VAL A 82 -17.207 8.169 10.723 1.00 62.40 O ATOM 1324 CB VAL A 82 -19.248 8.229 8.108 1.00 71.41 C ATOM 1325 CG1 VAL A 82 -20.184 9.421 8.234 1.00 61.42 C ATOM 1326 CG2 VAL A 82 -19.320 7.630 6.712 1.00 71.44 C ATOM 0 H VAL A 82 -17.177 6.644 8.272 1.00 64.34 H new ATOM 0 HA VAL A 82 -17.538 9.522 7.865 1.00 31.00 H new ATOM 0 HB VAL A 82 -19.568 7.470 8.822 1.00 71.41 H new ATOM 0 HG11 VAL A 82 -21.201 9.112 7.992 1.00 61.42 H new ATOM 0 HG12 VAL A 82 -20.153 9.801 9.255 1.00 61.42 H new ATOM 0 HG13 VAL A 82 -19.869 10.205 7.545 1.00 61.42 H new ATOM 0 HG21 VAL A 82 -20.349 7.347 6.490 1.00 71.44 H new ATOM 0 HG22 VAL A 82 -18.981 8.366 5.983 1.00 71.44 H new ATOM 0 HG23 VAL A 82 -18.682 6.748 6.661 1.00 71.44 H new ATOM 1336 N HIS A 83 -18.203 10.143 10.303 1.00 24.44 N ATOM 1337 CA HIS A 83 -18.178 10.575 11.696 1.00 40.11 C ATOM 1338 C HIS A 83 -19.520 10.310 12.371 1.00 52.12 C ATOM 1339 O HIS A 83 -19.774 9.209 12.859 1.00 32.24 O ATOM 1340 CB HIS A 83 -17.835 12.063 11.784 1.00 60.24 C ATOM 1341 CG HIS A 83 -16.397 12.364 11.492 1.00 22.33 C ATOM 1342 ND1 HIS A 83 -15.522 12.849 12.441 1.00 63.20 N ATOM 1343 CD2 HIS A 83 -15.681 12.244 10.349 1.00 2.20 C ATOM 1344 CE1 HIS A 83 -14.331 13.016 11.894 1.00 14.55 C ATOM 1345 NE2 HIS A 83 -14.401 12.656 10.625 1.00 2.30 N ATOM 0 H HIS A 83 -18.623 10.814 9.660 1.00 24.44 H new ATOM 0 HA HIS A 83 -17.410 10.001 12.215 1.00 40.11 H new ATOM 0 HB2 HIS A 83 -18.463 12.614 11.084 1.00 60.24 H new ATOM 0 HB3 HIS A 83 -18.078 12.425 12.783 1.00 60.24 H new ATOM 0 HD2 HIS A 83 -16.049 11.890 9.397 1.00 2.20 H new ATOM 0 HE1 HIS A 83 -13.450 13.384 12.399 1.00 14.55 H new ATOM 0 HE2 HIS A 83 -13.629 12.680 9.958 1.00 2.30 H new ATOM 1354 N ASP A 84 -20.375 11.327 12.396 1.00 72.44 N ATOM 1355 CA ASP A 84 -21.692 11.204 13.010 1.00 25.11 C ATOM 1356 C ASP A 84 -22.482 12.501 12.868 1.00 10.33 C ATOM 1357 O ASP A 84 -23.669 12.485 12.542 1.00 64.43 O ATOM 1358 CB ASP A 84 -21.556 10.833 14.488 1.00 41.30 C ATOM 1359 CG ASP A 84 -22.730 10.018 14.991 1.00 25.04 C ATOM 1360 OD1 ASP A 84 -22.688 8.776 14.864 1.00 11.00 O ATOM 1361 OD2 ASP A 84 -23.691 10.621 15.514 1.00 42.34 O ATOM 0 H ASP A 84 -20.179 12.246 11.998 1.00 72.44 H new ATOM 0 HA ASP A 84 -22.234 10.412 12.493 1.00 25.11 H new ATOM 0 HB2 ASP A 84 -20.636 10.267 14.634 1.00 41.30 H new ATOM 0 HB3 ASP A 84 -21.469 11.743 15.081 1.00 41.30 H new ATOM 1366 N ASP A 85 -21.815 13.623 13.117 1.00 61.04 N ATOM 1367 CA ASP A 85 -22.454 14.930 13.017 1.00 73.34 C ATOM 1368 C ASP A 85 -22.777 15.268 11.565 1.00 45.32 C ATOM 1369 O ASP A 85 -23.486 16.233 11.284 1.00 45.34 O ATOM 1370 CB ASP A 85 -21.553 16.010 13.617 1.00 44.23 C ATOM 1371 CG ASP A 85 -22.067 16.521 14.947 1.00 55.42 C ATOM 1372 OD1 ASP A 85 -23.171 17.107 14.971 1.00 14.30 O ATOM 1373 OD2 ASP A 85 -21.368 16.337 15.964 1.00 31.45 O ATOM 0 H ASP A 85 -20.833 13.653 13.389 1.00 61.04 H new ATOM 0 HA ASP A 85 -23.387 14.894 13.579 1.00 73.34 H new ATOM 0 HB2 ASP A 85 -20.548 15.608 13.749 1.00 44.23 H new ATOM 0 HB3 ASP A 85 -21.474 16.842 12.918 1.00 44.23 H new ATOM 1378 N GLY A 86 -22.250 14.466 10.644 1.00 22.24 N ATOM 1379 CA GLY A 86 -22.491 14.697 9.233 1.00 72.11 C ATOM 1380 C GLY A 86 -21.210 14.902 8.451 1.00 45.42 C ATOM 1381 O GLY A 86 -21.232 15.414 7.331 1.00 12.20 O ATOM 0 H GLY A 86 -21.660 13.660 10.851 1.00 22.24 H new ATOM 0 HA2 GLY A 86 -23.035 13.849 8.817 1.00 72.11 H new ATOM 0 HA3 GLY A 86 -23.129 15.573 9.115 1.00 72.11 H new ATOM 1385 N ARG A 87 -20.087 14.506 9.042 1.00 53.21 N ATOM 1386 CA ARG A 87 -18.789 14.652 8.395 1.00 1.31 C ATOM 1387 C ARG A 87 -18.188 13.289 8.067 1.00 61.24 C ATOM 1388 O ARG A 87 -18.327 12.336 8.834 1.00 52.22 O ATOM 1389 CB ARG A 87 -17.833 15.439 9.294 1.00 40.31 C ATOM 1390 CG ARG A 87 -18.211 16.904 9.449 1.00 23.43 C ATOM 1391 CD ARG A 87 -17.675 17.743 8.301 1.00 70.13 C ATOM 1392 NE ARG A 87 -18.072 19.143 8.413 1.00 14.43 N ATOM 1393 CZ ARG A 87 -17.808 20.059 7.488 1.00 72.12 C ATOM 1394 NH1 ARG A 87 -17.150 19.723 6.387 1.00 41.33 N ATOM 1395 NH2 ARG A 87 -18.203 21.314 7.663 1.00 52.33 N ATOM 0 H ARG A 87 -20.050 14.081 9.969 1.00 53.21 H new ATOM 0 HA ARG A 87 -18.935 15.199 7.464 1.00 1.31 H new ATOM 0 HB2 ARG A 87 -17.807 14.973 10.279 1.00 40.31 H new ATOM 0 HB3 ARG A 87 -16.825 15.374 8.884 1.00 40.31 H new ATOM 0 HG2 ARG A 87 -19.296 16.998 9.494 1.00 23.43 H new ATOM 0 HG3 ARG A 87 -17.819 17.284 10.392 1.00 23.43 H new ATOM 0 HD2 ARG A 87 -16.587 17.676 8.280 1.00 70.13 H new ATOM 0 HD3 ARG A 87 -18.038 17.338 7.356 1.00 70.13 H new ATOM 0 HE ARG A 87 -18.580 19.434 9.248 1.00 14.43 H new ATOM 0 HH11 ARG A 87 -16.845 18.759 6.249 1.00 41.33 H new ATOM 0 HH12 ARG A 87 -16.948 20.428 5.678 1.00 41.33 H new ATOM 0 HH21 ARG A 87 -18.710 21.576 8.509 1.00 52.33 H new ATOM 0 HH22 ARG A 87 -18.000 22.017 6.952 1.00 52.33 H new ATOM 1409 N VAL A 88 -17.520 13.203 6.920 1.00 34.20 N ATOM 1410 CA VAL A 88 -16.898 11.957 6.489 1.00 33.42 C ATOM 1411 C VAL A 88 -15.557 12.217 5.813 1.00 0.33 C ATOM 1412 O VAL A 88 -15.466 13.013 4.878 1.00 3.20 O ATOM 1413 CB VAL A 88 -17.808 11.181 5.518 1.00 53.42 C ATOM 1414 CG1 VAL A 88 -18.178 12.049 4.325 1.00 42.23 C ATOM 1415 CG2 VAL A 88 -17.130 9.898 5.065 1.00 72.25 C ATOM 0 H VAL A 88 -17.396 13.982 6.273 1.00 34.20 H new ATOM 0 HA VAL A 88 -16.740 11.357 7.385 1.00 33.42 H new ATOM 0 HB VAL A 88 -18.726 10.914 6.041 1.00 53.42 H new ATOM 0 HG11 VAL A 88 -18.821 11.484 3.650 1.00 42.23 H new ATOM 0 HG12 VAL A 88 -18.706 12.937 4.671 1.00 42.23 H new ATOM 0 HG13 VAL A 88 -17.272 12.348 3.798 1.00 42.23 H new ATOM 0 HG21 VAL A 88 -17.786 9.362 4.380 1.00 72.25 H new ATOM 0 HG22 VAL A 88 -16.196 10.140 4.558 1.00 72.25 H new ATOM 0 HG23 VAL A 88 -16.921 9.271 5.932 1.00 72.25 H new ATOM 1425 N SER A 89 -14.517 11.541 6.293 1.00 15.10 N ATOM 1426 CA SER A 89 -13.179 11.702 5.737 1.00 74.22 C ATOM 1427 C SER A 89 -12.654 10.376 5.194 1.00 1.21 C ATOM 1428 O SER A 89 -13.160 9.308 5.536 1.00 14.32 O ATOM 1429 CB SER A 89 -12.223 12.246 6.802 1.00 75.44 C ATOM 1430 OG SER A 89 -12.707 13.459 7.349 1.00 52.43 O ATOM 0 H SER A 89 -14.576 10.877 7.065 1.00 15.10 H new ATOM 0 HA SER A 89 -13.237 12.414 4.914 1.00 74.22 H new ATOM 0 HB2 SER A 89 -12.100 11.509 7.596 1.00 75.44 H new ATOM 0 HB3 SER A 89 -11.239 12.409 6.363 1.00 75.44 H new ATOM 0 HG SER A 89 -12.080 13.785 8.028 1.00 52.43 H new ATOM 1436 N TYR A 90 -11.634 10.454 4.347 1.00 42.35 N ATOM 1437 CA TYR A 90 -11.040 9.262 3.753 1.00 10.53 C ATOM 1438 C TYR A 90 -9.643 9.013 4.314 1.00 40.30 C ATOM 1439 O TYR A 90 -8.649 9.568 3.844 1.00 33.42 O ATOM 1440 CB TYR A 90 -10.974 9.403 2.232 1.00 42.23 C ATOM 1441 CG TYR A 90 -12.096 10.231 1.650 1.00 12.44 C ATOM 1442 CD1 TYR A 90 -13.337 9.666 1.381 1.00 3.35 C ATOM 1443 CD2 TYR A 90 -11.917 11.581 1.372 1.00 12.41 C ATOM 1444 CE1 TYR A 90 -14.365 10.420 0.850 1.00 41.55 C ATOM 1445 CE2 TYR A 90 -12.940 12.344 0.841 1.00 72.41 C ATOM 1446 CZ TYR A 90 -14.162 11.758 0.582 1.00 74.13 C ATOM 1447 OH TYR A 90 -15.185 12.513 0.053 1.00 23.32 O ATOM 0 H TYR A 90 -11.201 11.330 4.056 1.00 42.35 H new ATOM 0 HA TYR A 90 -11.670 8.409 4.004 1.00 10.53 H new ATOM 0 HB2 TYR A 90 -10.021 9.856 1.959 1.00 42.23 H new