USER MOD reduce.3.24.130724 H: found=0, std=0, add=1159, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1158 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 141 GLN : amide:sc= 0 X(o=1.3,f=1.1) USER MOD Set 1.2: A 144 LYS NZ :NH3+ -139:sc= 1.34 (180deg=0.658) USER MOD Set 2.1: A 138 GLN : amide:sc= -0.165 X(o=-0.33,f=-0.081) USER MOD Set 2.2: A 142 ASN : amide:sc= -0.169 X(o=-0.33,f=-0.081) USER MOD Set 3.1: A 74 GLN : amide:sc= 0 K(o=0,f=-1!) USER MOD Set 3.2: A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot -124:sc= 1.25 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot -73:sc= 0.243 USER MOD Single : A 22 SER OG : rot -21:sc= 0.0532 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 27 GLN : amide:sc= 1.38 K(o=1.4,f=-6.9!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot -50:sc= 0.0795 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 147:sc= 1.22 (180deg=0.882) USER MOD Single : A 37 THR OG1 : rot -122:sc= 0.0918 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0715) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= -0.129 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 157:sc= 1.22 (180deg=1.01) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0.00065 USER MOD Single : A 67 MET CE :methyl -151:sc= -0.0284 (180deg=-0.56) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 HIS : no HD1:sc= -0.107 X(o=-0.11,f=-0.59) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot -92:sc= 0.318 USER MOD Single : A 112 GLN : amide:sc= -0.955 K(o=-0.95,f=-1.9) USER MOD Single : A 116 LYS NZ :NH3+ 128:sc= 1.28 (180deg=0.792) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot 180:sc= 0 USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 TYR OH : rot -40:sc= -0.424 USER MOD Single : A 129 TYR OH : rot 169:sc= 0.508 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 ASN : amide:sc= -2 K(o=-2,f=-6!) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 HIS : no HD1:sc= -0.0493 X(o=-0.049,f=-0.12) USER MOD ----------------------------------------------------------------- ATOM 110 N ASP A 9 -23.002 -4.154 -9.040 1.00 31.13 N ATOM 111 CA ASP A 9 -22.320 -3.093 -9.804 1.00 62.10 C ATOM 112 C ASP A 9 -20.978 -2.681 -9.160 1.00 3.43 C ATOM 113 O ASP A 9 -20.436 -1.595 -9.402 1.00 25.13 O ATOM 114 CB ASP A 9 -23.299 -1.936 -10.049 1.00 73.40 C ATOM 115 CG ASP A 9 -22.793 -0.864 -11.021 1.00 3.35 C ATOM 116 OD1 ASP A 9 -22.196 -1.203 -12.066 1.00 72.21 O ATOM 117 OD2 ASP A 9 -23.043 0.340 -10.755 1.00 61.54 O ATOM 0 HA ASP A 9 -22.028 -3.473 -10.783 1.00 62.10 H new ATOM 0 HB2 ASP A 9 -24.234 -2.344 -10.434 1.00 73.40 H new ATOM 0 HB3 ASP A 9 -23.527 -1.463 -9.094 1.00 73.40 H new ATOM 122 N GLY A 10 -20.439 -3.574 -8.327 1.00 34.41 N ATOM 123 CA GLY A 10 -19.289 -3.430 -7.461 1.00 64.34 C ATOM 124 C GLY A 10 -19.658 -3.932 -6.065 1.00 45.24 C ATOM 125 O GLY A 10 -20.809 -3.838 -5.633 1.00 65.20 O ATOM 0 H GLY A 10 -20.845 -4.506 -8.241 1.00 34.41 H new ATOM 0 HA2 GLY A 10 -18.446 -3.997 -7.856 1.00 64.34 H new ATOM 0 HA3 GLY A 10 -18.978 -2.386 -7.417 1.00 64.34 H new ATOM 129 N GLU A 11 -18.673 -4.412 -5.318 1.00 72.20 N ATOM 130 CA GLU A 11 -18.708 -4.340 -3.867 1.00 65.31 C ATOM 131 C GLU A 11 -18.593 -2.856 -3.490 1.00 31.11 C ATOM 132 O GLU A 11 -18.176 -2.030 -4.308 1.00 32.33 O ATOM 133 CB GLU A 11 -17.537 -5.166 -3.310 1.00 34.34 C ATOM 134 CG GLU A 11 -17.487 -5.227 -1.796 1.00 13.43 C ATOM 135 CD GLU A 11 -16.770 -6.436 -1.206 1.00 23.52 C ATOM 136 OE1 GLU A 11 -15.705 -6.840 -1.733 1.00 3.11 O ATOM 137 OE2 GLU A 11 -17.192 -6.908 -0.121 1.00 53.53 O ATOM 0 H GLU A 11 -17.837 -4.857 -5.697 1.00 72.20 H new ATOM 0 HA GLU A 11 -19.629 -4.746 -3.449 1.00 65.31 H new ATOM 0 HB2 GLU A 11 -17.604 -6.181 -3.702 1.00 34.34 H new ATOM 0 HB3 GLU A 11 -16.602 -4.744 -3.677 1.00 34.34 H new ATOM 0 HG2 GLU A 11 -16.998 -4.324 -1.430 1.00 13.43 H new ATOM 0 HG3 GLU A 11 -18.509 -5.213 -1.416 1.00 13.43 H new ATOM 144 N ASP A 12 -18.941 -2.497 -2.263 1.00 3.25 N ATOM 145 CA ASP A 12 -18.755 -1.141 -1.774 1.00 22.42 C ATOM 146 C ASP A 12 -17.259 -0.844 -1.596 1.00 70.43 C ATOM 147 O ASP A 12 -16.483 -1.706 -1.161 1.00 21.21 O ATOM 148 CB ASP A 12 -19.508 -0.958 -0.456 1.00 70.10 C ATOM 149 CG ASP A 12 -19.832 0.508 -0.217 1.00 41.42 C ATOM 150 OD1 ASP A 12 -18.888 1.327 -0.178 1.00 42.33 O ATOM 151 OD2 ASP A 12 -21.030 0.860 -0.140 1.00 3.43 O ATOM 0 H ASP A 12 -19.357 -3.133 -1.583 1.00 3.25 H new ATOM 0 HA ASP A 12 -19.157 -0.437 -2.503 1.00 22.42 H new ATOM 0 HB2 ASP A 12 -20.429 -1.540 -0.475 1.00 70.10 H new ATOM 0 HB3 ASP A 12 -18.906 -1.341 0.368 1.00 70.10 H new ATOM 156 N PHE A 13 -16.852 0.399 -1.859 1.00 2.22 N ATOM 157 CA PHE A 13 -15.517 0.897 -1.545 1.00 14.12 C ATOM 158 C PHE A 13 -15.241 0.879 -0.043 1.00 64.11 C ATOM 159 O PHE A 13 -14.086 0.883 0.379 1.00 44.13 O ATOM 160 CB PHE A 13 -15.358 2.329 -2.073 1.00 12.13 C ATOM 161 CG PHE A 13 -16.306 3.367 -1.488 1.00 11.11 C ATOM 162 CD1 PHE A 13 -16.105 3.865 -0.185 1.00 61.44 C ATOM 163 CD2 PHE A 13 -17.399 3.838 -2.239 1.00 64.51 C ATOM 164 CE1 PHE A 13 -17.026 4.754 0.387 1.00 21.30 C ATOM 165 CE2 PHE A 13 -18.287 4.776 -1.685 1.00 61.53 C ATOM 166 CZ PHE A 13 -18.121 5.209 -0.361 1.00 51.23 C ATOM 0 H PHE A 13 -17.451 1.096 -2.302 1.00 2.22 H new ATOM 0 HA PHE A 13 -14.798 0.236 -2.029 1.00 14.12 H new ATOM 0 HB2 PHE A 13 -14.335 2.653 -1.883 1.00 12.13 H new ATOM 0 HB3 PHE A 13 -15.492 2.313 -3.155 1.00 12.13 H new ATOM 0 HD1 PHE A 13 -15.235 3.560 0.377 1.00 61.44 H new ATOM 0 HD2 PHE A 13 -17.556 3.477 -3.245 1.00 64.51 H new ATOM 0 HE1 PHE A 13 -16.892 5.089 1.405 1.00 21.30 H new ATOM 0 HE2 PHE A 13 -19.100 5.165 -2.281 1.00 61.53 H new ATOM 0 HZ PHE A 13 -18.834 5.890 0.080 1.00 51.23 H new ATOM 176 N LYS A 14 -16.282 0.894 0.778 1.00 32.11 N ATOM 177 CA LYS A 14 -16.200 0.774 2.219 1.00 45.11 C ATOM 178 C LYS A 14 -16.072 -0.691 2.595 1.00 11.25 C ATOM 179 O LYS A 14 -15.122 -1.011 3.300 1.00 62.34 O ATOM 180 CB LYS A 14 -17.424 1.439 2.860 1.00 73.04 C ATOM 181 CG LYS A 14 -17.261 1.603 4.374 1.00 4.42 C ATOM 182 CD LYS A 14 -16.087 2.537 4.704 1.00 1.31 C ATOM 183 CE LYS A 14 -16.203 2.991 6.153 1.00 63.05 C ATOM 184 NZ LYS A 14 -15.650 4.343 6.342 1.00 31.12 N ATOM 0 H LYS A 14 -17.240 0.994 0.442 1.00 32.11 H new ATOM 0 HA LYS A 14 -15.316 1.288 2.597 1.00 45.11 H new ATOM 0 HB2 LYS A 14 -17.586 2.416 2.405 1.00 73.04 H new ATOM 0 HB3 LYS A 14 -18.311 0.841 2.654 1.00 73.04 H new ATOM 0 HG2 LYS A 14 -18.180 2.004 4.801 1.00 4.42 H new ATOM 0 HG3 LYS A 14 -17.095 0.628 4.833 1.00 4.42 H new ATOM 0 HD2 LYS A 14 -15.140 2.021 4.546 1.00 1.31 H new ATOM 0 HD3 LYS A 14 -16.094 3.400 4.038 1.00 1.31 H new ATOM 0 HE2 LYS A 14 -17.250 2.980 6.456 1.00 63.05 H new ATOM 0 HE3 LYS A 14 -15.677 2.288 6.799 1.00 63.05 H new ATOM 0 HZ1 LYS A 14 -15.745 4.621 7.340 1.00 31.12 H new ATOM 0 HZ2 LYS A 14 -14.645 4.347 6.076 1.00 31.12 H new ATOM 0 HZ3 LYS A 14 -16.169 5.017 5.744 1.00 31.12 H new ATOM 198 N SER A 15 -16.928 -1.568 2.057 1.00 65.03 N ATOM 199 CA SER A 15 -16.951 -3.004 2.316 1.00 43.12 C ATOM 200 C SER A 15 -15.530 -3.551 2.274 1.00 64.04 C ATOM 201 O SER A 15 -15.037 -4.091 3.262 1.00 51.32 O ATOM 202 CB SER A 15 -17.800 -3.752 1.267 1.00 42.32 C ATOM 203 OG SER A 15 -18.065 -5.082 1.677 1.00 70.31 O ATOM 0 H SER A 15 -17.654 -1.279 1.401 1.00 65.03 H new ATOM 0 HA SER A 15 -17.394 -3.160 3.300 1.00 43.12 H new ATOM 0 HB2 SER A 15 -18.740 -3.222 1.111 1.00 42.32 H new ATOM 0 HB3 SER A 15 -17.277 -3.761 0.311 1.00 42.32 H new ATOM 0 HG SER A 15 -17.749 -5.705 0.990 1.00 70.31 H new ATOM 209 N PHE