USER MOD reduce.3.24.130724 H: found=0, std=0, add=881, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 884 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 50 THR OG1 : rot 85:sc= 1.25 USER MOD Set 1.2: A 78 MET CE :methyl 139:sc= -0.873 (180deg=-3.25!) USER MOD Set 2.1: A 18 CYS SG : rot 140:sc= 1.07 USER MOD Set 2.2: A 73 TYR OH : rot 179:sc= 1.37 USER MOD Single : A 10 TYR OH : rot 165:sc= -0.0272 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 SER OG : rot 111:sc= 1.22 USER MOD Single : A 23 CYS SG : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 150:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot -84:sc= 0.077 USER MOD Single : A 35 CYS SG : rot 180:sc=0.000908 USER MOD Single : A 38 LYS NZ :NH3+ 164:sc= -0.247 (180deg=-0.671) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 CYS SG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot -54:sc= 1.08 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot -179:sc= 0.464 USER MOD Single : A 82 THR OG1 : rot 84:sc= 1.04 USER MOD Single : A 84 SER OG : rot -129:sc= 0.0699 USER MOD Single : A 88 THR OG1 : rot 80:sc= 1.21 USER MOD Single : A 93 ASN : amide:sc= -0.078 X(o=-0.078,f=0) USER MOD Single : A 116 MET CE :methyl 165:sc= -3.02 (180deg=-4.85!) USER MOD Single : A 121 CYS SG : rot 84:sc= 0.012 USER MOD Single : A 125 THR OG1 : rot 92:sc= 1.28 USER MOD ----------------------------------------------------------------- ATOM 64 N LEU A 8 -7.135 -7.417 -2.832 1.00 12.12 N ATOM 65 CA LEU A 8 -8.103 -8.337 -2.244 1.00 0.42 C ATOM 66 C LEU A 8 -7.490 -9.719 -2.046 1.00 24.03 C ATOM 67 O LEU A 8 -7.823 -10.427 -1.095 1.00 62.23 O ATOM 68 CB LEU A 8 -9.344 -8.439 -3.132 1.00 62.24 C ATOM 69 CG LEU A 8 -10.656 -8.767 -2.418 1.00 44.12 C ATOM 70 CD1 LEU A 8 -10.603 -10.164 -1.820 1.00 21.11 C ATOM 71 CD2 LEU A 8 -10.948 -7.734 -1.340 1.00 55.31 C ATOM 0 HA LEU A 8 -8.393 -7.946 -1.269 1.00 0.42 H new ATOM 0 HB2 LEU A 8 -9.467 -7.493 -3.659 1.00 62.24 H new ATOM 0 HB3 LEU A 8 -9.164 -9.204 -3.887 1.00 62.24 H new ATOM 0 HG LEU A 8 -11.463 -8.738 -3.150 1.00 44.12 H new ATOM 0 HD11 LEU A 8 -11.545 -10.380 -1.316 1.00 21.11 H new ATOM 0 HD12 LEU A 8 -10.440 -10.893 -2.613 1.00 21.11 H new ATOM 0 HD13 LEU A 8 -9.786 -10.221 -1.101 1.00 21.11 H new ATOM 0 HD21 LEU A 8 -11.885 -7.983 -0.842 1.00 55.31 H new ATOM 0 HD22 LEU A 8 -10.139 -7.731 -0.610 1.00 55.31 H new ATOM 0 HD23 LEU A 8 -11.030 -6.747 -1.795 1.00 55.31 H new ATOM 83 N PHE A 9 -6.590 -10.096 -2.948 1.00 70.31 N ATOM 84 CA PHE A 9 -5.929 -11.394 -2.872 1.00 44.31 C ATOM 85 C PHE A 9 -5.329 -11.618 -1.487 1.00 61.21 C ATOM 86 O PHE A 9 -5.263 -12.748 -1.003 1.00 33.23 O ATOM 87 CB PHE A 9 -4.834 -11.495 -3.937 1.00 32.24 C ATOM 88 CG PHE A 9 -3.620 -12.251 -3.478 1.00 71.20 C ATOM 89 CD1 PHE A 9 -3.659 -13.628 -3.332 1.00 73.44 C ATOM 90 CD2 PHE A 9 -2.440 -11.584 -3.192 1.00 63.30 C ATOM 91 CE1 PHE A 9 -2.544 -14.327 -2.911 1.00 23.31 C ATOM 92 CE2 PHE A 9 -1.321 -12.278 -2.771 1.00 1.33 C ATOM 93 CZ PHE A 9 -1.373 -13.651 -2.629 1.00 12.33 C ATOM 0 H PHE A 9 -6.302 -9.521 -3.740 1.00 70.31 H new ATOM 0 HA PHE A 9 -6.676 -12.166 -3.054 1.00 44.31 H new ATOM 0 HB2 PHE A 9 -5.243 -11.983 -4.822 1.00 32.24 H new ATOM 0 HB3 PHE A 9 -4.535 -10.490 -4.236 1.00 32.24 H new ATOM 0 HD1 PHE A 9 -4.572 -14.162 -3.550 1.00 73.44 H new ATOM 0 HD2 PHE A 9 -2.394 -10.510 -3.299 1.00 63.30 H new ATOM 0 HE1 PHE A 9 -2.588 -15.401 -2.803 1.00 23.31 H new ATOM 0 HE2 PHE A 9 -0.406 -11.747 -2.553 1.00 1.33 H new ATOM 0 HZ PHE A 9 -0.500 -14.195 -2.298 1.00 12.33 H new ATOM 103 N TYR A 10 -4.892 -10.534 -0.856 1.00 31.34 N ATOM 104 CA TYR A 10 -4.295 -10.612 0.472 1.00 1.13 C ATOM 105 C TYR A 10 -5.368 -10.790 1.543 1.00 45.25 C ATOM 106 O TYR A 10 -5.150 -11.460 2.553 1.00 44.33 O ATOM 107 CB TYR A 10 -3.475 -9.353 0.760 1.00 13.12 C ATOM 108 CG TYR A 10 -2.631 -9.453 2.010 1.00 4.03 C ATOM 109 CD1 TYR A 10 -1.932 -10.616 2.309 1.00 3.11 C ATOM 110 CD2 TYR A 10 -2.531 -8.384 2.892 1.00 2.21 C ATOM 111 CE1 TYR A 10 -1.160 -10.712 3.451 1.00 45.25 C ATOM 112 CE2 TYR A 10 -1.760 -8.470 4.035 1.00 23.22 C ATOM 113 CZ TYR A 10 -1.076 -9.636 4.310 1.00 35.42 C ATOM 114 OH TYR A 10 -0.307 -9.727 5.447 1.00 32.55 O ATOM 0 H TYR A 10 -4.940 -9.591 -1.242 1.00 31.34 H new ATOM 0 HA TYR A 10 -3.636 -11.480 0.496 1.00 1.13 H new ATOM 0 HB2 TYR A 10 -2.826 -9.150 -0.091 1.00 13.12 H new ATOM 0 HB3 TYR A 10 -4.151 -8.503 0.855 1.00 13.12 H new ATOM 0 HD1 TYR A 10 -1.993 -11.459 1.637 1.00 3.11 H new ATOM 0 HD2 TYR A 10 -3.065 -7.470 2.680 1.00 2.21 H new ATOM 0 HE1 TYR A 10 -0.625 -11.624 3.670 1.00 45.25 H new ATOM 0 HE2 TYR A 10 -1.693 -7.629 4.709 1.00 23.22 H new ATOM 0 HH TYR A 10 -0.158 -8.831 5.814 1.00 32.55 H new ATOM 124 N THR A 11 -6.529 -10.185 1.313 1.00 11.14 N ATOM 125 CA THR A 11 -7.637 -10.275 2.256 1.00 3.32 C ATOM 126 C THR A 11 -8.177 -11.698 2.335 1.00 14.23 C ATOM 127 O THR A 11 -8.654 -12.133 3.384 1.00 61.21 O ATOM 128 CB THR A 11 -8.784 -9.323 1.868 1.00 43.22 C ATOM 129 OG1 THR A 11 -8.519 -8.007 2.368 1.00 33.42 O ATOM 130 CG2 THR A 11 -10.111 -9.823 2.417 1.00 13.54 C ATOM 0 H THR A 11 -6.726 -9.627 0.482 1.00 11.14 H new ATOM 0 HA THR A 11 -7.247 -9.983 3.231 1.00 3.32 H new ATOM 0 HB THR A 11 -8.848 -9.291 0.780 1.00 43.22 H new ATOM 0 HG1 THR A 11 -9.252 -7.407 2.116 1.00 33.42 H new ATOM 0 HG21 THR A 11 -10.906 -9.135 2.130 1.00 13.54 H new ATOM 0 HG22 THR A 11 -10.323 -10.812 2.011 1.00 13.54 H new ATOM 0 HG23 THR A 11 -10.056 -9.881 3.504 1.00 13.54 H new ATOM 138 N ILE A 12 -8.100 -12.418 1.221 1.00 3.14 N ATOM 139 CA ILE A 12 -8.580 -13.793 1.166 1.00 30.03 C ATOM 140 C ILE A 12 -7.551 -14.758 1.744 1.00 65.43 C ATOM 141 O ILE A 12 -7.900 -15.822 2.253 1.00 23.32 O ATOM 142 CB ILE A 12 -8.911 -14.216 -0.277 1.00 72.30 C ATOM 143 CG1 ILE A 12 -9.779 -13.155 -0.957 1.00 4.23 C ATOM 144 CG2 ILE A 12 -9.613 -15.566 -0.285 1.00 63.23 C ATOM 145 CD1 ILE A 12 -11.137 -12.982 -0.313 1.00 43.33 C ATOM 0 H ILE A 12 -7.710 -12.072 0.344 1.00 3.14 H new ATOM 0 HA ILE A 12 -9.489 -13.834 1.765 1.00 30.03 H new ATOM 0 HB ILE A 12 -7.979 -14.309 -0.835 1.00 72.30 H new ATOM 0 HG12 ILE A 12 -9.253 -12.201 -0.939 1.00 4.23 H new ATOM 0 HG13 ILE A 12 -9.914 -13.424 -2.004 1.00 4.23 H new ATOM 0 HG21 ILE A 12 -9.841 -15.852 -1.312 1.00 63.23 H new ATOM 0 HG22 ILE A 12 -8.963 -16.317 0.165 1.00 63.23 H new ATOM 0 HG23 ILE A 12 -10.539 -15.498 0.286 1.00 63.23 H new ATOM 0 HD11 ILE A 12 -11.698 -12.214 -0.847 1.00 43.33 H new ATOM 0 HD12 ILE A 12 -11.682 -13.925 -0.355 1.00 43.33 H new ATOM 0 HD13 ILE A 12 -11.011 -12.682 0.727 1.00 43.33 H new ATOM 157 N ASN A 13 -6.280 -14.378 1.662 1.00 64.34 N ATOM 158 CA ASN A 13 -5.198 -15.210 2.177 1.00 12.02 C ATOM 159 C ASN A 13 -5.030 -15.013 3.681 1.00 42.33 C ATOM 160 O ASN A 13 -4.409 -15.832 4.360 1.00 41.42 O ATOM 161 CB ASN A 13 -3.888 -14.882 1.459 1.00 62.44 C ATOM 162 CG ASN A 13 -2.927 -16.056 1.444 1.00 12.25 C ATOM 163 OD1 ASN A 13 -1.937 -16.071 2.176 1.00 50.41 O ATOM 164 ND2 ASN A 13 -3.216 -17.047 0.609 1.00 12.20 N ATOM 0 H ASN A 13 -5.974 -13.499 1.244 1.00 64.34 H new ATOM 0 HA ASN A 13 -5.455 -16.253 1.991 1.00 12.02 H new ATOM 0 HB2 ASN A 13 -4.104 -14.580 0.434 1.00 62.44 H new ATOM 0 HB3 ASN A 13 -3.412 -14.032 1.948 1.00 62.44 H new ATOM 0 HD21 ASN A 13 -2.607 -17.863 0.556 1.00 12.20 H new ATOM 0 HD22 ASN A 13 -4.047 -16.992 0.021 1.00 12.20 H new ATOM 171 N LEU A 14 -5.587 -13.922 4.195 1.00 50.24 N ATOM 172 CA LEU A 14 -5.500 -13.616 5.618 1.00 22.34 C ATOM 173 C LEU A 14 -6.703 -14.176 6.370 1.00 30.33 C ATOM 174 O LEU A 14 -6.606 -14.520 7.549 1.00 41.23 O ATOM 175 CB LEU A 14 -5.410 -12.104 5.831 1.00 24.21 C ATOM 176 CG LEU A 14 -4.085 -11.449 5.440 1.00 64.15 C ATOM 177 CD1 LEU A 14 -4.201 -9.934 5.495 1.00 13.12 C ATOM 178 CD2 LEU A 14 -2.962 -11.933 6.346 1.00 70.12 C ATOM 0 H LEU A 14 -6.104 -13.234 3.647 1.00 50.24 H new ATOM 0 HA LEU A 14 -4.598 -14.086 6.010 1.00 22.34 H new ATOM 0 HB2 LEU A 14 -6.209 -11.629 5.262 1.00 24.21 H new ATOM 0 HB3 LEU A 14 -5.600 -11.894 6.884 1.00 24.21 H new ATOM 0 HG LEU A 14 -3.848 -11.738 4.416 1.00 64.15 H new ATOM 0 HD11 LEU A 14 -3.248 -9.486 5.214 1.00 13.12 H new ATOM 0 HD12 LEU A 14 -4.976 -9.603 4.804 1.00 13.12 H new ATOM 0 HD13 LEU A 14 -4.462 -9.626 6.507 1.00 13.12 H new ATOM 0 HD21 LEU A 14 -2.027 -11.456 6.053 1.00 70.12 H new ATOM 0 HD22 LEU A 14 -3.192 -11.675 7.380 1.00 70.12 H new ATOM 0 HD23 LEU A 14 -2.862 -13.015 6.255 1.00 70.12 H new ATOM 190 N ILE A 15 -7.835 -14.267 5.681 1.00 71.04 N ATOM 191 CA ILE A 15 -9.056 -14.788 6.282 1.00 21.55 C ATOM 192 C ILE A 15 -9.016 -16.310 6.377 1.00 2.11 C ATOM 193 O ILE A 15 -9.558 -16.898 7.313 1.00 31.12 O ATOM 194 CB ILE A 15 -10.302 -14.368 5.482 1.00 55.12 C ATOM 195 CG1 ILE A 15 -11.575 -14.799 6.214 1.00 51.41 C ATOM 196 CG2 ILE A 15 -10.261 -14.967 4.084 1.00 42.43 C ATOM 197 CD1 ILE A 15 -11.863 -13.984 7.456 1.00 62.22 C ATOM 0 H ILE A 15 -7.932 -13.986 4.705 1.00 71.04 H new ATOM 0 HA ILE A 15 -9.119 -14.365 7.284 1.00 21.55 H new ATOM 0 HB ILE A 15 -10.307 -13.282 5.391 1.00 55.12 H new ATOM 0 HG12 ILE A 15 -12.422 -14.719 5.532 1.00 51.41 H new ATOM 0 HG13 ILE A 15 -11.487 -15.850 6.491 1.00 51.41 H new ATOM 0 HG21 ILE A 15 -11.149 -14.661 3.531 1.00 42.43 H new ATOM 0 HG22 ILE A 15 -9.370 -14.616 3.564 1.00 42.43 H new ATOM 0 HG23 ILE A 15 -10.235 -16.054 4.155 1.00 42.43 H new ATOM 0 HD11 ILE A 15 -12.779 -14.345 7.923 1.00 62.22 H new ATOM 0 HD12 ILE A 15 -11.034 -14.084 8.157 1.00 62.22 H new ATOM 0 HD13 ILE A 15 -11.983 -12.935 7.183 1.00 62.22 H new ATOM 209 N ILE A 16 -8.369 -16.941 5.403 1.00 4.21 N ATOM 210 CA ILE A 16 -8.255 -18.394 5.378 1.00 11.24 C ATOM 211 C ILE A 16 -7.723 -18.926 6.704 1.00 24.33 C ATOM 212 O ILE A 16 -8.355 -19.744 7.372 1.00 33.43 O ATOM 213 CB ILE A 16 -7.332 -18.867 4.240 1.00 2.01 C ATOM 214 CG1 ILE A 16 -8.137 -19.081 2.957 1.00 61.33 C ATOM 215 CG2 ILE A 16 -6.611 -20.146 4.640 1.00 53.04 C ATOM 216 CD1 ILE A 16 -9.033 -20.299 3.002 1.00 64.54 C ATOM 0 H ILE A 16 -7.916 -16.469 4.621 1.00 4.21 H new ATOM 0 HA ILE A 16 -9.258 -18.786 5.208 1.00 11.24 H new ATOM 0 HB ILE A 16 -6.585 -18.096 4.053 1.00 2.01 H new ATOM 0 HG12 ILE A 16 -8.747 -18.198 2.769 1.00 61.33 H new ATOM 0 HG13 ILE A 16 -7.449 -19.177 2.117 1.00 61.33 H new ATOM 0 HG21 ILE A 16 -5.962 -20.468 3.825 1.00 53.04 H new ATOM 0 HG22 ILE A 16 -6.011 -19.962 5.531 1.00 53.04 H new ATOM 0 HG23 ILE A 16 -7.343 -20.926 4.851 1.00 53.04 H new ATOM 0 HD11 ILE A 16 -9.573 -20.388 2.059 1.00 64.54 H new ATOM 0 HD12 ILE A 16 -8.427 -21.191 3.159 1.00 64.54 H new ATOM 0 HD13 ILE A 16 -9.746 -20.196 3.820 1.00 64.54 H new ATOM 228 N PRO A 17 -6.531 -18.451 7.097 1.00 34.03 N ATOM 229 CA PRO A 17 -5.888 -18.864 8.348 1.00 10.31 C ATOM 230 C PRO A 17 -6.616 -18.331 9.578 1.00 60.14 C ATOM 231 O PRO A 17 -6.585 -18.946 10.644 1.00 21.41 O ATOM 232 CB PRO A 17 -4.489 -18.250 8.247 1.00 15.30 C ATOM 233 CG PRO A 17 -4.653 -17.083 7.334 1.00 21.55 C ATOM 234 CD PRO A 17 -5.721 -17.474 6.351 1.00 52.21 C ATOM 0 HA PRO A 17 -5.886 -19.948 8.467 1.00 10.31 H new ATOM 0 HB2 PRO A 17 -4.121 -17.939 9.225 1.00 15.30 H new ATOM 0 HB3 PRO A 17 -3.770 -18.966 7.849 1.00 15.30 H new ATOM 0 HG2 PRO A 17 -4.941 -16.191 7.889 1.00 21.55 H new ATOM 0 HG3 PRO A 17 -3.718 -16.852 6.823 1.00 21.55 H new ATOM 0 HD2 PRO A 17 -6.315 -16.614 6.040 1.00 52.21 H new ATOM 0 HD3 PRO A 17 -5.295 -17.911 5.448 1.00 52.21 H new ATOM 242 N CYS A 18 -7.270 -17.186 9.422 1.00 52.41 N ATOM 243 CA CYS A 18 -8.006 -16.570 10.520 1.00 34.04 C ATOM 244 C CYS A 18 -9.013 -17.549 11.116 1.00 3.15 C ATOM 245 O CYS A 18 -9.279 -17.527 12.319 1.00 61.20 O ATOM 246 CB CYS A 18 -8.727 -15.311 10.037 1.00 44.43 C ATOM 247 SG CYS A 18 -8.360 -13.831 11.009 1.00 45.11 S ATOM 0 H CYS A 18 -7.306 -16.665 8.546 1.00 52.41 H new ATOM 0 HA CYS A 18 -7.290 -16.295 11.295 1.00 34.04 H new ATOM 0 HB2 CYS A 18 -8.456 -15.126 8.998 1.00 44.43 H new ATOM 0 HB3 CYS A 18 -9.802 -15.490 10.059 1.00 44.43 H new ATOM 0 HG CYS A 18 -8.235 -12.810 10.214 1.00 45.11 H new ATOM 253 N LEU A 19 -9.570 -18.406 10.268 1.00 15.51 N ATOM 254 CA LEU A 19 -10.550 -19.392 10.710 1.00 22.32 C ATOM 255 C LEU A 19 -9.859 -20.636 11.261 1.00 12.21 C ATOM 256 O LEU A 19 -10.200 -21.122 12.340 1.00 11.34 O ATOM 257 CB LEU A 19 -11.473 -19.778 9.553 1.00 43.01 C ATOM 258 CG LEU A 19 -11.996 -18.623 8.698 1.00 32.04 C ATOM 259 CD1 LEU A 19 -13.200 -19.066 7.882 1.00 33.20 C ATOM 260 CD2 LEU A 19 -12.353 -17.431 9.574 1.00 3.40 C ATOM 0 H LEU A 19 -9.360 -18.438 9.270 1.00 15.51 H new ATOM 0 HA LEU A 19 -11.145 -18.945 11.507 1.00 22.32 H new ATOM 0 HB2 LEU A 19 -10.938 -20.471 8.904 1.00 43.01 H new ATOM 0 HB3 LEU A 19 -12.328 -20.318 9.961 1.00 43.01 H new ATOM 0 HG LEU A 19 -11.208 -18.320 8.009 1.00 32.04 H new ATOM 0 HD11 LEU A 19 -13.559 -18.231 7.280 1.00 33.20 H new ATOM 0 HD12 LEU A 19 -12.913 -19.889 7.227 1.00 33.20 H new ATOM 0 HD13 LEU A 19 -13.993 -19.396 8.553 1.00 33.20 H new ATOM 0 HD21 LEU A 19 -12.723 -16.618 8.949 1.00 3.40 H new ATOM 0 HD22 LEU A 19 -13.125 -17.721 10.287 1.00 3.40 H new ATOM 0 HD23 LEU A 19 -11.467 -17.098 10.114 1.00 3.40 H new ATOM 272 N LEU A 20 -8.886 -21.145 10.514 1.00 22.33 N ATOM 273 CA LEU A 20 -8.145 -22.331 10.929 1.00 64.53 C ATOM 274 C LEU A 20 -7.605 -22.169 12.346 1.00 1.11 C ATOM 275 O LEU A 20 -7.635 -23.107 13.143 1.00 2.24 O ATOM 276 CB LEU A 20 -6.992 -22.601 9.960 1.00 71.23 C ATOM 277 CG LEU A 20 -6.460 -24.034 9.932 1.00 71.52 C ATOM 278 CD1 LEU A 20 -6.362 -24.540 8.501 1.00 44.53 C ATOM 279 CD2 LEU A 20 -5.106 -24.114 10.622 1.00 72.31 C ATOM 0 H LEU A 20 -8.592 -20.756 9.618 1.00 22.33 H new ATOM 0 HA LEU A 20 -8.830 -23.179 10.916 1.00 64.53 H new ATOM 0 HB2 LEU A 20 -7.320 -22.337 8.955 1.00 71.23 H new ATOM 0 HB3 LEU A 20 -6.168 -21.934 10.213 1.00 71.23 H new ATOM 0 HG LEU A 20 -7.159 -24.671 10.473 1.00 71.52 H new ATOM 0 HD11 LEU A 20 -5.981 -25.561 8.502 1.00 44.53 H new ATOM 0 HD12 LEU A 20 -7.349 -24.521 8.040 1.00 44.53 H new ATOM 0 HD13 LEU A 20 -5.685 -23.901 7.935 1.00 44.53 H new ATOM 0 HD21 LEU A 20 -4.743 -25.141 10.593 1.00 72.31 H new ATOM 0 HD22 LEU A 20 -4.397 -23.464 10.109 1.00 72.31 H new ATOM 0 HD23 LEU A 20 -5.207 -23.794 11.659 1.00 72.31 H new ATOM 291 N ILE A 21 -7.114 -20.973 12.653 1.00 13.21 N ATOM 292 CA ILE A 21 -6.571 -20.687 13.975 1.00 14.13 C ATOM 293 C ILE A 21 -7.686 -20.418 14.981 1.00 61.51 C ATOM 294 O ILE A 21 -7.546 -20.707 16.169 1.00 33.04 O ATOM 295 CB ILE A 21 -5.621 -19.475 13.944 1.00 71.43 C ATOM 296 CG1 ILE A 21 -6.388 -18.208 13.560 1.00 2.05 C ATOM 297 CG2 ILE A 21 -4.478 -19.724 12.971 1.00 71.12 C ATOM 298 CD1 ILE A 21 -5.508 -17.121 12.984 1.00 12.32 C ATOM 0 H ILE A 21 -7.081 -20.187 12.004 1.00 13.21 H new ATOM 0 HA ILE A 21 -6.011 -21.570 14.283 1.00 14.13 H new ATOM 0 HB ILE A 21 -5.201 -19.335 14.940 1.00 71.43 H new ATOM 0 HG12 ILE A 21 -7.157 -18.465 12.832 1.00 2.05 H new ATOM 0 HG13 ILE A 21 -6.900 -17.821 14.441 1.00 2.05 H new ATOM 0 HG21 ILE A 21 -3.815 -18.859 12.960 1.00 71.12 H new ATOM 0 HG22 ILE A 21 -3.919 -20.606 13.284 1.00 71.12 H new ATOM 0 HG23 ILE A 21 -4.880 -19.886 11.971 1.00 71.12 H new ATOM 0 HD11 ILE A 21 -6.118 -16.253 12.734 1.00 12.32 H new ATOM 0 HD12 ILE A 21 -4.754 -16.836 13.718 1.00 12.32 H new ATOM 0 HD13 ILE A 21 -5.016 -17.490 12.084 1.00 12.32 H new ATOM 310 N SER A 22 -8.793 -19.866 14.496 1.00 50.15 N ATOM 311 CA SER A 22 -9.932 -19.557 15.352 1.00 1.51 C ATOM 312 C SER A 22 -10.584 -20.834 15.872 1.00 64.31 C ATOM 313 O SER A 22 -10.821 -20.979 17.072 1.00 74.24 O ATOM 314 CB SER A 22 -10.960 -18.721 14.587 1.00 11.33 C ATOM 315 OG SER A 22 -10.593 -17.352 14.569 1.00 64.34 O ATOM 0 H SER A 22 -8.926 -19.623 13.514 1.00 50.15 H new ATOM 0 HA SER A 22 -9.569 -18.983 16.204 1.00 1.51 H new ATOM 0 HB2 SER A 22 -11.046 -19.091 13.565 1.00 11.33 H new ATOM 0 HB3 SER A 22 -11.941 -18.832 15.050 1.00 11.33 H new ATOM 0 HG SER A 22 -10.334 -17.095 13.659 1.00 64.34 H new ATOM 321 N CYS A 23 -10.870 -21.758 14.961 1.00 42.52 N ATOM 322 CA CYS A 23 -11.495 -23.024 15.326 1.00 40.13 C ATOM 323 C CYS A 23 -10.541 -23.885 16.147 1.00 3.41 C ATOM 324 O CYS A 23 -10.965 -24.637 17.025 1.00 15.22 O ATOM 325 CB CYS A 23 -11.932 -23.781 14.071 1.00 51.02 C ATOM 326 SG CYS A 23 -13.299 -23.004 13.178 1.00 11.34 S ATOM 0 H CYS A 23 -10.679 -21.654 13.964 1.00 42.52 H new ATOM 0 HA CYS A 23 -12.373 -22.805 15.934 1.00 40.13 H new ATOM 0 HB2 CYS A 23 -11.079 -23.872 13.399 1.00 51.02 H new ATOM 0 HB3 CYS A 23 -12.225 -24.792 14.353 1.00 51.02 H new ATOM 0 HG CYS A 23 -13.594 -23.717 12.132 1.00 11.34 H new ATOM 332 N LEU A 24 -9.250 -23.771 15.855 1.00 3.54 N ATOM 333 CA LEU A 24 -8.234 -24.540 16.566 1.00 41.40 C ATOM 334 C LEU A 24 -8.350 -24.333 18.073 1.00 44.12 C ATOM 335 O LEU A 24 -8.348 -25.293 18.845 1.00 53.35 O ATOM 336 CB LEU A 24 -6.837 -24.138 16.090 1.00 24.04 C ATOM 337 CG LEU A 24 -5.971 -25.264 15.523 1.00 14.02 C ATOM 338 CD1 LEU A 24 -5.572 -26.236 16.623 1.00 74.14 C ATOM 339 CD2 LEU A 24 -6.707 -25.991 14.407 1.00 63.12 C ATOM 0 H LEU A 24 -8.882 -23.154 15.131 1.00 3.54 H new ATOM 0 HA LEU A 24 -8.395 -25.596 16.350 1.00 41.40 H new ATOM 0 HB2 LEU A 24 -6.943 -23.368 15.326 1.00 24.04 H new ATOM 0 HB3 LEU A 24 -6.306 -23.685 16.927 1.00 24.04 H new ATOM 0 HG LEU A 24 -5.064 -24.826 15.108 1.00 14.02 H new ATOM 0 HD11 LEU A 24 -4.956 -27.030 16.201 1.00 74.14 H new ATOM 0 HD12 LEU A 24 -5.006 -25.706 17.389 1.00 74.14 H new ATOM 0 HD13 LEU A 24 -6.468 -26.669 17.068 1.00 74.14 H new ATOM 0 HD21 LEU A 24 -6.076 -26.789 14.015 1.00 63.12 H new ATOM 0 HD22 LEU A 24 -7.631 -26.417 14.798 1.00 63.12 H new ATOM 0 HD23 LEU A 24 -6.942 -25.288 13.608 1.00 63.12 H new ATOM 351 N THR A 25 -8.452 -23.073 18.486 1.00 24.53 N ATOM 352 CA THR A 25 -8.569 -22.740 19.900 1.00 31.42 C ATOM 353 C THR A 25 -9.842 -23.327 20.499 1.00 14.42 C ATOM 354 O THR A 25 -9.804 -23.995 21.532 1.00 20.13 O ATOM 355 CB THR A 25 -8.566 -21.216 20.120 1.00 15.23 C ATOM 356 OG1 THR A 25 -7.358 -20.648 19.603 1.00 60.32 O ATOM 357 CG2 THR A 25 -8.697 -20.882 21.599 1.00 62.32 C ATOM 0 H THR A 25 -8.456 -22.267 17.861 1.00 24.53 H new ATOM 0 HA THR A 25 -7.703 -23.173 20.400 1.00 31.42 H new ATOM 0 HB THR A 25 -9.420 -20.794 19.591 1.00 15.23 H new ATOM 0 HG1 THR A 25 -7.531 -19.732 19.300 1.00 60.32 H new ATOM 0 HG21 THR A 25 -8.692 -19.800 21.729 1.00 62.32 H new ATOM 0 HG22 THR A 25 -9.632 -21.290 21.983 1.00 62.32 H new ATOM 0 HG23 THR A 25 -7.860 -21.317 22.146 1.00 62.32 H new ATOM 365 N VAL A 26 -10.971 -23.073 19.844 1.00 43.32 N ATOM 366 CA VAL A 26 -12.256 -23.577 20.311 1.00 74.31 C ATOM 367 C VAL A 26 -12.256 -25.100 20.381 1.00 34.20 C ATOM 368 O VAL A 26 -12.934 -25.694 21.221 1.00 22.10 O ATOM 369 CB VAL A 26 -13.406 -23.116 19.396 1.00 73.43 C ATOM 370 CG1 VAL A 26 -14.740 -23.632 19.914 1.00 54.25 C ATOM 371 CG2 VAL A 26 -13.420 -21.600 19.281 1.00 42.44 C ATOM 0 H VAL A 26 -11.021 -22.521 18.988 1.00 43.32 H new ATOM 0 HA VAL A 26 -12.412 -23.170 21.310 1.00 74.31 H new ATOM 0 HB VAL A 26 -13.244 -23.531 18.401 1.00 73.43 H new ATOM 0 HG11 VAL A 26 -15.541 -23.296 19.255 1.00 54.25 H new ATOM 0 HG12 VAL A 26 -14.724 -24.722 19.939 1.00 54.25 H new ATOM 0 HG13 VAL A 26 -14.913 -23.248 20.919 1.00 54.25 H new ATOM 0 HG21 VAL A 26 -14.239 -21.292 18.631 1.00 42.44 H new ATOM 0 HG22 VAL A 26 -13.557 -21.161 20.269 1.00 42.44 H new ATOM 0 HG23 VAL A 26 -12.474 -21.258 18.860 1.00 42.44 H new ATOM 381 N LEU A 27 -11.492 -25.728 19.494 1.00 52.42 N ATOM 382 CA LEU A 27 -11.403 -27.183 19.455 1.00 61.24 C ATOM 383 C LEU A 27 -10.944 -27.737 20.800 1.00 74.12 C ATOM 384 O LEU A 27 -11.643 -28.535 21.425 1.00 11.44 O ATOM 385 CB LEU A 27 -10.438 -27.625 18.353 1.00 73.03 C ATOM 386 CG LEU A 27 -10.798 -28.921 17.626 1.00 70.32 C ATOM 387 CD1 LEU A 27 -11.041 -30.043 18.624 1.00 65.25 C ATOM 388 CD2 LEU A 27 -12.021 -28.716 16.743 1.00 23.34 C ATOM 0 H LEU A 27 -10.925 -25.252 18.792 1.00 52.42 H new ATOM 0 HA LEU A 27 -12.396 -27.577 19.240 1.00 61.24 H new ATOM 0 HB2 LEU A 27 -10.369 -26.825 17.616 1.00 73.03 H new ATOM 0 HB3 LEU A 27 -9.447 -27.741 18.791 1.00 73.03 H new ATOM 0 HG LEU A 27 -9.959 -29.203 16.990 1.00 70.32 H new ATOM 0 HD11 LEU A 27 -11.296 -30.957 18.088 1.00 65.25 H new ATOM 0 HD12 LEU A 27 -10.139 -30.207 19.214 1.00 65.25 H new ATOM 0 HD13 LEU A 27 -11.862 -29.769 19.286 1.00 65.25 H new ATOM 0 HD21 LEU A 27 -12.262 -29.649 16.233 1.00 23.34 H new ATOM 0 HD22 LEU A 27 -12.867 -28.409 17.358 1.00 23.34 H new ATOM 0 HD23 LEU A 27 -11.811 -27.943 16.004 1.00 23.34 H new ATOM 400 N VAL A 28 -9.766 -27.307 21.241 1.00 73.25 N ATOM 401 CA VAL A 28 -9.216 -27.757 22.513 1.00 24.43 C ATOM 402 C VAL A 28 -10.198 -27.514 23.654 1.00 63.23 C ATOM 403 O VAL A 28 -10.327 -28.335 24.562 1.00 63.40 O ATOM 404 CB VAL A 28 -7.888 -27.046 22.833 1.00 3.34 C ATOM 405 CG1 VAL A 28 -7.254 -27.635 24.084 1.00 64.20 C ATOM 406 CG2 VAL A 28 -6.936 -27.136 21.650 1.00 73.42 C ATOM 0 H VAL A 28 -9.175 -26.647 20.736 1.00 73.25 H new ATOM 0 HA VAL A 28 -9.033 -28.827 22.417 1.00 24.43 H new ATOM 0 HB VAL A 28 -8.097 -25.993 23.022 1.00 3.34 H new ATOM 0 HG11 VAL A 28 -6.317 -27.120 24.294 1.00 64.20 H new ATOM 0 HG12 VAL A 28 -7.933 -27.512 24.928 1.00 64.20 H new ATOM 0 HG13 VAL A 28 -7.058 -28.696 23.928 1.00 64.20 H new ATOM 0 HG21 VAL A 28 -6.003 -26.628 21.894 1.00 73.42 H new ATOM 0 HG22 VAL A 28 -6.731 -28.183 21.426 1.00 73.42 H new ATOM 0 HG23 VAL A 28 -7.390 -26.661 20.780 1.00 73.42 H new ATOM 416 N PHE A 29 -10.889 -26.381 23.600 1.00 11.43 N ATOM 417 CA PHE A 29 -11.860 -26.028 24.629 1.00 33.24 C ATOM 418 C PHE A 29 -12.971 -27.072 24.710 1.00 44.24 C ATOM 419 O PHE A 29 -13.552 -27.295 25.772 1.00 55.34 O ATOM 420 CB PHE A 29 -12.460 -24.650 24.344 1.00 51.11 C ATOM 421 CG PHE A 29 -11.677 -23.519 24.946 1.00 2.34 C ATOM 422 CD1 PHE A 29 -10.364 -23.288 24.567 1.00 33.22 C ATOM 423 CD2 PHE A 29 -12.253 -22.686 25.892 1.00 30.33 C ATOM 424 CE1 PHE A 29 -9.641 -22.248 25.119 1.00 2.03 C ATOM 425 CE2 PHE A 29 -11.535 -21.644 26.448 1.00 64.34 C ATOM 426 CZ PHE A 29 -10.227 -21.426 26.062 1.00 44.44 C ATOM 0 H PHE A 29 -10.795 -25.691 22.855 1.00 11.43 H new ATOM 0 HA PHE A 29 -11.341 -25.999 25.587 1.00 33.24 H new ATOM 0 HB2 PHE A 29 -12.521 -24.505 23.265 1.00 51.11 H new ATOM 0 HB3 PHE A 29 -13.480 -24.620 24.728 1.00 51.11 H new ATOM 0 HD1 PHE A 29 -9.900 -23.929 23.831 1.00 33.22 H new ATOM 0 HD2 PHE A 29 -13.275 -22.853 26.198 1.00 30.33 H new ATOM 0 HE1 PHE A 29 -8.619 -22.078 24.814 1.00 2.03 H new ATOM 0 HE2 PHE A 29 -11.996 -21.001 27.183 1.00 64.34 H new ATOM 0 HZ PHE A 29 -9.663 -20.614 26.497 1.00 44.44 H new ATOM 436 N TYR A 30 -13.259 -27.708 23.580 1.00 41.23 N ATOM 437 CA TYR A 30 -14.301 -28.726 23.520 1.00 12.32 C ATOM 438 C TYR A 30 -13.803 -30.050 24.091 1.00 42.10 C ATOM 439 O TYR A 30 -14.417 -30.622 24.992 1.00 13.23 O ATOM 440 CB TYR A 30 -14.769 -28.923 22.077 1.00 25.32 C ATOM 441 CG TYR A 30 -15.544 -30.203 21.862 1.00 71.23 C ATOM 442 CD1 TYR A 30 -16.887 -30.292 22.209 1.00 42.54 C ATOM 443 CD2 TYR A 30 -14.934 -31.324 21.312 1.00 35.34 C ATOM 444 CE1 TYR A 30 -17.599 -31.459 22.014 1.00 34.03 C ATOM 445 CE2 TYR A 30 -15.640 -32.495 21.113 1.00 24.32 C ATOM 446 CZ TYR A 30 -16.972 -32.558 21.466 1.00 44.11 C ATOM 447 OH TYR A 30 -17.677 -33.723 21.270 1.00 31.03 O ATOM 0 H TYR A 30 -12.785 -27.537 22.693 1.00 41.23 H new ATOM 0 HA TYR A 30 -15.142 -28.385 24.124 1.00 12.32 H new ATOM 0 HB2 TYR A 30 -15.393 -28.077 21.787 1.00 25.32 H new ATOM 0 HB3 TYR A 30 -13.901 -28.919 21.418 1.00 25.32 H new ATOM 0 HD1 TYR A 30 -17.382 -29.434 22.639 1.00 42.54 H new ATOM 0 HD2 TYR A 30 -13.891 -31.279 21.036 1.00 35.34 H new ATOM 0 HE1 TYR A 30 -18.642 -31.511 22.289 1.00 34.03 H new ATOM 0 HE2 TYR A 30 -15.151 -33.357 20.683 1.00 24.32 H new ATOM 0 HH TYR A 30 -17.088 -34.399 20.875 1.00 31.03 H new ATOM 457 N LEU A 31 -12.684 -30.532 23.560 1.00 13.52 N ATOM 458 CA LEU A 31 -12.101 -31.788 24.016 1.00 64.41 C ATOM 459 C LEU A 31 -10.703 -31.565 24.584 1.00 22.22 C ATOM 460 O LEU A 31 -9.698 -31.984 24.009 1.00 40.42 O ATOM 461 CB LEU A 31 -12.041 -32.793 22.864 1.00 62.01 C ATOM 462 CG LEU A 31 -11.600 -34.210 23.231 1.00 23.24 C ATOM 463 CD1 LEU A 31 -12.550 -34.817 24.252 1.00 71.44 C ATOM 464 CD2 LEU A 31 -11.520 -35.084 21.988 1.00 54.53 C ATOM 0 H LEU A 31 -12.163 -30.072 22.814 1.00 13.52 H new ATOM 0 HA LEU A 31 -12.735 -32.188 24.807 1.00 64.41 H new ATOM 0 HB2 LEU A 31 -13.028 -32.849 22.405 1.00 62.01 H new ATOM 0 HB3 LEU A 31 -11.359 -32.407 22.107 1.00 62.01 H new ATOM 0 HG LEU A 31 -10.607 -34.156 23.676 1.00 23.24 H new ATOM 0 HD11 LEU A 31 -12.220 -35.826 24.501 1.00 71.44 H new ATOM 0 HD12 LEU A 31 -12.556 -34.204 25.153 1.00 71.44 H new ATOM 0 HD13 LEU A 31 -13.556 -34.857 23.834 1.00 71.44 H new ATOM 0 HD21 LEU A 31 -11.205 -36.089 22.269 1.00 54.53 H new ATOM 0 HD22 LEU A 31 -12.500 -35.131 21.513 1.00 54.53 H new ATOM 0 HD23 LEU A 31 -10.798 -34.659 21.290 1.00 54.53 H new ATOM 476 N PRO A 32 -10.635 -30.892 25.742 1.00 11.22 N ATOM 477 CA PRO A 32 -9.366 -30.600 26.415 1.00 21.33 C ATOM 478 C PRO A 32 -8.715 -31.853 26.992 1.00 3.54 C ATOM 479 O PRO A 32 -9.400 -32.803 27.369 1.00 54.11 O ATOM 480 CB PRO A 32 -9.772 -29.643 27.538 1.00 1.34 C ATOM 481 CG PRO A 32 -11.203 -29.958 27.807 1.00 61.35 C ATOM 482 CD PRO A 32 -11.792 -30.364 26.484 1.00 54.31 C ATOM 0 HA PRO A 32 -8.627 -30.185 25.730 1.00 21.33 H new ATOM 0 HB2 PRO A 32 -9.160 -29.794 28.427 1.00 1.34 H new ATOM 0 HB3 PRO A 32 -9.646 -28.603 27.237 1.00 1.34 H new ATOM 0 HG2 PRO A 32 -11.295 -30.761 28.538 1.00 61.35 H new ATOM 0 HG3 PRO A 32 -11.723 -29.092 28.217 1.00 61.35 H new ATOM 0 HD2 PRO A 32 -12.570 -31.118 26.605 1.00 54.31 H new ATOM 0 HD3 PRO A 32 -12.246 -29.517 25.970 1.00 54.31 H new ATOM 490 N SER A 33 -7.387 -31.846 27.059 1.00 32.43 N ATOM 491 CA SER A 33 -6.643 -32.984 27.588 1.00 53.31 C ATOM 492 C SER A 33 -6.082 -32.670 28.972 1.00 74.33 C ATOM 493 O SER A 33 -6.351 -33.384 29.938 1.00 42.25 O ATOM 494 CB SER A 33 -5.506 -33.362 26.638 1.00 45.03 C ATOM 495 OG SER A 33 -4.951 -34.620 26.981 1.00 33.20 O ATOM 0 H SER A 33 -6.805 -31.066 26.754 1.00 32.43 H new ATOM 0 HA SER A 33 -7.329 -33.827 27.676 1.00 53.31 H new ATOM 0 HB2 SER A 33 -5.879 -33.393 25.614 1.00 45.03 H new ATOM 0 HB3 SER A 33 -4.730 -32.597 26.672 1.00 45.03 H new ATOM 0 HG SER A 33 -4.279 -34.500 27.684 1.00 33.20 H new ATOM 501 N GLU A 34 -5.302 -31.598 29.058 1.00 40.50 N ATOM 502 CA GLU A 34 -4.702 -31.190 30.323 1.00 15.41 C ATOM 503 C GLU A 34 -5.532 -30.097 30.991 1.00 51.21 C ATOM 504 O GLU A 34 -6.574 -29.690 30.474 1.00 25.23 O ATOM 505 CB GLU A 34 -3.272 -30.694 30.099 1.00 72.31 C ATOM 506 CG GLU A 34 -2.210 -31.644 30.626 1.00 64.13 C ATOM 507 CD GLU A 34 -2.078 -32.898 29.783 1.00 13.11 C ATOM 508 OE1 GLU A 34 -3.050 -33.243 29.079 1.00 73.11 O ATOM 509 OE2 GLU A 34 -1.005 -33.534 29.828 1.00 44.21 O ATOM 0 H GLU A 34 -5.071 -30.996 28.268 1.00 40.50 H new ATOM 0 HA GLU A 34 -4.678 -32.059 30.981 1.00 15.41 H new ATOM 0 HB2 GLU A 34 -3.113 -30.540 29.032 1.00 72.31 H new ATOM 0 HB3 GLU A 34 -3.153 -29.724 30.582 1.00 72.31 H new ATOM 0 HG2 GLU A 34 -1.250 -31.129 30.657 1.00 64.13 H new ATOM 0 HG3 GLU A 34 -2.454 -31.924 31.651 1.00 64.13 H new ATOM 516 N CYS A 35 -5.063 -29.627 32.141 1.00 14.44 N ATOM 517 CA CYS A 35 -5.762 -28.582 32.882 1.00 41.32 C ATOM 518 C CYS A 35 -5.193 -27.206 32.548 1.00 34.33 C ATOM 519 O CYS A 35 -5.922 -26.216 32.503 1.00 73.33 O ATOM 520 CB CYS A 35 -5.660 -28.838 34.386 1.00 64.30 C ATOM 521 SG CYS A 35 -5.601 -30.589 34.834 1.00 70.01 S ATOM 0 H CYS A 35 -4.202 -29.952 32.581 1.00 14.44 H new ATOM 0 HA CYS A 35 -6.811 -28.603 32.588 1.00 41.32 H new ATOM 0 HB2 CYS A 35 -4.765 -28.346 34.768 1.00 64.30 H new ATOM 0 HB3 CYS A 35 -6.514 -28.376 34.881 1.00 64.30 H new ATOM 0 HG CYS A 35 -5.513 -30.704 36.126 1.00 70.01 H new ATOM 527 N GLY A 36 -3.885 -27.152 32.317 1.00 30.42 N ATOM 528 CA GLY A 36 -3.240 -25.893 31.993 1.00 73.42 C ATOM 529 C GLY A 36 -2.832 -25.810 30.535 1.00 13.44 C ATOM 530 O GLY A 36 -2.189 -24.847 30.119 1.00 10.33 O ATOM 0 H GLY A 36 -3.260 -27.958 32.348 1.00 30.42 H new ATOM 0 HA2 GLY A 36 -3.917 -25.071 32.225 1.00 73.42 H new ATOM 0 HA3 GLY A 36 -2.359 -25.767 32.622 1.00 73.42 H new ATOM 534 N GLU A 37 -3.206 -26.822 29.759 1.00 42.34 N ATOM 535 CA GLU A 37 -2.872 -26.858 28.340 1.00 63.53 C ATOM 536 C GLU A 37 -3.472 -25.661 27.608 1.00 33.51 C ATOM 537 O GLU A 37 -2.897 -25.155 26.645 1.00 44.11 O ATOM 538 CB GLU A 37 -3.372 -28.159 27.709 1.00 72.43 C ATOM 539 CG GLU A 37 -3.529 -28.083 26.199 1.00 0.13 C ATOM 540 CD GLU A 37 -3.467 -29.445 25.536 1.00 23.24 C ATOM 541 OE1 GLU A 37 -2.651 -30.282 25.977 1.00 1.02 O ATOM 542 OE2 GLU A 37 -4.233 -29.675 24.577 1.00 3.35 O ATOM 0 H GLU A 37 -3.740 -27.627 30.088 1.00 42.34 H new ATOM 0 HA GLU A 37 -1.787 -26.811 28.247 1.00 63.53 H new ATOM 0 HB2 GLU A 37 -2.677 -28.962 27.953 1.00 72.43 H new ATOM 0 HB3 GLU A 37 -4.332 -28.423 28.153 1.00 72.43 H new ATOM 0 HG2 GLU A 37 -4.481 -27.610 25.960 1.00 0.13 H new ATOM 0 HG3 GLU A 37 -2.745 -27.447 25.788 1.00 0.13 H new ATOM 549 N LYS A 38 -4.634 -25.214 28.072 1.00 33.32 N ATOM 550 CA LYS A 38 -5.315 -24.077 27.464 1.00 3.14 C ATOM 551 C LYS A 38 -4.526 -22.790 27.685 1.00 53.11 C ATOM 552 O LYS A 38 -4.343 -21.998 26.760 1.00 2.53 O ATOM 553 CB LYS A 38 -6.724 -23.930 28.044 1.00 65.13 C ATOM 554 CG LYS A 38 -7.820 -24.392 27.100 1.00 34.32 C ATOM 555 CD LYS A 38 -7.648 -25.853 26.718 1.00 51.34 C ATOM 556 CE LYS A 38 -7.782 -26.765 27.927 1.00 22.31 C ATOM 557 NZ LYS A 38 -9.047 -26.517 28.672 1.00 73.32 N ATOM 0 H LYS A 38 -5.124 -25.622 28.868 1.00 33.32 H new ATOM 0 HA LYS A 38 -5.388 -24.259 26.392 1.00 3.14 H new ATOM 0 HB2 LYS A 38 -6.788 -24.502 28.970 1.00 65.13 H new ATOM 0 HB3 LYS A 38 -6.895 -22.885 28.302 1.00 65.13 H new ATOM 0 HG2 LYS A 38 -8.792 -24.251 27.573 1.00 34.32 H new ATOM 0 HG3 LYS A 38 -7.810 -23.776 26.201 1.00 34.32 H new ATOM 0 HD2 LYS A 38 -8.394 -26.125 25.971 1.00 51.34 H new ATOM 0 HD3 LYS A 38 -6.670 -25.997 26.259 1.00 51.34 H new ATOM 0 HE2 LYS A 38 -7.750 -27.805 27.603 1.00 22.31 H new ATOM 0 HE3 LYS A 38 -6.933 -26.612 28.593 1.00 22.31 H new ATOM 0 HZ1 LYS A 38 -9.236 -27.315 29.311 1.00 73.32 H new ATOM 0 HZ2 LYS A 38 -8.957 -25.642 29.228 1.00 73.32 H new ATOM 0 HZ3 LYS A 38 -9.833 -26.420 27.998 1.00 73.32 H new ATOM 571 N ILE A 39 -4.062 -22.589 28.913 1.00 23.24 N ATOM 572 CA ILE A 39 -3.291 -21.400 29.253 1.00 0.43 C ATOM 573 C ILE A 39 -2.074 -21.255 28.345 1.00 14.13 C ATOM 574 O ILE A 39 -1.856 -20.203 27.743 1.00 11.02 O ATOM 575 CB ILE A 39 -2.822 -21.433 30.720 1.00 41.32 C ATOM 576 CG1 ILE A 39 -3.986 -21.107 31.658 1.00 71.41 C ATOM 577 CG2 ILE A 39 -1.675 -20.455 30.931 1.00 33.43 C ATOM 578 CD1 ILE A 39 -4.618 -22.331 32.284 1.00 25.02 C ATOM 0 H ILE A 39 -4.207 -23.234 29.690 1.00 23.24 H new ATOM 0 HA ILE A 39 -3.952 -20.545 29.110 1.00 0.43 H new ATOM 0 HB ILE A 39 -2.465 -22.437 30.950 1.00 41.32 H new ATOM 0 HG12 ILE A 39 -3.631 -20.447 32.449 1.00 71.41 H new ATOM 0 HG13 ILE A 39 -4.747 -20.559 31.103 1.00 71.41 H new ATOM 0 HG21 ILE A 39 -1.354 -20.489 31.972 1.00 33.43 H new ATOM 0 HG22 ILE A 39 -0.841 -20.728 30.285 1.00 33.43 H new ATOM 0 HG23 ILE A 39 -2.008 -19.446 30.687 1.00 33.43 H new ATOM 0 HD11 ILE A 39 -5.436 -22.025 32.937 1.00 25.02 H new ATOM 0 HD12 ILE A 39 -5.004 -22.983 31.500 1.00 25.02 H new ATOM 0 HD13 ILE A 39 -3.870 -22.869 32.867 1.00 25.02 H new ATOM 590 N THR A 40 -1.284 -22.320 28.249 1.00 11.35 N ATOM 591 CA THR A 40 -0.090 -22.312 27.415 1.00 64.35 C ATOM 592 C THR A 40 -0.440 -22.037 25.957 1.00 64.34 C ATOM 593 O THR A 40 0.158 -21.171 25.317 1.00 52.32 O ATOM 594 CB THR A 40 0.668 -23.651 27.505 1.00 15.43 C ATOM 595 OG1 THR A 40 0.881 -24.001 28.877 1.00 11.33 O ATOM 596 CG2 THR A 40 2.004 -23.566 26.784 1.00 4.05 C ATOM 0 H THR A 40 -1.450 -23.199 28.739 1.00 11.35 H new ATOM 0 HA THR A 40 0.551 -21.514 27.789 1.00 64.35 H new ATOM 0 HB THR A 40 0.063 -24.420 27.024 1.00 15.43 H new ATOM 0 HG1 THR A 40 1.362 -24.854 28.926 1.00 11.33 H new ATOM 0 HG21 THR A 40 2.521 -24.523 26.861 1.00 4.05 H new ATOM 0 HG22 THR A 40 1.836 -23.328 25.734 1.00 4.05 H new ATOM 0 HG23 THR A 40 2.614 -22.786 27.240 1.00 4.05 H new ATOM 604 N LEU A 41 -1.411 -22.779 25.436 1.00 30.13 N ATOM 605 CA LEU A 41 -1.842 -22.614 24.052 1.00 23.52 C ATOM 606 C LEU A 41 -2.316 -21.188 23.796 1.00 52.34 C ATOM 607 O LEU A 41 -2.039 -20.611 22.743 1.00 14.33 O ATOM 608 CB LEU A 41 -2.962 -23.603 23.725 1.00 61.31 C ATOM 609 CG LEU A 41 -3.371 -23.691 22.254 1.00 34.03 C ATOM 610 CD1 LEU A 41 -2.188 -24.107 21.395 1.00 42.24 C ATOM 611 CD2 LEU A 41 -4.528 -24.665 22.080 1.00 42.32 C ATOM 0 H LEU A 41 -1.915 -23.501 25.951 1.00 30.13 H new ATOM 0 HA LEU A 41 -0.988 -22.815 23.405 1.00 23.52 H new ATOM 0 HB2 LEU A 41 -2.652 -24.594 24.055 1.00 61.31 H new ATOM 0 HB3 LEU A 41 -3.841 -23.332 24.310 1.00 61.31 H new ATOM 0 HG LEU A 41 -3.700 -22.704 21.928 1.00 34.03 H new ATOM 0 HD11 LEU A 41 -2.498 -24.164 20.352 1.00 42.24 H new ATOM 0 HD12 LEU A 41 -1.389 -23.373 21.496 1.00 42.24 H new ATOM 0 HD13 LEU A 41 -1.827 -25.083 21.720 1.00 42.24 H new ATOM 0 HD21 LEU A 41 -4.806 -24.715 21.027 1.00 42.32 H new ATOM 0 HD22 LEU A 41 -4.225 -25.654 22.423 1.00 42.32 H new ATOM 0 HD23 LEU A 41 -5.382 -24.324 22.665 1.00 42.32 H new ATOM 623 N CYS A 42 -3.030 -20.624 24.764 1.00 62.21 N ATOM 624 CA CYS A 42 -3.542 -19.264 24.644 1.00 43.43 C ATOM 625 C CYS A 42 -2.415 -18.284 24.332 1.00 24.24 C ATOM 626 O CYS A 42 -2.571 -17.386 23.505 1.00 1.52 O ATOM 627 CB CYS A 42 -4.253 -18.848 25.932 1.00 31.42 C ATOM 628 SG CYS A 42 -4.699 -17.097 25.998 1.00 73.42 S ATOM 0 H CYS A 42 -3.267 -21.088 25.641 1.00 62.21 H new ATOM 0 HA CYS A 42 -4.256 -19.243 23.821 1.00 43.43 H new ATOM 0 HB2 CYS A 42 -5.157 -19.446 26.045 1.00 31.42 H new ATOM 0 HB3 CYS A 42 -3.609 -19.080 26.781 1.00 31.42 H new ATOM 0 HG CYS A 42 -5.297 -16.844 27.124 1.00 73.42 H new ATOM 634 N ILE A 43 -1.281 -18.463 25.001 1.00 23.44 N ATOM 635 CA ILE A 43 -0.128 -17.595 24.796 1.00 30.03 C ATOM 636 C ILE A 43 0.458 -17.779 23.400 1.00 34.35 C ATOM 637 O ILE A 43 0.922 -16.823 22.780 1.00 73.03 O ATOM 638 CB ILE A 43 0.971 -17.862 25.841 1.00 22.44 C ATOM 639 CG1 ILE A 43 0.636 -17.158 27.158 1.00 42.14 C ATOM 640 CG2 ILE A 43 2.323 -17.403 25.317 1.00 4.53 C ATOM 641 CD1 ILE A 43 1.508 -17.593 28.315 1.00 75.41 C ATOM 0 H ILE A 43 -1.136 -19.201 25.690 1.00 23.44 H new ATOM 0 HA ILE A 43 -0.482 -16.570 24.907 1.00 30.03 H new ATOM 0 HB ILE A 43 1.021 -18.935 26.028 1.00 22.44 H new ATOM 0 HG12 ILE A 43 0.738 -16.081 27.021 1.00 42.14 H new ATOM 0 HG13 ILE A 43 -0.407 -17.350 27.408 1.00 42.14 H new ATOM 0 HG21 ILE A 43 3.089 -17.598 26.067 1.00 4.53 H new ATOM 0 HG22 ILE A 43 2.563 -17.947 24.403 1.00 4.53 H new ATOM 0 HG23 ILE A 43 2.287 -16.334 25.105 1.00 4.53 H new ATOM 0 HD11 ILE A 43 1.214 -17.053 29.215 1.00 75.41 H new ATOM 0 HD12 ILE A 43 1.388 -18.664 28.479 1.00 75.41 H new ATOM 0 HD13 ILE A 43 2.551 -17.376 28.086 1.00 75.41 H new ATOM 653 N SER A 44 0.431 -19.015 22.912 1.00 71.12 N ATOM 654 CA SER A 44 0.961 -19.326 21.589 1.00 11.23 C ATOM 655 C SER A 44 0.080 -18.727 20.497 1.00 62.23 C ATOM 656 O SER A 44 0.563 -18.020 19.612 1.00 71.42 O ATOM 657 CB SER A 44 1.067 -20.840 21.402 1.00 33.50 C ATOM 658 OG SER A 44 2.348 -21.313 21.780 1.00 1.23 O ATOM 0 H SER A 44 0.048 -19.817 23.412 1.00 71.12 H new ATOM 0 HA SER A 44 1.956 -18.887 21.510 1.00 11.23 H new ATOM 0 HB2 SER A 44 0.302 -21.337 21.998 1.00 33.50 H new ATOM 0 HB3 SER A 44 0.875 -21.095 20.360 1.00 33.50 H new ATOM 0 HG SER A 44 2.389 -22.284 21.653 1.00 1.23 H new ATOM 664 N VAL A 45 -1.216 -19.016 20.566 1.00 44.45 N ATOM 665 CA VAL A 45 -2.165 -18.506 19.584 1.00 54.12 C ATOM 666 C VAL A 45 -2.248 -16.985 19.637 1.00 1.53 C ATOM 667 O VAL A 45 -2.542 -16.332 18.635 1.00 70.02 O ATOM 668 CB VAL A 45 -3.572 -19.093 19.806 1.00 62.41 C ATOM 669 CG1 VAL A 45 -4.566 -18.485 18.828 1.00 5.44 C ATOM 670 CG2 VAL A 45 -3.542 -20.609 19.675 1.00 55.33 C ATOM 0 H VAL A 45 -1.632 -19.600 21.291 1.00 44.45 H new ATOM 0 HA VAL A 45 -1.801 -18.813 18.604 1.00 54.12 H new ATOM 0 HB VAL A 45 -3.896 -18.844 20.817 1.00 62.41 H new ATOM 0 HG11 VAL A 45 -5.554 -18.912 19.001 1.00 5.44 H new ATOM 0 HG12 VAL A 45 -4.607 -17.406 18.974 1.00 5.44 H new ATOM 0 HG13 VAL A 45 -4.251 -18.701 17.807 1.00 5.44 H new ATOM 0 HG21 VAL A 45 -4.544 -21.008 19.835 1.00 55.33 H new ATOM 0 HG22 VAL A 45 -3.198 -20.881 18.677 1.00 55.33 H new ATOM 0 HG23 VAL A 45 -2.863 -21.025 20.419 1.00 55.33 H new ATOM 680 N LEU A 46 -1.986 -16.425 20.813 1.00 11.51 N ATOM 681 CA LEU A 46 -2.030 -14.978 20.998 1.00 21.24 C ATOM 682 C LEU A 46 -0.793 -14.315 20.402 1.00 64.14 C ATOM 683 O LEU A 46 -0.867 -13.212 19.858 1.00 72.31 O ATOM 684 CB LEU A 46 -2.138 -14.638 22.486 1.00 44.22 C ATOM 685 CG LEU A 46 -2.131 -13.149 22.836 1.00 72.31 C ATOM 686 CD1 LEU A 46 -3.453 -12.504 22.448 1.00 24.11 C ATOM 687 CD2 LEU A 46 -1.854 -12.951 24.319 1.00 20.40 C ATOM 0 H LEU A 46 -1.741 -16.950 21.652 1.00 11.51 H new ATOM 0 HA LEU A 46 -2.909 -14.596 20.479 1.00 21.24 H new ATOM 0 HB2 LEU A 46 -3.057 -15.078 22.873 1.00 44.22 H new ATOM 0 HB3 LEU A 46 -1.311 -15.118 23.009 1.00 44.22 H new ATOM 0 HG LEU A 46 -1.334 -12.666 22.271 1.00 72.31 H new ATOM 0 HD11 LEU A 46 -3.430 -11.445 22.704 1.00 24.11 H new ATOM 0 HD12 LEU A 46 -3.611 -12.614 21.375 1.00 24.11 H new ATOM 0 HD13 LEU A 46 -4.267 -12.990 22.986 1.00 24.11 H new ATOM 0 HD21 LEU A 46 -1.853 -11.886 24.550 1.00 20.40 H new ATOM 0 HD22 LEU A 46 -2.628 -13.448 24.903 1.00 20.40 H new ATOM 0 HD23 LEU A 46 -0.882 -13.377 24.568 1.00 20.40 H new ATOM 699 N LEU A 47 0.344 -14.995 20.505 1.00 41.33 N ATOM 700 CA LEU A 47 1.598 -14.473 19.973 1.00 44.11 C ATOM 701 C LEU A 47 1.496 -14.237 18.469 1.00 1.35 C ATOM 702 O LEU A 47 1.767 -13.139 17.984 1.00 55.53 O ATOM 703 CB LEU A 47 2.744 -15.441 20.272 1.00 60.42 C ATOM 704 CG LEU A 47 3.970 -14.839 20.959 1.00 30.22 C ATOM 705 CD1 LEU A 47 4.437 -15.734 22.097 1.00 44.13 C ATOM 706 CD2 LEU A 47 5.092 -14.621 19.954 1.00 33.32 C ATOM 0 H LEU A 47 0.423 -15.909 20.952 1.00 41.33 H new ATOM 0 HA LEU A 47 1.800 -13.518 20.459 1.00 44.11 H new ATOM 0 HB2 LEU A 47 2.359 -16.245 20.899 1.00 60.42 H new ATOM 0 HB3 LEU A 47 3.064 -15.894 19.334 1.00 60.42 H new ATOM 0 HG LEU A 47 3.691 -13.871 21.376 1.00 30.22 H new ATOM 0 HD11 LEU A 47 5.310 -15.290 22.574 1.00 44.13 H new ATOM 0 HD12 LEU A 47 3.637 -15.838 22.830 1.00 44.13 H new ATOM 0 HD13 LEU A 47 4.699 -16.716 21.703 1.00 44.13 H new ATOM 0 HD21 LEU A 47 5.956 -14.192 20.461 1.00 33.32 H new ATOM 0 HD22 LEU A 47 5.370 -15.575 19.507 1.00 33.32 H new ATOM 0 HD23 LEU A 47 4.754 -13.939 19.173 1.00 33.32 H new ATOM 718 N SER A 48 1.102 -15.274 17.738 1.00 31.31 N ATOM 719 CA SER A 48 0.965 -15.180 16.289 1.00 30.44 C ATOM 720 C SER A 48 -0.061 -14.117 15.908 1.00 30.54 C ATOM 721 O SER A 48 0.115 -13.390 14.930 1.00 71.42 O ATOM 722 CB SER A 48 0.555 -16.534 15.706 1.00 53.21 C ATOM 723 OG SER A 48 1.684 -17.250 15.236 1.00 54.11 O ATOM 0 H SER A 48 0.872 -16.189 18.125 1.00 31.31 H new ATOM 0 HA SER A 48 1.931 -14.892 15.875 1.00 30.44 H new ATOM 0 HB2 SER A 48 0.040 -17.120 16.467 1.00 53.21 H new ATOM 0 HB3 SER A 48 -0.150 -16.383 14.888 1.00 53.21 H new ATOM 0 HG SER A 48 1.396 -18.112 14.870 1.00 54.11 H new ATOM 729 N LEU A 49 -1.133 -14.033 16.688 1.00 11.03 N ATOM 730 CA LEU A 49 -2.189 -13.059 16.434 1.00 32.12 C ATOM 731 C LEU A 49 -1.669 -11.635 16.602 1.00 22.23 C ATOM 732 O LEU A 49 -1.861 -10.785 15.732 1.00 13.15 O ATOM 733 CB LEU A 49 -3.368 -13.298 17.379 1.00 74.12 C ATOM 734 CG LEU A 49 -4.364 -14.377 16.950 1.00 24.13 C ATOM 735 CD1 LEU A 49 -5.258 -14.771 18.115 1.00 30.24 C ATOM 736 CD2 LEU A 49 -5.199 -13.895 15.773 1.00 11.04 C ATOM 0 H LEU A 49 -1.294 -14.627 17.501 1.00 11.03 H new ATOM 0 HA LEU A 49 -2.525 -13.184 15.405 1.00 32.12 H new ATOM 0 HB2 LEU A 49 -2.974 -13.565 18.359 1.00 74.12 H new ATOM 0 HB3 LEU A 49 -3.909 -12.359 17.498 1.00 74.12 H new ATOM 0 HG LEU A 49 -3.804 -15.257 16.635 1.00 24.13 H new ATOM 0 HD11 LEU A 49 -5.960 -15.539 17.791 1.00 30.24 H new ATOM 0 HD12 LEU A 49 -4.645 -15.159 18.929 1.00 30.24 H new ATOM 0 HD13 LEU A 49 -5.810 -13.898 18.461 1.00 30.24 H new ATOM 0 HD21 LEU A 49 -5.902 -14.676 15.482 1.00 11.04 H new ATOM 0 HD22 LEU A 49 -5.750 -12.999 16.060 1.00 11.04 H new ATOM 0 HD23 LEU A 49 -4.544 -13.664 14.933 1.00 11.04 H new ATOM 748 N THR A 50 -1.006 -11.382 17.726 1.00 1.45 N ATOM 749 CA THR A 50 -0.456 -10.062 18.009 1.00 53.45 C ATOM 750 C THR A 50 0.727 -9.753 17.099 1.00 25.01 C ATOM 751 O THR A 50 1.062 -8.590 16.871 1.00 31.34 O ATOM 752 CB THR A 50 -0.006 -9.943 19.477 1.00 41.53 C ATOM 753 OG1 THR A 50 -0.960 -10.578 20.335 1.00 61.11 O ATOM 754 CG2 THR A 50 0.152 -8.484 19.878 1.00 52.42 C ATOM 0 H THR A 50 -0.837 -12.074 18.456 1.00 1.45 H new ATOM 0 HA THR A 50 -1.252 -9.341 17.822 1.00 53.45 H new ATOM 0 HB THR A 50 0.960 -10.438 19.579 1.00 41.53 H new ATOM 0 HG1 THR A 50 -0.768 -11.538 20.384 1.00 61.11 H new ATOM 0 HG21 THR A 50 0.470 -8.425 20.919 1.00 52.42 H new ATOM 0 HG22 THR A 50 0.900 -8.011 19.242 1.00 52.42 H new ATOM 0 HG23 THR A 50 -0.802 -7.969 19.761 1.00 52.42 H new ATOM 762 N VAL A 51 1.358 -10.802 16.580 1.00 5.34 N ATOM 763 CA VAL A 51 2.505 -10.642 15.693 1.00 34.44 C ATOM 764 C VAL A 51 2.065 -10.201 14.302 1.00 64.33 C ATOM 765 O VAL A 51 2.644 -9.284 13.718 1.00 74.30 O ATOM 766 CB VAL A 51 3.309 -11.951 15.575 1.00 10.42 C ATOM 767 CG1 VAL A 51 4.025 -12.018 14.235 1.00 71.32 C ATOM 768 CG2 VAL A 51 4.298 -12.073 16.724 1.00 5.22 C ATOM 0 H VAL A 51 1.095 -11.771 16.758 1.00 5.34 H new ATOM 0 HA VAL A 51 3.141 -9.872 16.131 1.00 34.44 H new ATOM 0 HB VAL A 51 2.616 -12.790 15.632 1.00 10.42 H new ATOM 0 HG11 VAL A 51 4.588 -12.949 14.169 1.00 71.32 H new ATOM 0 HG12 VAL A 51 3.293 -11.979 13.429 1.00 71.32 H new ATOM 0 HG13 VAL A 51 4.709 -11.174 14.145 1.00 71.32 H new ATOM 0 HG21 VAL A 51 4.858 -13.003 16.625 1.00 5.22 H new ATOM 0 HG22 VAL A 51 4.989 -11.230 16.701 1.00 5.22 H new ATOM 0 HG23 VAL A 51 3.758 -12.073 17.671 1.00 5.22 H new ATOM 778 N PHE A 52 1.038 -10.860 13.775 1.00 43.20 N ATOM 779 CA PHE A 52 0.521 -10.536 12.451 1.00 72.03 C ATOM 780 C PHE A 52 -0.293 -9.246 12.485 1.00 2.52 C ATOM 781 O PHE A 52 -0.434 -8.560 11.472 1.00 40.31 O ATOM 782 CB PHE A 52 -0.344 -11.683 11.923 1.00 24.12 C ATOM 783 CG PHE A 52 -1.528 -11.222 11.123 1.00 71.11 C ATOM 784 CD1 PHE A 52 -1.369 -10.767 9.824 1.00 64.31 C ATOM 785 CD2 PHE A 52 -2.801 -11.243 11.670 1.00 60.21 C ATOM 786 CE1 PHE A 52 -2.457 -10.343 9.084 1.00 4.35 C ATOM 787 CE2 PHE A 52 -3.893 -10.820 10.935 1.00 24.32 C ATOM 788 CZ PHE A 52 -3.720 -10.368 9.641 1.00 31.45 C ATOM 0 H PHE A 52 0.548 -11.621 14.245 1.00 43.20 H new ATOM 0 HA PHE A 52 1.370 -10.392 11.783 1.00 72.03 H new ATOM 0 HB2 PHE A 52 0.271 -12.336 11.303 1.00 24.12 H new ATOM 0 HB3 PHE A 52 -0.695 -12.280 12.765 1.00 24.12 H new ATOM 0 HD1 PHE A 52 -0.383 -10.743 9.384 1.00 64.31 H new ATOM 0 HD2 PHE A 52 -2.942 -11.594 12.682 1.00 60.21 H new ATOM 0 HE1 PHE A 52 -2.319 -9.993 8.072 1.00 4.35 H new ATOM 0 HE2 PHE A 52 -4.880 -10.843 11.372 1.00 24.32 H new ATOM 0 HZ PHE A 52 -4.571 -10.035 9.066 1.00 31.45 H new ATOM 798 N LEU A 53 -0.826 -8.921 13.658 1.00 74.13 N ATOM 799 CA LEU A 53 -1.627 -7.713 13.826 1.00 61.20 C ATOM 800 C LEU A 53 -0.780 -6.464 13.606 1.00 52.23 C ATOM 801 O LEU A 53 -1.103 -5.622 12.766 1.00 22.12 O ATOM 802 CB LEU A 53 -2.250 -7.681 15.223 1.00 72.24 C ATOM 803 CG LEU A 53 -2.472 -6.294 15.827 1.00 74.23 C ATOM 804 CD1 LEU A 53 -3.394 -5.468 14.942 1.00 25.14 C ATOM 805 CD2 LEU A 53 -3.043 -6.410 17.233 1.00 63.12 C ATOM 0 H LEU A 53 -0.718 -9.477 14.506 1.00 74.13 H new ATOM 0 HA LEU A 53 -2.422 -7.727 13.080 1.00 61.20 H new ATOM 0 HB2 LEU A 53 -3.210 -8.196 15.183 1.00 72.24 H new ATOM 0 HB3 LEU A 53 -1.611 -8.251 15.897 1.00 72.24 H new ATOM 0 HG LEU A 53 -1.509 -5.787 15.888 1.00 74.23 H new ATOM 0 HD11 LEU A 53 -3.541 -4.484 15.388 1.00 25.14 H new ATOM 0 HD12 LEU A 53 -2.946 -5.356 13.954 1.00 25.14 H new ATOM 0 HD13 LEU A 53 -4.356 -5.971 14.849 1.00 25.14 H new ATOM 0 HD21 LEU A 53 -3.195 -5.413 17.648 1.00 63.12 H new ATOM 0 HD22 LEU A 53 -3.997 -6.937 17.196 1.00 63.12 H new ATOM 0 HD23 LEU A 53 -2.347 -6.963 17.864 1.00 63.12 H new ATOM 817 N LEU A 54 0.305 -6.350 14.363 1.00 22.02 N ATOM 818 CA LEU A 54 1.201 -5.204 14.250 1.00 72.15 C ATOM 819 C LEU A 54 1.754 -5.084 12.833 1.00 25.13 C ATOM 820 O LEU A 54 1.832 -3.988 12.276 1.00 31.22 O ATOM 821 CB LEU A 54 2.351 -5.330 15.250 1.00 1.31 C ATOM 822 CG LEU A 54 2.828 -4.026 15.891 1.00 22.13 C ATOM 823 CD1 LEU A 54 1.923 -3.639 17.051 1.00 64.22 C ATOM 824 CD2 LEU A 54 4.270 -4.158 16.359 1.00 63.41 C ATOM 0 H LEU A 54 0.586 -7.037 15.062 1.00 22.02 H new ATOM 0 HA LEU A 54 0.630 -4.303 14.475 1.00 72.15 H new ATOM 0 HB2 LEU A 54 2.043 -6.010 16.044 1.00 1.31 H new ATOM 0 HB3 LEU A 54 3.198 -5.794 14.743 1.00 1.31 H new ATOM 0 HG LEU A 54 2.781 -3.237 15.141 1.00 22.13 H new ATOM 0 HD11 LEU A 54 2.278 -2.709 17.495 1.00 64.22 H new ATOM 0 HD12 LEU A 54 0.904 -3.502 16.688 1.00 64.22 H new ATOM 0 HD13 LEU A 54 1.937 -4.428 17.803 1.00 64.22 H new ATOM 0 HD21 LEU A 54 4.593 -3.221 16.812 1.00 63.41 H new ATOM 0 HD22 LEU A 54 4.342 -4.960 17.093 1.00 63.41 H new ATOM 0 HD23 LEU A 54 4.910 -4.388 15.507 1.00 63.41 H new ATOM 836 N LEU A 55 2.136 -6.217 12.255 1.00 25.41 N ATOM 837 CA LEU A 55 2.681 -6.240 10.902 1.00 70.31 C ATOM 838 C LEU A 55 1.745 -5.534 9.926 1.00 1.03 C ATOM 839 O LEU A 55 2.194 -4.869 8.992 1.00 75.11 O ATOM 840 CB LEU A 55 2.914 -7.683 10.449 1.00 2.31 C ATOM 841 CG LEU A 55 4.335 -8.023 9.997 1.00 53.10 C ATOM 842 CD1 LEU A 55 4.410 -9.462 9.512 1.00 22.42 C ATOM 843 CD2 LEU A 55 4.790 -7.066 8.905 1.00 5.12 C ATOM 0 H LEU A 55 2.079 -7.132 12.702 1.00 25.41 H new ATOM 0 HA LEU A 55 3.634 -5.710 10.912 1.00 70.31 H new ATOM 0 HB2 LEU A 55 2.646 -8.348 11.270 1.00 2.31 H new ATOM 0 HB3 LEU A 55 2.231 -7.900 9.628 1.00 2.31 H new ATOM 0 HG LEU A 55 5.004 -7.913 10.851 1.00 53.10 H new ATOM 0 HD11 LEU A 55 5.428 -9.686 9.194 1.00 22.42 H new ATOM 0 HD12 LEU A 55 4.126 -10.134 10.322 1.00 22.42 H new ATOM 0 HD13 LEU A 55 3.729 -9.599 8.672 1.00 22.42 H new ATOM 0 HD21 LEU A 55 5.803 -7.323 8.595 1.00 5.12 H new ATOM 0 HD22 LEU A 55 4.118 -7.144 8.050 1.00 5.12 H new ATOM 0 HD23 LEU A 55 4.775 -6.045 9.286 1.00 5.12 H new ATOM 855 N ILE A 56 0.444 -5.681 10.151 1.00 32.12 N ATOM 856 CA ILE A 56 -0.555 -5.054 9.294 1.00 23.40 C ATOM 857 C ILE A 56 -0.632 -3.553 9.547 1.00 43.41 C ATOM 858 O ILE A 56 -0.957 -2.776 8.648 1.00 2.34 O ATOM 859 CB ILE A 56 -1.949 -5.672 9.509 1.00 10.05 C ATOM 860 CG1 ILE A 56 -1.988 -7.101 8.963 1.00 0.32 C ATOM 861 CG2 ILE A 56 -3.016 -4.816 8.844 1.00 12.54 C ATOM 862 CD1 ILE A 56 -1.772 -7.182 7.468 1.00 33.02 C ATOM 0 H ILE A 56 0.057 -6.229 10.919 1.00 32.12 H new ATOM 0 HA ILE A 56 -0.243 -5.231 8.265 1.00 23.40 H new ATOM 0 HB ILE A 56 -2.153 -5.707 10.579 1.00 10.05 H new ATOM 0 HG12 ILE A 56 -1.224 -7.694 9.465 1.00 0.32 H new ATOM 0 HG13 ILE A 56 -2.951 -7.549 9.208 1.00 0.32 H new ATOM 0 HG21 ILE A 56 -3.996 -5.266 9.005 1.00 12.54 H new ATOM 0 HG22 ILE A 56 -3.001 -3.815 9.276 1.00 12.54 H new ATOM 0 HG23 ILE A 56 -2.817 -4.753 7.774 1.00 12.54 H new ATOM 0 HD11 ILE A 56 -1.812 -8.224 7.150 1.00 33.02 H new ATOM 0 HD12 ILE A 56 -2.551 -6.616 6.957 1.00 33.02 H new ATOM 0 HD13 ILE A 56 -0.797 -6.764 7.218 1.00 33.02 H new ATOM 874 N THR A 57 -0.328 -3.149 10.777 1.00 54.32 N ATOM 875 CA THR A 57 -0.362 -1.740 11.149 1.00 54.03 C ATOM 876 C THR A 57 0.856 -1.000 10.610 1.00 5.43 C ATOM 877 O THR A 57 0.894 0.230 10.605 1.00 1.34 O ATOM 878 CB THR A 57 -0.422 -1.564 12.678 1.00 42.01 C ATOM 879 OG1 THR A 57 0.876 -1.773 13.246 1.00 71.42 O ATOM 880 CG2 THR A 57 -1.415 -2.536 13.296 1.00 23.54 C ATOM 0 H THR A 57 -0.055 -3.778 11.532 1.00 54.32 H new ATOM 0 HA THR A 57 -1.265 -1.318 10.707 1.00 54.03 H new ATOM 0 HB THR A 57 -0.752 -0.548 12.892 1.00 42.01 H new ATOM 0 HG1 THR A 57 1.223 -2.643 12.958 1.00 71.42 H new ATOM 0 HG21 THR A 57 -1.440 -2.393 14.376 1.00 23.54 H new ATOM 0 HG22 THR A 57 -2.407 -2.354 12.883 1.00 23.54 H new ATOM 0 HG23 THR A 57 -1.111 -3.558 13.072 1.00 23.54 H new ATOM 888 N GLU A 58 1.851 -1.757 10.157 1.00 12.23 N ATOM 889 CA GLU A 58 3.071 -1.170 9.617 1.00 64.44 C ATOM 890 C GLU A 58 2.935 -0.916 8.118 1.00 2.42 C ATOM 891 O GLU A 58 3.398 0.105 7.607 1.00 71.40 O ATOM 892 CB GLU A 58 4.266 -2.089 9.882 1.00 1.34 C ATOM 893 CG GLU A 58 4.549 -2.307 11.359 1.00 23.02 C ATOM 894 CD GLU A 58 4.397 -1.039 12.176 1.00 2.41 C ATOM 895 OE1 GLU A 58 3.255 -0.720 12.569 1.00 41.14 O ATOM 896 OE2 GLU A 58 5.419 -0.365 12.423 1.00 41.24 O ATOM 0 H GLU A 58 1.836 -2.777 10.153 1.00 12.23 H new ATOM 0 HA GLU A 58 3.237 -0.216 10.117 1.00 64.44 H new ATOM 0 HB2 GLU A 58 4.084 -3.054 9.409 1.00 1.34 H new ATOM 0 HB3 GLU A 58 5.152 -1.665 9.409 1.00 1.34 H new ATOM 0 HG2 GLU A 58 3.871 -3.068 11.746 1.00 23.02 H new ATOM 0 HG3 GLU A 58 5.562 -2.692 11.478 1.00 23.02 H new ATOM 903 N ILE A 59 2.298 -1.850 7.421 1.00 62.02 N ATOM 904 CA ILE A 59 2.101 -1.727 5.982 1.00 53.02 C ATOM 905 C ILE A 59 0.958 -0.768 5.664 1.00 62.53 C ATOM 906 O ILE A 59 0.889 -0.211 4.568 1.00 61.32 O ATOM 