ATOM 0 HB3 TYR A 90 -10.996 8.410 1.783 1.00 42.23 H new ATOM 0 HD1 TYR A 90 -13.500 8.619 1.591 1.00 3.35 H new ATOM 0 HD2 TYR A 90 -10.962 12.042 1.574 1.00 12.41 H new ATOM 0 HE1 TYR A 90 -15.323 9.965 0.646 1.00 41.55 H new ATOM 0 HE2 TYR A 90 -12.784 13.392 0.630 1.00 72.41 H new ATOM 0 HH TYR A 90 -14.879 13.435 -0.075 1.00 23.32 H new ATOM 1457 N PRO A 91 -9.564 8.158 5.344 1.00 74.42 N ATOM 1458 CA PRO A 91 -8.295 7.813 5.992 1.00 2.20 C ATOM 1459 C PRO A 91 -7.397 6.969 5.094 1.00 62.02 C ATOM 1460 O PRO A 91 -7.545 5.748 5.022 1.00 4.45 O ATOM 1461 CB PRO A 91 -8.730 7.011 7.221 1.00 45.00 C ATOM 1462 CG PRO A 91 -10.057 6.443 6.852 1.00 30.03 C ATOM 1463 CD PRO A 91 -10.708 7.461 5.956 1.00 71.31 C ATOM 0 HA PRO A 91 -7.706 8.698 6.232 1.00 2.20 H new ATOM 0 HB2 PRO A 91 -8.013 6.224 7.454 1.00 45.00 H new ATOM 0 HB3 PRO A 91 -8.803 7.647 8.103 1.00 45.00 H new ATOM 0 HG2 PRO A 91 -9.944 5.488 6.340 1.00 30.03 H new ATOM 0 HG3 PRO A 91 -10.663 6.259 7.739 1.00 30.03 H new ATOM 0 HD2 PRO A 91 -11.340 6.989 5.204 1.00 71.31 H new ATOM 0 HD3 PRO A 91 -11.341 8.146 6.520 1.00 71.31 H new ATOM 1471 N LEU A 92 -6.465 7.625 4.411 1.00 11.12 N ATOM 1472 CA LEU A 92 -5.542 6.934 3.518 1.00 32.54 C ATOM 1473 C LEU A 92 -4.511 6.138 4.311 1.00 12.11 C ATOM 1474 O LEU A 92 -3.809 6.686 5.162 1.00 14.13 O ATOM 1475 CB LEU A 92 -4.836 7.939 2.606 1.00 74.23 C ATOM 1476 CG LEU A 92 -5.331 7.995 1.160 1.00 62.01 C ATOM 1477 CD1 LEU A 92 -5.994 9.333 0.874 1.00 43.23 C ATOM 1478 CD2 LEU A 92 -4.181 7.750 0.193 1.00 0.03 C ATOM 0 H LEU A 92 -6.329 8.635 4.459 1.00 11.12 H new ATOM 0 HA LEU A 92 -6.118 6.239 2.906 1.00 32.54 H new ATOM 0 HB2 LEU A 92 -4.940 8.932 3.043 1.00 74.23 H new ATOM 0 HB3 LEU A 92 -3.771 7.705 2.596 1.00 74.23 H new ATOM 0 HG LEU A 92 -6.072 7.208 1.019 1.00 62.01 H new ATOM 0 HD11 LEU A 92 -6.340 9.354 -0.159 1.00 43.23 H new ATOM 0 HD12 LEU A 92 -6.843 9.469 1.544 1.00 43.23 H new ATOM 0 HD13 LEU A 92 -5.275 10.137 1.033 1.00 43.23 H new ATOM 0 HD21 LEU A 92 -4.551 7.793 -0.831 1.00 0.03 H new ATOM 0 HD22 LEU A 92 -3.417 8.514 0.335 1.00 0.03 H new ATOM 0 HD23 LEU A 92 -3.750 6.767 0.382 1.00 0.03 H new ATOM 1490 N CYS A 93 -4.423 4.844 4.025 1.00 61.40 N ATOM 1491 CA CYS A 93 -3.476 3.971 4.711 1.00 42.04 C ATOM 1492 C CYS A 93 -2.550 3.284 3.713 1.00 64.42 C ATOM 1493 O CYS A 93 -2.810 3.280 2.509 1.00 21.42 O ATOM 1494 CB CYS A 93 -4.222 2.923 5.538 1.00 54.54 C ATOM 1495 SG CYS A 93 -5.170 3.610 6.917 1.00 64.21 S ATOM 0 H CYS A 93 -4.996 4.376 3.323 1.00 61.40 H new ATOM 0 HA CYS A 93 -2.871 4.585 5.378 1.00 42.04 H new ATOM 0 HB2 CYS A 93 -4.899 2.374 4.884 1.00 54.54 H new ATOM 0 HB3 CYS A 93 -3.502 2.204 5.928 1.00 54.54 H new ATOM 0 HG CYS A 93 -6.058 4.443 6.461 1.00 64.21 H new ATOM 1501 N PHE A 94 -1.467 2.706 4.221 1.00 65.43 N ATOM 1502 CA PHE A 94 -0.500 2.017 3.374 1.00 70.11 C ATOM 1503 C PHE A 94 -0.565 0.507 3.590 1.00 12.42 C ATOM 1504 O PHE A 94 -0.087 -0.006 4.602 1.00 21.11 O ATOM 1505 CB PHE A 94 0.915 2.524 3.663 1.00 72.03 C ATOM 1506 CG PHE A 94 1.953 1.963 2.735 1.00 24.31 C ATOM 1507 CD1 PHE A 94 2.046 2.408 1.426 1.00 33.30 C ATOM 1508 CD2 PHE A 94 2.839 0.990 3.172 1.00 13.33 C ATOM 1509 CE1 PHE A 94 3.000 1.894 0.569 1.00 23.34 C ATOM 1510 CE2 PHE A 94 3.795 0.473 2.320 1.00 25.24 C ATOM 1511 CZ PHE A 94 3.877 0.924 1.018 1.00 54.25 C ATOM 0 H PHE A 94 -1.237 2.701 5.215 1.00 65.43 H new ATOM 0 HA PHE A 94 -0.750 2.229 2.334 1.00 70.11 H new ATOM 0 HB2 PHE A 94 0.924 3.612 3.591 1.00 72.03 H new ATOM 0 HB3 PHE A 94 1.181 2.270 4.689 1.00 72.03 H new ATOM 0 HD1 PHE A 94 1.364 3.166 1.071 1.00 33.30 H new ATOM 0 HD2 PHE A 94 2.781 0.633 4.190 1.00 13.33 H new ATOM 0 HE1 PHE A 94 3.061 2.249 -0.449 1.00 23.34 H new ATOM 0 HE2 PHE A 94 4.479 -0.285 2.673 1.00 25.24 H new ATOM 0 HZ PHE A 94 4.625 0.520 0.351 1.00 54.25 H new ATOM 1521 N ILE A 95 -1.161 -0.196 2.633 1.00 21.11 N ATOM 1522 CA ILE A 95 -1.288 -1.646 2.718 1.00 54.51 C ATOM 1523 C ILE A 95 -0.135 -2.341 2.004 1.00 1.14 C ATOM 1524 O ILE A 95 0.035 -2.201 0.793 1.00 43.22 O ATOM 1525 CB ILE A 95 -2.620 -2.129 2.113 1.00 62.34 C ATOM 1526 CG1 ILE A 95 -3.801 -1.554 2.895 1.00 12.55 C ATOM 1527 CG2 ILE A 95 -2.675 -3.650 2.103 1.00 22.33 C ATOM 1528 CD1 ILE A 95 -5.142 -1.818 2.247 1.00 31.14 C ATOM 0 H ILE A 95 -1.563 0.214 1.790 1.00 21.11 H new ATOM 0 HA ILE A 95 -1.264 -1.905 3.777 1.00 54.51 H new ATOM 0 HB ILE A 95 -2.684 -1.774 1.084 1.00 62.34 H new ATOM 0 HG12 ILE A 95 -3.802 -1.978 3.899 1.00 12.55 H new ATOM 0 HG13 ILE A 95 -3.665 -0.478 3.004 1.00 12.55 H new ATOM 0 HG21 ILE A 95 -3.622 -3.977 1.673 1.00 22.33 H new ATOM 0 HG22 ILE A 95 -1.851 -4.040 1.505 1.00 22.33 H new ATOM 0 HG23 ILE A 95 -2.592 -4.024 3.124 1.00 22.33 H new ATOM 0 HD11 ILE A 95 -5.933 -1.382 2.857 1.00 31.14 H new ATOM 0 HD12 ILE A 95 -5.161 -1.370 1.254 1.00 31.14 H new ATOM 0 HD13 ILE A 95 -5.300 -2.893 2.163 1.00 31.14 H new ATOM 1540 N PHE A 96 0.655 -3.094 2.764 1.00 74.14 N ATOM 1541 CA PHE A 96 1.793 -3.814 2.203 1.00 4.13 C ATOM 1542 C PHE A 96 1.434 -5.271 1.931 1.00 24.53 C ATOM 1543 O PHE A 96 1.290 -6.070 2.857 1.00 11.30 O ATOM 1544 CB PHE A 96 2.989 -3.740 3.156 1.00 54.42 C ATOM 1545 CG PHE A 96 4.237 -4.363 2.600 1.00 53.13 C ATOM 1546 CD1 PHE A 96 4.285 -4.793 1.283 1.00 25.23 C ATOM 1547 CD2 PHE A 96 5.362 -4.520 3.394 1.00 60.03 C ATOM 1548 CE1 PHE A 96 5.433 -5.367 0.769 1.00 53.12 C ATOM 1549 CE2 PHE A 96 6.512 -5.093 2.885 1.00 51.13 C ATOM 1550 CZ PHE A 96 6.547 -5.517 1.571 1.00 64.50 C ATOM 0 H PHE A 96 0.528 -3.221 3.768 1.00 74.14 H new ATOM 0 HA PHE A 96 2.060 -3.342 1.257 1.00 4.13 H new ATOM 0 HB2 PHE A 96 3.189 -2.695 3.395 1.00 54.42 H new ATOM 0 HB3 PHE A 96 2.730 -4.237 4.091 1.00 54.42 H new ATOM 0 HD1 PHE A 96 3.416 -4.678 0.652 1.00 25.23 H new ATOM 0 HD2 PHE A 96 5.340 -4.191 4.422 1.00 60.03 H new ATOM 0 HE1 PHE A 96 5.458 -5.698 -0.259 1.00 53.12 H new ATOM 0 HE2 PHE A 96 7.382 -5.209 3.514 1.00 51.13 H new ATOM 0 HZ PHE A 96 7.445 -5.965 1.171 1.00 64.50 H new ATOM 1560 N SER A 97 1.292 -5.612 0.654 1.00 53.21 N ATOM 1561 CA SER A 97 0.946 -6.972 0.259 1.00 15.32 C ATOM 1562 C SER A 97 2.173 -7.877 0.296 1.00 44.01 C ATOM 1563 O SER A 97 2.910 -7.983 -0.685 1.00 31.44 O ATOM 1564 CB SER A 97 0.335 -6.978 -1.143 1.00 24.31 C ATOM 1565 OG SER A 97 -0.184 -8.257 -1.468 1.00 1.24 O ATOM 0 H SER A 97 1.411 -4.964 -0.125 1.00 53.21 H new ATOM 0 HA SER A 97 0.213 -7.355 0.969 1.00 15.32 H new ATOM 0 HB2 SER A 97 -0.460 -6.234 -1.200 1.00 24.31 H new ATOM 0 HB3 SER A 97 1.091 -6.693 -1.874 1.00 24.31 H new ATOM 0 HG SER A 97 -0.126 -8.397 -2.436 1.00 1.24 H new ATOM 1571 N SER A 98 2.387 -8.528 1.435 1.00 14.14 N ATOM 1572 CA SER A 98 3.527 -9.422 1.602 1.00 34.45 C ATOM 1573 C SER A 98 3.077 -10.786 2.116 1.00 31.02 C ATOM 1574 O SER A 98 2.901 -10.999 3.317 1.00 42.24 O ATOM 1575 CB SER A 98 4.544 -8.811 2.569 1.00 51.10 C ATOM 1576 OG SER A 98 4.093 -8.902 3.909 1.00 23.32 O ATOM 0 H SER A 98 1.786 -8.453 2.256 1.00 14.14 H new ATOM 0 HA SER A 98 3.997 -9.557 0.628 1.00 34.45 H new ATOM 0 HB2 SER A 98 5.500 -9.325 2.468 1.00 51.10 H new ATOM 0 HB3 SER A 98 4.715 -7.766 2.310 1.00 51.10 H new ATOM 0 HG SER A 98 3.944 -9.842 4.141 1.00 23.32 