A 16 -14.841 -3.416 1.132 1.00 11.12 N ATOM 210 CA PHE A 16 -13.535 -4.046 0.983 1.00 11.15 C ATOM 211 C PHE A 16 -12.456 -3.361 1.835 1.00 71.21 C ATOM 212 O PHE A 16 -11.417 -3.972 2.096 1.00 61.24 O ATOM 213 CB PHE A 16 -13.147 -4.143 -0.501 1.00 34.11 C ATOM 214 CG PHE A 16 -12.282 -3.017 -1.028 1.00 14.55 C ATOM 215 CD1 PHE A 16 -12.664 -1.679 -0.837 1.00 51.24 C ATOM 216 CD2 PHE A 16 -11.064 -3.306 -1.668 1.00 22.45 C ATOM 217 CE1 PHE A 16 -11.798 -0.640 -1.208 1.00 74.31 C ATOM 218 CE2 PHE A 16 -10.226 -2.263 -2.100 1.00 22.13 C ATOM 219 CZ PHE A 16 -10.586 -0.928 -1.848 1.00 31.13 C ATOM 0 H PHE A 16 -15.162 -2.888 0.320 1.00 11.12 H new ATOM 0 HA PHE A 16 -13.609 -5.063 1.368 1.00 11.15 H new ATOM 0 HB2 PHE A 16 -12.622 -5.085 -0.660 1.00 34.11 H new ATOM 0 HB3 PHE A 16 -14.060 -4.183 -1.095 1.00 34.11 H new ATOM 0 HD1 PHE A 16 -13.626 -1.450 -0.404 1.00 51.24 H new ATOM 0 HD2 PHE A 16 -10.771 -4.333 -1.828 1.00 22.45 H new ATOM 0 HE1 PHE A 16 -12.067 0.385 -1.000 1.00 74.31 H new ATOM 0 HE2 PHE A 16 -9.308 -2.487 -2.624 1.00 22.13 H new ATOM 0 HZ PHE A 16 -9.929 -0.125 -2.148 1.00 31.13 H new ATOM 229 N LEU A 17 -12.666 -2.107 2.251 1.00 54.22 N ATOM 230 CA LEU A 17 -11.752 -1.388 3.127 1.00 24.22 C ATOM 231 C LEU A 17 -11.882 -2.004 4.511 1.00 1.23 C ATOM 232 O LEU A 17 -10.941 -2.625 4.995 1.00 43.30 O ATOM 233 CB LEU A 17 -12.080 0.119 3.136 1.00 62.02 C ATOM 234 CG LEU A 17 -10.894 1.077 3.333 1.00 62.41 C ATOM 235 CD1 LEU A 17 -10.210 0.924 4.688 1.00 45.15 C ATOM 236 CD2 LEU A 17 -9.874 0.946 2.198 1.00 33.24 C ATOM 0 H LEU A 17 -13.486 -1.563 1.983 1.00 54.22 H new ATOM 0 HA LEU A 17 -10.723 -1.475 2.778 1.00 24.22 H new ATOM 0 HB2 LEU A 17 -12.567 0.368 2.193 1.00 62.02 H new ATOM 0 HB3 LEU A 17 -12.805 0.306 3.928 1.00 62.02 H new ATOM 0 HG LEU A 17 -11.319 2.080 3.309 1.00 62.41 H new ATOM 0 HD11 LEU A 17 -9.382 1.630 4.760 1.00 45.15 H new ATOM 0 HD12 LEU A 17 -10.928 1.125 5.483 1.00 45.15 H new ATOM 0 HD13 LEU A 17 -9.830 -0.092 4.791 1.00 45.15 H new ATOM 0 HD21 LEU A 17 -9.049 1.637 2.369 1.00 33.24 H new ATOM 0 HD22 LEU A 17 -9.492 -0.074 2.168 1.00 33.24 H new ATOM 0 HD23 LEU A 17 -10.354 1.182 1.248 1.00 33.24 H new ATOM 248 N ASP A 18 -13.078 -1.912 5.091 1.00 32.42 N ATOM 249 CA ASP A 18 -13.376 -2.398 6.432 1.00 72.21 C ATOM 250 C ASP A 18 -13.101 -3.907 6.526 1.00 33.23 C ATOM 251 O ASP A 18 -12.687 -4.390 7.576 1.00 63.30 O ATOM 252 CB ASP A 18 -14.821 -2.027 6.834 1.00 52.50 C ATOM 253 CG ASP A 18 -15.016 -0.559 7.290 1.00 11.54 C ATOM 254 OD1 ASP A 18 -14.035 0.120 7.698 1.00 14.33 O ATOM 255 OD2 ASP A 18 -16.177 -0.084 7.280 1.00 22.02 O ATOM 0 H ASP A 18 -13.882 -1.488 4.629 1.00 32.42 H new ATOM 0 HA ASP A 18 -12.716 -1.909 7.149 1.00 72.21 H new ATOM 0 HB2 ASP A 18 -15.479 -2.219 5.986 1.00 52.50 H new ATOM 0 HB3 ASP A 18 -15.139 -2.688 7.640 1.00 52.50 H new ATOM 260 N LYS A 19 -13.243 -4.671 5.431 1.00 52.20 N ATOM 261 CA LYS A 19 -12.856 -6.076 5.404 1.00 32.23 C ATOM 262 C LYS A 19 -11.349 -6.290 5.405 1.00 4.44 C ATOM 263 O LYS A 19 -10.909 -7.205 6.101 1.00 62.01 O ATOM 264 CB LYS A 19 -13.482 -6.816 4.213 1.00 23.43 C ATOM 265 CG LYS A 19 -14.726 -7.584 4.669 1.00 62.12 C ATOM 266 CD LYS A 19 -15.361 -8.374 3.521 1.00 43.32 C ATOM 267 CE LYS A 19 -16.298 -9.451 4.080 1.00 52.40 C ATOM 268 NZ LYS A 19 -17.139 -10.042 3.021 1.00 14.44 N ATOM 0 H LYS A 19 -13.627 -4.328 4.550 1.00 52.20 H new ATOM 0 HA LYS A 19 -13.245 -6.495 6.332 1.00 32.23 H new ATOM 0 HB2 LYS A 19 -13.750 -6.104 3.432 1.00 23.43 H new ATOM 0 HB3 LYS A 19 -12.757 -7.506 3.781 1.00 23.43 H new ATOM 0 HG2 LYS A 19 -14.456 -8.267 5.474 1.00 62.12 H new ATOM 0 HG3 LYS A 19 -15.456 -6.884 5.076 1.00 62.12 H new ATOM 0 HD2 LYS A 19 -15.916 -7.700 2.869 1.00 43.32 H new ATOM 0 HD3 LYS A 19 -14.583 -8.837 2.913 1.00 43.32 H new ATOM 0 HE2 LYS A 19 -15.709 -10.234 4.557 1.00 52.40 H new ATOM 0 HE3 LYS A 19 -16.934 -9.016 4.851 1.00 52.40 H new ATOM 0 HZ1 LYS A 19 -17.760 -10.766 3.435 1.00 14.44 H new ATOM 0 HZ2 LYS A 19 -17.719 -9.298 2.582 1.00 14.44 H new ATOM 0 HZ3 LYS A 19 -16.532 -10.479 2.298 1.00 14.44 H new ATOM 282 N PHE A 20 -10.546 -5.577 4.597 1.00 4.45 N ATOM 283 CA PHE A 20 -9.132 -5.979 4.521 1.00 11.14 C ATOM 284 C PHE A 20 -8.386 -5.376 5.719 1.00 65.00 C ATOM 285 O PHE A 20 -7.331 -5.899 6.086 1.00 65.30 O ATOM 286 CB PHE A 20 -8.417 -5.653 3.192 1.00 34.13 C ATOM 287 CG PHE A 20 -7.569 -4.390 3.139 1.00 70.33 C ATOM 288 CD1 PHE A 20 -8.113 -3.120 3.366 1.00 61.32 C ATOM 289 CD2 PHE A 20 -6.184 -4.502 2.905 1.00 11.21 C ATOM 290 CE1 PHE A 20 -7.286 -1.987 3.369 1.00 50.42 C ATOM 291 CE2 PHE A 20 -5.343 -3.379 2.940 1.00 52.40 C ATOM 292 CZ PHE A 20 -5.902 -2.112 3.152 1.00 21.21 C ATOM 0 H PHE A 20 -10.822 -4.778 4.026 1.00 4.45 H new ATOM 0 HA PHE A 20 -9.118 -7.068 4.556 1.00 11.14 H new ATOM 0 HB2 PHE A 20 -7.777 -6.498 2.939 1.00 34.13 H new ATOM 0 HB3 PHE A 20 -9.175 -5.582 2.412 1.00 34.13 H new ATOM 0 HD1 PHE A 20 -9.174 -3.012 3.539 1.00 61.32 H new ATOM 0 HD2 PHE A 20 -5.761 -5.473 2.694 1.00 11.21 H new ATOM 0 HE1 PHE A 20 -7.715 -1.011 3.539 1.00 50.42 H new ATOM 0 HE2 PHE A 20 -4.277 -3.490 2.805 1.00 52.40 H new ATOM 0 HZ PHE A 20 -5.272 -1.234 3.149 1.00 21.21 H new ATOM 302 N THR A 21 -8.914 -4.314 6.346 1.00 13.33 N ATOM 303 CA THR A 21 -8.438 -3.889 7.651 1.00 23.03 C ATOM 304 C THR A 21 -8.773 -4.988 8.667 1.00 53.20 C ATOM 305 O THR A 21 -7.874 -5.405 9.379 1.00 24.35 O ATOM 306 CB THR A 21 -9.016 -2.519 8.039 1.00 4.42 C ATOM 307 OG1 THR A 21 -10.418 -2.544 8.006 1.00 41.53 O ATOM 308 CG2 THR A 21 -8.574 -1.378 7.115 1.00 65.10 C ATOM 0 H THR A 21 -9.667 -3.742 5.964 1.00 13.33 H new ATOM 0 HA THR A 21 -7.357 -3.751 7.632 1.00 23.03 H new ATOM 0 HB THR A 21 -8.633 -2.330 9.042 1.00 4.42 H new ATOM 0 HG1 THR A 21 -10.723 -2.554 7.075 1.00 41.53 H new ATOM 0 HG21 THR A 21 -9.022 -0.443 7.452 1.00 65.10 H new ATOM 0 HG22 THR A 21 -7.488 -1.290 7.140 1.00 65.10 H new ATOM 0 HG23 THR A 21 -8.898 -1.589 6.096 1.00 65.10 H new ATOM 316 N SER A 22 -10.013 -5.508 8.681 1.00 64.03 N ATOM 317 CA SER A 22 -10.490 -6.587 9.554 1.00 1.55 C ATOM 318 C SER A 22 -9.733 -7.912 9.361 1.00 53.22 C ATOM 319 O SER A 22 -9.873 -8.815 10.187 1.00 5.52 O ATOM 320 CB SER A 22 -12.003 -6.751 9.283 1.00 64.10 C ATOM 321 OG SER A 22 -12.681 -7.767 10.003 1.00 72.34 O ATOM 0 H SER A 22 -10.742 -5.169 8.053 1.00 64.03 H new ATOM 0 HA SER A 22 -10.302 -6.317 10.593 1.00 1.55 H new ATOM 0 HB2 SER A 22 -12.490 -5.800 9.499 1.00 64.10 H new ATOM 0 HB3 SER A 22 -12.137 -6.943 8.219 1.00 64.10 H new ATOM 0 HG SER A 22 -12.034 -8.432 10.318 1.00 72.34 H new ATOM 327 N SER A 23 -8.959 -8.082 8.283 1.00 5.55 N ATOM 328 CA SER A 23 -8.480 -9.394 7.890 1.00 70.31 C ATOM 329 C SER A 23 -7.162 -9.279 7.123 1.00 5.24 C ATOM 330 O SER A 23 -7.130 -9.165 5.891 1.00 12.25 O ATOM 331 CB SER A 23 -9.605 -10.056 7.084 1.00 21.13 C ATOM 332 OG SER A 23 -9.467 -11.460 6.980 1.00 62.33 O ATOM 0 H SER A 23 -8.656 -7.322 7.673 1.00 5.55 H new ATOM 0 HA SER A 23 -8.250 -10.019 8.753 1.00 70.31 H new ATOM 0 HB2 SER A 23 -10.562 -9.826 7.552 1.00 21.13 H new ATOM 0 HB3 SER A 23 -9.628 -9.625 6.083 1.00 21.13 H new ATOM 0 HG SER A 23 -10.212 -11.824 6.458 1.00 62.33 H new ATOM 338 N ALA A 24 -6.053 -9.390 7.856 1.00 33.02 N ATOM 339 CA ALA A 24 -4.720 -9.640 7.330 1.00 31.33 C ATOM 340 C ALA A 24 -4.752 -10.768 6.299 1.00 64.01 C ATOM 341 O ALA A 24 -4.199 -10.639 5.207 1.00 52.10 O ATOM 342 CB ALA A 24 -3.806 -10.018 8.490 1.00 22.43 C ATOM 0 H ALA A 24 -6.065 -9.304 8.872 1.00 33.02 H new ATOM 0 HA ALA A 24 -4.348 -8.743 