907 CB ILE A 59 1.805 -3.093 5.335 1.00 32.13 C ATOM 908 CG1 ILE A 59 0.462 -3.636 5.829 1.00 2.45 C ATOM 909 CG2 ILE A 59 2.924 -4.077 5.640 1.00 24.14 C ATOM 910 CD1 ILE A 59 0.301 -5.126 5.627 1.00 24.04 C ATOM 0 H ILE A 59 1.909 -2.700 7.829 1.00 62.02 H new ATOM 0 HA ILE A 59 3.029 -1.332 5.569 1.00 53.02 H new ATOM 0 HB ILE A 59 1.747 -2.961 4.255 1.00 32.13 H new ATOM 0 HG12 ILE A 59 0.355 -3.408 6.889 1.00 2.45 H new ATOM 0 HG13 ILE A 59 -0.344 -3.118 5.309 1.00 2.45 H new ATOM 0 HG21 ILE A 59 2.700 -5.038 5.176 1.00 24.14 H new ATOM 0 HG22 ILE A 59 3.864 -3.693 5.244 1.00 24.14 H new ATOM 0 HG23 ILE A 59 3.011 -4.207 6.719 1.00 24.14 H new ATOM 0 HD11 ILE A 59 -0.674 -5.441 6.000 1.00 24.04 H new ATOM 0 HD12 ILE A 59 0.376 -5.359 4.565 1.00 24.04 H new ATOM 0 HD13 ILE A 59 1.085 -5.654 6.170 1.00 24.04 H new ATOM 922 N ILE A 60 0.065 -0.580 6.629 1.00 2.03 N ATOM 923 CA ILE A 60 -1.073 0.314 6.453 1.00 24.20 C ATOM 924 C ILE A 60 -1.843 -0.022 5.181 1.00 52.44 C ATOM 925 O ILE A 60 -1.776 0.690 4.178 1.00 1.45 O ATOM 926 CB ILE A 60 -0.628 1.787 6.397 1.00 43.20 C ATOM 927 CG1 ILE A 60 0.257 2.122 7.600 1.00 61.44 C ATOM 928 CG2 ILE A 60 -1.840 2.705 6.353 1.00 51.31 C ATOM 929 CD1 ILE A 60 1.693 2.420 7.229 1.00 60.11 C ATOM 0 H ILE A 60 0.107 -1.035 7.541 1.00 2.03 H new ATOM 0 HA ILE A 60 -1.723 0.172 7.317 1.00 24.20 H new ATOM 0 HB ILE A 60 -0.046 1.941 5.488 1.00 43.20 H new ATOM 0 HG12 ILE A 60 -0.162 2.984 8.120 1.00 61.44 H new ATOM 0 HG13 ILE A 60 0.237 1.286 8.300 1.00 61.44 H new ATOM 0 HG21 ILE A 60 -1.509 3.743 6.314 1.00 51.31 H new ATOM 0 HG22 ILE A 60 -2.435 2.480 5.468 1.00 51.31 H new ATOM 0 HG23 ILE A 60 -2.446 2.551 7.246 1.00 51.31 H new ATOM 0 HD11 ILE A 60 2.262 2.649 8.130 1.00 60.11 H new ATOM 0 HD12 ILE A 60 2.129 1.551 6.736 1.00 60.11 H new ATOM 0 HD13 ILE A 60 1.724 3.275 6.553 1.00 60.11 H new ATOM 941 N PRO A 61 -2.596 -1.131 5.220 1.00 64.42 N ATOM 942 CA PRO A 61 -3.396 -1.586 4.079 1.00 40.32 C ATOM 943 C PRO A 61 -4.585 -0.671 3.804 1.00 61.41 C ATOM 944 O PRO A 61 -5.193 -0.733 2.736 1.00 54.23 O ATOM 945 CB PRO A 61 -3.877 -2.973 4.513 1.00 40.42 C ATOM 946 CG PRO A 61 -3.866 -2.929 6.002 1.00 50.51 C ATOM 947 CD PRO A 61 -2.723 -2.028 6.381 1.00 12.31 C ATOM 0 HA PRO A 61 -2.821 -1.590 3.153 1.00 40.32 H new ATOM 0 HB2 PRO A 61 -4.876 -3.183 4.131 1.00 40.42 H new ATOM 0 HB3 PRO A 61 -3.220 -3.756 4.135 1.00 40.42 H new ATOM 0 HG2 PRO A 61 -4.810 -2.545 6.388 1.00 50.51 H new ATOM 0 HG3 PRO A 61 -3.732 -3.926 6.421 1.00 50.51 H new ATOM 0 HD2 PRO A 61 -2.934 -1.474 7.296 1.00 12.31 H new ATOM 0 HD3 PRO A 61 -1.807 -2.593 6.555 1.00 12.31 H new ATOM 1043 N SER A 69 -10.939 -1.410 5.855 1.00 63.43 N ATOM 1044 CA SER A 69 -9.742 -1.577 6.671 1.00 12.33 C ATOM 1045 C SER A 69 -9.925 -2.707 7.679 1.00 31.51 C ATOM 1046 O SER A 69 -10.955 -2.797 8.348 1.00 52.40 O ATOM 1047 CB SER A 69 -9.414 -0.274 7.403 1.00 25.13 C ATOM 1048 OG SER A 69 -10.359 -0.011 8.426 1.00 70.15 O ATOM 0 HA SER A 69 -8.914 -1.834 6.010 1.00 12.33 H new ATOM 0 HB2 SER A 69 -8.415 -0.337 7.834 1.00 25.13 H new ATOM 0 HB3 SER A 69 -9.403 0.553 6.693 1.00 25.13 H new ATOM 0 HG SER A 69 -10.126 0.826 8.879 1.00 70.15 H new ATOM 1054 N ILE A 70 -8.919 -3.569 7.781 1.00 4.25 N ATOM 1055 CA ILE A 70 -8.967 -4.693 8.708 1.00 72.23 C ATOM 1056 C ILE A 70 -8.700 -4.239 10.139 1.00 44.25 C ATOM 1057 O ILE A 70 -8.950 -4.975 11.092 1.00 63.01 O ATOM 1058 CB ILE A 70 -7.946 -5.781 8.327 1.00 45.11 C ATOM 1059 CG1 ILE A 70 -8.365 -7.132 8.910 1.00 2.21 C ATOM 1060 CG2 ILE A 70 -6.556 -5.396 8.813 1.00 33.12 C ATOM 1061 CD1 ILE A 70 -7.489 -8.281 8.463 1.00 72.25 C ATOM 0 H ILE A 70 -8.061 -3.511 7.233 1.00 4.25 H new ATOM 0 HA ILE A 70 -9.972 -5.111 8.644 1.00 72.23 H new ATOM 0 HB ILE A 70 -7.919 -5.869 7.241 1.00 45.11 H new ATOM 0 HG12 ILE A 70 -8.343 -7.071 9.998 1.00 2.21 H new ATOM 0 HG13 ILE A 70 -9.396 -7.339 8.623 1.00 2.21 H new ATOM 0 HG21 ILE A 70 -5.845 -6.175 8.536 1.00 33.12 H new ATOM 0 HG22 ILE A 70 -6.258 -4.453 8.354 1.00 33.12 H new ATOM 0 HG23 ILE A 70 -6.568 -5.284 9.897 1.00 33.12 H new ATOM 0 HD11 ILE A 70 -7.845 -9.207 8.915 1.00 72.25 H new ATOM 0 HD12 ILE A 70 -7.529 -8.368 7.377 1.00 72.25 H new ATOM 0 HD13 ILE A 70 -6.461 -8.097 8.774 1.00 72.25 H new ATOM 1073 N GLY A 71 -8.191 -3.019 10.281 1.00 44.31 N ATOM 1074 CA GLY A 71 -7.899 -2.486 11.599 1.00 51.31 C ATOM 1075 C GLY A 71 -9.087 -2.575 12.536 1.00 11.11 C ATOM 1076 O GLY A 71 -8.920 -2.667 13.752 1.00 75.53 O ATOM 0 H GLY A 71 -7.976 -2.390 9.507 1.00 44.31 H new ATOM 0 HA2 GLY A 71 -7.059 -3.030 12.030 1.00 51.31 H new ATOM 0 HA3 GLY A 71 -7.590 -1.445 11.506 1.00 51.31 H new ATOM 1080 N GLU A 72 -10.289 -2.545 11.970 1.00 74.43 N ATOM 1081 CA GLU A 72 -11.510 -2.621 12.764 1.00 24.15 C ATOM 1082 C GLU A 72 -11.866 -4.071 13.077 1.00 31.53 C ATOM 1083 O GLU A 72 -12.478 -4.364 14.105 1.00 40.01 O ATOM 1084 CB GLU A 72 -12.668 -1.947 12.026 1.00 32.52 C ATOM 1085 CG GLU A 72 -12.337 -0.556 11.514 1.00 64.02 C ATOM 1086 CD GLU A 72 -13.495 0.412 11.661 1.00 22.54 C ATOM 1087 OE1 GLU A 72 -13.814 0.785 12.809 1.00 32.34 O ATOM 1088 OE2 GLU A 72 -14.082 0.796 10.628 1.00 65.41 O ATOM 0 H GLU A 72 -10.444 -2.469 10.965 1.00 74.43 H new ATOM 0 HA GLU A 72 -11.335 -2.097 13.704 1.00 24.15 H new ATOM 0 HB2 GLU A 72 -12.965 -2.573 11.185 1.00 32.52 H new ATOM 0 HB3 GLU A 72 -13.526 -1.884 12.695 1.00 32.52 H new ATOM 0 HG2 GLU A 72 -11.474 -0.169 12.056 1.00 64.02 H new ATOM 0 HG3 GLU A 72 -12.052 -0.618 10.464 1.00 64.02 H new ATOM 1095 N TYR A 73 -11.479 -4.975 12.184 1.00 75.22 N ATOM 1096 CA TYR A 73 -11.760 -6.395 12.362 1.00 54.21 C ATOM 1097 C TYR A 73 -10.787 -7.022 13.355 1.00 34.34 C ATOM 1098 O TYR A 73 -11.195 -7.709 14.293 1.00 74.53 O ATOM 1099 CB TYR A 73 -11.678 -7.125 11.020 1.00 11.41 C ATOM 1100 CG TYR A 73 -11.578 -8.627 11.153 1.00 24.44 C ATOM 1101 CD1 TYR A 73 -12.699 -9.396 11.441 1.00 43.10 C ATOM 1102 CD2 TYR A 73 -10.361 -9.279 10.991 1.00 50.13 C ATOM 1103 CE1 TYR A 73 -12.611 -10.769 11.564 1.00 11.14 C ATOM 1104 CE2 TYR A 73 -10.264 -10.652 11.111 1.00 53.22 C ATOM 1105 CZ TYR A 73 -11.392 -11.392 11.398 1.00 21.22 C ATOM 1106 OH TYR A 73 -11.301 -12.760 11.519 1.00 43.01 O ATOM 0 H TYR A 73 -10.970 -4.750 11.329 1.00 75.22 H new ATOM 0 HA TYR A 73 -12.770 -6.493 12.760 1.00 54.21 H new ATOM 0 HB2 TYR A 73 -12.559 -6.879 10.428 1.00 11.41 H new ATOM 0 HB3 TYR A 73 -10.812 -6.759 10.469 1.00 11.41 H new ATOM 0 HD1 TYR A 73 -13.656 -8.912 11.571 1.00 43.10 H new ATOM 0 HD2 TYR A 73 -9.476 -8.702 10.767 1.00 50.13 H new ATOM 0 HE1 TYR A 73 -13.492 -11.351 11.789 1.00 11.14 H new ATOM 0 HE2 TYR A 73 -9.311 -11.143 10.981 1.00 53.22 H new ATOM 0 HH TYR A 73 -10.377 -13.042 11.356 1.00 43.01 H new ATOM 1116 N LEU A 74 -9.498 -6.781 13.144 1.00 54.42 N ATOM 1117 CA LEU A 74 -8.465 -7.321 14.020 1.00 2.42 C ATOM 1118 C LEU A 74 -8.681 -6.867 15.460 1.00 24.15 C ATOM 1119 O LEU A 74 -8.261 -7.539 16.404 1.00 45.32 O ATOM 1120 CB LEU A 74 -7.080 -6.884 13.538 1.00 13.10 C ATOM 1121 CG LEU A 74 -6.222 -7.970 12.889 1.00 20.32 C ATOM 1122 CD1 LEU A 74 -5.277 -7.363 11.864 1.00 11.10 C ATOM 1123 CD2 LEU A 74 -5.442 -8.737 13.948 1.00 52.14 C ATOM 0 H LEU A 74 -9.143 -6.215 12.373 1.00 54.42 H new ATOM 0 HA LEU A 74 -8.528 -8.409 13.988 1.00 2.42 H new ATOM 0 HB2 LEU A 74 -7.206 -6.072 12.822 1.00 13.10 H new ATOM 0 HB3 LEU A 74 -6.533 -6.477 14.388 1.00 13.10 H new ATOM 0 HG LEU A 74 -6.882 -8.669 12.375 1.00 20.32 H new ATOM 0 HD11 LEU A 74 -4.675 -8.151 11.413 1.00 11.10 H new ATOM 0 HD12 LEU A 74 -5.855 -6.860 11.089 1.00 11.10 H new ATOM 0 HD13 LEU A 74 -4.623 -6.642 12.354 1.00 11.10 H new ATOM 0 HD21 LEU A 74 -4.837 -9.506 13.468 1.00 52.14 H new ATOM 0 HD22 LEU A 74 -4.793 -8.050 14.490 1.00 52.14 H new ATOM 0 HD23 LEU A 74 -6.138 -9.205 14.645 1.00 52.14 H new ATOM 1135 N LEU A 75 -9.340 -5.725 15.623 1.00 23.21 N ATOM 1136 CA LEU A 75 -9.614 -5.182 16.949 1.00 31.41 C ATOM 1137 C LEU A 75 -10.818 -5.873 17.582 1.00 63.31 C ATOM 1138 O LEU A 75 -10.707 -6.487 18.644 1.00 54.33 O ATOM 1139 CB LEU A 75 -9.863 -3.676 16.863 1.00 13.44 C ATOM 1140 CG LEU A 75 -8.726 -2.778 17.353 1.00 71.31 C ATOM 1141 CD1 LEU A 75 -7.436 -3.100 16.614 1.00 33.34 C ATOM 1142 CD2 LEU A 75 -9.091 -1.311 17.178 1.00 72.42 C ATOM 0 H LEU A 75 -9.695 -5.157 14.853 1.00 23.21 H new ATOM 0 HA LEU A 75 -8.742 -5.364 17.577 1.00 31.41 H new ATOM 0 HB2 LEU A 75 -10.078 -3.422 15.825 1.00 13.44 H new ATOM 0 HB3 LEU A 75 -10.758 -3.442 17.440 1.00 13.44 H new ATOM 0 HG LEU A 75 -8.570 -2.968 18.415 1.00 71.31 H new ATOM 0 HD11 LEU A 75 -6.638 -2.451 16.976 1.00 33.34 H new ATOM 0 HD12 LEU A 75 -7.166 -4.141 16.791 1.00 33.34 H new ATOM 0 HD13 LEU A 75 -7.579 -2.939 15.546 1.00 33.34 H new ATOM 0 HD21 LEU A 75 -8.270 -0.687 17.532 1.00 72.42 H new ATOM 0 HD22 LEU A 75 -9.275 -1.105 16.124 1.00 72.42 H new ATOM 0 HD23 LEU A 75 -9.990 -1.089 17.753 1.00 72.42 H new ATOM 1154 N PHE A 76 -11.967 -5.771 16.922 1.00 64.31 N ATOM 1155 CA PHE A 76 -13.191 -6.387 17.419 1.00 33.30 C ATOM 1156 C PHE A 76 -12.994 -7.883 17.647 1.00 70.23 C ATOM 1157 O PHE A 76 -13.541 -8.458 18.588 1.00 14.25 O ATOM 1158 CB PHE A 76 -14.339 -6.157 16.434 1.00 14.23 C ATOM 1159 CG PHE A 76 -15.359 -5.169 16.923 1.00 15.24 C ATOM 1160 CD1 PHE A 76 -14.970 -3.924 17.389 1.00 5.41 C ATOM 1161 CD2 PHE A 76 -16.708 -5.486 16.918 1.00 54.41 C ATOM 1162 CE1 PHE A 76 -15.906 -3.012 17.840 1.00 43.24 C ATOM 1163 CE2 PHE A 76 -17.649 -4.578 17.367 1.00 40.13 C ATOM 1164 CZ PHE A 76 -17.247 -3.340 17.829 1.00 31.02 C ATOM 0 H PHE A 76 -12.076 -5.267 16.042 1.00 64.31 H new ATOM 0 HA PHE A 76 -13.440 -5.922 18.373 1.00 33.30 H new ATOM 0 HB2 PHE A 76 -13.930 -5.806 15.487 1.00 14.23 H new ATOM 0 HB3 PHE A 76 -14.832 -7.108 16.235 1.00 14.23 H new ATOM 0 HD1 PHE A 76 -13.922 -3.662 17.400 1.00 5.41 H new ATOM 0 HD2 PHE A 76 -17.028 -6.453 16.559 1.00 54.41 H new ATOM 0 HE1 PHE A 76 -15.589 -2.045 18.200 1.00 43.24 H new ATOM 0 HE2 PHE A 76 -18.698 -4.837 17.356 1.00 40.13 H new ATOM 0 HZ PHE A 76 -17.980 -2.630 18.181 1.00 31.02 H new ATOM 1174 N THR A 77 -12.208 -8.510 16.776 1.00 10.34 N ATOM 1175 CA THR A 77 -11.939 -9.938 16.880 1.00 31.31 C ATOM 1176 C THR A 77 -11.185 -10.264 18.164 1.00 4.10 C ATOM 1177 O THR A 77 -11.612 -11.111 18.948 1.00 43.00 O ATOM 1178 CB THR A 77 -11.123 -10.445 15.676 1.00 71.20 C ATOM 1179 OG1 THR A 77 -11.938 -10.448 14.498 1.00 3.53 O ATOM 1180 CG2 THR A 77 -10.592 -11.847 15.934 1.00 63.00 C ATOM 0 H THR A 77 -11.747 -8.050 15.991 1.00 10.34 H new ATOM 0 HA THR A 77 -12.906 -10.441 16.892 1.00 31.31 H new ATOM 0 HB THR A 77 -10.277 -9.774 15.530 1.00 71.20 H new ATOM 0 HG1 THR A 77 -11.418 -10.790 13.741 1.00 3.53 H new ATOM 0 HG21 THR A 77 -10.019 -12.184 15.070 1.00 63.00 H new ATOM 0 HG22 THR A 77 -9.949 -11.836 16.814 1.00 63.00 H new ATOM 0 HG23 THR A 77 -11.427 -12.527 16.103 1.00 63.00 H new ATOM 1188 N MET A 78 -10.061 -9.585 18.373 1.00 32.41 N ATOM 1189 CA MET A 78 -9.248 -9.802 19.564 1.00 33.22 C ATOM 1190 C MET A 78 -10.007 -9.392 20.822 1.00 33.33 C ATOM 1191 O MET A 78 -9.862 -10.013 21.876 1.00 44.01 O ATOM 1192 CB MET A 78 -7.940 -9.016 19.465 1.00 42.41 C ATOM 1193 CG MET A 78 -6.795 -9.814 18.863 1.00 70.20 C ATOM 1194 SD MET A 78 -5.268 -9.660 19.809 1.00 21.43 S ATOM 1195 CE MET A 78 -4.069 -9.482 18.491 1.00 50.33 C ATOM 0 H MET A 78 -9.693 -8.881 17.733 1.00 32.41 H new ATOM 0 HA MET A 78 -9.020 -10.866 19.629 1.00 33.22 H new ATOM 0 HB2 MET A 78 -8.107 -8.124 18.862 1.00 42.41 H new ATOM 0 HB3 MET A 78 -7.652 -8.678 20.461 1.00 42.41 H new ATOM 0 HG2 MET A 78 -7.079 -10.865 18.808 1.00 70.20 H new ATOM 0 HG3 MET A 78 -6.620 -9.477 17.841 1.00 70.20 H new ATOM 0 HE1 MET A 78 -3.336 -8.724 18.766 1.00 50.33 H new ATOM 0 HE2 MET A 78 -3.563 -10.434 18.328 1.00 50.33 H new ATOM 0 HE3 MET A 78 -4.577 -9.180 17.575 1.00 50.33 H new ATOM 1205 N ILE A 79 -10.816 -8.345 20.705 1.00 11.31 N ATOM 1206 CA ILE A 79 -11.598 -7.854 21.833 1.00 2.31 C ATOM 1207 C ILE A 79 -12.691 -8.845 22.217 1.00 1.05 C ATOM 1208 O ILE A 79 -12.978 -9.043 23.398 1.00 4.54 O ATOM 1209 CB ILE A 79 -12.243 -6.491 21.520 1.00 12.21 C ATOM 1210 CG1 ILE A 79 -11.182 -5.389 21.514 1.00 1.30 C ATOM 1211 CG2 ILE A 79 -13.335 -6.177 22.532 1.00 2.12 C ATOM 1212 CD1 ILE A 79 -10.753 -4.955 22.898 1.00 15.33 C ATOM 0 H ILE A 79 -10.947 -7.820 19.840 