H new ATOM 1582 N PRO A 99 2.885 -11.734 1.187 1.00 55.13 N ATOM 1583 CA PRO A 99 2.453 -13.095 1.521 1.00 2.20 C ATOM 1584 C PRO A 99 3.538 -13.885 2.245 1.00 0.13 C ATOM 1585 O PRO A 99 4.553 -13.328 2.662 1.00 42.13 O ATOM 1586 CB PRO A 99 2.159 -13.718 0.155 1.00 34.42 C ATOM 1587 CG PRO A 99 3.004 -12.952 -0.802 1.00 51.03 C ATOM 1588 CD PRO A 99 3.075 -11.551 -0.261 1.00 43.34 C ATOM 0 HA PRO A 99 1.599 -13.098 2.199 1.00 2.20 H new ATOM 0 HB2 PRO A 99 2.409 -14.779 0.142 1.00 34.42 H new ATOM 0 HB3 PRO A 99 1.102 -13.636 -0.098 1.00 34.42 H new ATOM 0 HG2 PRO A 99 3.999 -13.390 -0.882 1.00 51.03 H new ATOM 0 HG3 PRO A 99 2.570 -12.963 -1.802 1.00 51.03 H new ATOM 0 HD2 PRO A 99 4.033 -11.082 -0.484 1.00 43.34 H new ATOM 0 HD3 PRO A 99 2.301 -10.915 -0.691 1.00 43.34 H new ATOM 1596 N VAL A 100 3.316 -15.188 2.391 1.00 43.40 N ATOM 1597 CA VAL A 100 4.276 -16.056 3.064 1.00 53.35 C ATOM 1598 C VAL A 100 4.997 -16.954 2.065 1.00 21.11 C ATOM 1599 O VAL A 100 6.101 -17.429 2.327 1.00 70.11 O ATOM 1600 CB VAL A 100 3.588 -16.935 4.125 1.00 0.12 C ATOM 1601 CG1 VAL A 100 2.730 -18.001 3.462 1.00 71.12 C ATOM 1602 CG2 VAL A 100 4.623 -17.567 5.043 1.00 23.14 C ATOM 0 H VAL A 100 2.481 -15.665 2.053 1.00 43.40 H new ATOM 0 HA VAL A 100 5.002 -15.408 3.555 1.00 53.35 H new ATOM 0 HB VAL A 100 2.936 -16.303 4.729 1.00 0.12 H new ATOM 0 HG11 VAL A 100 2.252 -18.612 4.228 1.00 71.12 H new ATOM 0 HG12 VAL A 100 1.965 -17.523 2.849 1.00 71.12 H new ATOM 0 HG13 VAL A 100 3.357 -18.633 2.833 1.00 71.12 H new ATOM 0 HG21 VAL A 100 4.120 -18.185 5.787 1.00 23.14 H new ATOM 0 HG22 VAL A 100 5.301 -18.186 4.455 1.00 23.14 H new ATOM 0 HG23 VAL A 100 5.190 -16.784 5.545 1.00 23.14 H new ATOM 1612 N GLY A 101 4.365 -17.182 0.917 1.00 34.22 N ATOM 1613 CA GLY A 101 4.962 -18.023 -0.103 1.00 60.55 C ATOM 1614 C GLY A 101 5.962 -17.273 -0.960 1.00 61.13 C ATOM 1615 O GLY A 101 6.652 -17.869 -1.787 1.00 65.34 O ATOM 0 H GLY A 101 3.451 -16.799 0.676 1.00 34.22 H new ATOM 0 HA2 GLY A 101 5.458 -18.869 0.373 1.00 60.55 H new ATOM 0 HA3 GLY A 101 4.176 -18.431 -0.739 1.00 60.55 H new ATOM 1619 N CYS A 102 6.039 -15.961 -0.765 1.00 21.51 N ATOM 1620 CA CYS A 102 6.961 -15.127 -1.529 1.00 14.20 C ATOM 1621 C CYS A 102 8.405 -15.556 -1.294 1.00 33.53 C ATOM 1622 O CYS A 102 8.680 -16.424 -0.464 1.00 15.24 O ATOM 1623 CB CYS A 102 6.785 -13.657 -1.149 1.00 12.33 C ATOM 1624 SG CYS A 102 6.492 -13.379 0.614 1.00 73.11 S ATOM 0 H CYS A 102 5.475 -15.452 -0.085 1.00 21.51 H new ATOM 0 HA CYS A 102 6.732 -15.251 -2.587 1.00 14.20 H new ATOM 0 HB2 CYS A 102 7.676 -13.106 -1.449 1.00 12.33 H new ATOM 0 HB3 CYS A 102 5.950 -13.244 -1.715 1.00 12.33 H new ATOM 0 HG CYS A 102 6.358 -12.105 0.836 1.00 73.11 H new ATOM 1630 N LYS A 103 9.326 -14.945 -2.030 1.00 62.04 N ATOM 1631 CA LYS A 103 10.743 -15.263 -1.903 1.00 5.41 C ATOM 1632 C LYS A 103 11.471 -14.193 -1.095 1.00 10.31 C ATOM 1633 O LYS A 103 11.101 -13.018 -1.100 1.00 63.53 O ATOM 1634 CB LYS A 103 11.384 -15.395 -3.287 1.00 72.21 C ATOM 1635 CG LYS A 103 10.479 -16.051 -4.315 1.00 51.44 C ATOM 1636 CD LYS A 103 10.250 -15.146 -5.514 1.00 15.15 C ATOM 1637 CE LYS A 103 11.550 -14.845 -6.242 1.00 61.04 C ATOM 1638 NZ LYS A 103 11.678 -15.635 -7.498 1.00 3.11 N ATOM 0 H LYS A 103 9.116 -14.226 -2.722 1.00 62.04 H new ATOM 0 HA LYS A 103 10.830 -16.213 -1.377 1.00 5.41 H new ATOM 0 HB2 LYS A 103 11.667 -14.404 -3.643 1.00 72.21 H new ATOM 0 HB3 LYS A 103 12.302 -15.976 -3.199 1.00 72.21 H new ATOM 0 HG2 LYS A 103 10.923 -16.990 -4.646 1.00 51.44 H new ATOM 0 HG3 LYS A 103 9.522 -16.296 -3.855 1.00 51.44 H new ATOM 0 HD2 LYS A 103 9.549 -15.621 -6.201 1.00 15.15 H new ATOM 0 HD3 LYS A 103 9.792 -14.213 -5.185 1.00 15.15 H new ATOM 0 HE2 LYS A 103 11.598 -13.781 -6.476 1.00 61.04 H new ATOM 0 HE3 LYS A 103 12.393 -15.066 -5.587 1.00 61.04 H new ATOM 0 HZ1 LYS A 103 12.577 -15.401 -7.965 1.00 3.11 H new ATOM 0 HZ2 LYS A 103 11.658 -16.650 -7.273 1.00 3.11 H new ATOM 0 HZ3 LYS A 103 10.888 -15.406 -8.134 1.00 3.11 H new ATOM 1652 N PRO A 104 12.531 -14.605 -0.384 1.00 41.24 N ATOM 1653 CA PRO A 104 13.334 -13.697 0.440 1.00 12.32 C ATOM 1654 C PRO A 104 14.152 -12.721 -0.400 1.00 33.25 C ATOM 1655 O PRO A 104 14.622 -11.700 0.100 1.00 22.55 O ATOM 1656 CB PRO A 104 14.256 -14.641 1.214 1.00 60.23 C ATOM 1657 CG PRO A 104 14.359 -15.856 0.358 1.00 75.24 C ATOM 1658 CD PRO A 104 13.029 -15.989 -0.332 1.00 72.30 C ATOM 0 HA PRO A 104 12.712 -13.069 1.078 1.00 12.32 H new ATOM 0 HB2 PRO A 104 15.234 -14.190 1.381 1.00 60.23 H new ATOM 0 HB3 PRO A 104 13.844 -14.881 2.194 1.00 60.23 H new ATOM 0 HG2 PRO A 104 15.167 -15.756 -0.367 1.00 75.24 H new ATOM 0 HG3 PRO A 104 14.578 -16.739 0.958 1.00 75.24 H new ATOM 0 HD2 PRO A 104 13.135 -16.416 -1.329 1.00 72.30 H new ATOM 0 HD3 PRO A 104 12.352 -16.639 0.222 1.00 72.30 H new ATOM 1666 N GLU A 105 14.317 -13.043 -1.679 1.00 74.11 N ATOM 1667 CA GLU A 105 15.079 -12.194 -2.587 1.00 71.53 C ATOM 1668 C GLU A 105 14.281 -10.951 -2.969 1.00 22.23 C ATOM 1669 O GLU A 105 14.843 -9.868 -3.136 1.00 34.53 O ATOM 1670 CB GLU A 105 15.463 -12.974 -3.847 1.00 71.23 C ATOM 1671 CG GLU A 105 16.941 -13.319 -3.924 1.00 15.14 C ATOM 1672 CD GLU A 105 17.371 -13.738 -5.316 1.00 11.44 C ATOM 1673 OE1 GLU A 105 17.010 -13.037 -6.285 1.00 73.12 O ATOM 1674 OE2 GLU A 105 18.069 -14.765 -5.436 1.00 64.23 O ATOM 0 H GLU A 105 13.934 -13.885 -2.109 1.00 74.11 H new ATOM 0 HA GLU A 105 15.986 -11.878 -2.072 1.00 71.53 H new ATOM 0 HB2 GLU A 105 14.881 -13.895 -3.885 1.00 71.23 H new ATOM 0 HB3 GLU A 105 15.189 -12.388 -4.724 1.00 71.23 H new ATOM 0 HG2 GLU A 105 17.528 -12.456 -3.611 1.00 15.14 H new ATOM 0 HG3 GLU A 105 17.159 -14.124 -3.223 1.00 15.14 H new ATOM 1681 N GLN A 106 12.969 -11.115 -3.104 1.00 10.32 N ATOM 1682 CA GLN A 106 12.095 -10.006 -3.467 1.00 34.35 C ATOM 1683 C GLN A 106 11.590 -9.282 -2.223 1.00 34.22 C ATOM 1684 O GLN A 106 11.807 -8.082 -2.061 1.00 4.54 O ATOM 1685 CB GLN A 106 10.911 -10.511 -4.293 1.00 31.33 C ATOM 1686 CG GLN A 106 11.271 -11.643 -5.242 1.00 31.31 C ATOM 1687 CD GLN A 106 12.021 -11.161 -6.467 1.00 54.52 C ATOM 1688 OE1 GLN A 106 13.069 -11.702 -6.821 1.00 5.44 O ATOM 1689 NE2 GLN A 106 11.487 -10.137 -7.124 1.00 70.51 N ATOM 0 H GLN A 106 12.488 -12.004 -2.968 1.00 10.32 H new ATOM 0 HA GLN A 106 12.673 -9.302 -4.066 1.00 34.35 H new ATOM 0 HB2 GLN A 106 10.126 -10.850 -3.618 1.00 31.33 H new ATOM 0 HB3 GLN A 106 10.500 -9.682 -4.869 1.00 31.33 H new ATOM 0 HG2 GLN A 106 11.880 -12.376 -4.713 1.00 31.31 H new ATOM 0 HG3 GLN A 106 10.360 -12.153 -5.556 1.00 31.31 H new ATOM 0 HE21 GLN A 106 10.617 -9.718 -6.796 1.00 70.51 H new ATOM 0 HE22 GLN A 106 11.947 -9.769 -7.957 1.00 70.51 H new ATOM 1698 N GLN A 107 10.915 -10.021 -1.347 1.00 53.24 N ATOM 1699 CA GLN A 107 10.377 -9.447 -0.119 1.00 25.21 C ATOM 1700 C GLN A 107 11.307 -8.370 0.430 1.00 14.40 C ATOM 1701 O GLN A 107 10.855 -7.317 0.880 1.00 75.42 O ATOM 1702 CB GLN A 107 10.169 -10.540 0.930 1.00 72.33 C ATOM 1703 CG GLN A 107 8.744 -10.616 1.456 1.00 4.41 C ATOM 1704 CD GLN A 107 8.608 -10.041 2.853 1.00 30.20 C ATOM 1705 OE1 GLN A 107 8.905 -10.710 3.843 1.00 2.33 O ATOM 1706 NE2 GLN A 107 8.156 -8.796 2.939 1.00 41.42 