6.836 1.00 31.33 H new ATOM 0 HB1 ALA A 24 -2.801 -10.209 8.114 1.00 22.43 H new ATOM 0 HB2 ALA A 24 -3.775 -9.200 9.210 1.00 22.43 H new ATOM 0 HB3 ALA A 24 -4.188 -10.915 8.977 1.00 22.43 H new ATOM 348 N ALA A 25 -5.385 -11.895 6.634 1.00 61.12 N ATOM 349 CA ALA A 25 -5.461 -13.063 5.763 1.00 14.42 C ATOM 350 C ALA A 25 -6.168 -12.780 4.425 1.00 44.10 C ATOM 351 O ALA A 25 -6.002 -13.552 3.478 1.00 54.14 O ATOM 352 CB ALA A 25 -6.162 -14.186 6.528 1.00 12.54 C ATOM 0 H ALA A 25 -5.863 -12.020 7.527 1.00 61.12 H new ATOM 0 HA ALA A 25 -4.446 -13.356 5.495 1.00 14.42 H new ATOM 0 HB1 ALA A 25 -6.230 -15.070 5.895 1.00 12.54 H new ATOM 0 HB2 ALA A 25 -5.592 -14.425 7.426 1.00 12.54 H new ATOM 0 HB3 ALA A 25 -7.164 -13.864 6.810 1.00 12.54 H new ATOM 358 N PHE A 26 -6.933 -11.692 4.310 1.00 42.24 N ATOM 359 CA PHE A 26 -7.665 -11.337 3.099 1.00 25.02 C ATOM 360 C PHE A 26 -6.834 -10.460 2.160 1.00 52.13 C ATOM 361 O PHE A 26 -7.034 -10.528 0.950 1.00 42.20 O ATOM 362 CB PHE A 26 -8.956 -10.620 3.504 1.00 45.54 C ATOM 363 CG PHE A 26 -9.971 -10.439 2.396 1.00 73.11 C ATOM 364 CD1 PHE A 26 -10.781 -11.523 2.006 1.00 13.21 C ATOM 365 CD2 PHE A 26 -10.145 -9.180 1.789 1.00 62.32 C ATOM 366 CE1 PHE A 26 -11.767 -11.344 1.021 1.00 61.44 C ATOM 367 CE2 PHE A 26 -11.128 -9.007 0.800 1.00 51.12 C ATOM 368 CZ PHE A 26 -11.940 -10.088 0.416 1.00 1.43 C ATOM 0 H PHE A 26 -7.061 -11.024 5.070 1.00 42.24 H new ATOM 0 HA PHE A 26 -7.896 -12.249 2.549 1.00 25.02 H new ATOM 0 HB2 PHE A 26 -9.423 -11.179 4.315 1.00 45.54 H new ATOM 0 HB3 PHE A 26 -8.698 -9.638 3.901 1.00 45.54 H new ATOM 0 HD1 PHE A 26 -10.644 -12.492 2.464 1.00 13.21 H new ATOM 0 HD2 PHE A 26 -9.523 -8.348 2.084 1.00 62.32 H new ATOM 0 HE1 PHE A 26 -12.393 -12.174 0.728 1.00 61.44 H new ATOM 0 HE2 PHE A 26 -11.260 -8.042 0.334 1.00 51.12 H new ATOM 0 HZ PHE A 26 -12.696 -9.953 -0.343 1.00 1.43 H new ATOM 378 N GLN A 27 -5.889 -9.660 2.678 1.00 34.11 N ATOM 379 CA GLN A 27 -5.269 -8.574 1.908 1.00 5.35 C ATOM 380 C GLN A 27 -4.614 -9.064 0.606 1.00 32.33 C ATOM 381 O GLN A 27 -4.678 -8.383 -0.417 1.00 44.44 O ATOM 382 CB GLN A 27 -4.244 -7.792 2.752 1.00 62.41 C ATOM 383 CG GLN A 27 -4.729 -7.343 4.136 1.00 25.44 C ATOM 384 CD GLN A 27 -3.882 -6.200 4.705 1.00 61.13 C ATOM 385 OE1 GLN A 27 -2.813 -5.866 4.187 1.00 1.12 O ATOM 386 NE2 GLN A 27 -4.365 -5.589 5.766 1.00 71.21 N ATOM 0 H GLN A 27 -5.537 -9.747 3.631 1.00 34.11 H new ATOM 0 HA GLN A 27 -6.083 -7.904 1.634 1.00 5.35 H new ATOM 0 HB2 GLN A 27 -3.358 -8.413 2.881 1.00 62.41 H new ATOM 0 HB3 GLN A 27 -3.936 -6.910 2.191 1.00 62.41 H new ATOM 0 HG2 GLN A 27 -5.769 -7.023 4.068 1.00 25.44 H new ATOM 0 HG3 GLN A 27 -4.700 -8.190 4.821 1.00 25.44 H new ATOM 0 HE21 GLN A 27 -5.252 -5.891 6.169 1.00 71.21 H new ATOM 0 HE22 GLN A 27 -3.852 -4.813 6.185 1.00 71.21 H new ATOM 395 N TYR A 28 -4.030 -10.264 0.642 1.00 70.33 N ATOM 396 CA TYR A 28 -3.383 -10.949 -0.473 1.00 33.05 C ATOM 397 C TYR A 28 -4.330 -11.135 -1.666 1.00 33.14 C ATOM 398 O TYR A 28 -3.980 -10.806 -2.799 1.00 52.41 O ATOM 399 CB TYR A 28 -2.865 -12.307 0.022 1.00 23.21 C ATOM 400 CG TYR A 28 -2.032 -12.233 1.288 1.00 42.51 C ATOM 401 CD1 TYR A 28 -0.647 -11.983 1.197 1.00 32.34 C ATOM 402 CD2 TYR A 28 -2.636 -12.407 2.553 1.00 22.02 C ATOM 403 CE1 TYR A 28 0.132 -11.884 2.364 1.00 14.53 C ATOM 404 CE2 TYR A 28 -1.854 -12.332 3.716 1.00 41.21 C ATOM 405 CZ TYR A 28 -0.474 -12.055 3.630 1.00 73.40 C ATOM 406 OH TYR A 28 0.243 -11.953 4.776 1.00 44.54 O ATOM 0 H TYR A 28 -3.996 -10.813 1.501 1.00 70.33 H new ATOM 0 HA TYR A 28 -2.555 -10.335 -0.827 1.00 33.05 H new ATOM 0 HB2 TYR A 28 -3.716 -12.965 0.199 1.00 23.21 H new ATOM 0 HB3 TYR A 28 -2.267 -12.764 -0.766 1.00 23.21 H new ATOM 0 HD1 TYR A 28 -0.183 -11.867 0.229 1.00 32.34 H new ATOM 0 HD2 TYR A 28 -3.697 -12.597 2.625 1.00 22.02 H new ATOM 0 HE1 TYR A 28 1.190 -11.678 2.293 1.00 14.53 H new ATOM 0 HE2 TYR A 28 -2.312 -12.487 4.682 1.00 41.21 H new ATOM 0 HH TYR A 28 -0.346 -12.101 5.545 1.00 44.54 H new ATOM 416 N THR A 29 -5.542 -11.651 -1.442 1.00 13.24 N ATOM 417 CA THR A 29 -6.487 -12.027 -2.495 1.00 51.42 C ATOM 418 C THR A 29 -7.274 -10.794 -2.991 1.00 70.43 C ATOM 419 O THR A 29 -8.488 -10.838 -3.202 1.00 14.31 O ATOM 420 CB THR A 29 -7.306 -13.248 -2.014 1.00 62.43 C ATOM 421 OG1 THR A 29 -8.110 -13.786 -3.045 1.00 2.24 O ATOM 422 CG2 THR A 29 -8.149 -13.046 -0.752 1.00 23.24 C ATOM 0 H THR A 29 -5.900 -11.822 -0.503 1.00 13.24 H new ATOM 0 HA THR A 29 -5.984 -12.367 -3.401 1.00 51.42 H new ATOM 0 HB THR A 29 -6.530 -13.959 -1.730 1.00 62.43 H new ATOM 0 HG1 THR A 29 -8.625 -13.067 -3.467 1.00 2.24 H new ATOM 0 HG21 THR A 29 -8.676 -13.970 -0.515 1.00 23.24 H new ATOM 0 HG22 THR A 29 -7.499 -12.775 0.080 1.00 23.24 H new ATOM 0 HG23 THR A 29 -8.873 -12.249 -0.922 1.00 23.24 H new ATOM 430 N ARG A 30 -6.586 -9.658 -3.143 1.00 10.25 N ATOM 431 CA ARG A 30 -7.139 -8.346 -3.462 1.00 2.35 C ATOM 432 C ARG A 30 -6.037 -7.480 -4.104 1.00 5.04 C ATOM 433 O ARG A 30 -5.973 -6.274 -3.871 1.00 14.25 O ATOM 434 CB ARG A 30 -7.725 -7.778 -2.148 1.00 10.34 C ATOM 435 CG ARG A 30 -8.455 -6.425 -2.264 1.00 42.42 C ATOM 436 CD ARG A 30 -8.017 -5.412 -1.197 1.00 10.15 C ATOM 437 NE ARG A 30 -6.557 -5.210 -1.170 1.00 54.51 N ATOM 438 CZ ARG A 30 -5.905 -4.281 -0.460 1.00 30.45 C ATOM 439 NH1 ARG A 30 -6.570 -3.327 0.179 1.00 33.24 N ATOM 440 NH2 ARG A 30 -4.575 -4.308 -0.395 1.00 41.22 N ATOM 0 H ARG A 30 -5.572 -9.632 -3.040 1.00 10.25 H new ATOM 0 HA ARG A 30 -7.944 -8.380 -4.196 1.00 2.35 H new ATOM 0 HB2 ARG A 30 -8.421 -8.510 -1.737 1.00 10.34 H new ATOM 0 HB3 ARG A 30 -6.914 -7.670 -1.428 1.00 10.34 H new ATOM 0 HG2 ARG A 30 -8.273 -6.004 -3.253 1.00 42.42 H new ATOM 0 HG3 ARG A 30 -9.529 -6.590 -2.181 1.00 42.42 H new ATOM 0 HD2 ARG A 30 -8.508 -4.457 -1.385 1.00 10.15 H new ATOM 0 HD3 ARG A 30 -8.350 -5.755 -0.218 1.00 10.15 H new ATOM 0 HE ARG A 30 -5.992 -5.835 -1.745 1.00 54.51 H new ATOM 0 HH11 ARG A 30 -7.588 -3.296 0.132 1.00 33.24 H new ATOM 0 HH12 ARG A 30 -6.063 -2.624 0.717 1.00 33.24 H new ATOM 0 HH21 ARG A 30 -4.055 -5.036 -0.886 1.00 41.22 H new ATOM 0 HH22 ARG A 30 -4.076 -3.601 0.145 1.00 41.22 H new ATOM 454 N VAL A 31 -5.116 -8.070 -4.872 1.00 21.11 N ATOM 455 CA VAL A 31 -4.002 -7.360 -5.505 1.00 33.55 C ATOM 456 C VAL A 31 -3.847 -7.886 -6.936 1.00 73.41 C ATOM 457 O VAL A 31 -3.827 -9.102 -7.151 1.00 42.43 O ATOM 458 CB VAL A 31 -2.698 -7.504 -4.685 1.00 52.32 C ATOM 459 CG1 VAL A 31 -1.703 -6.426 -5.136 1.00 73.30 C ATOM 460 CG2 VAL A 31 -2.881 -7.362 -3.162 1.00 70.24 C ATOM 0 H VAL A 31 -5.124 -9.070 -5.074 1.00 21.11 H new ATOM 0 HA VAL A 31 -4.215 -6.292 -5.538 1.00 33.55 H new ATOM 0 HB VAL A 31 -2.341 -8.516 -4.873 1.00 52.32 H new ATOM 0 HG11 VAL A 31 -0.780 -6.520 -4.563 1.00 73.30 H new ATOM 0 HG12 VAL A 31 -1.486 -6.552 -6.197 1.00 73.30 H new ATOM 0 HG13 VAL A 31 -2.135 -5.439 -4.969 1.00 73.30 H new ATOM 0 HG21 VAL A 31 -1.917 -7.477 -2.667 1.00 70.24 H new ATOM 0 HG22 VAL A 31 -3.290 -6.378 -2.935 1.00 70.24 H new ATOM 0 HG23 VAL A 31 -3.566 -8.131 -2.805 1.00 70.24 H new ATOM 470 N LYS A 32 -3.824 -6.968 -7.907 1.00 24.42 N ATOM 471 CA LYS A 32 -3.591 -7.189 -9.337 1.00 22.44 C ATOM 472 C LYS A 32 -2.086 -7.342 -9.576 1.00 44.11 C ATOM 473 O LYS A 32 -1.284 -7.208 -8.643 1.00 11.32 O ATOM 474 CB LYS A 32 -4.137 -5.969 -10.115 1.00 1.13 C ATOM 475 CG LYS A 32 -5.510 -6.150 -10.787 1.00 23.55 C ATOM 476 CD LYS A 32 -5.413 -6.831 -12.160 1.00 30.15 C ATOM 477 CE LYS A 32 -6.702 -6.603 -12.955 1.00 12.44 C ATOM 478 NZ LYS A 32 -6.645 -7.152 -14.323 1.00 73.14 