1.00 11.31 H new ATOM 0 HA ILE A 79 -10.908 -7.737 22.668 1.00 2.31 H new ATOM 0 HB ILE A 79 -12.695 -6.539 20.529 1.00 12.21 H new ATOM 0 HG12 ILE A 79 -10.308 -5.740 20.965 1.00 1.30 H new ATOM 0 HG13 ILE A 79 -11.571 -4.525 20.975 1.00 1.30 H new ATOM 0 HG21 ILE A 79 -13.781 -5.211 22.298 1.00 2.12 H new ATOM 0 HG22 ILE A 79 -14.102 -6.950 22.491 1.00 2.12 H new ATOM 0 HG23 ILE A 79 -12.905 -6.145 23.533 1.00 2.12 H new ATOM 0 HD11 ILE A 79 -9.999 -4.172 22.816 1.00 15.33 H new ATOM 0 HD12 ILE A 79 -11.616 -4.573 23.443 1.00 15.33 H new ATOM 0 HD13 ILE A 79 -10.334 -5.807 23.433 1.00 15.33 H new ATOM 1224 N PHE A 80 -13.297 -9.468 21.212 1.00 13.33 N ATOM 1225 CA PHE A 80 -14.359 -10.440 21.444 1.00 21.14 C ATOM 1226 C PHE A 80 -13.813 -11.688 22.132 1.00 3.13 C ATOM 1227 O PHE A 80 -14.266 -12.063 23.214 1.00 61.13 O ATOM 1228 CB PHE A 80 -15.026 -10.824 20.122 1.00 12.11 C ATOM 1229 CG PHE A 80 -16.380 -11.451 20.294 1.00 71.23 C ATOM 1230 CD1 PHE A 80 -16.503 -12.811 20.532 1.00 52.41 C ATOM 1231 CD2 PHE A 80 -17.530 -10.682 20.216 1.00 3.42 C ATOM 1232 CE1 PHE A 80 -17.748 -13.391 20.691 1.00 65.13 C ATOM 1233 CE2 PHE A 80 -18.777 -11.256 20.375 1.00 65.44 C ATOM 1234 CZ PHE A 80 -18.886 -12.613 20.611 1.00 43.11 C ATOM 0 H PHE A 80 -13.071 -9.317 20.229 1.00 13.33 H new ATOM 0 HA PHE A 80 -15.101 -9.981 22.097 1.00 21.14 H new ATOM 0 HB2 PHE A 80 -15.123 -9.933 19.501 1.00 12.11 H new ATOM 0 HB3 PHE A 80 -14.379 -11.518 19.586 1.00 12.11 H new ATOM 0 HD1 PHE A 80 -15.616 -13.425 20.594 1.00 52.41 H new ATOM 0 HD2 PHE A 80 -17.451 -9.621 20.029 1.00 3.42 H new ATOM 0 HE1 PHE A 80 -17.830 -14.452 20.878 1.00 65.13 H new ATOM 0 HE2 PHE A 80 -19.665 -10.645 20.315 1.00 65.44 H new ATOM 0 HZ PHE A 80 -19.860 -13.064 20.733 1.00 43.11 H new ATOM 1244 N VAL A 81 -12.836 -12.327 21.497 1.00 60.35 N ATOM 1245 CA VAL A 81 -12.227 -13.533 22.046 1.00 2.51 C ATOM 1246 C VAL A 81 -11.688 -13.285 23.451 1.00 52.44 C ATOM 1247 O VAL A 81 -11.730 -14.167 24.309 1.00 45.02 O ATOM 1248 CB VAL A 81 -11.081 -14.040 21.151 1.00 61.41 C ATOM 1249 CG1 VAL A 81 -11.611 -14.451 19.786 1.00 54.02 C ATOM 1250 CG2 VAL A 81 -10.001 -12.978 21.015 1.00 43.01 C ATOM 0 H VAL A 81 -12.449 -12.030 20.601 1.00 60.35 H new ATOM 0 HA VAL A 81 -13.008 -14.292 22.088 1.00 2.51 H new ATOM 0 HB VAL A 81 -10.638 -14.918 21.621 1.00 61.41 H new ATOM 0 HG11 VAL A 81 -10.787 -14.806 19.168 1.00 54.02 H new ATOM 0 HG12 VAL A 81 -12.345 -15.248 19.906 1.00 54.02 H new ATOM 0 HG13 VAL A 81 -12.082 -13.593 19.305 1.00 54.02 H new ATOM 0 HG21 VAL A 81 -9.199 -13.354 20.379 1.00 43.01 H new ATOM 0 HG22 VAL A 81 -10.428 -12.080 20.568 1.00 43.01 H new ATOM 0 HG23 VAL A 81 -9.601 -12.738 22.000 1.00 43.01 H new ATOM 1260 N THR A 82 -11.182 -12.077 23.680 1.00 14.30 N ATOM 1261 CA THR A 82 -10.635 -11.712 24.980 1.00 2.24 C ATOM 1262 C THR A 82 -11.654 -11.942 26.090 1.00 22.24 C ATOM 1263 O THR A 82 -11.396 -12.684 27.040 1.00 51.42 O ATOM 1264 CB THR A 82 -10.187 -10.238 25.008 1.00 60.21 C ATOM 1265 OG1 THR A 82 -8.878 -10.113 24.441 1.00 21.33 O ATOM 1266 CG2 THR A 82 -10.183 -9.700 26.431 1.00 64.41 C ATOM 0 H THR A 82 -11.140 -11.335 22.981 1.00 14.30 H new ATOM 0 HA THR A 82 -9.768 -12.351 25.148 1.00 2.24 H new ATOM 0 HB THR A 82 -10.895 -9.655 24.419 1.00 60.21 H new ATOM 0 HG1 THR A 82 -8.948 -10.056 23.465 1.00 21.33 H new ATOM 0 HG21 THR A 82 -9.863 -8.658 26.425 1.00 64.41 H new ATOM 0 HG22 THR A 82 -11.187 -9.769 26.849 1.00 64.41 H new ATOM 0 HG23 THR A 82 -9.495 -10.287 27.040 1.00 64.41 H new ATOM 1274 N LEU A 83 -12.812 -11.304 25.966 1.00 41.43 N ATOM 1275 CA LEU A 83 -13.872 -11.440 26.959 1.00 4.21 C ATOM 1276 C LEU A 83 -14.374 -12.879 27.026 1.00 42.52 C ATOM 1277 O LEU A 83 -14.706 -13.381 28.099 1.00 21.51 O ATOM 1278 CB LEU A 83 -15.031 -10.498 26.629 1.00 2.35 C ATOM 1279 CG LEU A 83 -14.690 -9.008 26.574 1.00 31.10 C ATOM 1280 CD1 LEU A 83 -15.937 -8.185 26.290 1.00 72.41 C ATOM 1281 CD2 LEU A 83 -14.039 -8.561 27.875 1.00 60.12 C ATOM 0 H LEU A 83 -13.041 -10.687 25.187 1.00 41.43 H new ATOM 0 HA LEU A 83 -13.461 -11.173 27.932 1.00 4.21 H new ATOM 0 HB2 LEU A 83 -15.448 -10.791 25.665 1.00 2.35 H new ATOM 0 HB3 LEU A 83 -15.814 -10.644 27.373 1.00 2.35 H new ATOM 0 HG LEU A 83 -13.981 -8.847 25.762 1.00 31.10 H new ATOM 0 HD11 LEU A 83 -15.675 -7.128 26.255 1.00 72.41 H new ATOM 0 HD12 LEU A 83 -16.361 -8.486 25.332 1.00 72.41 H new ATOM 0 HD13 LEU A 83 -16.670 -8.351 27.080 1.00 72.41 H new ATOM 0 HD21 LEU A 83 -13.803 -7.498 27.818 1.00 60.12 H new ATOM 0 HD22 LEU A 83 -14.725 -8.736 28.704 1.00 60.12 H new ATOM 0 HD23 LEU A 83 -13.122 -9.128 28.037 1.00 60.12 H new ATOM 1293 N SER A 84 -14.425 -13.536 25.872 1.00 63.32 N ATOM 1294 CA SER A 84 -14.888 -14.917 25.799 1.00 63.12 C ATOM 1295 C SER A 84 -14.075 -15.812 26.730 1.00 74.45 C ATOM 1296 O SER A 84 -14.633 -16.535 27.556 1.00 70.54 O ATOM 1297 CB SER A 84 -14.791 -15.434 24.362 1.00 21.42 C ATOM 1298 OG SER A 84 -16.044 -15.354 23.706 1.00 73.51 O ATOM 0 H SER A 84 -14.152 -13.135 24.975 1.00 63.32 H new ATOM 0 HA SER A 84 -15.930 -14.943 26.117 1.00 63.12 H new ATOM 0 HB2 SER A 84 -14.051 -14.852 23.812 1.00 21.42 H new ATOM 0 HB3 SER A 84 -14.445 -16.467 24.367 1.00 21.42 H new ATOM 0 HG SER A 84 -16.260 -16.222 23.306 1.00 73.51 H new ATOM 1304 N ILE A 85 -12.755 -15.758 26.589 1.00 12.01 N ATOM 1305 CA ILE A 85 -11.866 -16.563 27.417 1.00 4.42 C ATOM 1306 C ILE A 85 -11.977 -16.169 28.886 1.00 23.23 C ATOM 1307 O ILE A 85 -11.722 -16.979 29.778 1.00 10.20 O ATOM 1308 CB ILE A 85 -10.399 -16.422 26.969 1.00 2.21 C ATOM 1309 CG1 ILE A 85 -10.240 -16.881 25.518 1.00 3.23 C ATOM 1310 CG2 ILE A 85 -9.486 -17.221 27.887 1.00 62.45 C ATOM 1311 CD1 ILE A 85 -9.335 -15.989 24.698 1.00 4.50 C ATOM 0 H ILE A 85 -12.278 -15.166 25.910 1.00 12.01 H new ATOM 0 HA ILE A 85 -12.176 -17.601 27.297 1.00 4.42 H new ATOM 0 HB ILE A 85 -10.114 -15.372 27.031 1.00 2.21 H new ATOM 0 HG12 ILE A 85 -9.842 -17.896 25.508 1.00 3.23 H new ATOM 0 HG13 ILE A 85 -11.223 -16.919 25.048 1.00 3.23 H new ATOM 0 HG21 ILE A 85 -8.453 -17.112 27.558 1.00 62.45 H new ATOM 0 HG22 ILE A 85 -9.583 -16.851 28.908 1.00 62.45 H new ATOM 0 HG23 ILE A 85 -9.768 -18.273 27.854 1.00 62.45 H new ATOM 0 HD11 ILE A 85 -9.269 -16.375 23.681 1.00 4.50 H new ATOM 0 HD12 ILE A 85 -9.742 -14.978 24.677 1.00 4.50 H new ATOM 0 HD13 ILE A 85 -8.341 -15.970 25.144 1.00 4.50 H new ATOM 1323 N VAL A 86 -12.360 -14.920 29.131 1.00 34.35 N ATOM 1324 CA VAL A 86 -12.509 -14.419 30.493 1.00 64.43 C ATOM 1325 C VAL A 86 -13.742 -15.012 31.165 1.00 0.21 C ATOM 1326 O VAL A 86 -13.669 -15.513 32.287 1.00 1.05 O ATOM 1327 CB VAL A 86 -12.612 -12.883 30.517 1.00 13.21 C ATOM 1328 CG1 VAL A 86 -13.580 -12.430 31.599 1.00 14.14 C ATOM 1329 CG2 VAL A 86 -11.240 -12.260 30.723 1.00 1.21 C ATOM 0 H VAL A 86 -12.573 -14.236 28.405 1.00 34.35 H new ATOM 0 HA VAL A 86 -11.618 -14.724 31.042 1.00 64.43 H new ATOM 0 HB VAL A 86 -12.997 -12.547 29.554 1.00 13.21 H new ATOM 0 HG11 VAL A 86 -13.640 -11.342 31.601 1.00 14.14 H new ATOM 0 HG12 VAL A 86 -14.567 -12.847 31.402 1.00 14.14 H new ATOM 0 HG13 VAL A 86 -13.227 -12.776 32.571 1.00 14.14 H new ATOM 0 HG21 VAL A 86 -11.332 -11.174 30.737 1.00 1.21 H new ATOM 0 HG22 VAL A 86 -10.824 -12.601 31.671 1.00 1.21 H new ATOM 0 HG23 VAL A 86 -10.579 -12.557 29.909 1.00 1.21 H new ATOM 1339 N ILE A 87 -14.874 -14.951 30.471 1.00 23.25 N ATOM 1340 CA ILE A 87 -16.123 -15.483 31.001 1.00 31.31 C ATOM 1341 C ILE A 87 -16.099 -17.008 31.040 1.00 41.52 C ATOM 1342 O ILE A 87 -16.388 -17.619 32.069 1.00 55.20 O ATOM 1343 CB ILE A 87 -17.331 -15.021 30.165 1.00 71.31 C ATOM 1344 CG1 ILE A 87 -17.386 -13.493 30.109 1.00 64.24 C ATOM 1345 CG2 ILE A 87 -18.621 -15.582 30.744 1.00 55.20 C ATOM 1346 CD1 ILE A 87 -17.527 -12.843 31.467 1.00 31.21 C ATOM 0 H ILE A 87 -14.951 -14.539 29.541 1.00 23.25 H new ATOM 0 HA ILE A 87 -16.225 -15.098 32.016 1.00 31.31 H new ATOM 0 HB ILE A 87 -17.217 -15.399 29.149 1.00 71.31 H new ATOM 0 HG12 ILE A 87 -16.480 -13.122 29.630 1.00 64.24 H new ATOM 0 HG13 ILE A 87 -18.224 -13.191 29.482 1.00 64.24 H new ATOM 0 HG21 ILE A 87 -19.466 -15.247 30.142 1.00 55.20 H new ATOM 0 HG22 ILE A 87 -18.580 -16.671 30.737 1.00 55.20 H new ATOM 0 HG23 ILE A 87 -18.743 -15.231 31.769 1.00 55.20 H new ATOM 0 HD11 ILE A 87 -17.559 -11.760 31.350 1.00 31.21 H new ATOM 0 HD12 ILE A 87 -18.448 -13.185 31.940 1.00 31.21 H new ATOM 0 HD13 ILE A 87 -16.676 -13.115 32.091 1.00 31.21 H new ATOM 1358 N THR A 88 -15.750 -17.617 29.911 1.00 24.32 N ATOM 1359 CA THR A 88 -15.686 -19.070 29.815 1.00 35.25 C ATOM 1360 C THR A 88 -14.841 -19.659 30.939 1.00 70.00 C ATOM 1361 O THR A 88 -15.102 -20.765 31.412 1.00 35.10 O ATOM 1362 CB THR A 88 -15.105 -19.519 28.462 1.00 71.25 C ATOM 1363 OG1 THR A 88 -15.865 -18.950 27.389 1.00 5.03 O ATOM 1364 CG2 THR A 88 -15.113 -21.036 28.346 1.00 63.03 C ATOM 0 H THR A 88 -15.507 -17.126 29.050 1.00 24.32 H new ATOM 0 HA THR A 88 -16.709 -19.437 29.902 1.00 35.25 H new ATOM 0 HB THR A 88 -14.074 -19.171 28.401 1.00 71.25 H new ATOM 0 HG1 THR A 88 -15.587 -18.021 27.248 1.00 5.03 H new ATOM 0 HG21 THR A 88 -14.698 -21.329 27.382 1.00 63.03 H new ATOM 0 HG22 THR A 88 -14.510 -21.465 29.146 1.00 63.03 H new ATOM 0 HG23 THR A 88 -16.137 -21.402 28.427 1.00 63.03 H new ATOM 1372 N VAL A 89 -13.826 -18.913 31.363 1.00 11.32 N ATOM 1373 CA VAL A 89 -12.943 -19.360 32.433 1.00 21.44 C ATOM 1374 C VAL A 89 -13.630 -19.260 33.791 1.00 63.43 C ATOM 1375 O VAL A 89 -13.484 -20.141 34.639 1.00 74.35 O ATOM 1376 CB VAL A 89 -11.641 -18.538 32.467 1.00 22.33 C ATOM 1377 CG1 VAL A 89 -11.104 -18.447 33.887 1.00 3.14 C ATOM 1378 CG2 VAL A 89 -10.604 -19.145 31.534 1.00 2.12 C ATOM 0 H VAL A 89 -13.595 -17.996 30.981 1.00 11.32 H new ATOM 0 HA VAL A 89 -12.700 -20.403 32.228 1.00 21.44 H new ATOM 0 HB VAL A 89 -11.860 -17.528 32.122 1.00 22.33 H new ATOM 0 HG11 VAL A 89 -10.184 -17.863 33.891 1.00 3.14 H new ATOM 0 HG12 VAL A 89 -11.844 -17.964 34.525 1.00 3.14 H new ATOM 0 HG13 VAL A 89 -10.899 -19.449 34.263 1.00 3.14 H new ATOM 0 HG21 VAL A 89 -9.690 -18.552 31.570 1.00 2.12 H new ATOM 0 HG22 VAL A 89 -10.386 -20.166 31.847 1.00 2.12 H new ATOM 0 HG23 VAL A 89 -10.991 -19.153 30.515 1.00 2.12 H new ATOM 1388 N PHE A 90 -14.379 -18.181 33.990 1.00 32.44 N ATOM 1389 CA PHE A 90 -15.089 -17.965 35.246 1.00 73.34 C ATOM 1390 C PHE A 90 -16.226 -18.970 35.408 1.00 61.45 C ATOM 1391 O PHE A 90 -16.321 -19.658 36.424 1.00 34.30 O ATOM 1392 CB PHE A 90 -15.642 -16.540 35.305 1.00 42.32 C ATOM 1393 CG PHE A 90 -14.596 -15.504 35.604 1.00 14.42 C ATOM 1394 CD1 PHE A 90 -13.724 -15.668 36.668 1.00 62.01 C ATOM 1395 CD2 PHE A 90 -14.486 -14.366 34.822 1.00 42.43 C ATOM 1396 CE1 PHE A 90 -12.762 -14.716 36.946 1.00 44.30 C ATOM 1397 CE2 PHE A 90 -13.525 -13.410 35.095 1.00 52.14 C ATOM 1398 CZ PHE A 90 -12.661 -13.586 36.158 1.00 53.13 C ATOM 0 H PHE A 90 -14.510 -17.443 33.299 1.00 32.44 H new ATOM 0 HA PHE A 90 -14.382 -18.108 36.063 1.00 73.34 H new ATOM 0 HB2 PHE A 90 -16.115 -16.303 34.352 1.00 42.32 H new ATOM 0 HB3 PHE A 90 -16.419 -16.491 36.068 1.00 42.32 H new ATOM 0 HD1 PHE A 90 -13.797 -16.550 37.287 1.00 62.01 H new ATOM 0 HD2 PHE A 90 -15.159 -14.224 33.989 1.00 42.43 H new ATOM 0 HE1 PHE A 90 -12.089 -14.855 37.779 1.00 44.30 H new ATOM 0 HE2 PHE A 90 -13.450 -12.527 34.478 1.00 52.14 H new ATOM 0 HZ PHE A 90 -11.908 -12.842 36.373 1.00 53.13 H new ATOM 1408 N VAL A 91 -17.087 -19.049 34.398 1.00 65.25 N ATOM 1409 CA VAL A 91 -18.217 -19.970 34.426 1.00 1.44 C ATOM 1410 C VAL A 91 -17.764 -21.386 34.761 1.00 23.22 C ATOM 1411 O VAL A 91 -18.450 -22.117 35.477 1.00 10.55 O ATOM 1412 CB VAL A 91 -18.962 -19.986 33.078 1.00 10.15 C ATOM 1413 CG1 VAL A 91 -18.011 -20.345 31.947 1.00 73.31 C ATOM 1414 CG2 VAL A 91 -20.134 -20.955 33.130 1.00 43.25 C ATOM 0 H VAL A 91 -17.023 -18.486 33.550 1.00 65.25 H new ATOM 0 HA VAL A 91 -18.895 -19.616 35.203 1.00 1.44 H new ATOM 0 HB VAL A 91 -19.354 -18.987 32.886 1.00 10.15 H new ATOM 0 HG11 VAL A 91 -18.555 -20.351 31.002 1.00 73.31 H new ATOM 0 HG12 VAL A 91 -17.209 -19.609 31.899 1.00 73.31 H new ATOM 0 HG13 VAL A 91 -17.587 -21.333 32.128 1.00 73.31 H new ATOM 0 HG21 VAL A 91 -20.650 -20.954 32.170 1.00 43.25 H new ATOM 0 HG22 VAL A 91 -19.767 -21.959 33.344 1.00 43.25 H new ATOM 0 HG23 VAL A 91 -20.826 -20.647 33.914 1.00 43.25 