N ATOM 0 H GLN A 107 10.728 -11.017 -1.465 1.00 53.24 H new ATOM 0 HA GLN A 107 9.416 -8.988 -0.352 1.00 25.21 H new ATOM 0 HB2 GLN A 107 10.440 -11.503 0.497 1.00 72.33 H new ATOM 0 HB3 GLN A 107 10.847 -10.364 1.765 1.00 72.33 H new ATOM 0 HG2 GLN A 107 8.081 -10.077 0.779 1.00 4.41 H new ATOM 0 HG3 GLN A 107 8.417 -11.656 1.461 1.00 4.41 H new ATOM 0 HE21 GLN A 107 7.922 -8.279 2.092 1.00 41.42 H new ATOM 0 HE22 GLN A 107 8.043 -8.357 3.852 1.00 41.42 H new ATOM 1715 N MET A 108 12.607 -8.640 0.391 1.00 24.31 N ATOM 1716 CA MET A 108 13.599 -7.693 0.885 1.00 23.31 C ATOM 1717 C MET A 108 13.582 -6.409 0.061 1.00 21.51 C ATOM 1718 O MET A 108 13.596 -5.309 0.610 1.00 1.33 O ATOM 1719 CB MET A 108 14.995 -8.318 0.847 1.00 4.01 C ATOM 1720 CG MET A 108 15.268 -9.266 2.004 1.00 33.40 C ATOM 1721 SD MET A 108 17.027 -9.453 2.351 1.00 45.33 S ATOM 1722 CE MET A 108 17.656 -9.832 0.717 1.00 72.33 C ATOM 0 H MET A 108 12.998 -9.507 0.022 1.00 24.31 H new ATOM 0 HA MET A 108 13.347 -7.446 1.916 1.00 23.31 H new ATOM 0 HB2 MET A 108 15.117 -8.859 -0.092 1.00 4.01 H new ATOM 0 HB3 MET A 108 15.741 -7.523 0.856 1.00 4.01 H new ATOM 0 HG2 MET A 108 14.763 -8.898 2.897 1.00 33.40 H new ATOM 0 HG3 MET A 108 14.841 -10.243 1.776 1.00 33.40 H new ATOM 0 HE1 MET A 108 18.666 -10.233 0.800 1.00 72.33 H new ATOM 0 HE2 MET A 108 17.011 -10.570 0.241 1.00 72.33 H new ATOM 0 HE3 MET A 108 17.674 -8.924 0.115 1.00 72.33 H new ATOM 1732 N MET A 109 13.553 -6.559 -1.259 1.00 70.03 N ATOM 1733 CA MET A 109 13.533 -5.411 -2.158 1.00 64.41 C ATOM 1734 C MET A 109 12.473 -4.402 -1.728 1.00 32.13 C ATOM 1735 O MET A 109 12.658 -3.194 -1.870 1.00 4.22 O ATOM 1736 CB MET A 109 13.269 -5.865 -3.594 1.00 62.22 C ATOM 1737 CG MET A 109 14.495 -6.438 -4.286 1.00 63.13 C ATOM 1738 SD MET A 109 14.093 -7.277 -5.831 1.00 43.30 S ATOM 1739 CE MET A 109 13.348 -5.938 -6.759 1.00 1.43 C ATOM 0 H MET A 109 13.543 -7.464 -1.730 1.00 70.03 H new ATOM 0 HA MET A 109 14.509 -4.928 -2.111 1.00 64.41 H new ATOM 0 HB2 MET A 109 12.480 -6.617 -3.589 1.00 62.22 H new ATOM 0 HB3 MET A 109 12.899 -5.018 -4.172 1.00 62.22 H new ATOM 0 HG2 MET A 109 15.203 -5.634 -4.487 1.00 63.13 H new ATOM 0 HG3 MET A 109 14.992 -7.139 -3.615 1.00 63.13 H new ATOM 0 HE1 MET A 109 12.903 -6.332 -7.673 1.00 1.43 H new ATOM 0 HE2 MET A 109 12.575 -5.463 -6.155 1.00 1.43 H new ATOM 0 HE3 MET A 109 14.112 -5.204 -7.015 1.00 1.43 H new ATOM 1749 N TYR A 110 11.362 -4.906 -1.202 1.00 51.04 N ATOM 1750 CA TYR A 110 10.271 -4.050 -0.754 1.00 52.52 C ATOM 1751 C TYR A 110 10.411 -3.719 0.728 1.00 11.22 C ATOM 1752 O TYR A 110 10.092 -2.613 1.162 1.00 15.21 O ATOM 1753 CB TYR A 110 8.924 -4.726 -1.013 1.00 31.12 C ATOM 1754 CG TYR A 110 8.781 -5.276 -2.414 1.00 22.30 C ATOM 1755 CD1 TYR A 110 9.323 -6.509 -2.755 1.00 43.32 C ATOM 1756 CD2 TYR A 110 8.104 -4.564 -3.396 1.00 13.01 C ATOM 1757 CE1 TYR A 110 9.196 -7.015 -4.035 1.00 61.30 C ATOM 1758 CE2 TYR A 110 7.970 -5.063 -4.677 1.00 24.33 C ATOM 1759 CZ TYR A 110 8.519 -6.289 -4.991 1.00 73.35 C ATOM 1760 OH TYR A 110 8.389 -6.790 -6.266 1.00 34.31 O ATOM 0 H TYR A 110 11.194 -5.904 -1.076 1.00 51.04 H new ATOM 0 HA TYR A 110 10.317 -3.120 -1.321 1.00 52.52 H new ATOM 0 HB2 TYR A 110 8.791 -5.538 -0.298 1.00 31.12 H new ATOM 0 HB3 TYR A 110 8.125 -4.007 -0.831 1.00 31.12 H new ATOM 0 HD1 TYR A 110 9.852 -7.082 -2.008 1.00 43.32 H new ATOM 0 HD2 TYR A 110 7.675 -3.603 -3.154 1.00 13.01 H new ATOM 0 HE1 TYR A 110 9.625 -7.974 -4.285 1.00 61.30 H new ATOM 0 HE2 TYR A 110 7.439 -4.497 -5.428 1.00 24.33 H new ATOM 0 HH TYR A 110 7.884 -6.156 -6.817 1.00 34.31 H new ATOM 1770 N ALA A 111 10.891 -4.688 1.501 1.00 64.34 N ATOM 1771 CA ALA A 111 11.077 -4.502 2.934 1.00 51.52 C ATOM 1772 C ALA A 111 12.052 -3.363 3.218 1.00 22.41 C ATOM 1773 O ALA A 111 11.942 -2.678 4.234 1.00 64.31 O ATOM 1774 CB ALA A 111 11.567 -5.792 3.576 1.00 41.54 C ATOM 0 H ALA A 111 11.158 -5.611 1.158 1.00 64.34 H new ATOM 0 HA ALA A 111 10.113 -4.237 3.369 1.00 51.52 H new ATOM 0 HB1 ALA A 111 11.701 -5.637 4.647 1.00 41.54 H new ATOM 0 HB2 ALA A 111 10.833 -6.581 3.413 1.00 41.54 H new ATOM 0 HB3 ALA A 111 12.518 -6.082 3.129 1.00 41.54 H new ATOM 1780 N GLY A 112 13.007 -3.169 2.313 1.00 15.24 N ATOM 1781 CA GLY A 112 13.987 -2.113 2.485 1.00 22.12 C ATOM 1782 C GLY A 112 13.563 -0.814 1.828 1.00 25.35 C ATOM 1783 O GLY A 112 13.933 0.268 2.282 1.00 1.11 O ATOM 0 H GLY A 112 13.119 -3.724 1.465 1.00 15.24 H new ATOM 0 HA2 GLY A 112 14.149 -1.942 3.549 1.00 22.12 H new ATOM 0 HA3 GLY A 112 14.940 -2.434 2.065 1.00 22.12 H new ATOM 1787 N SER A 113 12.786 -0.922 0.756 1.00 31.11 N ATOM 1788 CA SER A 113 12.315 0.252 0.031 1.00 3.34 C ATOM 1789 C SER A 113 10.953 0.702 0.552 1.00 71.15 C ATOM 1790 O SER A 113 10.466 1.778 0.204 1.00 41.52 O ATOM 1791 CB SER A 113 12.228 -0.046 -1.466 1.00 22.42 C ATOM 1792 OG SER A 113 13.365 -0.769 -1.909 1.00 13.01 O ATOM 0 H SER A 113 12.469 -1.811 0.370 1.00 31.11 H new ATOM 0 HA SER A 113 13.031 1.058 0.192 1.00 3.34 H new ATOM 0 HB2 SER A 113 11.325 -0.619 -1.674 1.00 22.42 H new ATOM 0 HB3 SER A 113 12.148 0.888 -2.022 1.00 22.42 H new ATOM 0 HG SER A 113 13.290 -1.704 -1.624 1.00 13.01 H new ATOM 1798 N LYS A 114 10.341 -0.131 1.387 1.00 25.04 N ATOM 1799 CA LYS A 114 9.035 0.179 1.957 1.00 25.44 C ATOM 1800 C LYS A 114 9.019 1.585 2.547 1.00 24.23 C ATOM 1801 O LYS A 114 8.247 2.439 2.118 1.00 55.02 O ATOM 1802 CB LYS A 114 8.673 -0.843 3.038 1.00 24.53 C ATOM 1803 CG LYS A 114 7.423 -0.482 3.822 1.00 22.12 C ATOM 1804 CD LYS A 114 6.968 -1.631 4.705 1.00 35.40 C ATOM 1805 CE LYS A 114 7.517 -1.500 6.118 1.00 71.12 C ATOM 1806 NZ LYS A 114 6.865 -2.455 7.056 1.00 2.23 N ATOM 0 H LYS A 114 10.729 -1.026 1.684 1.00 25.04 H new ATOM 0 HA LYS A 114 8.296 0.131 1.157 1.00 25.44 H new ATOM 0 HB2 LYS A 114 8.530 -1.818 2.571 1.00 24.53 H new ATOM 0 HB3 LYS A 114 9.510 -0.940 3.729 1.00 24.53 H new ATOM 0 HG2 LYS A 114 7.619 0.396 4.438 1.00 22.12 H new ATOM 0 HG3 LYS A 114 6.624 -0.214 3.131 1.00 22.12 H new ATOM 0 HD2 LYS A 114 5.879 -1.657 4.738 1.00 35.40 H new ATOM 0 HD3 LYS A 114 7.296 -2.576 4.272 1.00 35.40 H new ATOM 0 HE2 LYS A 114 8.592 -1.678 6.108 1.00 71.12 H new ATOM 0 HE3 LYS A 114 7.366 -0.481 6.474 1.00 71.12 H new ATOM 0 HZ1 LYS A 114 7.266 -2.335 8.008 1.00 2.23 H new ATOM 0 HZ2 LYS A 114 5.842 -2.269 7.085 1.00 2.23 H new ATOM 0 HZ3 LYS A 114 7.031 -3.429 6.731 1.00 2.23 H new ATOM 1820 N ASN A 115 9.880 1.819 3.533 1.00 31.14 N ATOM 1821 CA ASN A 115 9.965 3.123 4.181 1.00 50.30 C ATOM 1822 C ASN A 115 10.234 4.222 3.157 1.00 11.12 C ATOM 1823 O ASN A 115 9.686 5.320 3.253 1.00 53.04 O ATOM 1824 CB ASN A 115 11.068 3.118 5.243 1.00 54.34 C ATOM 1825 CG ASN A 115 10.535 2.804 6.627 1.00 61.22 C ATOM 1826 OD1 ASN A 115 10.486 3.673 7.498 1.00 63.01 O ATOM 1827 ND2 ASN A 115 10.131 1.555 6.837 1.00 3.52 N ATOM 0 H ASN A 115 10.528 1.123 3.900 1.00 31.14 H new ATOM 0 HA ASN A 115 9.008 3.325 4.662 1.00 50.30 H new ATOM 0 HB2 ASN A 115 11.826 2.383 4.973 1.00 54.34 H new ATOM 0 HB3 ASN A 115 11.559 4.091 5.258 1.00 54.34 H new ATOM 0 HD21 ASN A 115 9.762 1.285 7.749 1.00 3.52 H new ATOM 0 HD22 ASN A 115 10.190 0.867 6.086 1.00 3.52 H new ATOM 1834 N ARG A 116 11.081 3.919 