N ATOM 0 H LYS A 32 -3.979 -5.981 -7.699 1.00 24.42 H new ATOM 0 HA LYS A 32 -4.097 -8.092 -9.678 1.00 22.44 H new ATOM 0 HB2 LYS A 32 -4.200 -5.125 -9.428 1.00 1.13 H new ATOM 0 HB3 LYS A 32 -3.412 -5.701 -10.884 1.00 1.13 H new ATOM 0 HG2 LYS A 32 -6.153 -6.743 -10.137 1.00 23.55 H new ATOM 0 HG3 LYS A 32 -5.985 -5.176 -10.902 1.00 23.55 H new ATOM 0 HD2 LYS A 32 -4.561 -6.433 -12.712 1.00 30.15 H new ATOM 0 HD3 LYS A 32 -5.240 -7.900 -12.033 1.00 30.15 H new ATOM 0 HE2 LYS A 32 -7.536 -7.059 -12.422 1.00 12.44 H new ATOM 0 HE3 LYS A 32 -6.904 -5.533 -13.008 1.00 12.44 H new ATOM 0 HZ1 LYS A 32 -7.545 -6.966 -14.809 1.00 73.14 H new ATOM 0 HZ2 LYS A 32 -5.869 -6.699 -14.847 1.00 73.14 H new ATOM 0 HZ3 LYS A 32 -6.481 -8.178 -14.279 1.00 73.14 H new ATOM 492 N PHE A 33 -1.687 -7.608 -10.820 1.00 74.44 N ATOM 493 CA PHE A 33 -0.292 -7.583 -11.230 1.00 30.42 C ATOM 494 C PHE A 33 -0.184 -7.358 -12.745 1.00 63.53 C ATOM 495 O PHE A 33 -1.079 -7.823 -13.457 1.00 51.31 O ATOM 496 CB PHE A 33 0.354 -8.921 -10.841 1.00 1.12 C ATOM 497 CG PHE A 33 1.818 -8.792 -10.505 1.00 43.14 C ATOM 498 CD1 PHE A 33 2.213 -7.928 -9.468 1.00 31.35 C ATOM 499 CD2 PHE A 33 2.788 -9.512 -11.225 1.00 12.11 C ATOM 500 CE1 PHE A 33 3.566 -7.795 -9.143 1.00 4.03 C ATOM 501 CE2 PHE A 33 4.145 -9.380 -10.891 1.00 12.22 C ATOM 502 CZ PHE A 33 4.539 -8.522 -9.849 1.00 61.33 C ATOM 0 H PHE A 33 -2.331 -7.848 -11.573 1.00 74.44 H new ATOM 0 HA PHE A 33 0.225 -6.763 -10.731 1.00 30.42 H new ATOM 0 HB2 PHE A 33 -0.175 -9.338 -9.984 1.00 1.12 H new ATOM 0 HB3 PHE A 33 0.236 -9.628 -11.663 1.00 1.12 H new ATOM 0 HD1 PHE A 33 1.470 -7.366 -8.922 1.00 31.35 H new ATOM 0 HD2 PHE A 33 2.490 -10.164 -12.032 1.00 12.11 H new ATOM 0 HE1 PHE A 33 3.865 -7.131 -8.346 1.00 4.03 H new ATOM 0 HE2 PHE A 33 4.890 -9.940 -11.437 1.00 12.22 H new ATOM 0 HZ PHE A 33 5.583 -8.422 -9.593 1.00 61.33 H new ATOM 512 N PRO A 34 0.896 -6.744 -13.274 1.00 13.33 N ATOM 513 CA PRO A 34 1.958 -6.046 -12.543 1.00 62.44 C ATOM 514 C PRO A 34 1.416 -4.812 -11.811 1.00 34.15 C ATOM 515 O PRO A 34 0.308 -4.354 -12.104 1.00 74.52 O ATOM 516 CB PRO A 34 3.001 -5.677 -13.603 1.00 23.35 C ATOM 517 CG PRO A 34 2.184 -5.535 -14.879 1.00 42.11 C ATOM 518 CD PRO A 34 1.106 -6.600 -14.708 1.00 23.23 C ATOM 0 HA PRO A 34 2.393 -6.670 -11.762 1.00 62.44 H new ATOM 0 HB2 PRO A 34 3.516 -4.750 -13.352 1.00 23.35 H new ATOM 0 HB3 PRO A 34 3.764 -6.449 -13.700 1.00 23.35 H new ATOM 0 HG2 PRO A 34 1.756 -4.537 -14.976 1.00 42.11 H new ATOM 0 HG3 PRO A 34 2.789 -5.710 -15.769 1.00 42.11 H new ATOM 0 HD2 PRO A 34 0.184 -6.303 -15.208 1.00 23.23 H new ATOM 0 HD3 PRO A 34 1.419 -7.545 -15.152 1.00 23.23 H new ATOM 526 N LEU A 35 2.171 -4.301 -10.835 1.00 44.00 N ATOM 527 CA LEU A 35 1.846 -3.042 -10.155 1.00 33.53 C ATOM 528 C LEU A 35 2.470 -1.878 -10.924 1.00 12.25 C ATOM 529 O LEU A 35 3.126 -2.094 -11.945 1.00 32.22 O ATOM 530 CB LEU A 35 2.338 -3.066 -8.702 1.00 53.33 C ATOM 531 CG LEU A 35 1.632 -4.103 -7.814 1.00 32.45 C ATOM 532 CD1 LEU A 35 2.382 -4.139 -6.492 1.00 14.02 C ATOM 533 CD2 LEU A 35 0.149 -3.864 -7.547 1.00 31.55 C ATOM 0 H LEU A 35 3.023 -4.746 -10.494 1.00 44.00 H new ATOM 0 HA LEU A 35 0.764 -2.914 -10.133 1.00 33.53 H new ATOM 0 HB2 LEU A 35 3.409 -3.269 -8.696 1.00 53.33 H new ATOM 0 HB3 LEU A 35 2.198 -2.076 -8.267 1.00 53.33 H new ATOM 0 HG LEU A 35 1.655 -5.047 -8.359 1.00 32.45 H new ATOM 0 HD11 LEU A 35 1.913 -4.865 -5.828 1.00 14.02 H new ATOM 0 HD12 LEU A 35 3.419 -4.426 -6.669 1.00 14.02 H new ATOM 0 HD13 LEU A 35 2.352 -3.152 -6.030 1.00 14.02 H new ATOM 0 HD21 LEU A 35 -0.239 -4.659 -6.910 1.00 31.55 H new ATOM 0 HD22 LEU A 35 0.019 -2.904 -7.048 1.00 31.55 H new ATOM 0 HD23 LEU A 35 -0.395 -3.858 -8.492 1.00 31.55 H new ATOM 545 N LYS A 36 2.274 -0.638 -10.470 1.00 24.44 N ATOM 546 CA LYS A 36 2.746 0.525 -11.237 1.00 2.23 C ATOM 547 C LYS A 36 4.195 0.826 -10.895 1.00 24.10 C ATOM 548 O LYS A 36 5.017 0.975 -11.803 1.00 25.14 O ATOM 549 CB LYS A 36 1.882 1.779 -11.022 1.00 71.25 C ATOM 550 CG LYS A 36 0.379 1.519 -10.908 1.00 62.41 C ATOM 551 CD LYS A 36 -0.218 0.650 -12.032 1.00 73.45 C ATOM 552 CE LYS A 36 -1.746 0.762 -12.132 1.00 1.42 C ATOM 553 NZ LYS A 36 -2.187 2.111 -12.538 1.00 32.21 N ATOM 0 H LYS A 36 1.802 -0.412 -9.594 1.00 24.44 H new ATOM 0 HA LYS A 36 2.661 0.260 -12.291 1.00 2.23 H new ATOM 0 HB2 LYS A 36 2.218 2.282 -10.115 1.00 71.25 H new ATOM 0 HB3 LYS A 36 2.054 2.467 -11.850 1.00 71.25 H new ATOM 0 HG2 LYS A 36 0.181 1.036 -9.951 1.00 62.41 H new ATOM 0 HG3 LYS A 36 -0.140 2.477 -10.895 1.00 62.41 H new ATOM 0 HD2 LYS A 36 0.225 0.943 -12.984 1.00 73.45 H new ATOM 0 HD3 LYS A 36 0.054 -0.392 -11.861 1.00 73.45 H new ATOM 0 HE2 LYS A 36 -2.115 0.031 -12.851 1.00 1.42 H new ATOM 0 HE3 LYS A 36 -2.190 0.513 -11.168 1.00 1.42 H new ATOM 0 HZ1 LYS A 36 -3.052 2.036 -13.111 1.00 32.21 H new ATOM 0 HZ2 LYS A 36 -2.381 2.682 -11.691 1.00 32.21 H new ATOM 0 HZ3 LYS A 36 -1.439 2.567 -13.099 1.00 32.21 H new ATOM 567 N THR A 37 4.495 0.921 -9.605 1.00 10.22 N ATOM 568 CA THR A 37 5.793 1.310 -9.062 1.00 74.34 C ATOM 569 C THR A 37 6.395 0.119 -8.301 1.00 13.00 C ATOM 570 O THR A 37 6.036 -0.117 -7.146 1.00 71.51 O ATOM 571 CB THR A 37 5.737 2.664 -8.334 1.00 62.43 C ATOM 572 OG1 THR A 37 6.921 2.904 -7.611 1.00 72.22 O ATOM 573 CG2 THR A 37 4.529 2.877 -7.437 1.00 2.22 C ATOM 0 H THR A 37 3.810 0.720 -8.876 1.00 10.22 H new ATOM 0 HA THR A 37 6.505 1.526 -9.858 1.00 74.34 H new ATOM 0 HB THR A 37 5.632 3.391 -9.139 1.00 62.43 H new ATOM 0 HG1 THR A 37 6.704 3.043 -6.665 1.00 72.22 H new ATOM 0 HG21 THR A 37 4.589 3.862 -6.973 1.00 2.22 H new ATOM 0 HG22 THR A 37 3.618 2.811 -8.032 1.00 2.22 H new ATOM 0 HG23 THR A 37 4.512 2.111 -6.661 1.00 2.22 H new ATOM 581 N PRO A 38 7.138 -0.787 -8.971 1.00 61.15 N ATOM 582 CA PRO A 38 7.788 -1.919 -8.315 1.00 63.34 C ATOM 583 C PRO A 38 8.833 -1.460 -7.280 1.00 5.45 C ATOM 584 O PRO A 38 9.083 -0.266 -7.091 1.00 42.03 O ATOM 585 CB PRO A 38 8.416 -2.724 -9.462 1.00 52.30 C ATOM 586 CG PRO A 38 8.769 -1.652 -10.483 1.00 24.21 C ATOM 587 CD PRO A 38 7.586 -0.699 -10.357 1.00 4.12 C ATOM 0 HA PRO A 38 7.084 -2.520 -7.740 1.00 63.34 H new ATOM 0 HB2 PRO A 38 9.298 -3.274 -9.133 1.00 52.30 H new ATOM 0 HB3 PRO A 38 7.719 -3.455 -9.870 1.00 52.30 H new ATOM 0 HG2 PRO A 38 9.715 -1.162 -10.251 1.00 24.21 H new ATOM 0 HG3 PRO A 38 8.860 -2.060 -11.490 1.00 24.21 H new ATOM 0 HD2 PRO A 38 7.879 0.321 -10.607 1.00 4.12 H new ATOM 0 HD3 PRO A 38 6.786 -0.978 -11.043 1.00 4.12 H new ATOM 595 N ILE A 39 9.477 -2.430 -6.624 1.00 24.32 N ATOM 596 CA ILE A 39 10.696 -2.197 -5.864 1.00 2.15 C ATOM 597 C ILE A 39 11.737 -1.707 -6.867 1.00 5.25 C ATOM 598 O ILE A 39 12.010 -2.407 -7.847 1.00 73.21 O ATOM 599 CB ILE A 39 11.187 -3.481 -5.154 1.00 5.15 C ATOM 600 CG1 ILE A 39 10.090 -4.152 -4.300 1.00 24.44 C ATOM 601 CG2 ILE A 39 12.420 -3.178 -4.284 1.00 22.14 C ATOM 602 CD1 ILE A 39 9.451 -5.326 -5.044 1.00 31.04 C ATOM 0 H ILE A 39 9.162 -3.400 -6.609 1.00 24.32 H new ATOM 0 HA ILE A 39 10.519 -1.465 -5.076 1.00 2.15 H new ATOM 0 HB ILE A 39 11.457 -4.186 -5.940 1.00 5.15 H new ATOM 0 HG12 ILE A 39 10.520 -4.503 -3.362 1.00 24.44 H new ATOM 0 HG13 ILE A 39 9.324 -3.419 -4.045 1.00 24.44 H new ATOM 0 HG21 ILE A 39 12.752 -4.092 -3.792 1.00 22.14 H new ATOM 0 HG22 ILE A 39 13.223 -2.792 -4.912 1.00 22.14 H new ATOM 0 HG23 ILE A 39 12.160 -2.435 -3.531 1.00 22.14 H new ATOM 0 HD11 ILE A 39 8.682 -5.779 -4.418 1.00 31.04 H new ATOM 0 HD12 ILE A 39 9.001 -4.968 -5.970 1.00 31.04 H new ATOM 0 HD13 ILE A 39 10.214 -6.069 -5.275 1.00 