H new ATOM 1424 N LEU A 92 -16.604 -21.769 34.239 1.00 22.13 N ATOM 1425 CA LEU A 92 -16.057 -23.099 34.483 1.00 30.40 C ATOM 1426 C LEU A 92 -15.337 -23.155 35.827 1.00 53.53 C ATOM 1427 O LEU A 92 -15.361 -24.175 36.513 1.00 65.31 O ATOM 1428 CB LEU A 92 -15.095 -23.491 33.360 1.00 50.31 C ATOM 1429 CG LEU A 92 -14.478 -24.886 33.460 1.00 33.30 C ATOM 1430 CD1 LEU A 92 -13.254 -24.865 34.362 1.00 34.54 C ATOM 1431 CD2 LEU A 92 -15.504 -25.887 33.972 1.00 21.03 C ATOM 0 H LEU A 92 -16.024 -21.177 33.644 1.00 22.13 H new ATOM 0 HA LEU A 92 -16.886 -23.806 34.506 1.00 30.40 H new ATOM 0 HB2 LEU A 92 -15.627 -23.418 32.411 1.00 50.31 H new ATOM 0 HB3 LEU A 92 -14.287 -22.760 33.329 1.00 50.31 H new ATOM 0 HG LEU A 92 -14.163 -25.196 32.463 1.00 33.30 H new ATOM 0 HD11 LEU A 92 -12.828 -25.867 34.421 1.00 34.54 H new ATOM 0 HD12 LEU A 92 -12.512 -24.179 33.953 1.00 34.54 H new ATOM 0 HD13 LEU A 92 -13.543 -24.534 35.360 1.00 34.54 H new ATOM 0 HD21 LEU A 92 -15.048 -26.875 34.037 1.00 21.03 H new ATOM 0 HD22 LEU A 92 -15.849 -25.581 34.960 1.00 21.03 H new ATOM 0 HD23 LEU A 92 -16.351 -25.923 33.287 1.00 21.03 H new ATOM 1443 N ASN A 93 -14.700 -22.048 36.197 1.00 71.43 N ATOM 1444 CA ASN A 93 -13.975 -21.970 37.460 1.00 62.24 C ATOM 1445 C ASN A 93 -14.928 -22.102 38.643 1.00 12.34 C ATOM 1446 O ASN A 93 -14.645 -22.814 39.606 1.00 22.35 O ATOM 1447 CB ASN A 93 -13.209 -20.648 37.551 1.00 35.51 C ATOM 1448 CG ASN A 93 -13.028 -20.184 38.983 1.00 3.31 C ATOM 1449 OD1 ASN A 93 -13.513 -19.120 39.368 1.00 3.34 O ATOM 1450 ND2 ASN A 93 -12.326 -20.981 39.779 1.00 24.54 N ATOM 0 H ASN A 93 -14.671 -21.194 35.640 1.00 71.43 H new ATOM 0 HA ASN A 93 -13.265 -22.796 37.495 1.00 62.24 H new ATOM 0 HB2 ASN A 93 -12.231 -20.764 37.083 1.00 35.51 H new ATOM 0 HB3 ASN A 93 -13.743 -19.882 36.988 1.00 35.51 H new ATOM 0 HD21 ASN A 93 -12.170 -20.720 40.753 1.00 24.54 H new ATOM 0 HD22 ASN A 93 -11.942 -21.854 39.417 1.00 24.54 H new ATOM 1457 N VAL A 94 -16.060 -21.410 38.564 1.00 14.32 N ATOM 1458 CA VAL A 94 -17.057 -21.450 39.628 1.00 70.24 C ATOM 1459 C VAL A 94 -17.611 -22.859 39.808 1.00 12.12 C ATOM 1460 O VAL A 94 -17.655 -23.647 38.863 1.00 42.44 O ATOM 1461 CB VAL A 94 -18.223 -20.485 39.342 1.00 45.35 C ATOM 1462 CG1 VAL A 94 -19.235 -21.131 38.409 1.00 33.50 C ATOM 1463 CG2 VAL A 94 -18.884 -20.049 40.640 1.00 3.33 C ATOM 0 H VAL A 94 -16.310 -20.815 37.774 1.00 14.32 H new ATOM 0 HA VAL A 94 -16.555 -21.139 40.544 1.00 70.24 H new ATOM 0 HB VAL A 94 -17.825 -19.598 38.848 1.00 45.35 H new ATOM 0 HG11 VAL A 94 -20.051 -20.434 38.219 1.00 33.50 H new ATOM 0 HG12 VAL A 94 -18.750 -21.387 37.467 1.00 33.50 H new ATOM 0 HG13 VAL A 94 -19.631 -22.035 38.871 1.00 33.50 H new ATOM 0 HG21 VAL A 94 -19.706 -19.368 40.419 1.00 3.33 H new ATOM 0 HG22 VAL A 94 -19.269 -20.924 41.164 1.00 3.33 H new ATOM 0 HG23 VAL A 94 -18.152 -19.543 41.269 1.00 3.33 H new ATOM 1644 N GLY A 108 -26.381 -29.241 26.933 1.00 40.53 N ATOM 1645 CA GLY A 108 -26.121 -28.727 25.600 1.00 21.44 C ATOM 1646 C GLY A 108 -25.376 -27.407 25.623 1.00 70.43 C ATOM 1647 O GLY A 108 -25.483 -26.611 24.690 1.00 55.22 O ATOM 0 HA2 GLY A 108 -25.540 -29.459 25.039 1.00 21.44 H new ATOM 0 HA3 GLY A 108 -27.066 -28.598 25.073 1.00 21.44 H new ATOM 1651 N ILE A 109 -24.620 -27.174 26.691 1.00 75.25 N ATOM 1652 CA ILE A 109 -23.856 -25.941 26.830 1.00 22.21 C ATOM 1653 C ILE A 109 -22.597 -25.975 25.970 1.00 2.25 C ATOM 1654 O ILE A 109 -22.099 -24.935 25.539 1.00 10.54 O ATOM 1655 CB ILE A 109 -23.456 -25.689 28.296 1.00 33.41 C ATOM 1656 CG1 ILE A 109 -24.616 -26.040 29.231 1.00 40.52 C ATOM 1657 CG2 ILE A 109 -23.033 -24.241 28.488 1.00 3.13 C ATOM 1658 CD1 ILE A 109 -24.365 -25.660 30.673 1.00 22.35 C ATOM 0 H ILE A 109 -24.521 -27.823 27.472 1.00 75.25 H new ATOM 0 HA ILE A 109 -24.502 -25.130 26.493 1.00 22.21 H new ATOM 0 HB ILE A 109 -22.609 -26.330 28.542 1.00 33.41 H new ATOM 0 HG12 ILE A 109 -25.518 -25.537 28.883 1.00 40.52 H new ATOM 0 HG13 ILE A 109 -24.807 -27.112 29.174 1.00 40.52 H new ATOM 0 HG21 ILE A 109 -22.753 -24.079 29.529 1.00 3.13 H new ATOM 0 HG22 ILE A 109 -22.180 -24.023 27.845 1.00 3.13 H new ATOM 0 HG23 ILE A 109 -23.862 -23.582 28.228 1.00 3.13 H new ATOM 0 HD11 ILE A 109 -25.228 -25.938 31.278 1.00 22.35 H new ATOM 0 HD12 ILE A 109 -23.482 -26.184 31.039 1.00 22.35 H new ATOM 0 HD13 ILE A 109 -24.204 -24.584 30.743 1.00 22.35 H new ATOM 1670 N ASP A 110 -22.088 -27.177 25.724 1.00 43.34 N ATOM 1671 CA ASP A 110 -20.888 -27.347 24.912 1.00 22.05 C ATOM 1672 C ASP A 110 -21.206 -27.178 23.430 1.00 4.00 C ATOM 1673 O ASP A 110 -20.528 -26.434 22.721 1.00 50.02 O ATOM 1674 CB ASP A 110 -20.270 -28.724 25.161 1.00 42.15 C ATOM 1675 CG ASP A 110 -18.946 -28.641 25.895 1.00 52.40 C ATOM 1676 OD1 ASP A 110 -17.909 -28.450 25.227 1.00 25.20 O ATOM 1677 OD2 ASP A 110 -18.948 -28.767 27.138 1.00 43.44 O ATOM 0 H ASP A 110 -22.487 -28.048 26.075 1.00 43.34 H new ATOM 0 HA ASP A 110 -20.171 -26.578 25.200 1.00 22.05 H new ATOM 0 HB2 ASP A 110 -20.965 -29.332 25.740 1.00 42.15 H new ATOM 0 HB3 ASP A 110 -20.122 -29.230 24.207 1.00 42.15 H new ATOM 1682 N ARG A 111 -22.239 -27.874 22.969 1.00 74.14 N ATOM 1683 CA ARG A 111 -22.645 -27.803 21.570 1.00 14.31 C ATOM 1684 C ARG A 111 -22.990 -26.369 21.176 1.00 24.34 C ATOM 1685 O ARG A 111 -22.603 -25.899 20.106 1.00 63.41 O ATOM 1686 CB ARG A 111 -23.848 -28.715 21.319 1.00 43.42 C ATOM 1687 CG ARG A 111 -25.025 -28.439 22.240 1.00 4.42 C ATOM 1688 CD ARG A 111 -26.043 -29.567 22.197 1.00 63.32 C ATOM 1689 NE ARG A 111 -25.588 -30.743 22.933 1.00 22.44 N ATOM 1690 CZ ARG A 111 -26.114 -31.954 22.783 1.00 12.30 C ATOM 1691 NH1 ARG A 111 -27.108 -32.146 21.927 1.00 32.30 N ATOM 1692 NH2 ARG A 111 -25.646 -32.975 23.489 1.00 2.34 N ATOM 0 H ARG A 111 -22.811 -28.494 23.543 1.00 74.14 H new ATOM 0 HA ARG A 111 -21.808 -28.139 20.957 1.00 14.31 H new ATOM 0 HB2 ARG A 111 -24.172 -28.598 20.285 1.00 43.42 H new ATOM 0 HB3 ARG A 111 -23.538 -29.753 21.441 1.00 43.42 H new ATOM 0 HG2 ARG A 111 -24.667 -28.310 23.261 1.00 4.42 H new ATOM 0 HG3 ARG A 111 -25.504 -27.504 21.950 1.00 4.42 H new ATOM 0 HD2 ARG A 111 -26.987 -29.220 22.617 1.00 63.32 H new ATOM 0 HD3 ARG A 111 -26.237 -29.841 21.160 1.00 63.32 H new ATOM 0 HE ARG A 111 -24.824 -30.629 23.599 1.00 22.44 H new ATOM 0 HH11 ARG A 111 -27.470 -31.363 21.382 1.00 32.30 H new ATOM 0 HH12 ARG A 111 -27.510 -33.076 21.813 1.00 32.30 H new ATOM 0 HH21 ARG A 111 -24.881 -32.831 24.148 1.00 2.34 H new ATOM 0 HH22 ARG A 111 -26.051 -33.904 23.373 1.00 2.34 H new ATOM 1706 N ILE A 112 -23.719 -25.681 22.048 1.00 4.41 N ATOM 1707 CA ILE A 112 -24.114 -24.301 21.791 1.00 30.44 C ATOM 1708 C ILE A 112 -22.928 -23.354 21.936 1.00 53.50 C ATOM 1709 O ILE A 112 -22.834 -22.348 21.232 1.00 12.21 O ATOM 1710 CB ILE A 112 -25.236 -23.851 22.745 1.00 53.21 C ATOM 1711 CG1 ILE A 112 -26.500 -24.681 22.509 1.00 2.01 C ATOM 1712 CG2 ILE A 112 -25.527 -22.369 22.558 1.00 30.11 C ATOM 1713 CD1 ILE A 112 -27.060 -24.544 21.111 1.00 75.11 C ATOM 0 H ILE A 112 -24.048 -26.056 22.938 1.00 4.41 H new ATOM 0 HA ILE A 112 -24.482 -24.263 20.766 1.00 30.44 H new ATOM 0 HB ILE A 112 -24.906 -24.010 23.771 1.00 53.21 H new ATOM 0 HG12 ILE A 112 -26.277 -25.730 22.701 1.00 2.01 H new ATOM 0 HG13 ILE A 112 -27.262 -24.380 23.228 1.00 2.01 H new ATOM 0 HG21 ILE A 112 -26.322 -22.066 23.239 1.00 30.11 H new ATOM 0 HG22 ILE A 112 -24.627 -21.792 22.771 1.00 30.11 H new ATOM 0 HG23 ILE A 112 -25.840 -22.187 21.530 1.00 30.11 H new ATOM 0 HD11 ILE A 112 -27.955 -25.159 21.015 1.00 75.11 H new ATOM 0 HD12 ILE A 112 -27.315 -23.501 20.922 1.00 75.11 H new ATOM 0 HD13 ILE A 112 -26.315 -24.872 20.387 1.00 75.11 H new ATOM 1725 N PHE A 113 -22.024 -23.682 22.852 1.00 24.03 N ATOM 1726 CA PHE A 113 -20.842 -22.860 23.089 1.00 33.51 C ATOM 1727 C PHE A 113 -20.063 -22.642 21.795 1.00 31.54 C ATOM 1728 O PHE A 113 -19.876 -21.508 21.353 1.00 34.12 O ATOM 1729 CB PHE A 113 -19.940 -23.517 24.137 1.00 53.35 C ATOM 1730 CG PHE A 113 -18.574 -22.898 24.223 1.00 33.34 C ATOM 1731 CD1 PHE A 113 -17.535 -23.368 23.436 1.00 54.30 C ATOM 1732 CD2 PHE A 113 -18.329 -21.848 25.093 1.00 51.31 C ATOM 1733 CE1 PHE A 113 -16.277 -22.801 23.513 1.00 12.41 C ATOM 1734 CE2 PHE A 113 -17.073 -21.276 25.174 1.00 32.41 C ATOM 1735 CZ PHE A 113 -16.046 -21.754 24.384 1.00 22.22 C ATOM 0 H PHE A 113 -22.086 -24.511 23.443 1.00 24.03 H new ATOM 0 HA PHE A 113 -21.173 -21.890 23.461 1.00 33.51 H new ATOM 0 HB2 PHE A 113 -20.422 -23.452 25.112 1.00 53.35 H new ATOM 0 HB3 PHE A 113 -19.836 -24.577 23.903 1.00 53.35 H new ATOM 0 HD1 PHE A 113 -17.710 -24.187 22.754 1.00 54.30 H new ATOM 0 HD2 PHE A 113 -19.128 -21.472 25.715 1.00 51.31 H new ATOM 0 HE1 PHE A 113 -15.476 -23.176 22.893 1.00 12.41 H new ATOM 0 HE2 PHE A 113 -16.895 -20.456 25.854 1.00 32.41 H new ATOM 0 HZ PHE A 113 -15.064 -21.310 24.447 1.00 22.22 H new ATOM 1745 N LEU A 114 -19.610 -23.737 21.193 1.00 11.54 N ATOM 1746 CA LEU A 114 -18.850 -23.667 19.950 1.00 10.41 C ATOM 1747 C LEU A 114 -19.713 -23.128 18.814 1.00 74.54 C ATOM 1748 O LEU A 114 -19.202 -22.568 17.844 1.00 23.41 O ATOM 1749 CB LEU A 114 -18.307 -25.049 19.583 1.00 51.21 C ATOM 1750 CG LEU A 114 -19.250 -25.950 18.785 1.00 41.13 C ATOM 1751 CD1 LEU A 114 -18.985 -25.812 17.294 1.00 65.54 C ATOM 1752 CD2 LEU A 114 -19.101 -27.399 19.223 1.00 22.44 C ATOM 0 H LEU A 114 -19.756 -24.683 21.546 1.00 11.54 H new ATOM 0 HA LEU A 114 -18.014 -22.984 20.101 1.00 10.41 H new ATOM 0 HB2 LEU A 114 -17.390 -24.916 19.008 1.00 51.21 H new ATOM 0 HB3 LEU A 114 -18.034 -25.566 20.503 1.00 51.21 H new ATOM 0 HG LEU A 114 -20.275 -25.636 18.982 1.00 41.13 H new ATOM 0 HD11 LEU A 114 -19.665 -26.460 16.742 1.00 65.54 H new ATOM 0 HD12 LEU A 114 -19.144 -24.777 16.990 1.00 65.54 H new ATOM 0 HD13 LEU A 114 -17.956 -26.099 17.079 1.00 65.54 H new ATOM 0 HD21 LEU A 114 -19.780 -28.026 18.644 1.00 22.44 H new ATOM 0 HD22 LEU A 114 -18.075 -27.726 19.056 1.00 22.44 H new ATOM 0 HD23 LEU A 114 -19.342 -27.485 20.283 1.00 22.44 H new ATOM 1764 N TRP A 115 -21.024 -23.300 18.941 1.00 30.42 N ATOM 1765 CA TRP A 115 -21.959 -22.830 17.925 1.00 1.34 C ATOM 1766 C TRP A 115 -21.993 -21.306 17.881 1.00 31.12 C ATOM 1767 O TRP A 115 -22.295 -20.713 16.846 1.00 3.11 O ATOM 1768 CB TRP A 115 -23.361 -23.376 18.201 1.00 42.12 C ATOM 1769 CG TRP A 115 -23.824 -24.368 17.177 1.00 43.42 C ATOM 1770 CD1 TRP A 115 -24.206 -25.660 17.401 1.00 5.51 C ATOM 1771 CD2 TRP A 115 -23.951 -24.148 15.768 1.00 73.32 C ATOM 1772 NE1 TRP A 115 -24.563 -26.257 16.216 1.00 2.42 N ATOM 1773 CE2 TRP A 115 -24.417 -25.350 15.200 1.00 65.45 C ATOM 1774 CE3 TRP A 115 -23.720 -23.053 14.931 1.00 21.21 C ATOM 1775 CZ2 TRP A 115 -24.652 -25.485 13.834 1.00 34.50 C ATOM 1776 CZ3 TRP A 115 -23.954 -23.189 13.576 1.00 32.01 C ATOM 1777 CH2 TRP A 115 -24.417 -24.397 13.038 1.00 33.33 C ATOM 0 H TRP A 115 -21.464 -23.761 19.737 1.00 30.42 H new ATOM 0 HA TRP A 115 -21.619 -23.196 16.956 1.00 1.34 H new ATOM 0 HB2 TRP A 115 -23.373 -23.847 19.184 1.00 42.12 H new ATOM 0 HB3 TRP A 115 -24.066 -22.546 18.237 1.00 42.12 H new ATOM 0 HD1 TRP A 115 -24.225 -26.142 18.367 1.00 5.51 H new ATOM 0 HE1 TRP A 115 -24.884 -27.219 16.110 1.00 2.42 H new ATOM 0 HE3 TRP A 115 -23.365 -22.117 15.336 1.00 21.21 H new ATOM 0 HZ2 TRP A 115 -25.007 -26.416 13.417 1.00 34.50 H new ATOM 0 HZ3 TRP A 115 -23.777 -22.349 12.920 1.00 32.01 H new ATOM 0 HH2 TRP A 115 -24.592 -24.471 11.975 1.00 33.33 H new ATOM 1788 N MET A 116 -21.682 -20.678 19.011 1.00 61.54 N ATOM 1789 CA MET A 116 -21.676 -19.223 19.099 1.00 51.21 C ATOM 1790 C MET A 116 -20.412 -18.645 18.471 1.00 62.14 C ATOM 1791 O MET A 116 -20.477 -17.727 17.653 1.00 2.44 O ATOM 1792 CB MET A 116 -21.783 -18.779 20.559 1.00 2.30 C ATOM 1793 CG MET A 116 -22.846 -17.718 20.795 1.00 4.05 C ATOM 1794 SD MET A 116 -22.148 -16.143 21.328 1.00 54.32 S ATOM 1795 CE MET A 116 -20.876 -15.900 20.090 1.00 15.12 C ATOM 0 H MET A 116 -21.431 -21.154 19.877 1.00 61.54 H new ATOM 0 HA MET A 116 -22.538 -18.847 18.548 1.00 51.21 H new ATOM 0 HB2 MET A 116 -22.004 -19.648 21.179 1.00 2.30 H new ATOM 0 HB3 MET A 116 -20.817 -18.393 20.885 1.00 2.30 H new ATOM 0 HG2 MET A 116 -23.414 -17.567 19.877 1.00 4.05 H new ATOM 0 HG3 MET A 116 -23.548 -18.074 21.549 1.00 4.05 H new ATOM 0 HE1 MET A 116 -20.536 -14.865 20.116 1.00 15.12 H