2.179 1.00 30.43 N ATOM 1835 CA ARG A 116 11.424 4.880 1.139 1.00 51.34 C ATOM 1836 C ARG A 116 10.183 5.298 0.356 1.00 61.02 C ATOM 1837 O ARG A 116 9.951 6.486 0.126 1.00 23.21 O ATOM 1838 CB ARG A 116 12.464 4.286 0.188 1.00 13.22 C ATOM 1839 CG ARG A 116 12.651 5.089 -1.089 1.00 51.41 C ATOM 1840 CD ARG A 116 13.489 6.335 -0.846 1.00 70.23 C ATOM 1841 NE ARG A 116 14.880 6.146 -1.249 1.00 52.35 N ATOM 1842 CZ ARG A 116 15.788 7.115 -1.229 1.00 63.41 C ATOM 1843 NH1 ARG A 116 15.455 8.333 -0.825 1.00 62.02 N ATOM 1844 NH2 ARG A 116 17.034 6.865 -1.612 1.00 22.23 N ATOM 0 H ARG A 116 11.543 3.014 2.085 1.00 30.43 H new ATOM 0 HA ARG A 116 11.845 5.763 1.620 1.00 51.34 H new ATOM 0 HB2 ARG A 116 13.420 4.216 0.707 1.00 13.22 H new ATOM 0 HB3 ARG A 116 12.168 3.270 -0.072 1.00 13.22 H new ATOM 0 HG2 ARG A 116 13.132 4.467 -1.844 1.00 51.41 H new ATOM 0 HG3 ARG A 116 11.677 5.376 -1.486 1.00 51.41 H new ATOM 0 HD2 ARG A 116 13.062 7.172 -1.398 1.00 70.23 H new ATOM 0 HD3 ARG A 116 13.450 6.597 0.211 1.00 70.23 H new ATOM 0 HE ARG A 116 15.170 5.220 -1.563 1.00 52.35 H new ATOM 0 HH11 ARG A 116 14.499 8.528 -0.528 1.00 62.02 H new ATOM 0 HH12 ARG A 116 16.155 9.075 -0.811 1.00 62.02 H new ATOM 0 HH21 ARG A 116 17.294 5.929 -1.922 1.00 22.23 H new ATOM 0 HH22 ARG A 116 17.731 7.609 -1.597 1.00 22.23 H new ATOM 1858 N LEU A 117 9.388 4.315 -0.053 1.00 30.30 N ATOM 1859 CA LEU A 117 8.170 4.580 -0.811 1.00 4.14 C ATOM 1860 C LEU A 117 7.121 5.257 0.064 1.00 32.32 C ATOM 1861 O LEU A 117 6.569 6.295 -0.300 1.00 1.41 O ATOM 1862 CB LEU A 117 7.610 3.278 -1.385 1.00 65.03 C ATOM 1863 CG LEU A 117 6.345 3.408 -2.234 1.00 11.03 C ATOM 1864 CD1 LEU A 117 5.151 3.762 -1.361 1.00 13.42 C ATOM 1865 CD2 LEU A 117 6.539 4.452 -3.324 1.00 64.52 C ATOM 0 H LEU A 117 9.565 3.327 0.128 1.00 30.30 H new ATOM 0 HA LEU A 117 8.421 5.253 -1.631 1.00 4.14 H new ATOM 0 HB2 LEU A 117 8.384 2.809 -1.992 1.00 65.03 H new ATOM 0 HB3 LEU A 117 7.400 2.600 -0.558 1.00 65.03 H new ATOM 0 HG LEU A 117 6.149 2.447 -2.710 1.00 11.03 H new ATOM 0 HD11 LEU A 117 4.260 3.850 -1.982 1.00 13.42 H new ATOM 0 HD12 LEU A 117 4.999 2.979 -0.618 1.00 13.42 H new ATOM 0 HD13 LEU A 117 5.337 4.710 -0.857 1.00 13.42 H new ATOM 0 HD21 LEU A 117 5.629 4.531 -3.918 1.00 64.52 H new ATOM 0 HD22 LEU A 117 6.760 5.417 -2.868 1.00 64.52 H new ATOM 0 HD23 LEU A 117 7.368 4.157 -3.967 1.00 64.52 H new ATOM 1877 N VAL A 118 6.849 4.662 1.221 1.00 30.43 N ATOM 1878 CA VAL A 118 5.868 5.209 2.151 1.00 20.10 C ATOM 1879 C VAL A 118 6.212 6.645 2.531 1.00 33.21 C ATOM 1880 O VAL A 118 5.385 7.547 2.399 1.00 64.22 O ATOM 1881 CB VAL A 118 5.773 4.358 3.432 1.00 43.41 C ATOM 1882 CG1 VAL A 118 4.849 5.019 4.444 1.00 70.44 C ATOM 1883 CG2 VAL A 118 5.299 2.952 3.103 1.00 32.42 C ATOM 0 H VAL A 118 7.295 3.801 1.537 1.00 30.43 H new ATOM 0 HA VAL A 118 4.905 5.192 1.641 1.00 20.10 H new ATOM 0 HB VAL A 118 6.766 4.287 3.875 1.00 43.41 H new ATOM 0 HG11 VAL A 118 4.794 4.404 5.342 1.00 70.44 H new ATOM 0 HG12 VAL A 118 5.237 6.004 4.702 1.00 70.44 H new ATOM 0 HG13 VAL A 118 3.853 5.123 4.014 1.00 70.44 H new ATOM 0 HG21 VAL A 118 5.238 2.365 4.019 1.00 32.42 H new ATOM 0 HG22 VAL A 118 4.315 3.000 2.636 1.00 32.42 H new ATOM 0 HG23 VAL A 118 6.004 2.482 2.417 1.00 32.42 H new ATOM 1893 N GLN A 119 7.437 6.849 3.004 1.00 64.54 N ATOM 1894 CA GLN A 119 7.890 8.176 3.404 1.00 71.44 C ATOM 1895 C GLN A 119 7.604 9.200 2.311 1.00 42.20 C ATOM 1896 O GLN A 119 7.229 10.338 2.595 1.00 51.24 O ATOM 1897 CB GLN A 119 9.387 8.153 3.720 1.00 54.22 C ATOM 1898 CG GLN A 119 9.706 7.653 5.120 1.00 41.43 C ATOM 1899 CD GLN A 119 10.991 8.239 5.670 1.00 54.41 C ATOM 1900 OE1 GLN A 119 11.350 9.376 5.361 1.00 11.35 O ATOM 1901 NE2 GLN A 119 11.691 7.466 6.491 1.00 34.41 N ATOM 0 H GLN A 119 8.133 6.113 3.120 1.00 64.54 H new ATOM 0 HA GLN A 119 7.342 8.466 4.300 1.00 71.44 H new ATOM 0 HB2 GLN A 119 9.894 7.519 2.993 1.00 54.22 H new ATOM 0 HB3 GLN A 119 9.790 9.159 3.602 1.00 54.22 H new ATOM 0 HG2 GLN A 119 8.882 7.904 5.788 1.00 41.43 H new ATOM 0 HG3 GLN A 119 9.784 6.566 5.104 1.00 41.43 H new ATOM 0 HE21 GLN A 119 11.356 6.530 6.720 1.00 34.41 H new ATOM 0 HE22 GLN A 119 12.564 7.808 6.893 1.00 34.41 H new ATOM 1910 N THR A 120 7.786 8.790 1.060 1.00 40.44 N ATOM 1911 CA THR A 120 7.549 9.672 -0.076 1.00 3.44 C ATOM 1912 C THR A 120 6.090 10.111 -0.137 1.00 43.43 C ATOM 1913 O THR A 120 5.794 11.282 -0.375 1.00 22.02 O ATOM 1914 CB THR A 120 7.925 8.991 -1.406 1.00 10.22 C ATOM 1915 OG1 THR A 120 9.210 8.370 -1.292 1.00 32.03 O ATOM 1916 CG2 THR A 120 7.942 9.999 -2.545 1.00 34.32 C ATOM 0 H THR A 120 8.097 7.852 0.808 1.00 40.44 H new ATOM 0 HA THR A 120 8.183 10.547 0.067 1.00 3.44 H new ATOM 0 HB THR A 120 7.174 8.232 -1.625 1.00 10.22 H new ATOM 0 HG1 THR A 120 9.121 7.519 -0.814 1.00 32.03 H new ATOM 0 HG21 THR A 120 8.210 9.495 -3.473 1.00 34.32 H new ATOM 0 HG22 THR A 120 6.954 10.448 -2.648 1.00 34.32 H new ATOM 0 HG23 THR A 120 8.674 10.778 -2.331 1.00 34.32 H new ATOM 1924 N ALA A 121 5.183 9.164 0.080 1.00 4.41 N ATOM 1925 CA ALA A 121 3.755 9.454 0.052 1.00 11.04 C ATOM 1926 C ALA A 121 3.332 10.246 1.286 1.00 61.34 C ATOM 1927 O ALA A 121 2.344 10.978 1.253 1.00 4.54 O ATOM 1928 CB ALA A 121 2.957 8.163 -0.049 1.00 51.41 C ATOM 0 H ALA A 121 5.412 8.190 0.277 1.00 4.41 H new ATOM 0 HA ALA A 121 3.549 10.065 -0.827 1.00 11.04 H new ATOM 0 HB1 ALA A 121 1.892 8.394 -0.069 1.00 51.41 H new ATOM 0 HB2 ALA A 121 3.231 7.636 -0.963 1.00 51.41 H new ATOM 0 HB3 ALA A 121 3.175 7.532 0.813 1.00 51.41 H new ATOM 1934 N GLU A 122 4.085 10.090 2.370 1.00 14.32 N ATOM 1935 CA GLU A 122 3.784 10.790 3.614 1.00 63.43 C ATOM 1936 C GLU A 122 2.648 10.102 4.364 1.00 53.34 C ATOM 1937 O GLU A 122 1.781 10.760 4.941 1.00 3.41 O ATOM 1938 CB GLU A 122 3.415 12.247 3.329 1.00 71.24 C ATOM 1939 CG GLU A 122 4.171 13.246 4.189 1.00 60.14 C ATOM 1940 CD GLU A 122 3.251 14.227 4.889 1.00 53.24 C ATOM 1941 OE1 GLU A 122 2.481 13.794 5.771 1.00 25.41 O ATOM 1942 OE2 GLU A 122 3.301 15.429 4.552 1.00 14.35 O ATOM 0 H GLU A 122 4.906 9.487 2.413 1.00 14.32 H new ATOM 0 HA GLU A 122 4.676 10.765 4.240 1.00 63.43 H new ATOM 0 HB2 GLU A 122 3.610 12.464 2.279 1.00 71.24 H new ATOM 0 HB3 GLU A 122 2.345 12.380 3.488 1.00 71.24 H new ATOM 0 HG2 GLU A 122 4.757 12.708 4.934 1.00 60.14 H new ATOM 0 HG3 GLU A 122 4.876 13.796 3.566 1.00 60.14 H new ATOM 1949 N LEU A 123 2.655 8.774 4.350 1.00 64.51 N ATOM 1950 CA LEU A 123 1.625 7.995 5.028 1.00 21.23 C ATOM 1951 C LEU A 123 2.059 7.635 6.446 1.00 32.13 C ATOM 1952 O LEU A 123 2.924 6.782 6.645 1.00 4.22 O ATOM 1953 CB LEU A 123 1.318 6.722 4.238 1.00 14.10 C ATOM 1954 CG LEU A 123 0.862 6.922 2.792 1.00 14.02 C ATOM 1955 CD1 LEU A 123 1.197 5.700 1.953 1.00 34.32 C ATOM 1956 CD2 LEU A 123 -0.631 7.216 2.740 1.00 44.44 C ATOM 0 H LEU A 123 3.363 8.214 3.876 1.00 64.51 H new ATOM 0 HA LEU A 123 0.723 8.605 5.088 1.00 21.23 H new ATOM 0 HB2 LEU A 123 2.211 6.097 4.233 1.00 14.10 H new ATOM 0 HB3 LEU A 123 0.544 6.167 4.768 1.00 14.10 H new ATOM 0 HG LEU A 123 1.395 7.778 2.378 1.00 14.02 H new ATOM 0 HD11 LEU A 123 0.865 5.861 0.927 1.00 34.32 H new ATOM 0 HD12 LEU A 123 2.274 5.535 1.964 1.00 34.32 H new ATOM 0 