31.04 H new ATOM 614 N THR A 40 12.331 -0.556 -6.587 1.00 41.21 N ATOM 615 CA THR A 40 13.399 0.086 -7.320 1.00 70.23 C ATOM 616 C THR A 40 14.474 0.390 -6.290 1.00 65.34 C ATOM 617 O THR A 40 14.216 1.082 -5.306 1.00 30.30 O ATOM 618 CB THR A 40 12.861 1.364 -7.972 1.00 61.41 C ATOM 619 OG1 THR A 40 11.844 1.028 -8.890 1.00 12.24 O ATOM 620 CG2 THR A 40 13.955 2.141 -8.706 1.00 62.52 C ATOM 0 H THR A 40 12.051 -0.007 -5.774 1.00 41.21 H new ATOM 0 HA THR A 40 13.802 -0.535 -8.120 1.00 70.23 H new ATOM 0 HB THR A 40 12.472 2.000 -7.177 1.00 61.41 H new ATOM 0 HG1 THR A 40 11.497 1.844 -9.307 1.00 12.24 H new ATOM 0 HG21 THR A 40 13.527 3.039 -9.152 1.00 62.52 H new ATOM 0 HG22 THR A 40 14.736 2.424 -8.000 1.00 62.52 H new ATOM 0 HG23 THR A 40 14.383 1.515 -9.489 1.00 62.52 H new ATOM 628 N LEU A 41 15.662 -0.163 -6.505 1.00 23.30 N ATOM 629 CA LEU A 41 16.832 -0.017 -5.653 1.00 74.43 C ATOM 630 C LEU A 41 17.791 0.776 -6.509 1.00 62.32 C ATOM 631 O LEU A 41 18.117 0.358 -7.624 1.00 14.12 O ATOM 632 CB LEU A 41 17.387 -1.399 -5.267 1.00 74.14 C ATOM 633 CG LEU A 41 16.302 -2.303 -4.652 1.00 21.25 C ATOM 634 CD1 LEU A 41 16.847 -3.664 -4.237 1.00 34.23 C ATOM 635 CD2 LEU A 41 15.637 -1.674 -3.431 1.00 42.51 C ATOM 0 H LEU A 41 15.842 -0.753 -7.317 1.00 23.30 H new ATOM 0 HA LEU A 41 16.631 0.481 -4.705 1.00 74.43 H new ATOM 0 HB2 LEU A 41 17.804 -1.882 -6.151 1.00 74.14 H new ATOM 0 HB3 LEU A 41 18.203 -1.276 -4.555 1.00 74.14 H new ATOM 0 HG LEU A 41 15.564 -2.428 -5.445 1.00 21.25 H new ATOM 0 HD11 LEU A 41 16.043 -4.263 -3.810 1.00 34.23 H new ATOM 0 HD12 LEU A 41 17.255 -4.174 -5.110 1.00 34.23 H new ATOM 0 HD13 LEU A 41 17.634 -3.530 -3.495 1.00 34.23 H new ATOM 0 HD21 LEU A 41 14.881 -2.354 -3.038 1.00 42.51 H new ATOM 0 HD22 LEU A 41 16.388 -1.485 -2.664 1.00 42.51 H new ATOM 0 HD23 LEU A 41 15.166 -0.734 -3.717 1.00 42.51 H new ATOM 647 N LEU A 42 18.233 1.914 -6.004 1.00 72.35 N ATOM 648 CA LEU A 42 19.403 2.607 -6.485 1.00 74.12 C ATOM 649 C LEU A 42 20.544 1.616 -6.297 1.00 3.41 C ATOM 650 O LEU A 42 20.769 1.166 -5.170 1.00 51.43 O ATOM 651 CB LEU A 42 19.569 3.885 -5.650 1.00 64.42 C ATOM 652 CG LEU A 42 20.431 4.967 -6.299 1.00 23.00 C ATOM 653 CD1 LEU A 42 19.756 5.564 -7.542 1.00 24.30 C ATOM 654 CD2 LEU A 42 20.646 6.056 -5.242 1.00 73.12 C ATOM 0 H LEU A 42 17.772 2.390 -5.228 1.00 72.35 H new ATOM 0 HA LEU A 42 19.355 2.919 -7.528 1.00 74.12 H new ATOM 0 HB2 LEU A 42 18.582 4.300 -5.447 1.00 64.42 H new ATOM 0 HB3 LEU A 42 20.007 3.619 -4.688 1.00 64.42 H new ATOM 0 HG LEU A 42 21.376 4.539 -6.633 1.00 23.00 H new ATOM 0 HD11 LEU A 42 20.401 6.329 -7.974 1.00 24.30 H new ATOM 0 HD12 LEU A 42 19.585 4.777 -8.276 1.00 24.30 H new ATOM 0 HD13 LEU A 42 18.803 6.010 -7.259 1.00 24.30 H new ATOM 0 HD21 LEU A 42 21.259 6.854 -5.661 1.00 73.12 H new ATOM 0 HD22 LEU A 42 19.682 6.462 -4.936 1.00 73.12 H new ATOM 0 HD23 LEU A 42 21.150 5.628 -4.376 1.00 73.12 H new ATOM 666 N ALA A 43 21.172 1.188 -7.391 1.00 52.23 N ATOM 667 CA ALA A 43 22.214 0.170 -7.417 1.00 1.21 C ATOM 668 C ALA A 43 23.400 0.594 -6.561 1.00 21.03 C ATOM 669 O ALA A 43 23.487 1.723 -6.062 1.00 12.40 O ATOM 670 CB ALA A 43 22.671 -0.028 -8.874 1.00 51.15 C ATOM 0 H ALA A 43 20.959 1.557 -8.318 1.00 52.23 H new ATOM 0 HA ALA A 43 21.818 -0.762 -7.015 1.00 1.21 H new ATOM 0 HB1 ALA A 43 23.452 -0.788 -8.910 1.00 51.15 H new ATOM 0 HB2 ALA A 43 21.824 -0.349 -9.481 1.00 51.15 H new ATOM 0 HB3 ALA A 43 23.061 0.912 -9.264 1.00 51.15 H new ATOM 676 N ASP A 44 24.355 -0.324 -6.482 1.00 4.51 N ATOM 677 CA ASP A 44 25.599 -0.140 -5.730 1.00 5.11 C ATOM 678 C ASP A 44 26.345 1.103 -6.243 1.00 74.14 C ATOM 679 O ASP A 44 27.008 1.795 -5.473 1.00 53.43 O ATOM 680 CB ASP A 44 26.474 -1.401 -5.856 1.00 53.22 C ATOM 681 CG ASP A 44 26.750 -2.084 -4.516 1.00 23.04 C ATOM 682 OD1 ASP A 44 27.732 -1.698 -3.832 1.00 53.13 O ATOM 683 OD2 ASP A 44 26.019 -3.049 -4.196 1.00 54.32 O ATOM 0 H ASP A 44 24.290 -1.231 -6.943 1.00 4.51 H new ATOM 0 HA ASP A 44 25.367 0.014 -4.676 1.00 5.11 H new ATOM 0 HB2 ASP A 44 25.983 -2.110 -6.523 1.00 53.22 H new ATOM 0 HB3 ASP A 44 27.423 -1.131 -6.320 1.00 53.22 H new ATOM 688 N ASP A 45 26.167 1.410 -7.533 1.00 13.42 N ATOM 689 CA ASP A 45 26.735 2.522 -8.301 1.00 54.22 C ATOM 690 C ASP A 45 26.145 3.888 -7.946 1.00 1.02 C ATOM 691 O ASP A 45 26.689 4.916 -8.346 1.00 11.43 O ATOM 692 CB ASP A 45 26.481 2.274 -9.792 1.00 22.14 C ATOM 693 CG ASP A 45 27.750 1.879 -10.533 1.00 63.24 C ATOM 694 OD1 ASP A 45 28.356 0.860 -10.130 1.00 13.00 O ATOM 695 OD2 ASP A 45 28.032 2.525 -11.572 1.00 62.32 O ATOM 0 H ASP A 45 25.565 0.832 -8.120 1.00 13.42 H new ATOM 0 HA ASP A 45 27.797 2.553 -8.056 1.00 54.22 H new ATOM 0 HB2 ASP A 45 25.736 1.487 -9.906 1.00 22.14 H new ATOM 0 HB3 ASP A 45 26.065 3.175 -10.243 1.00 22.14 H new ATOM 700 N GLY A 46 25.011 3.912 -7.244 1.00 4.51 N ATOM 701 CA GLY A 46 24.401 5.125 -6.722 1.00 45.24 C ATOM 702 C GLY A 46 23.599 5.951 -7.717 1.00 21.21 C ATOM 703 O GLY A 46 23.039 6.953 -7.290 1.00 34.01 O ATOM 0 H GLY A 46 24.484 3.068 -7.020 1.00 4.51 H new ATOM 0 HA2 GLY A 46 23.745 4.851 -5.896 1.00 45.24 H new ATOM 0 HA3 GLY A 46 25.189 5.755 -6.309 1.00 45.24 H new ATOM 707 N GLU A 47 23.452 5.536 -8.978 1.00 25.23 N ATOM 708 CA GLU A 47 22.576 6.219 -9.927 1.00 33.10 C ATOM 709 C GLU A 47 21.660 5.249 -10.676 1.00 10.12 C ATOM 710 O GLU A 47 20.493 5.570 -10.890 1.00 62.52 O ATOM 711 CB GLU A 47 23.406 7.087 -10.881 1.00 21.51 C ATOM 712 CG GLU A 47 23.972 8.317 -10.152 1.00 53.25 C ATOM 713 CD GLU A 47 24.489 9.420 -11.077 1.00 64.35 C ATOM 714 OE1 GLU A 47 23.762 9.861 -11.996 1.00 42.04 O ATOM 715 OE2 GLU A 47 25.617 9.908 -10.844 1.00 73.25 O ATOM 0 H GLU A 47 23.933 4.724 -9.365 1.00 25.23 H new ATOM 0 HA GLU A 47 21.913 6.874 -9.362 1.00 33.10 H new ATOM 0 HB2 GLU A 47 24.223 6.498 -11.297 1.00 21.51 H new ATOM 0 HB3 GLU A 47 22.787 7.409 -11.718 1.00 21.51 H new ATOM 0 HG2 GLU A 47 23.195 8.733 -9.510 1.00 53.25 H new ATOM 0 HG3 GLU A 47 24.785 7.996 -9.501 1.00 53.25 H new ATOM 722 N THR A 48 22.152 4.069 -11.057 1.00 62.42 N ATOM 723 CA THR A 48 21.395 3.083 -11.821 1.00 32.51 C ATOM 724 C THR A 48 20.231 2.514 -10.994 1.00 5.23 C ATOM 725 O THR A 48 20.427 1.758 -10.042 1.00 12.22 O ATOM 726 CB THR A 48 22.369 2.011 -12.340 1.00 52.13 C ATOM 727 OG1 THR A 48 23.298 2.661 -13.185 1.00 22.11 O ATOM 728 CG2 THR A 48 21.684 0.910 -13.151 1.00 51.34 C ATOM 0 H THR A 48 23.102 3.769 -10.839 1.00 62.42 H new ATOM 0 HA THR A 48 20.924 3.550 -12.686 1.00 32.51 H new ATOM 0 HB THR A 48 22.832 1.534 -11.476 1.00 52.13 H new ATOM 0 HG1 THR A 48 23.938 2.005 -13.534 1.00 22.11 H new ATOM 0 HG21 THR A 48 22.429 0.188 -13.486 1.00 51.34 H new ATOM 0 HG22 THR A 48 20.944 0.406 -12.529 1.00 51.34 H new ATOM 0 HG23 THR A 48 21.190 1.350 -14.017 1.00 51.34 H new ATOM 736 N GLU A 49 19.008 2.894 -11.343 1.00 43.02 N ATOM 737 CA GLU A 49 17.766 2.420 -10.747 1.00 61.52 C ATOM 738 C GLU A 49 17.442 1.054 -11.364 1.00 30.14 C ATOM 739 O GLU A 49 17.022 1.001 -12.526 1.00 45.12 O ATOM 740 CB GLU A 49 16.645 3.432 -11.050 1.00 42.02 C ATOM 741 CG GLU A 49 16.913 4.819 -10.451 1.00 61.51 C ATOM 742 CD GLU A 49 15.973 5.918 -10.957 1.00 21.40 C ATOM 743 OE1 GLU A 49 15.284 5.774 -11.995 1.00 13.12 O ATOM 744 OE2 GLU A 49 15.923 6.974 -10.289 1.00 23.14 O ATOM 0 H GLU A 49 18.848 3.574 -12.086 1.00 43.02 H new ATOM 0 HA GLU A 49 17.859 2.322 -9.665 1.00 61.52 H new ATOM 0 HB2 GLU A 49 16.529 3.525 -12.130 1.00 42.02 H new ATOM 0 HB3 GLU A 49 15.702 3.049 -10.659 1.00 42.02 H new ATOM 0 HG2 GLU A 49 16.828 4.756 -9.366 1.00 61.51 H new ATOM 0 HG3 GLU A 49 17.941 5.105 -10.674 1.00 61.51 H new ATOM 751 N LYS A 50 17.650 -0.052 -10.636 1.00 31.52 N ATOM 752 CA LYS A 50 17.265 -1.393 -11.098 1.00 72.44 C ATOM 753 C LYS A 50 16.052 -1.854 -10.296 1.00 62.34 C ATOM 754 O LYS A 50 16.020 -1.711 -9.069 1.00 51.43 O ATOM 755 CB LYS A 50 18.407 -2.423 -10.995 1.00 25.15 C ATOM 756 CG LYS A 50 19.757 -1.953 -11.578 1.00 32.41 C ATOM 757 CD LYS A 50 20.760 -3.104 -11.743 1.00 64.24 C ATOM 758 CE LYS A 50 21.473 -3.355 -10.412 1.00 22.15 C ATOM 759 NZ LYS A 50 22.036 -4.714 -10.302 1.00 21.23 N ATOM 0 H LYS A 50 18.088 -0.043 -9.715 1.00 31.52 H new ATOM 0 HA LYS A 50 17.022 -1.325 -12.158 1.00 72.44 H new ATOM 0 HB2 LYS A 50 18.551 -2.682 -9.946 1.00 25.15 H new ATOM 0 HB3 LYS A 50 18.103 -3.335 -11.509 1.00 25.15 H new ATOM 0 HG2 LYS A 50 19.587 -1.482 -12.546 1.00 32.41 H new ATOM 0 HG3 LYS A 50 20.186 -1.193 -10.925 1.00 32.41 H new ATOM 0 HD2 LYS A 50 20.243 -4.007 -12.067 1.00 64.24 H new ATOM 0 HD3 LYS A 50 21.487 -2.858 -12.517 1.00 64.24 H new ATOM 0 HE2 LYS A 50 22.275 -2.626 -10.293 1.00 22.15 H new ATOM 0 HE3 LYS A 50 20.771 -3.192 -9.595 1.00 22.15 H new ATOM 0 HZ1 LYS A 50 22.632 -4.775 -9.452 1.00 21.23 H new ATOM 0 HZ2 LYS A 50 21.262 -5.406 -10.232 1.00 21.23 H new ATOM 0 HZ3 LYS A 50 22.611 -4.921 -11.144 1.00 21.23 H new ATOM 773 N THR A 51 15.046 -2.398 -10.976 1.00 43.02 N ATOM 774 CA THR A 51 13.841 -2.902 -10.330 1.00 42.24 C ATOM 775 C THR A 51 14.036 -4.336 -9.826 1.00 64.30 C ATOM 776 O THR A 51 15.002 -5.018 -10.203 1.00 43.32 O ATOM 777 CB THR A 51 12.627 -2.790 -11.271 1.00 43.12 C ATOM 778 OG1 THR A 51 12.837 -3.484 -12.486 1.00 54.41 O ATOM 779 CG2 THR A 51 12.315 -1.336 -11.614 1.00 51.23 C ATOM 0 H THR A 51 15.045 -2.501 -11.991 1.00 43.02 H new ATOM 0 HA THR A 51 13.641 -2.280 -9.457 1.00 42.24 H new ATOM 0 HB THR A 51 11.791 -3.235 -10.731 1.00 43.12 H new ATOM 0 HG1 THR A 51 12.045 -3.392 -13.056 1.00 54.41 H new ATOM 0 HG21 THR A 51 11.453 -1.296 -12.280 1.00 51.23 H new ATOM 0 HG22 THR A 51 12.093 -0.786 -10.699 1.00 51.23 H new ATOM 0 HG23 THR A 51 13.176 -0.886 -12.108 1.00 51.23 H new ATOM 787 N PHE A 52 13.083 -4.820 -9.022 1.00 14.11 N ATOM 788 CA PHE A 52 12.972 -6.212 -8.597 1.00 4.04 C ATOM 789 C PHE A 52 11.509 -6.687 -8.617 1.00 5.34 C ATOM 790 O PHE A 52 10.585 -5.864 -8.549 1.00 73.12 O ATOM 791 CB PHE A 52 13.579 -6.363 -7.193 1.00 30.21 C ATOM 792 CG PHE A 52 15.092 -6.413 -7.203 1.00 34.11 C ATOM 793 CD1 PHE A 52 15.835 -5.219 -7.212 1.00 12.14 C ATOM 794 CD2 PHE A 52 15.760 -7.653 -7.223 1.00 2.31 C ATOM 795 CE1 PHE A 52 17.236 -5.261 -7.260 1.00 11.03 C ATOM 796 CE2 PHE A 52 17.164 -7.693 -7.251 1.00 10.01 C ATOM 797 CZ PHE A 52 17.904 -6.499 -7.271 1.00 33.21 C ATOM 0 H PHE A 52 12.345 -4.230 -8.638 1.00 14.11 H new ATOM 0 HA PHE A 52 13.523 -6.840 -9.297 1.00 4.04 H new ATOM 0 HB2 PHE A 52 13.253 -5.529 -6.571 1.00 30.21 H new ATOM 0 HB3 PHE A 52 13.194 -7.273 -6.733 1.00 30.21 H new ATOM 0 HD1 PHE A 52 15.325 -4.267 -7.182 1.00 12.14 H new ATOM 0 HD2 PHE A 52 15.193 -8.572 -7.217 1.00 2.31 H new ATOM 0 HE1 PHE A 52 17.803 -4.342 -7.289 1.00 11.03 H new ATOM 0 HE2 PHE A 52 17.676 -8.644 -7.257 1.00 10.01 H new ATOM 0 HZ PHE A 52 18.983 -6.531 -7.295 1.00 33.21 H new ATOM 807 N PRO A 53 11.274 -8.015 -8.659 1.00 3.31 N ATOM 808 CA PRO A 53 9.934 -8.578 -8.600 1.00 43.14 C ATOM 809 C PRO A 53 9.265 -8.279 -7.268 1.00 2.43 C ATOM 810 O PRO A 53 9.877 -8.424 -6.206 1.00 43.14 O ATOM 811 CB PRO A 53 10.064 -10.087 -8.821 1.00 53.20 C ATOM 812 CG PRO A 53 11.533 -10.379 -8.525 1.00 14.03 C ATOM 813 CD PRO A 53 12.248 -9.076 -8.874 1.00 61.10 C ATOM 0 HA PRO A 53 9.304 -8.131 -9.369 1.00 43.14 H new ATOM 0 HB2 PRO A 53 9.404 -10.646 -8.157 1.00 53.20 H new ATOM 0 HB3 PRO A 53 9.800 -10.365 -9.841 1.00 53.20 H new ATOM 0 HG2 PRO A 53 11.683 -10.649 -7.480 1.00 14.03 H new ATOM 0 HG3 PRO A 53 11.903 -11.210 -9.125 1.00 14.03 H new ATOM 0 HD2 PRO A 53 13.127 -8.932 -8.245 1.00 61.10 H new ATOM 0 HD3 PRO A 53 12.594 -9.085 -9.908 1.00 61.10 H new ATOM 821 N PHE A 54 7.992 -7.906 -7.336 1.00 21.15 N ATOM 822 CA PHE A 54 7.091 -7.808 -6.206 1.00 5.31 C ATOM 823 C PHE A 54 6.371 -9.151 -6.089 1.00 73.54 C ATOM 824 O PHE A 54 5.739 -9.618 -7.045 1.00 65.10 O ATOM 825 CB PHE A 54 6.153 -6.619 -6.440 1.00 51.41 C ATOM 826 CG PHE A 54 5.177 -6.321 -5.323 1.00 74.23 C ATOM 827 CD1 PHE A 54 4.021 -7.106 -5.138 1.00 72.31 C ATOM 828 CD2 PHE A 54 5.416 -5.224 -4.478 1.00 25.03 C ATOM 829 CE1 PHE A 54 3.131 -6.809 -4.089 1.00 53.31 C ATOM 830 CE2 PHE A 54 4.524 -4.919 -3.440 1.00 71.40 C ATOM 831 CZ PHE A 54 3.386 -5.714 -3.240 1.00 65.23 C ATOM 0 H PHE A 54 7.547 -7.655 -8.218 1.00 21.15 H new ATOM 0 HA PHE A 54 7.600 -7.620 -5.261 1.00 5.31 H new ATOM 0 HB2 PHE A 54 6.760 -5.730 -6.614 1.00 51.41 H new ATOM 0 HB3 PHE A 54 5.586 -6.802 -7.353 1.00 51.41 H new ATOM 0 HD1 PHE A 54 3.818 -7.935 -5.801 1.00 72.31 H new ATOM 0 HD2 PHE A 54 6.293 -4.612 -4.629 1.00 25.03 H new ATOM 0 HE1 PHE A 54 2.254 -7.420 -3.935 1.00 53.31 H new ATOM 0 HE2 PHE A 54 4.713 -4.073 -2.796 1.00 71.40 H new ATOM 0 HZ PHE A 54 2.704 -5.486 -2.434 1.00 65.23 H new ATOM 841 N THR A 55 6.509 -9.795 -4.938 1.00 22.24 N ATOM 842 CA THR A 55 5.918 -11.083 -4.599 1.00 31.21 C ATOM 843 C THR A 55 5.174 -10.952 -3.263 1.00 10.55 C ATOM 844 O THR A 55 5.404 -10.000 -2.516 1.00 71.42 O ATOM 845 CB THR A 55 7.044 -12.138 -4.571 1.00 34.35 C ATOM 846 OG1 THR A 55 8.173 -11.658 -3.862 1.00 25.14 O ATOM 847 CG2 THR A 55 7.496 -12.483 -5.993 1.00 51.34 C ATOM 0 H THR A 55 7.066 -9.412 -4.174 1.00 22.24 H new ATOM 0 HA THR A 55 5.185 -11.405 -5.338 1.00 31.21 H new ATOM 0 HB THR A 55 6.642 -13.022 -4.076 1.00 34.35 H new ATOM 0 HG1 THR A 55 8.872 -12.345 -3.857 1.00 25.14 H new ATOM 0 HG21 THR A 55 8.290 -13.228 -5.952 1.00 51.34 H new ATOM 0 HG22 THR A 55 6.653 -12.882 -6.556 1.00 51.34 H new ATOM 0 HG23 THR A 55 7.867 -11.584 -6.485 1.00 51.34 H new ATOM 855 N LYS A 56 4.284 -11.894 -2.925 1.00 70.11 N ATOM 856 CA LYS A 56 3.435 -11.800 -1.733 1.00 11.24 C ATOM 857 C LYS A 56 4.216 -11.762 -0.424 1.00 13.12 C ATOM 858 O LYS A 56 3.728 -11.221 0.564 1.00 22.23 O ATOM 859 CB LYS A 56 2.448 -12.967 -1.722 1.00 53.53 C ATOM 860 CG LYS A 56 3.096 -14.347 -1.515 1.00 21.13 C ATOM 861 CD LYS A 56 2.194 -15.458 -2.056 1.00 4.51 C ATOM 862 CE LYS A 56 0.802 -15.494 -1.414 1.00 25.04 C ATOM 863 NZ LYS A 56 0.838 -16.055 -0.047 1.00 25.05 N ATOM 0 H LYS A 56 4.133 -12.742 -3.471 1.00 70.11 H new ATOM 0 HA LYS A 56 2.907 -10.848 -1.796 1.00 11.24 H new ATOM 0 HB2 LYS A 56 1.717 -12.801 -0.931 1.00 53.53 H new ATOM 0 HB3 LYS A 56 1.902 -12.974 -2.665 1.00 53.53 H new ATOM 0 HG2 LYS A 56 4.062 -14.379 -2.019 1.00 21.13 H new ATOM 0 HG3 LYS A 56 3.284 -14.510 -0.454 1.00 21.13 H new ATOM 0 HD2 LYS A 56 2.084 -15.331 -3.133 1.00 4.51 H new ATOM 0 HD3 LYS A 56 2.682 -16.419 -1.896 1.00 4.51 H new ATOM 0 HE2 LYS A 56 0.392 -14.485 -1.381 1.00 25.04 H new ATOM 0 HE3 LYS A 56 0.132 -16.091 -2.033 1.00 25.04 H new ATOM 0 HZ1 LYS A 56 -0.123 -16.062 0.351 1.00 25.05 H new ATOM 0 HZ2 LYS A 56 1.206 -17.027 -0.080 1.00 25.05 H new ATOM 0 HZ3 LYS A 56 1.457 -15.471 0.552 1.00 25.05 H new ATOM 877 N GLU A 57 5.423 -12.322 -0.420 1.00 70.31 N ATOM 878 CA GLU A 57 6.330 -12.278 0.722 1.00 50.13 C ATOM 879 C GLU A 57 6.759 -10.836 1.038 1.00 12.32 C ATOM 880 O GLU A 57 7.214 -10.538 2.138 1.00 72.13 O ATOM 881 CB GLU A 57 7.551 -13.148 0.389 1.00 51.23 C ATOM 882 CG GLU A 57 8.221 -13.690 1.655 1.00 13.51 C ATOM 883 CD GLU A 57 9.482 -14.508 1.380 1.00 50.50 C