new ATOM 0 HE2 MET A 116 -20.036 -16.563 20.297 1.00 15.12 H new ATOM 0 HE3 MET A 116 -21.281 -16.125 19.103 1.00 15.12 H new ATOM 1805 N PHE A 117 -19.263 -19.189 18.857 1.00 4.25 N ATOM 1806 CA PHE A 117 -17.983 -18.726 18.333 1.00 71.13 C ATOM 1807 C PHE A 117 -17.996 -18.707 16.807 1.00 22.20 C ATOM 1808 O PHE A 117 -17.503 -17.766 16.183 1.00 33.54 O ATOM 1809 CB PHE A 117 -16.848 -19.622 18.833 1.00 34.15 C ATOM 1810 CG PHE A 117 -16.398 -19.296 20.229 1.00 75.21 C ATOM 1811 CD1 PHE A 117 -17.236 -19.517 21.310 1.00 11.34 C ATOM 1812 CD2 PHE A 117 -15.138 -18.769 20.459 1.00 10.22 C ATOM 1813 CE1 PHE A 117 -16.825 -19.218 22.596 1.00 71.21 C ATOM 1814 CE2 PHE A 117 -14.721 -18.469 21.742 1.00 14.24 C ATOM 1815 CZ PHE A 117 -15.566 -18.693 22.812 1.00 54.41 C ATOM 0 H PHE A 117 -19.192 -19.951 19.531 1.00 4.25 H new ATOM 0 HA PHE A 117 -17.818 -17.710 18.691 1.00 71.13 H new ATOM 0 HB2 PHE A 117 -17.174 -20.661 18.798 1.00 34.15 H new ATOM 0 HB3 PHE A 117 -15.999 -19.532 18.156 1.00 34.15 H new ATOM 0 HD1 PHE A 117 -18.221 -19.927 21.146 1.00 11.34 H new ATOM 0 HD2 PHE A 117 -14.474 -18.590 19.626 1.00 10.22 H new ATOM 0 HE1 PHE A 117 -17.488 -19.395 23.430 1.00 71.21 H new ATOM 0 HE2 PHE A 117 -13.735 -18.060 21.908 1.00 14.24 H new ATOM 0 HZ PHE A 117 -15.243 -18.458 23.815 1.00 54.41 H new ATOM 1825 N ILE A 118 -18.562 -19.752 16.213 1.00 25.51 N ATOM 1826 CA ILE A 118 -18.639 -19.856 14.761 1.00 20.13 C ATOM 1827 C ILE A 118 -19.768 -18.994 14.208 1.00 13.51 C ATOM 1828 O ILE A 118 -19.761 -18.622 13.034 1.00 0.12 O ATOM 1829 CB ILE A 118 -18.854 -21.313 14.311 1.00 24.35 C ATOM 1830 CG1 ILE A 118 -20.191 -21.840 14.836 1.00 70.14 C ATOM 1831 CG2 ILE A 118 -17.707 -22.190 14.793 1.00 74.43 C ATOM 1832 CD1 ILE A 118 -20.483 -23.266 14.423 1.00 44.23 C ATOM 0 H ILE A 118 -18.974 -20.539 16.715 1.00 25.51 H new ATOM 0 HA ILE A 118 -17.687 -19.500 14.368 1.00 20.13 H new ATOM 0 HB ILE A 118 -18.876 -21.342 13.222 1.00 24.35 H new ATOM 0 HG12 ILE A 118 -20.195 -21.777 15.924 1.00 70.14 H new ATOM 0 HG13 ILE A 118 -20.993 -21.195 14.477 1.00 70.14 H new ATOM 0 HG21 ILE A 118 -17.873 -23.217 14.468 1.00 74.43 H new ATOM 0 HG22 ILE A 118 -16.769 -21.824 14.376 1.00 74.43 H new ATOM 0 HG23 ILE A 118 -17.657 -22.158 15.881 1.00 74.43 H new ATOM 0 HD11 ILE A 118 -21.446 -23.573 14.831 1.00 44.23 H new ATOM 0 HD12 ILE A 118 -20.512 -23.331 13.335 1.00 44.23 H new ATOM 0 HD13 ILE A 118 -19.702 -23.923 14.805 1.00 44.23 H new ATOM 1844 N ILE A 119 -20.736 -18.677 15.062 1.00 74.54 N ATOM 1845 CA ILE A 119 -21.871 -17.856 14.659 1.00 71.02 C ATOM 1846 C ILE A 119 -21.446 -16.411 14.419 1.00 72.32 C ATOM 1847 O ILE A 119 -22.006 -15.721 13.567 1.00 71.54 O ATOM 1848 CB ILE A 119 -22.989 -17.881 15.718 1.00 23.42 C ATOM 1849 CG1 ILE A 119 -24.247 -18.539 15.148 1.00 51.11 C ATOM 1850 CG2 ILE A 119 -23.293 -16.471 16.200 1.00 35.03 C ATOM 1851 CD1 ILE A 119 -24.952 -19.447 16.130 1.00 34.35 C ATOM 0 H ILE A 119 -20.757 -18.976 16.037 1.00 74.54 H new ATOM 0 HA ILE A 119 -22.253 -18.280 13.730 1.00 71.02 H new ATOM 0 HB ILE A 119 -22.649 -18.470 16.570 1.00 23.42 H new ATOM 0 HG12 ILE A 119 -24.939 -17.761 14.824 1.00 51.11 H new ATOM 0 HG13 ILE A 119 -23.977 -19.115 14.263 1.00 51.11 H new ATOM 0 HG21 ILE A 119 -24.085 -16.505 16.948 1.00 35.03 H new ATOM 0 HG22 ILE A 119 -22.396 -16.036 16.641 1.00 35.03 H new ATOM 0 HG23 ILE A 119 -23.616 -15.860 15.357 1.00 35.03 H new ATOM 0 HD11 ILE A 119 -25.834 -19.879 15.658 1.00 34.35 H new ATOM 0 HD12 ILE A 119 -24.277 -20.246 16.436 1.00 34.35 H new ATOM 0 HD13 ILE A 119 -25.254 -18.872 17.005 1.00 34.35 H new ATOM 1863 N VAL A 120 -20.451 -15.959 15.175 1.00 22.52 N ATOM 1864 CA VAL A 120 -19.948 -14.597 15.043 1.00 21.32 C ATOM 1865 C VAL A 120 -18.901 -14.503 13.939 1.00 52.42 C ATOM 1866 O VAL A 120 -18.752 -13.461 13.299 1.00 40.03 O ATOM 1867 CB VAL A 120 -19.332 -14.096 16.363 1.00 14.02 C ATOM 1868 CG1 VAL A 120 -20.405 -13.950 17.431 1.00 33.45 C ATOM 1869 CG2 VAL A 120 -18.230 -15.036 16.827 1.00 11.14 C ATOM 0 H VAL A 120 -19.977 -16.516 15.886 1.00 22.52 H new ATOM 0 HA VAL A 120 -20.800 -13.968 14.786 1.00 21.32 H new ATOM 0 HB VAL A 120 -18.891 -13.115 16.189 1.00 14.02 H new ATOM 0 HG11 VAL A 120 -19.951 -13.595 18.356 1.00 33.45 H new ATOM 0 HG12 VAL A 120 -21.156 -13.234 17.097 1.00 33.45 H new ATOM 0 HG13 VAL A 120 -20.878 -14.916 17.606 1.00 33.45 H new ATOM 0 HG21 VAL A 120 -17.806 -14.667 17.761 1.00 11.14 H new ATOM 0 HG22 VAL A 120 -18.644 -16.032 16.985 1.00 11.14 H new ATOM 0 HG23 VAL A 120 -17.449 -15.084 16.068 1.00 11.14 H new ATOM 1879 N CYS A 121 -18.179 -15.596 13.720 1.00 13.04 N ATOM 1880 CA CYS A 121 -17.145 -15.637 12.692 1.00 12.35 C ATOM 1881 C CYS A 121 -17.751 -15.460 11.304 1.00 14.41 C ATOM 1882 O CYS A 121 -17.335 -14.588 10.540 1.00 61.35 O ATOM 1883 CB CYS A 121 -16.379 -16.958 12.763 1.00 62.32 C ATOM 1884 SG CYS A 121 -15.017 -16.960 13.953 1.00 53.43 S ATOM 0 H CYS A 121 -18.290 -16.466 14.241 1.00 13.04 H new ATOM 0 HA CYS A 121 -16.453 -14.814 12.874 1.00 12.35 H new ATOM 0 HB2 CYS A 121 -17.075 -17.756 13.023 1.00 62.32 H new ATOM 0 HB3 CYS A 121 -15.983 -17.190 11.774 1.00 62.32 H new ATOM 0 HG CYS A 121 -15.477 -17.227 15.139 1.00 53.43 H new ATOM 1890 N LEU A 122 -18.736 -16.292 10.984 1.00 63.13 N ATOM 1891 CA LEU A 122 -19.399 -16.229 9.686 1.00 70.11 C ATOM 1892 C LEU A 122 -20.235 -14.959 9.563 1.00 61.23 C ATOM 1893 O LEU A 122 -20.101 -14.206 8.597 1.00 72.30 O ATOM 1894 CB LEU A 122 -20.286 -17.459 9.484 1.00 12.23 C ATOM 1895 CG LEU A 122 -20.208 -18.125 8.110 1.00 21.02 C ATOM 1896 CD1 LEU A 122 -20.226 -17.078 7.008 1.00 42.15 C ATOM 1897 CD2 LEU A 122 -18.960 -18.990 8.007 1.00 1.41 C ATOM 0 H LEU A 122 -19.093 -17.018 11.605 1.00 63.13 H new ATOM 0 HA LEU A 122 -18.630 -16.212 8.913 1.00 70.11 H new ATOM 0 HB2 LEU A 122 -20.024 -18.199 10.240 1.00 12.23 H new ATOM 0 HB3 LEU A 122 -21.321 -17.170 9.667 1.00 12.23 H new ATOM 0 HG LEU A 122 -21.081 -18.766 7.988 1.00 21.02 H new ATOM 0 HD11 LEU A 122 -20.170 -17.571 6.037 1.00 42.15 H new ATOM 0 HD12 LEU A 122 -21.149 -16.501 7.069 1.00 42.15 H new ATOM 0 HD13 LEU A 122 -19.372 -16.411 7.126 1.00 42.15 H new ATOM 0 HD21 LEU A 122 -18.921 -19.456 7.023 1.00 1.41 H new ATOM 0 HD22 LEU A 122 -18.075 -18.370 8.151 1.00 1.41 H new ATOM 0 HD23 LEU A 122 -18.989 -19.764 8.774 1.00 1.41 H new ATOM 1909 N LEU A 123 -21.095 -14.726 10.547 1.00 15.24 N ATOM 1910 CA LEU A 123 -21.952 -13.545 10.551 1.00 72.00 C ATOM 1911 C LEU A 123 -21.123 -12.271 10.428 1.00 53.52 C ATOM 1912 O LEU A 123 -21.272 -11.511 9.471 1.00 22.33 O ATOM 1913 CB LEU A 123 -22.788 -13.501 11.831 1.00 35.41 C ATOM 1914 CG LEU A 123 -23.680 -12.272 12.009 1.00 51.03 C ATOM 1915 CD1 LEU A 123 -22.916 -11.154 12.701 1.00 71.00 C ATOM 1916 CD2 LEU A 123 -24.215 -11.802 10.664 1.00 45.13 C ATOM 0 H LEU A 123 -21.218 -15.339 11.353 1.00 15.24 H new ATOM 0 HA LEU A 123 -22.619 -13.608 9.691 1.00 72.00 H new ATOM 0 HB2 LEU A 123 -23.418 -14.390 11.860 1.00 35.41 H new ATOM 0 HB3 LEU A 123 -22.113 -13.561 12.684 1.00 35.41 H new ATOM 0 HG LEU A 123 -24.526 -12.549 12.637 1.00 51.03 H new ATOM 0 HD11 LEU A 123 -23.567 -10.288 12.819 1.00 71.00 H new ATOM 0 HD12 LEU A 123 -22.583 -11.494 13.682 1.00 71.00 H new ATOM 0 HD13 LEU A 123 -22.050 -10.878 12.099 1.00 71.00 H new ATOM 0 HD21 LEU A 123 -24.848 -10.927 10.810 1.00 45.13 H new ATOM 0 HD22 LEU A 123 -23.381 -11.542 10.011 1.00 45.13 H new ATOM 0 HD23 LEU A 123 -24.800 -12.600 10.206 1.00 45.13 H new ATOM 1928 N GLY A 124 -20.248 -12.043 11.403 1.00 62.35 N ATOM 1929 CA GLY A 124 -19.406 -10.861 11.383 1.00 34.02 C ATOM 1930 C GLY A 124 -18.649 -10.710 10.079 1.00 51.41 C ATOM 1931 O GLY A 124 -18.604 -9.624 9.500 1.00 55.32 O ATOM 0 H GLY A 124 -20.107 -12.656 12.206 1.00 62.35 H new ATOM 0 HA2 GLY A 124 -20.022 -9.977 11.546 1.00 34.02 H new ATOM 0 HA3 GLY A 124 -18.696 -10.911 12.208 1.00 34.02 H new ATOM 1935 N THR A 125 -18.049 -11.801 9.614 1.00 33.43 N ATOM 1936 CA THR A 125 -17.288 -11.785 8.372 1.00 44.01 C ATOM 1937 C THR A 125 -18.152 -11.325 7.203 1.00 5.23 C ATOM 1938 O THR A 125 -17.815 -10.365 6.509 1.00 21.43 O ATOM 1939 CB THR A 125 -16.707 -13.175 8.050 1.00 32.14 C ATOM 1940 OG1 THR A 125 -15.610 -13.462 8.924 1.00 3.13 O ATOM 1941 CG2 THR A 125 -16.242 -13.246 6.604 1.00 50.13 C ATOM 0 H THR A 125 -18.076 -12.708 10.080 1.00 33.43 H new ATOM 0 HA THR A 125 -16.468 -11.081 8.514 1.00 44.01 H new ATOM 0 HB THR A 125 -17.493 -13.916 8.199 1.00 32.14 H new ATOM 0 HG1 THR A 125 -15.939 -13.931 9.719 1.00 3.13 H new ATOM 0 HG21 THR A 125 -15.836 -14.237 6.401 1.00 50.13 H new ATOM 0 HG22 THR A 125 -17.086 -13.057 5.941 1.00 50.13 H new ATOM 0 HG23 THR A 125 -15.470 -12.495 6.433 1.00 50.13 H new ATOM 1949 N VAL A 126 -19.268 -12.015 6.991 1.00 42.31 N ATOM 1950 CA VAL A 126 -20.182 -11.675 5.907 1.00 64.22 C ATOM 1951 C VAL A 126 -20.597 -10.210 5.977 1.00 71.13 C ATOM 1952 O VAL A 126 -20.556 -9.494 4.977 1.00 2.23 O ATOM 1953 CB VAL A 126 -21.444 -12.558 5.940 1.00 43.54 C ATOM 1954 CG1 VAL A 126 -22.485 -12.037 4.960 1.00 21.05 C ATOM 1955 CG2 VAL A 126 -21.089 -14.005 5.634 1.00 34.03 C ATOM 0 H VAL A 126 -19.561 -12.813 7.555 1.00 42.31 H new ATOM 0 HA VAL A 126 -19.647 -11.853 4.974 1.00 64.22 H new ATOM 0 HB VAL A 126 -21.870 -12.517 6.942 1.00 43.54 H new ATOM 0 HG11 VAL A 126 -23.370 -12.673 4.997 1.00 21.05 H new ATOM 0 HG12 VAL A 126 -22.760 -11.017 5.229 1.00 21.05 H new ATOM 0 HG13 VAL A 126 -22.072 -12.047 3.951 1.00 21.05 H new ATOM 0 HG21 VAL A 126 -21.992 -14.615 5.661 1.00 34.03 H new ATOM 0 HG22 VAL A 126 -20.639 -14.068 4.643 1.00 34.03 H new ATOM 0 HG23 VAL A 126 -20.381 -14.371 6.378 1.00 34.03 H new ATOM 1965 N GLY A 127 -20.998 -9.770 7.166 1.00 62.12 N ATOM 1966 CA GLY A 127 -21.415 -8.392 7.345 1.00 42.32 C ATOM 1967 C GLY A 127 -20.312 -7.405 7.017 1.00 2.02 C ATOM 1968 O GLY A 127 -20.574 -6.317 6.504 1.00 54.51 O ATOM 0 H GLY A 127 -21.041 -10.344 8.008 1.00 62.12 H new ATOM 0 HA2 GLY A 127 -22.278 -8.192 6.710 1.00 42.32 H new ATOM 0 HA3 GLY A 127 -21.736 -8.244 8.376 1.00 42.32 H new ATOM 1972 N LEU A 128 -19.074 -7.784 7.315 1.00 1.44 N ATOM 1973 CA LEU A 128 -17.926 -6.923 7.051 1.00 61.22 C ATOM 1974 C LEU A 128 -17.686 -6.781 5.551 1.00 22.52 C ATOM 1975 O LEU A 128 -17.340 -5.704 5.066 1.00 13.23 O ATOM 1976 CB LEU A 128 -16.675 -7.486 7.728 1.00 11.33 C ATOM 1977 CG LEU A 128 -15.396 -6.663 7.566 1.00 15.02 C ATOM 1978 CD1 LEU A 128 -15.626 -5.227 8.011 1.00 41.23 C ATOM 1979 CD2 LEU A 128 -14.255 -7.291 8.353 1.00 50.23 C ATOM 0 H LEU A 128 -18.839 -8.681 7.739 1.00 1.44 H new ATOM 0 HA LEU A 128 -18.141 -5.936 7.461 1.00 61.22 H new ATOM 0 HB2 LEU A 128 -16.881 -7.595 8.793 1.00 11.33 H new ATOM 0 HB3 LEU A 128 -16.492 -8.486 7.334 1.00 11.33 H new ATOM 0 HG LEU A 128 -15.122 -6.655 6.511 1.00 15.02 H new ATOM 0 HD11 LEU A 128 -14.705 -4.656 7.889 1.00 41.23 H new ATOM 0 HD12 LEU A 128 -16.413 -4.780 7.404 1.00 41.23 H new ATOM 0 HD13 LEU A 128 -15.924 -5.214 9.059 1.00 41.23 H new ATOM 0 HD21 LEU A 128 -13.353 -6.692 8.226 1.00 50.23 H new ATOM 0 HD22 LEU A 128 -14.520 -7.329 9.410 1.00 50.23 H new ATOM 0 HD23 LEU A 128 -14.074 -8.302 7.987 1.00 50.23 H new ATOM 1991 N PHE A 129 -17.873 -7.876 4.821 1.00 11.02 N ATOM 1992 CA PHE A 129 -17.678 -7.874 3.376 1.00 11.30 C ATOM 1993 C PHE A 129 -18.802 -7.114 2.677 1.00 44.12 C ATOM 1994 O PHE A 129 -18.598 -6.518 1.618 1.00 15.22 O ATOM 1995 CB PHE A 129 -17.611 -9.308 2.847 1.00 43.21 C ATOM 1996 CG PHE A 129 -16.209 -9.821 2.682 1.00 4.25 C ATOM 1997 CD1 PHE A 129 -15.258 -9.605 3.667 1.00 20.31 C ATOM 1998 CD2 PHE A 129 -15.841 -10.518 1.543 1.00 72.02 C ATOM 1999 CE1 PHE A 129 -13.967 -10.076 3.519 1.00 21.31 C ATOM 2000 CE2 PHE A 129 -14.552 -10.992 1.389 1.00 1.25 C ATOM 2001 CZ PHE A 129 -13.613 -10.770 2.378 1.00 13.42 C ATOM 0 H PHE A 129 -18.159 -8.776 5.207 1.00 11.02 H new ATOM 0 HA PHE A 129 -16.735 -7.371 3.162 1.00 11.30 H new ATOM 0 HB2 PHE A 129 -18.152 -9.964 3.529 1.00 43.21 H new ATOM 0 HB3 PHE A 129 -18.123 -9.356 1.886 1.00 43.21 H new ATOM 0 HD1 PHE A 129 -15.529 -9.062 4.561 1.00 20.31 H new ATOM 0 HD2 PHE A 129 -16.570 -10.693 0.766 1.00 72.02 H new ATOM 0 HE1 PHE A 129 -13.236 -9.902 4.294 1.00 21.31 H new ATOM 0 HE2 PHE A 129 -14.279 -11.535 0.497 1.00 1.25 H new ATOM 0 HZ PHE A 129 -12.605 -11.138 2.259 1.00 13.42 H new