HD13 LEU A 123 0.692 4.826 2.365 1.00 34.32 H new ATOM 0 HD21 LEU A 123 -0.938 7.356 1.704 1.00 44.44 H new ATOM 0 HD22 LEU A 123 -1.182 6.381 3.172 1.00 44.44 H new ATOM 0 HD23 LEU A 123 -0.843 8.123 3.307 1.00 44.44 H new ATOM 1968 N THR A 124 1.450 8.290 7.430 1.00 43.10 N ATOM 1969 CA THR A 124 1.772 8.040 8.829 1.00 32.11 C ATOM 1970 C THR A 124 1.230 6.690 9.284 1.00 33.41 C ATOM 1971 O THR A 124 1.610 6.180 10.338 1.00 71.00 O ATOM 1972 CB THR A 124 1.205 9.142 9.742 1.00 5.43 C ATOM 1973 OG1 THR A 124 1.448 8.815 11.115 1.00 25.03 O ATOM 1974 CG2 THR A 124 -0.289 9.319 9.514 1.00 22.34 C ATOM 0 H THR A 124 0.731 8.998 7.283 1.00 43.10 H new ATOM 0 HA THR A 124 2.859 8.038 8.908 1.00 32.11 H new ATOM 0 HB THR A 124 1.707 10.078 9.498 1.00 5.43 H new ATOM 0 HG1 THR A 124 1.500 7.842 11.215 1.00 25.03 H new ATOM 0 HG21 THR A 124 -0.667 10.103 10.170 1.00 22.34 H new ATOM 0 HG22 THR A 124 -0.468 9.598 8.476 1.00 22.34 H new ATOM 0 HG23 THR A 124 -0.804 8.383 9.733 1.00 22.34 H new ATOM 1982 N LYS A 125 0.339 6.114 8.483 1.00 5.14 N ATOM 1983 CA LYS A 125 -0.254 4.821 8.803 1.00 53.53 C ATOM 1984 C LYS A 125 0.281 3.734 7.878 1.00 71.25 C ATOM 1985 O LYS A 125 0.075 3.779 6.665 1.00 64.33 O ATOM 1986 CB LYS A 125 -1.779 4.896 8.690 1.00 24.44 C ATOM 1987 CG LYS A 125 -2.378 6.123 9.356 1.00 34.33 C ATOM 1988 CD LYS A 125 -3.891 6.021 9.453 1.00 33.52 C ATOM 1989 CE LYS A 125 -4.578 6.989 8.502 1.00 64.13 C ATOM 1990 NZ LYS A 125 -4.767 8.331 9.118 1.00 15.34 N ATOM 0 H LYS A 125 0.012 6.523 7.608 1.00 5.14 H new ATOM 0 HA LYS A 125 0.017 4.567 9.828 1.00 53.53 H new ATOM 0 HB2 LYS A 125 -2.058 4.892 7.636 1.00 24.44 H new ATOM 0 HB3 LYS A 125 -2.213 4.002 9.138 1.00 24.44 H new ATOM 0 HG2 LYS A 125 -1.955 6.239 10.354 1.00 34.33 H new ATOM 0 HG3 LYS A 125 -2.108 7.014 8.789 1.00 34.33 H new ATOM 0 HD2 LYS A 125 -4.203 5.002 9.225 1.00 33.52 H new ATOM 0 HD3 LYS A 125 -4.206 6.229 10.476 1.00 33.52 H new ATOM 0 HE2 LYS A 125 -3.985 7.087 7.593 1.00 64.13 H new ATOM 0 HE3 LYS A 125 -5.547 6.584 8.209 1.00 64.13 H new ATOM 0 HZ1 LYS A 125 -5.238 8.962 8.438 1.00 15.34 H new ATOM 0 HZ2 LYS A 125 -5.354 8.241 9.972 1.00 15.34 H new ATOM 0 HZ3 LYS A 125 -3.841 8.729 9.375 1.00 15.34 H new ATOM 2004 N VAL A 126 0.967 2.754 8.458 1.00 10.31 N ATOM 2005 CA VAL A 126 1.531 1.653 7.685 1.00 14.13 C ATOM 2006 C VAL A 126 1.108 0.306 8.261 1.00 14.13 C ATOM 2007 O VAL A 126 1.493 -0.055 9.373 1.00 51.04 O ATOM 2008 CB VAL A 126 3.069 1.723 7.648 1.00 72.44 C ATOM 2009 CG1 VAL A 126 3.617 0.824 6.550 1.00 52.34 C ATOM 2010 CG2 VAL A 126 3.533 3.159 7.455 1.00 2.10 C ATOM 0 H VAL A 126 1.146 2.700 9.461 1.00 10.31 H new ATOM 0 HA VAL A 126 1.146 1.749 6.670 1.00 14.13 H new ATOM 0 HB VAL A 126 3.455 1.367 8.603 1.00 72.44 H new ATOM 0 HG11 VAL A 126 4.705 0.886 6.538 1.00 52.34 H new ATOM 0 HG12 VAL A 126 3.314 -0.206 6.738 1.00 52.34 H new ATOM 0 HG13 VAL A 126 3.225 1.147 5.586 1.00 52.34 H new ATOM 0 HG21 VAL A 126 4.622 3.189 7.431 1.00 2.10 H new ATOM 0 HG22 VAL A 126 3.139 3.546 6.515 1.00 2.10 H new ATOM 0 HG23 VAL A 126 3.171 3.772 8.280 1.00 2.10 H new ATOM 2020 N PHE A 127 0.312 -0.434 7.496 1.00 31.00 N ATOM 2021 CA PHE A 127 -0.165 -1.742 7.929 1.00 62.40 C ATOM 2022 C PHE A 127 0.461 -2.853 7.093 1.00 23.31 C ATOM 2023 O PHE A 127 0.815 -2.647 5.933 1.00 52.45 O ATOM 2024 CB PHE A 127 -1.691 -1.812 7.830 1.00 44.34 C ATOM 2025 CG PHE A 127 -2.391 -0.743 8.619 1.00 15.04 C ATOM 2026 CD1 PHE A 127 -1.873 -0.302 9.826 1.00 42.35 C ATOM 2027 CD2 PHE A 127 -3.570 -0.181 8.154 1.00 61.21 C ATOM 2028 CE1 PHE A 127 -2.518 0.681 10.554 1.00 65.43 C ATOM 2029 CE2 PHE A 127 -4.218 0.802 8.879 1.00 41.24 C ATOM 2030 CZ PHE A 127 -3.690 1.234 10.079 1.00 73.23 C ATOM 0 H PHE A 127 -0.016 -0.150 6.573 1.00 31.00 H new ATOM 0 HA PHE A 127 0.131 -1.882 8.969 1.00 62.40 H new ATOM 0 HB2 PHE A 127 -1.984 -1.731 6.783 1.00 44.34 H new ATOM 0 HB3 PHE A 127 -2.026 -2.789 8.179 1.00 44.34 H new ATOM 0 HD1 PHE A 127 -0.956 -0.730 10.202 1.00 42.35 H new ATOM 0 HD2 PHE A 127 -3.987 -0.515 7.215 1.00 61.21 H new ATOM 0 HE1 PHE A 127 -2.105 1.016 11.494 1.00 65.43 H new ATOM 0 HE2 PHE A 127 -5.136 1.231 8.507 1.00 41.24 H new ATOM 0 HZ PHE A 127 -4.193 2.004 10.645 1.00 73.23 H new ATOM 2040 N GLU A 128 0.597 -4.032 7.692 1.00 31.34 N ATOM 2041 CA GLU A 128 1.182 -5.177 7.003 1.00 12.44 C ATOM 2042 C GLU A 128 0.200 -6.344 6.954 1.00 3.12 C ATOM 2043 O GLU A 128 -0.436 -6.675 7.955 1.00 4.12 O ATOM 2044 CB GLU A 128 2.475 -5.612 7.698 1.00 54.51 C ATOM 2045 CG GLU A 128 3.297 -6.600 6.888 1.00 33.04 C ATOM 2046 CD GLU A 128 4.245 -7.414 7.749 1.00 53.10 C ATOM 2047 OE1 GLU A 128 4.579 -6.952 8.860 1.00 43.21 O ATOM 2048 OE2 GLU A 128 4.650 -8.510 7.312 1.00 23.24 O ATOM 0 H GLU A 128 0.310 -4.219 8.653 1.00 31.34 H new ATOM 0 HA GLU A 128 1.411 -4.875 5.981 1.00 12.44 H new ATOM 0 HB2 GLU A 128 3.082 -4.730 7.904 1.00 54.51 H new ATOM 0 HB3 GLU A 128 2.228 -6.060 8.660 1.00 54.51 H new ATOM 0 HG2 GLU A 128 2.626 -7.274 6.355 1.00 33.04 H new ATOM 0 HG3 GLU A 128 3.870 -6.059 6.135 1.00 33.04 H new ATOM 2055 N ILE A 129 0.081 -6.961 5.784 1.00 63.11 N ATOM 2056 CA ILE A 129 -0.822 -8.090 5.605 1.00 60.10 C ATOM 2057 C ILE A 129 -0.054 -9.359 5.250 1.00 44.11 C ATOM 2058 O ILE A 129 0.740 -9.372 4.307 1.00 34.54 O ATOM 2059 CB ILE A 129 -1.863 -7.809 4.505 1.00 61.31 C ATOM 2060 CG1 ILE A 129 -1.196 -7.144 3.299 1.00 61.40 C ATOM 2061 CG2 ILE A 129 -2.983 -6.934 5.046 1.00 30.55 C ATOM 2062 CD1 ILE A 129 -2.052 -7.156 2.052 1.00 54.20 C ATOM 0 H ILE A 129 0.599 -6.698 4.946 1.00 63.11 H new ATOM 0 HA ILE A 129 -1.338 -8.234 6.554 1.00 60.10 H new ATOM 0 HB ILE A 129 -2.293 -8.757 4.182 1.00 61.31 H new ATOM 0 HG12 ILE A 129 -0.952 -6.112 3.552 1.00 61.40 H new ATOM 0 HG13 ILE A 129 -0.255 -7.652 3.089 1.00 61.40 H new ATOM 0 HG21 ILE A 129 -3.710 -6.745 4.257 1.00 30.55 H new ATOM 0 HG22 ILE A 129 -3.473 -7.442 5.877 1.00 30.55 H new ATOM 0 HG23 ILE A 129 -2.570 -5.987 5.393 1.00 30.55 H new ATOM 0 HD11 ILE A 129 -1.516 -6.668 1.238 1.00 54.20 H new ATOM 0 HD12 ILE A 129 -2.275 -8.186 1.774 1.00 54.20 H new ATOM 0 HD13 ILE A 129 -2.983 -6.622 2.244 1.00 54.20 H new ATOM 2074 N ARG A 130 -0.294 -10.422 6.009 1.00 15.24 N ATOM 2075 CA ARG A 130 0.375 -11.696 5.774 1.00 30.42 C ATOM 2076 C ARG A 130 -0.190 -12.388 4.537 1.00 50.30 C ATOM 2077 O ARG A 130 0.421 -13.307 3.991 1.00 12.44 O ATOM 2078 CB ARG A 130 0.225 -12.607 6.994 1.00 25.10 C ATOM 2079 CG ARG A 130 1.016 -13.900 6.888 1.00 63.50 C ATOM 2080 CD ARG A 130 2.513 -13.648 6.987 1.00 1.04 C ATOM 2081 NE ARG A 130 2.965 -13.576 8.375 1.00 41.14 N ATOM 2082 CZ ARG A 130 4.225 -13.767 8.748 1.00 44.51 C ATOM 2083 NH1 ARG A 130 5.155 -14.040 7.841 1.00 13.25 N ATOM 2084 NH2 ARG A 130 4.559 -13.684 10.029 1.00 2.54 N ATOM 0 H ARG A 130 -0.947 -10.427 6.793 1.00 15.24 H new ATOM 0 HA ARG A 130 1.433 -11.496 5.605 1.00 30.42 H new ATOM 0 HB2 ARG A 130 0.547 -12.065 7.883 1.00 25.10 H new ATOM 0 HB3 ARG A 130 -0.830 -12.846 7.131 1.00 25.10 H new ATOM 0 HG2 ARG A 130 0.708 -14.582 7.680 1.00 63.50 H new ATOM 0 HG3 ARG A 130 0.790 -14.389 5.940 1.00 63.50 H new ATOM 0 HD2 ARG A 130 3.050 -14.445 6.472 1.00 1.04 H new ATOM 0 HD3 ARG A 130 2.758 -12.717 6.477 1.00 1.04 H new ATOM 0 HE ARG A 130 2.275 -13.368 9.097 1.00 41.14 H new ATOM 0 HH11 ARG A 130 4.902 -14.103 6.855 1.00 13.25 H new ATOM 0 HH12 ARG A 130 6.122 -14.186 8.130 1.00 13.25 H new ATOM 0 HH21 ARG A 130 3.848 -13.473 10.729 1.00 2.54 H new ATOM 0 HH22 ARG A 130 5.527 -13.831 10.314 1.00 2.54 H new ATOM 2098 N THR A 131 -1.363 -11.938 4.099 1.00 64.42 N ATOM 2099 CA THR A 131 -2.012 -12.515 2.927 1.00 45.20 C ATOM 2100 C THR A 131 -3.212 -11.679 2.497 1.00 22.03 C ATOM 2101 O THR A 131 -3.928 -11.125 3.333 1.00 11.30 O ATOM 2102 CB THR A 131 -2.475 -13.959 3.196 1.00 52.54 C ATOM 2103 OG1 THR A 131 -3.091 -14.501 2.021 1.00 20.21 O ATOM 2104 CG2 THR A 131 -3.458 -14.005 4.356 1.00 43.13 C ATOM 0 H THR A 131 -1.882 -11.177 4.537 1.00 64.42 H new ATOM 0 HA THR A 131 -1.272 -12.522 2.126 1.00 45.20 H new ATOM 0 HB THR A 131 -1.601 -14.555 3.457 1.00 52.54 H new ATOM 0 HG1 THR A 131 -3.382 -15.420 2.198 1.00 20.21 H new ATOM 0 HG21 THR A 131 -3.771 -15.035 4.527 1.00 43.13 H new ATOM 0 HG22 THR A 131 -2.979 -13.617 5.255 1.00 43.13 H new ATOM 0 HG23 THR A 131 -4.330 -13.396 4.118 1.00 43.13 H new ATOM 2112 N THR A 132 -3.429 -11.592 1.189 1.00 43.43 N ATOM 2113 CA THR A 132 -4.542 -10.823 0.647 1.00 11.15 C ATOM 2114 C THR A 132 -5.799 -11.009 1.491 1.00 14.01 C ATOM 2115 O THR A 132 -6.466 -10.037 1.850 1.00 23.51 O ATOM 2116 CB THR A 132 -4.849 -11.227 -0.807 1.00 54.30 C ATOM 2117 OG1 THR A 132 -5.136 -12.628 -0.876 1.00 52.02 O ATOM 2118 CG2 THR A 132 -3.677 -10.898 -1.719 1.00 2.02 C ATOM 0 H THR A 132 -2.848 -12.045 0.484 1.00 43.43 H new ATOM 0 HA THR A 132 -4.244 -9.775 0.669 1.00 11.15 H new ATOM 0 HB THR A 132 -5.719 -10.662 -1.142 1.00 54.30 H new ATOM 0 HG1 THR A 132 -5.332 -12.877 -1.804 1.00 52.02 H new ATOM 0 HG21 THR A 132 -3.917 -11.192 -2.741 1.00 2.02 H new ATOM 0 HG22 THR A 132 -3.481 -9.826 -1.687 1.00 2.02 H new ATOM 0 HG23 THR A 132 -2.792 -11.439 -1.384 1.00 2.02 H new ATOM 2126 N ASP A 133 -6.117 -12.260 1.803 1.00 64.12 N ATOM 2127 CA ASP A 133 -7.293 -12.572 2.606 1.00 40.23 C ATOM 2128 C ASP A 133 -7.489 -11.536 3.708 1.00 32.24 C ATOM 2129 O ASP A 133 -8.588 -11.008 3.890 1.00 24.14 O ATOM 2130 CB ASP A 133 -7.163 -13.968 3.218 1.00 14.14 C ATOM 2131 CG ASP A 133 -8.107 -14.969 2.581 1.00 52.41 C ATOM 2132 OD1 ASP A 133 -8.229 -14.962 1.339 1.00 63.24 O ATOM 2133 OD2 ASP A 133 -8.724 -15.760 3.326 1.00 2.30 O ATOM 0 H ASP A 133 -5.577 -13.075 1.512 1.00 64.12 H new ATOM 0 HA ASP A 133 -8.165 -12.550 1.953 1.00 40.23 H new ATOM 0 HB2 ASP A 133 -6.137 -14.317 3.104 1.00 14.14 H new ATOM 0 HB3 ASP A 133 -7.364 -13.913 4.288 1.00 14.14 H new ATOM 2138 N ASP A 134 -6.420 -11.250 4.441 1.00 23.53 N ATOM 2139 CA ASP A 134 -6.473 -10.277 5.527 1.00 55.42 C ATOM 2140 C ASP A 134 -7.188 -9.005 5.081 1.00 74.13 C ATOM 2141 O ASP A 134 -8.073 -8.501 5.775 1.00 64.33 O ATOM 2142 CB ASP A 134 -5.062 -9.940 6.010 1.00 73.43 C ATOM 2143 CG ASP A 134 -4.871 -10.231 7.485 1.00 2.52 C ATOM 2144 OD1 ASP A 134 -5.721 -9.797 8.289 1.00 15.15 O ATOM 2145 OD2 ASP A 134 -3.870 -10.889 7.836 1.00 25.51 O ATOM 0 H ASP A 134 -5.504 -11.678 4.304 1.00 23.53 H new ATOM 0 HA ASP A 134 -7.034 -10.719 6.351 1.00 55.42 H new ATOM 0 HB2 ASP A 134 -4.337 -10.513 5.433 1.00 73.43 H new ATOM 0 HB3 ASP A 134 -4.858 -8.886 5.821 1.00 73.43 H new ATOM 2150 N LEU A 135 -6.800 -8.491 3.919 1.00 11.45 N ATOM 2151 CA LEU A 135 -7.403 -7.277 3.381 1.00 62.03 C ATOM 2152 C LEU A 135 -8.914 -7.435 3.241 1.00 45.14 C ATOM 2153 O LEU A 135 -9.418 -7.771 2.168 1.00 2.13 O ATOM 2154 CB LEU A 135 -6.786 -6.937 2.022 1.00 30.15 C ATOM 2155 CG LEU A 135 -7.524 -5.883 1.195 1.00 23.21 C ATOM 2156 CD1 LEU A 135 -8.070 -4.785 2.095 1.00 51.02 C ATOM 2157 CD2 LEU A 135 -6.603 -5.297 0.134 1.00 35.34 C ATOM 0 H LEU A 135 -6.071 -8.896 3.332 1.00 11.45 H new ATOM 0 HA LEU A 135 -7.205 -6.463 4.078 1.00 62.03 H new ATOM 0 HB2 LEU A 135 -5.765 -6.593 2.185 1.00 30.15 H new ATOM 0 HB3 LEU A 135 -6.724 -7.853 1.434 1.00 30.15 H new ATOM 0 HG LEU A 135 -8.363 -6.364 0.693 1.00 23.21 H new ATOM 0 HD11 LEU A 135 -8.592 -4.044 1.489 1.00 51.02 H new ATOM 0 HD12 LEU A 135 -8.763 -5.217 2.817 1.00 51.02 H new ATOM 0 HD13 LEU A 135 -7.247 -4.306 2.625 1.00 51.02 H new ATOM 0 HD21 LEU A 135 -7.145 -4.549 -0.445 1.00 35.34 H new ATOM 0 HD22 LEU A 135 -5.743 -4.831 0.616 1.00 35.34 H new ATOM 0 HD23 LEU A 135 -6.261 -6.091 -0.529 1.00 35.34 H new ATOM 2169 N THR A 136 -9.634 -7.188 4.331 1.00 4.13 N ATOM 2170 CA THR A 136 -11.087 -7.301 4.330 1.00 64.40 C ATOM 2171 C THR A 136 -11.737 -6.025 4.850 1.00 75.31 C ATOM 2172 O THR A 136 -11.147 -5.297 5.646 1.00 35.14 O ATOM 2173 CB THR A 136 -11.557 -8.491 5.188 1.00 22.21 C ATOM 2174 OG1 THR A 136 -10.663 -8.684 6.290 1.00 22.41 O ATOM 2175 CG2 THR A 136 -11.629 -9.763 4.357 1.00 62.40 C ATOM 0 H THR A 136 -9.234 -6.908 5.226 1.00 4.13 H new ATOM 0 HA THR A 136 -11.392 -7.465 3.296 1.00 64.40 H new ATOM 0 HB THR A 136 -12.555 -8.266 5.566 1.00 22.21 H new ATOM 0 HG1 THR A 136 -9.789 -8.974 5.955 1.00 22.41 H new ATOM 0 HG21 THR A 136 -11.963 -10.589 4.985 1.00 62.40 H new ATOM 0 HG22 THR A 136 -12.333 -9.622 3.537 1.00 62.40 H new ATOM 0 HG23 THR A 136 -10.642 -9.990 3.953 1.00 62.40 H new ATOM 2183 N GLU A 137 -12.958 -5.762 4.393 1.00 11.22 N ATOM 2184 CA GLU A 137 -13.689 -4.572 4.813 1.00 32.14 C ATOM 2185 C GLU A 137 -13.551 -4.351 6.317 1.00 73.32 C ATOM 2186 O GLU A 137 -13.482 -3.215 6.786 1.00 1.51 O ATOM 2187 CB GLU A 137 -15.168 -4.696 4.439 1.00 21.13 C ATOM 2188 CG GLU A 137 -16.018 -3.533 4.922 1.00 2.11 C ATOM 2189 CD GLU A 137 -17.356 -3.979 5.477 1.00 13.01 C ATOM 2190 OE1 GLU A 137 -17.400 -5.030 6.149 1.00 23.31 O ATOM 2191 OE2 GLU A 137 -18.361 -3.276 5.239 1.00 53.15 O ATOM 0 H GLU A 137 -13.461 -6.356 3.733 1.00 11.22 H new ATOM 0 HA GLU A 137 -13.261 -3.713 4.296 1.00 32.14 H new ATOM 0 HB2 GLU A 137 -15.255 -4.773 3.355 1.00 21.13 H new ATOM 0 HB3 GLU A 137 -15.563 -5.622 4.857 1.00 21.13 H new ATOM 0 HG2 GLU A 137 -15.474 -2.985 5.692 1.00 2.11 H new ATOM 0 HG3 GLU A 137 -16.184 -2.842 4.096 1.00 2.11 H new ATOM 2198 N THR A 138 -13.512 -5.447 7.069 1.00 3.01 N ATOM 2199 CA THR A 138 -13.383 -5.375 8.519 1.00 11.50 C ATOM 2200 C THR A 138 -11.935 -5.137 8.932 1.00 1.20 C ATOM 2201 O THR A 138 -11.620 -4.136 9.577 1.00 72.20 O ATOM 2202 CB THR A 138 -13.893 -6.662 9.193 1.00 40.31 C ATOM 2203 OG1 THR A 138 -15.162 -7.032 8.644 1.00 20.44 O ATOM 2204 CG2 THR A 138 -14.020 -6.471 10.697 1.00 31.44 C ATOM 0 H THR A 138 -13.568 -6.395 6.697 1.00 3.01 H new ATOM 0 HA THR A 138 -13.994 -4.535 8.849 1.00 11.50 H new ATOM 0 HB THR A 138 -13.171 -7.456 9.004 1.00 40.31 H new ATOM 0 HG1 THR A 138 -15.479 -7.852 9.076 1.00 20.44 H new ATOM 0 HG21 THR A 138 -14.382 -7.393 11.152 1.00 31.44 H new ATOM 0 HG22 THR A 138 -13.046 -6.218 11.115 1.00 31.44 H new ATOM 0 HG23 THR A 138 -14.724 -5.664 10.903 1.00 31.44 H new ATOM 2212 N TRP A 139 -11.059 -6.061 8.556 1.00 11.35 N ATOM 2213 CA TRP A 139 -9.642 -5.952 8.888 1.00 13.42 C ATOM 2214 C TRP A 139 -9.107 -4.566 8.539 1.00 75.31 C ATOM 2215 O TRP A 139 -8.088 -4.130 9.075 1.00 72.41 O ATOM 2216 CB TRP A 139 -8.840 -7.023 8.148 1.00 50.21 C ATOM 2217 CG TRP A 139 -7.386 -6.687 8.011 