ATOM 884 OE1 GLU A 57 9.500 -15.318 0.426 1.00 65.20 O ATOM 885 OE2 GLU A 57 10.447 -14.397 2.172 1.00 43.41 O ATOM 0 H GLU A 57 5.803 -12.826 -1.221 1.00 70.31 H new ATOM 0 HA GLU A 57 5.824 -12.659 1.609 1.00 50.13 H new ATOM 0 HB2 GLU A 57 7.243 -13.980 -0.245 1.00 51.23 H new ATOM 0 HB3 GLU A 57 8.271 -12.562 -0.182 1.00 51.23 H new ATOM 0 HG2 GLU A 57 8.476 -12.854 2.307 1.00 13.51 H new ATOM 0 HG3 GLU A 57 7.507 -14.311 2.196 1.00 13.51 H new ATOM 892 N LYS A 58 6.612 -9.926 0.072 1.00 10.45 N ATOM 893 CA LYS A 58 6.957 -8.518 0.182 1.00 43.23 C ATOM 894 C LYS A 58 5.734 -7.663 0.487 1.00 62.00 C ATOM 895 O LYS A 58 5.752 -6.468 0.202 1.00 32.01 O ATOM 896 CB LYS A 58 7.636 -8.035 -1.101 1.00 65.00 C ATOM 897 CG LYS A 58 8.738 -8.986 -1.566 1.00 42.20 C ATOM 898 CD LYS A 58 9.651 -8.288 -2.569 1.00 34.24 C ATOM 899 CE LYS A 58 10.614 -9.321 -3.151 1.00 14.11 C ATOM 900 NZ LYS A 58 11.585 -8.703 -4.071 1.00 51.54 N ATOM 0 H LYS A 58 6.233 -10.166 -0.844 1.00 10.45 H new ATOM 0 HA LYS A 58 7.652 -8.411 1.015 1.00 43.23 H new ATOM 0 HB2 LYS A 58 6.890 -7.934 -1.889 1.00 65.00 H new ATOM 0 HB3 LYS A 58 8.060 -7.045 -0.935 1.00 65.00 H new ATOM 0 HG2 LYS A 58 9.320 -9.326 -0.709 1.00 42.20 H new ATOM 0 HG3 LYS A 58 8.295 -9.872 -2.022 1.00 42.20 H new ATOM 0 HD2 LYS A 58 9.061 -7.831 -3.363 1.00 34.24 H new ATOM 0 HD3 LYS A 58 10.205 -7.486 -2.082 1.00 34.24 H new ATOM 0 HE2 LYS A 58 11.146 -9.819 -2.341 1.00 14.11 H new ATOM 0 HE3 LYS A 58 10.049 -10.088 -3.680 1.00 14.11 H new ATOM 0 HZ1 LYS A 58 12.429 -9.306 -4.141 1.00 51.54 H new ATOM 0 HZ2 LYS A 58 11.154 -8.600 -5.012 1.00 51.54 H new ATOM 0 HZ3 LYS A 58 11.857 -7.766 -3.710 1.00 51.54 H new ATOM 914 N TRP A 59 4.661 -8.268 0.997 1.00 61.40 N ATOM 915 CA TRP A 59 3.422 -7.595 1.345 1.00 54.51 C ATOM 916 C TRP A 59 3.452 -7.161 2.816 1.00 1.54 C ATOM 917 O TRP A 59 3.065 -7.973 3.666 1.00 52.20 O ATOM 918 CB TRP A 59 2.191 -8.462 1.016 1.00 51.22 C ATOM 919 CG TRP A 59 0.904 -7.699 1.117 1.00 12.13 C ATOM 920 CD1 TRP A 59 0.155 -7.531 2.232 1.00 65.10 C ATOM 921 CD2 TRP A 59 0.301 -6.843 0.108 1.00 34.02 C ATOM 922 NE1 TRP A 59 -0.849 -6.611 1.989 1.00 70.11 N ATOM 923 CE2 TRP A 59 -0.751 -6.097 0.712 1.00 73.12 C ATOM 924 CE3 TRP A 59 0.608 -6.560 -1.237 1.00 14.42 C ATOM 925 CZ2 TRP A 59 -1.396 -5.055 0.030 1.00 44.44 C ATOM 926 CZ3 TRP A 59 -0.040 -5.522 -1.933 1.00 2.54 C ATOM 927 CH2 TRP A 59 -1.026 -4.756 -1.291 1.00 24.42 C ATOM 0 H TRP A 59 4.635 -9.271 1.183 1.00 61.40 H new ATOM 0 HA TRP A 59 3.333 -6.697 0.734 1.00 54.51 H new ATOM 0 HB2 TRP A 59 2.293 -8.863 0.008 1.00 51.22 H new ATOM 0 HB3 TRP A 59 2.159 -9.313 1.696 1.00 51.22 H new ATOM 0 HD1 TRP A 59 0.317 -8.039 3.171 1.00 65.10 H new ATOM 0 HE1 TRP A 59 -1.567 -6.347 2.664 1.00 70.11 H new ATOM 0 HE3 TRP A 59 1.356 -7.151 -1.745 1.00 14.42 H new ATOM 0 HZ2 TRP A 59 -2.173 -4.486 0.518 1.00 44.44 H new ATOM 0 HZ3 TRP A 59 0.221 -5.315 -2.960 1.00 2.54 H new ATOM 0 HH2 TRP A 59 -1.499 -3.937 -1.813 1.00 24.42 H new ATOM 938 N PRO A 60 3.976 -5.979 3.198 1.00 12.21 N ATOM 939 CA PRO A 60 3.685 -5.447 4.520 1.00 61.32 C ATOM 940 C PRO A 60 2.165 -5.338 4.648 1.00 73.42 C ATOM 941 O PRO A 60 1.508 -4.671 3.845 1.00 72.32 O ATOM 942 CB PRO A 60 4.402 -4.098 4.615 1.00 51.24 C ATOM 943 CG PRO A 60 4.512 -3.637 3.169 1.00 3.34 C ATOM 944 CD PRO A 60 4.603 -4.944 2.385 1.00 62.41 C ATOM 0 HA PRO A 60 4.034 -6.076 5.339 1.00 61.32 H new ATOM 0 HB2 PRO A 60 3.837 -3.387 5.219 1.00 51.24 H new ATOM 0 HB3 PRO A 60 5.384 -4.199 5.077 1.00 51.24 H new ATOM 0 HG2 PRO A 60 3.646 -3.048 2.868 1.00 3.34 H new ATOM 0 HG3 PRO A 60 5.392 -3.013 3.012 1.00 3.34 H new ATOM 0 HD2 PRO A 60 4.098 -4.852 1.423 1.00 62.41 H new ATOM 0 HD3 PRO A 60 5.643 -5.196 2.176 1.00 62.41 H new ATOM 952 N LEU A 61 1.588 -6.090 5.585 1.00 62.34 N ATOM 953 CA LEU A 61 0.178 -5.937 5.932 1.00 64.03 C ATOM 954 C LEU A 61 0.016 -4.556 6.562 1.00 61.12 C ATOM 955 O LEU A 61 0.715 -4.260 7.530 1.00 53.14 O ATOM 956 CB LEU A 61 -0.276 -7.022 6.916 1.00 45.40 C ATOM 957 CG LEU A 61 -0.296 -8.448 6.339 1.00 42.34 C ATOM 958 CD1 LEU A 61 -0.198 -9.478 7.464 1.00 51.20 C ATOM 959 CD2 LEU A 61 -1.531 -8.697 5.480 1.00 65.03 C ATOM 0 H LEU A 61 2.076 -6.811 6.116 1.00 62.34 H new ATOM 0 HA LEU A 61 -0.438 -6.038 5.039 1.00 64.03 H new ATOM 0 HB2 LEU A 61 0.384 -7.005 7.783 1.00 45.40 H new ATOM 0 HB3 LEU A 61 -1.276 -6.775 7.272 1.00 45.40 H new ATOM 0 HG LEU A 61 0.573 -8.554 5.690 1.00 42.34 H new ATOM 0 HD11 LEU A 61 -0.213 -10.482 7.040 1.00 51.20 H new ATOM 0 HD12 LEU A 61 0.732 -9.330 8.013 1.00 51.20 H new ATOM 0 HD13 LEU A 61 -1.043 -9.357 8.142 1.00 51.20 H new ATOM 0 HD21 LEU A 61 -1.505 -9.715 5.092 1.00 65.03 H new ATOM 0 HD22 LEU A 61 -2.428 -8.561 6.084 1.00 65.03 H new ATOM 0 HD23 LEU A 61 -1.544 -7.993 4.648 1.00 65.03 H new ATOM 971 N LEU A 62 -0.852 -3.714 6.000 1.00 2.34 N ATOM 972 CA LEU A 62 -1.102 -2.357 6.486 1.00 22.02 C ATOM 973 C LEU A 62 -2.431 -2.303 7.231 1.00 31.13 C ATOM 974 O LEU A 62 -3.302 -3.154 7.012 1.00 25.05 O ATOM 975 CB LEU A 62 -1.129 -1.367 5.304 1.00 42.21 C ATOM 976 CG LEU A 62 0.161 -0.537 5.188 1.00 50.34 C ATOM 977 CD1 LEU A 62 1.358 -1.394 4.755 1.00 31.33 C ATOM 978 CD2 LEU A 62 -0.067 0.584 4.172 1.00 72.15 C ATOM 0 H LEU A 62 -1.409 -3.960 5.182 1.00 2.34 H new ATOM 0 HA LEU A 62 -0.299 -2.077 7.168 1.00 22.02 H new ATOM 0 HB2 LEU A 62 -1.284 -1.920 4.377 1.00 42.21 H new ATOM 0 HB3 LEU A 62 -1.979 -0.694 5.420 1.00 42.21 H new ATOM 0 HG LEU A 62 0.395 -0.125 6.170 1.00 50.34 H new ATOM 0 HD11 LEU A 62 2.248 -0.768 4.686 1.00 31.33 H new ATOM 0 HD12 LEU A 62 1.525 -2.182 5.489 1.00 31.33 H new ATOM 0 HD13 LEU A 62 1.152 -1.841 3.782 1.00 31.33 H new ATOM 0 HD21 LEU A 62 0.840 1.181 4.079 1.00 72.15 H new ATOM 0 HD22 LEU A 62 -0.317 0.152 3.203 1.00 72.15 H new ATOM 0 HD23 LEU A 62 -0.887 1.219 4.509 1.00 72.15 H new ATOM 990 N ASP A 63 -2.608 -1.246 8.024 1.00 34.31 N ATOM 991 CA ASP A 63 -3.810 -0.922 8.790 1.00 42.43 C ATOM 992 C ASP A 63 -4.459 0.341 8.222 1.00 44.23 C ATOM 993 O ASP A 63 -4.061 0.908 7.200 1.00 1.54 O ATOM 994 CB ASP A 63 -3.450 -0.744 10.277 1.00 61.33 C ATOM 995 CG ASP A 63 -4.574 -0.921 11.307 1.00 2.33 C ATOM 996 OD1 ASP A 63 -5.774 -0.944 10.954 1.00 50.41 O ATOM 997 OD2 ASP A 63 -4.253 -1.010 12.508 1.00 65.02 O ATOM 0 H ASP A 63 -1.872 -0.552 8.156 1.00 34.31 H new ATOM 0 HA ASP A 63 -4.527 -1.739 8.711 1.00 42.43 H new ATOM 0 HB2 ASP A 63 -2.659 -1.454 10.518 1.00 61.33 H new ATOM 0 HB3 ASP A 63 -3.032 0.255 10.404 1.00 61.33 H new ATOM 1002 N SER A 64 -5.508 0.765 8.894 1.00 14.30 N ATOM 1003 CA SER A 64 -6.424 1.834 8.551 1.00 12.12 C ATOM 1004 C SER A 64 -5.919 3.195 9.038 1.00 12.20 C ATOM 1005 O SER A 64 -6.309 4.210 8.469 1.00 43.15 O ATOM 1006 CB SER A 64 -7.755 1.470 9.213 1.00 62.34 C ATOM 1007 OG SER A 64 -8.870 2.169 8.698 1.00 1.14 O ATOM 0 H SER A 64 -5.766 0.328 9.779 1.00 14.30 H new ATOM 0 HA SER A 64 -6.525 1.929 7.470 1.00 12.12 H new ATOM 0 HB2 SER A 64 -7.926 0.400 9.095 1.00 62.34 H new ATOM 0 HB3 SER A 64 -7.681 1.665 10.283 1.00 62.34 H new ATOM 0 HG SER A 64 -9.681 1.883 9.168 1.00 1.14 H new ATOM 1013 N GLU A 65 -5.035 3.240 10.039 1.00 5.34 N ATOM 1014 CA GLU A 65 -4.498 4.484 10.595 1.00 43.23 C ATOM 1015 C GLU A 65 -3.808 5.337 9.529 1.00 45.25 C ATOM 1016 O GLU A 65 -3.831 6.566 9.612 1.00 63.35 O ATOM 1017 CB GLU A 65 -3.554 4.165 11.771 1.00 4.42 C ATOM 1018 CG GLU A 65 -2.298 3.379 11.347 1.00 31.02 C ATOM 1019 CD GLU A 65 -1.399 2.993 12.526 1.00 12.41 C ATOM 1020 OE1 GLU A 65 -1.854 2.225 13.407 1.00 63.04 O ATOM 1021 OE2 