1.00 23.53 C ATOM 2218 CD1 TRP A 139 -6.355 -7.197 8.748 1.00 43.24 C ATOM 2219 CD2 TRP A 139 -6.803 -5.766 7.084 1.00 44.04 C ATOM 2220 NE1 TRP A 139 -5.165 -6.648 8.333 1.00 40.10 N ATOM 2221 CE2 TRP A 139 -5.412 -5.768 7.313 1.00 72.01 C ATOM 2222 CE3 TRP A 139 -7.319 -4.941 6.081 1.00 62.33 C ATOM 2223 CZ2 TRP A 139 -4.536 -4.976 6.576 1.00 72.31 C ATOM 2224 CZ3 TRP A 139 -6.447 -4.156 5.350 1.00 72.21 C ATOM 2225 CH2 TRP A 139 -5.069 -4.179 5.600 1.00 44.43 C ATOM 0 H TRP A 139 -11.304 -6.894 8.021 1.00 11.35 H new ATOM 0 HA TRP A 139 -9.533 -6.104 9.962 1.00 13.42 H new ATOM 0 HB2 TRP A 139 -8.938 -7.971 8.677 1.00 50.21 H new ATOM 0 HB3 TRP A 139 -9.268 -7.166 7.156 1.00 50.21 H new ATOM 0 HD1 TRP A 139 -6.459 -7.924 9.540 1.00 43.24 H new ATOM 0 HE1 TRP A 139 -4.247 -6.862 8.722 1.00 40.10 H new ATOM 0 HE3 TRP A 139 -8.380 -4.917 5.881 1.00 62.33 H new ATOM 0 HZ2 TRP A 139 -3.473 -4.990 6.768 1.00 72.31 H new ATOM 0 HZ3 TRP A 139 -6.835 -3.514 4.573 1.00 72.21 H new ATOM 0 HH2 TRP A 139 -4.414 -3.555 5.010 1.00 44.43 H new ATOM 2236 N LEU A 140 -9.801 -3.879 7.637 1.00 70.34 N ATOM 2237 CA LEU A 140 -9.395 -2.543 7.216 1.00 20.42 C ATOM 2238 C LEU A 140 -10.013 -1.478 8.116 1.00 74.34 C ATOM 2239 O LEU A 140 -9.306 -0.680 8.730 1.00 44.12 O ATOM 2240 CB LEU A 140 -9.803 -2.299 5.762 1.00 65.21 C ATOM 2241 CG LEU A 140 -9.854 -0.837 5.316 1.00 14.11 C ATOM 2242 CD1 LEU A 140 -11.234 -0.250 5.572 1.00 42.53 C ATOM 2243 CD2 LEU A 140 -8.785 -0.024 6.031 1.00 53.31 C ATOM 0 H LEU A 140 -10.647 -4.225 7.184 1.00 70.34 H new ATOM 0 HA LEU A 140 -8.310 -2.476 7.298 1.00 20.42 H new ATOM 0 HB2 LEU A 140 -9.105 -2.831 5.116 1.00 65.21 H new ATOM 0 HB3 LEU A 140 -10.786 -2.741 5.602 1.00 65.21 H new ATOM 0 HG LEU A 140 -9.657 -0.796 4.245 1.00 14.11 H new ATOM 0 HD11 LEU A 140 -11.252 0.791 5.249 1.00 42.53 H new ATOM 0 HD12 LEU A 140 -11.980 -0.816 5.014 1.00 42.53 H new ATOM 0 HD13 LEU A 140 -11.460 -0.303 6.637 1.00 42.53 H new ATOM 0 HD21 LEU A 140 -8.836 1.014 5.701 1.00 53.31 H new ATOM 0 HD22 LEU A 140 -8.951 -0.072 7.107 1.00 53.31 H new ATOM 0 HD23 LEU A 140 -7.801 -0.431 5.797 1.00 53.31 H new ATOM 2255 N LYS A 141 -11.341 -1.472 8.190 1.00 4.42 N ATOM 2256 CA LYS A 141 -12.056 -0.507 9.017 1.00 34.41 C ATOM 2257 C LYS A 141 -11.671 -0.658 10.485 1.00 1.12 C ATOM 2258 O LYS A 141 -11.836 0.270 11.276 1.00 34.25 O ATOM 2259 CB LYS A 141 -13.568 -0.689 8.855 1.00 45.44 C ATOM 2260 CG LYS A 141 -14.181 0.228 7.810 1.00 65.20 C ATOM 2261 CD LYS A 141 -15.391 -0.411 7.150 1.00 44.31 C ATOM 2262 CE LYS A 141 -16.689 0.092 7.760 1.00 32.34 C ATOM 2263 NZ LYS A 141 -17.118 -0.743 8.917 1.00 35.30 N ATOM 0 H LYS A 141 -11.943 -2.124 7.687 1.00 4.42 H new ATOM 0 HA LYS A 141 -11.778 0.494 8.687 1.00 34.41 H new ATOM 0 HB2 LYS A 141 -13.774 -1.724 8.584 1.00 45.44 H new ATOM 0 HB3 LYS A 141 -14.052 -0.508 9.815 1.00 45.44 H new ATOM 0 HG2 LYS A 141 -14.474 1.169 8.277 1.00 65.20 H new ATOM 0 HG3 LYS A 141 -13.435 0.467 7.052 1.00 65.20 H new ATOM 0 HD2 LYS A 141 -15.381 -0.193 6.082 1.00 44.31 H new ATOM 0 HD3 LYS A 141 -15.334 -1.494 7.255 1.00 44.31 H new ATOM 0 HE2 LYS A 141 -16.562 1.125 8.085 1.00 32.34 H new ATOM 0 HE3 LYS A 141 -17.471 0.091 7.001 1.00 32.34 H new ATOM 0 HZ1 LYS A 141 -18.007 -0.368 9.305 1.00 35.30 H new ATOM 0 HZ2 LYS A 141 -17.264 -1.723 8.602 1.00 35.30 H new ATOM 0 HZ3 LYS A 141 -16.383 -0.722 9.652 1.00 35.30 H new ATOM 2277 N GLU A 142 -11.155 -1.830 10.841 1.00 62.43 N ATOM 2278 CA GLU A 142 -10.745 -2.099 12.213 1.00 22.42 C ATOM 2279 C GLU A 142 -9.494 -1.303 12.574 1.00 11.44 C ATOM 2280 O GLU A 142 -9.416 -0.700 13.645 1.00 43.25 O ATOM 2281 CB GLU A 142 -10.485 -3.595 12.408 1.00 51.42 C ATOM 2282 CG GLU A 142 -11.731 -4.389 12.758 1.00 14.41 C ATOM 2283 CD GLU A 142 -11.456 -5.497 13.757 1.00 43.11 C ATOM 2284 OE1 GLU A 142 -10.896 -6.536 13.351 1.00 24.20 O ATOM 2285 OE2 GLU A 142 -11.801 -5.324 14.945 1.00 54.54 O ATOM 0 H GLU A 142 -11.011 -2.608 10.198 1.00 62.43 H new ATOM 0 HA GLU A 142 -11.555 -1.789 12.874 1.00 22.42 H new ATOM 0 HB2 GLU A 142 -10.050 -4.002 11.495 1.00 51.42 H new ATOM 0 HB3 GLU A 142 -9.747 -3.727 13.199 1.00 51.42 H new ATOM 0 HG2 GLU A 142 -12.484 -3.715 13.167 1.00 14.41 H new ATOM 0 HG3 GLU A 142 -12.150 -4.820 11.849 1.00 14.41 H new ATOM 2292 N LYS A 143 -8.518 -1.306 11.673 1.00 32.42 N ATOM 2293 CA LYS A 143 -7.270 -0.585 11.894 1.00 40.24 C ATOM 2294 C LYS A 143 -7.523 0.915 12.014 1.00 51.20 C ATOM 2295 O LYS A 143 -6.883 1.601 12.812 1.00 3.20 O ATOM 2296 CB LYS A 143 -6.290 -0.857 10.750 1.00 31.44 C ATOM 2297 CG LYS A 143 -5.976 -2.331 10.558 1.00 74.41 C ATOM 2298 CD LYS A 143 -4.601 -2.684 11.098 1.00 44.40 C ATOM 2299 CE LYS A 143 -3.920 -3.743 10.244 1.00 55.55 C ATOM 2300 NZ LYS A 143 -2.504 -3.958 10.650 1.00 30.15 N ATOM 0 H LYS A 143 -8.567 -1.800 10.782 1.00 32.42 H new ATOM 0 HA LYS A 143 -6.835 -0.939 12.829 1.00 40.24 H new ATOM 0 HB2 LYS A 143 -6.705 -0.459 9.824 1.00 31.44 H new ATOM 0 HB3 LYS A 143 -5.362 -0.318 10.941 1.00 31.44 H new ATOM 0 HG2 LYS A 143 -6.731 -2.933 11.063 1.00 74.41 H new ATOM 0 HG3 LYS A 143 -6.026 -2.579 9.498 1.00 74.41 H new ATOM 0 HD2 LYS A 143 -3.981 -1.788 11.131 1.00 44.40 H new ATOM 0 HD3 LYS A 143 -4.693 -3.045 12.122 1.00 44.40 H new ATOM 0 HE2 LYS A 143 -4.467 -4.682 10.325 1.00 55.55 H new ATOM 0 HE3 LYS A 143 -3.956 -3.443 9.197 1.00 55.55 H new ATOM 0 HZ1 LYS A 143 -2.076 -4.687 10.044 1.00 30.15 H new ATOM 0 HZ2 LYS A 143 -1.975 -3.068 10.548 1.00 30.15 H new ATOM 0 HZ3 LYS A 143 -2.471 -4.269 11.642 1.00 30.15 H new ATOM 2314 N LEU A 144 -8.460 1.418 11.218 1.00 32.30 N ATOM 2315 CA LEU A 144 -8.798 2.837 11.236 1.00 71.42 C ATOM 2316 C LEU A 144 -9.557 3.199 12.509 1.00 45.23 C ATOM 2317 O LEU A 144 -9.159 4.102 13.244 1.00 54.40 O ATOM 2318 CB LEU A 144 -9.635 3.197 10.008 1.00 34.12 C ATOM 2319 CG LEU A 144 -9.152 2.627 8.674 1.00 14.22 C ATOM 2320 CD1 LEU A 144 -10.229 2.770 7.611 1.00 40.13 C ATOM 2321 CD2 LEU A 144 -7.869 3.318 8.234 1.00 53.43 C ATOM 0 H LEU A 144 -8.999 0.865 10.552 1.00 32.30 H new ATOM 0 HA LEU A 144 -7.870 3.408 11.214 1.00 71.42 H new ATOM 0 HB2 LEU A 144 -10.656 2.856 10.177 1.00 34.12 H new ATOM 0 HB3 LEU A 144 -9.671 4.283 9.924 1.00 34.12 H new ATOM 0 HG LEU A 144 -8.943 1.566 8.808 1.00 14.22 H new ATOM 0 HD11 LEU A 144 -9.867 2.359 6.669 1.00 40.13 H new ATOM 0 HD12 LEU A 144 -11.123 2.229 7.923 1.00 40.13 H new ATOM 0 HD13 LEU A 144 -10.471 3.824 7.478 1.00 40.13 H new ATOM 0 HD21 LEU A 144 -7.539 2.901 7.283 1.00 53.43 H new ATOM 0 HD22 LEU A 144 -8.053 4.386 8.117 1.00 53.43 H new ATOM 0 HD23 LEU A 144 -7.096 3.163 8.986 1.00 53.43 H new ATOM 2333 N ALA A 145 -10.651 2.486 12.763 1.00 43.35 N ATOM 2334 CA ALA A 145 -11.463 2.730 13.948 1.00 4.41 C ATOM 2335 C ALA A 145 -10.587 2.991 15.170 1.00 72.23 C ATOM 2336 O ALA A 145 -10.402 4.136 15.580 1.00 1.44 O ATOM 2337 CB ALA A 145 -12.390 1.552 14.203 1.00 14.33 C ATOM 0 H ALA A 145 -10.994 1.735 12.164 1.00 43.35 H new ATOM 0 HA ALA A 145 -12.065 3.621 13.769 1.00 4.41 H new ATOM 0 HB1 ALA A 145 -12.991 1.747 15.091 1.00 14.33 H new ATOM 0 HB2 ALA A 145 -13.047 1.413 13.344 1.00 14.33 H new ATOM 0 HB3 ALA A 145 -11.798 0.650 14.357 1.00 14.33 H new