GLU A 65 -0.218 3.405 12.536 1.00 4.23 O ATOM 0 H GLU A 65 -4.668 2.403 10.491 1.00 5.34 H new ATOM 0 HA GLU A 65 -5.330 5.080 10.970 1.00 43.23 H new ATOM 0 HB2 GLU A 65 -3.248 5.097 12.246 1.00 4.42 H new ATOM 0 HB3 GLU A 65 -4.099 3.590 12.520 1.00 4.42 H new ATOM 0 HG2 GLU A 65 -2.604 2.475 10.821 1.00 31.02 H new ATOM 0 HG3 GLU A 65 -1.723 3.979 10.642 1.00 31.02 H new ATOM 1028 N THR A 66 -3.234 4.699 8.509 1.00 13.54 N ATOM 1029 CA THR A 66 -2.525 5.367 7.435 1.00 11.31 C ATOM 1030 C THR A 66 -3.507 6.071 6.481 1.00 64.13 C ATOM 1031 O THR A 66 -3.140 7.051 5.832 1.00 51.54 O ATOM 1032 CB THR A 66 -1.679 4.310 6.699 1.00 73.24 C ATOM 1033 OG1 THR A 66 -1.158 3.347 7.600 1.00 62.13 O ATOM 1034 CG2 THR A 66 -0.512 4.929 5.934 1.00 25.10 C ATOM 0 H THR A 66 -3.253 3.684 8.411 1.00 13.54 H new ATOM 0 HA THR A 66 -1.874 6.144 7.837 1.00 11.31 H new ATOM 0 HB THR A 66 -2.355 3.832 5.990 1.00 73.24 H new ATOM 0 HG1 THR A 66 -0.627 2.689 7.104 1.00 62.13 H new ATOM 0 HG21 THR A 66 0.053 4.143 5.433 1.00 25.10 H new ATOM 0 HG22 THR A 66 -0.894 5.630 5.192 1.00 25.10 H new ATOM 0 HG23 THR A 66 0.140 5.457 6.630 1.00 25.10 H new ATOM 1042 N MET A 67 -4.757 5.603 6.390 1.00 65.02 N ATOM 1043 CA MET A 67 -5.763 6.012 5.409 1.00 24.31 C ATOM 1044 C MET A 67 -6.483 7.278 5.865 1.00 54.52 C ATOM 1045 O MET A 67 -7.716 7.316 5.928 1.00 63.15 O ATOM 1046 CB MET A 67 -6.761 4.861 5.183 1.00 4.31 C ATOM 1047 CG MET A 67 -6.099 3.642 4.541 1.00 23.21 C ATOM 1048 SD MET A 67 -5.460 3.916 2.859 1.00 14.13 S ATOM 1049 CE MET A 67 -7.027 4.199 1.987 1.00 61.11 C ATOM 0 H MET A 67 -5.110 4.893 7.032 1.00 65.02 H new ATOM 0 HA MET A 67 -5.267 6.238 4.465 1.00 24.31 H new ATOM 0 HB2 MET A 67 -7.203 4.573 6.137 1.00 4.31 H new ATOM 0 HB3 MET A 67 -7.575 5.208 4.547 1.00 4.31 H new ATOM 0 HG2 MET A 67 -5.277 3.315 5.178 1.00 23.21 H new ATOM 0 HG3 MET A 67 -6.822 2.827 4.511 1.00 23.21 H new ATOM 0 HE1 MET A 67 -6.928 3.881 0.949 1.00 61.11 H new ATOM 0 HE2 MET A 67 -7.820 3.626 2.468 1.00 61.11 H new ATOM 0 HE3 MET A 67 -7.275 5.260 2.020 1.00 61.11 H new ATOM 1059 N LYS A 68 -5.728 8.306 6.244 1.00 45.52 N ATOM 1060 CA LYS A 68 -6.269 9.501 6.862 1.00 24.13 C ATOM 1061 C LYS A 68 -5.651 10.733 6.243 1.00 70.34 C ATOM 1062 O LYS A 68 -4.450 10.989 6.338 1.00 5.30 O ATOM 1063 CB LYS A 68 -6.116 9.421 8.391 1.00 43.15 C ATOM 1064 CG LYS A 68 -7.338 8.753 9.049 1.00 30.43 C ATOM 1065 CD LYS A 68 -7.104 7.259 9.329 1.00 42.44 C ATOM 1066 CE LYS A 68 -8.395 6.453 9.502 1.00 31.24 C ATOM 1067 NZ LYS A 68 -9.238 6.952 10.607 1.00 32.04 N ATOM 0 H LYS A 68 -4.715 8.328 6.127 1.00 45.52 H new ATOM 0 HA LYS A 68 -7.339 9.575 6.670 1.00 24.13 H new ATOM 0 HB2 LYS A 68 -5.216 8.858 8.638 1.00 43.15 H new ATOM 0 HB3 LYS A 68 -5.986 10.424 8.797 1.00 43.15 H new ATOM 0 HG2 LYS A 68 -7.570 9.264 9.984 1.00 30.43 H new ATOM 0 HG3 LYS A 68 -8.206 8.867 8.400 1.00 30.43 H new ATOM 0 HD2 LYS A 68 -6.527 6.831 8.509 1.00 42.44 H new ATOM 0 HD3 LYS A 68 -6.500 7.158 10.231 1.00 42.44 H new ATOM 0 HE2 LYS A 68 -8.965 6.485 8.573 1.00 31.24 H new ATOM 0 HE3 LYS A 68 -8.144 5.408 9.686 1.00 31.24 H new ATOM 0 HZ1 LYS A 68 -10.097 6.370 10.678 1.00 32.04 H new ATOM 0 HZ2 LYS A 68 -8.708 6.897 11.500 1.00 32.04 H new ATOM 0 HZ3 LYS A 68 -9.504 7.940 10.422 1.00 32.04 H new ATOM 1081 N GLU A 69 -6.507 11.464 5.545 1.00 22.13 N ATOM 1082 CA GLU A 69 -6.227 12.735 4.925 1.00 13.31 C ATOM 1083 C GLU A 69 -5.975 13.757 6.034 1.00 12.20 C ATOM 1084 O GLU A 69 -6.900 14.287 6.656 1.00 63.03 O ATOM 1085 CB GLU A 69 -7.388 13.123 4.000 1.00 64.31 C ATOM 1086 CG GLU A 69 -7.463 12.224 2.751 1.00 50.13 C ATOM 1087 CD GLU A 69 -8.462 11.057 2.836 1.00 4.11 C ATOM 1088 OE1 GLU A 69 -8.146 10.029 3.486 1.00 51.52 O ATOM 1089 OE2 GLU A 69 -9.528 11.108 2.181 1.00 71.23 O ATOM 0 H GLU A 69 -7.469 11.162 5.392 1.00 22.13 H new ATOM 0 HA GLU A 69 -5.336 12.690 4.299 1.00 13.31 H new ATOM 0 HB2 GLU A 69 -8.327 13.056 4.550 1.00 64.31 H new ATOM 0 HB3 GLU A 69 -7.273 14.162 3.691 1.00 64.31 H new ATOM 0 HG2 GLU A 69 -7.726 12.844 1.894 1.00 50.13 H new ATOM 0 HG3 GLU A 69 -6.471 11.817 2.557 1.00 50.13 H new ATOM 1096 N GLU A 70 -4.702 14.010 6.300 1.00 31.31 N ATOM 1097 CA GLU A 70 -4.191 14.896 7.335 1.00 34.34 C ATOM 1098 C GLU A 70 -2.852 15.434 6.835 1.00 45.52 C ATOM 1099 O GLU A 70 -2.167 14.756 6.062 1.00 1.44 O ATOM 1100 CB GLU A 70 -3.978 14.120 8.652 1.00 2.23 C ATOM 1101 CG GLU A 70 -4.171 14.991 9.908 1.00 42.22 C ATOM 1102 CD GLU A 70 -5.616 14.892 10.420 1.00 1.43 C ATOM 1103 OE1 GLU A 70 -6.016 13.839 10.983 1.00 3.21 O ATOM 1104 OE2 GLU A 70 -6.390 15.850 10.185 1.00 2.22 O ATOM 0 H GLU A 70 -3.951 13.574 5.765 1.00 31.31 H new ATOM 0 HA GLU A 70 -4.896 15.703 7.532 1.00 34.34 H new ATOM 0 HB2 GLU A 70 -4.674 13.282 8.689 1.00 2.23 H new ATOM 0 HB3 GLU A 70 -2.972 13.700 8.660 1.00 2.23 H new ATOM 0 HG2 GLU A 70 -3.481 14.671 10.688 1.00 42.22 H new ATOM 0 HG3 GLU A 70 -3.932 16.029 9.677 1.00 42.22 H new ATOM 1111 N ARG A 71 -2.459 16.610 7.320 1.00 30.41 N ATOM 1112 CA ARG A 71 -1.244 17.329 6.955 1.00 50.32 C ATOM 1113 C ARG A 71 -0.559 17.700 8.270 1.00 64.05 C ATOM 1114 O ARG A 71 -1.209 18.306 9.121 1.00 31.24 O ATOM 1115 CB ARG A 71 -1.640 18.586 6.162 1.00 12.53 C ATOM 1116 CG ARG A 71 -0.403 19.239 5.545 1.00 11.54 C ATOM 1117 CD ARG A 71 -0.356 20.733 5.859 1.00 53.34 C ATOM 1118 NE ARG A 71 -1.239 21.489 4.963 1.00 31.42 N ATOM 1119 CZ ARG A 71 -0.992 22.662 4.375 1.00 25.30 C ATOM 1120 NH1 ARG A 71 0.022 23.429 4.763 1.00 43.35 N ATOM 1121 NH2 ARG A 71 -1.806 23.032 3.401 1.00 33.12 N ATOM 0 H ARG A 71 -3.011 17.112 8.016 1.00 30.41 H new ATOM 0 HA ARG A 71 -0.573 16.737 6.333 1.00 50.32 H new ATOM 0 HB2 ARG A 71 -2.348 18.320 5.377 1.00 12.53 H new ATOM 0 HB3 ARG A 71 -2.143 19.295 6.819 1.00 12.53 H new ATOM 0 HG2 ARG A 71 0.496 18.755 5.927 1.00 11.54 H new ATOM 0 HG3 ARG A 71 -0.410 19.091 4.465 1.00 11.54 H new ATOM 0 HD2 ARG A 71 -0.654 20.900 6.894 1.00 53.34 H new ATOM 0 HD3 ARG A 71 0.667 21.097 5.759 1.00 53.34 H new ATOM 0 HE ARG A 71 -2.148 21.069 4.767 1.00 31.42 H new ATOM 0 HH11 ARG A 71 0.629 23.125 5.524 1.00 43.35 H new ATOM 0 HH12 ARG A 71 0.193 24.322 4.300 1.00 43.35 H new ATOM 0 HH21 ARG A 71 -2.583 22.429 3.129 1.00 33.12 H new ATOM 0 HH22 ARG A 71 -1.657 23.920 2.922 1.00 33.12 H new ATOM 1135 N ILE A 72 0.695 17.313 8.475 1.00 2.30 N ATOM 1136 CA ILE A 72 1.411 17.390 9.739 1.00 72.01 C ATOM 1137 C ILE A 72 2.672 18.205 9.510 1.00 24.30 C ATOM 1138 O ILE A 72 3.600 17.713 8.877 1.00 10.32 O ATOM 1139 CB ILE A 72 1.736 15.965 10.242 1.00 64.22 C ATOM 1140 CG1 ILE A 72 0.464 15.090 10.378 1.00 64.21 C ATOM 1141 CG2 ILE A 72 2.478 16.019 11.589 1.00 42.24 C ATOM 1142 CD1 ILE A 72 0.561 13.777 9.598 1.00 61.34 C ATOM 0 H ILE A 72 1.266 16.918 7.727 1.00 2.30 H new ATOM 0 HA ILE A 72 0.806 17.874 10.505 1.00 72.01 H new ATOM 0 HB ILE A 72 2.380 15.504 9.493 1.00 64.22 H new ATOM 0 HG12 ILE A 72 0.291 14.870 11.431 1.00 64.21 H new ATOM 0 HG13 ILE A 72 -0.399 15.654 10.025 1.00 64.21 H new ATOM 0 HG21 ILE A 72 2.697 15.005 11.925 1.00 42.24 H new ATOM 0 HG22 ILE A 72 3.410 16.571 11.469 1.00 42.24 H new ATOM 0 HG23 ILE A 72 1.853 16.519 12.329 1.00 42.24 H new ATOM 0 HD11 ILE A 72 -0.358 13.206 9.731 1.00 61.34 H new ATOM 0 HD12 ILE A 72 0.705 13.993 8.539 1.00 61.34 H new ATOM 0 HD13 ILE A 72 1.406 13.196 9.968 1.00 61.34 H new ATOM 1154 N THR A 73 2.722 19.441 9.999 1.00 61.42 N ATOM 1155 CA THR A 73 3.963 20.200 10.029 1.00 22.13 C ATOM 1156 C THR A 73 4.842 19.650 11.155 1.00 2.54 C ATOM 1157 O THR A 73 4.405 19.577 12.309 1.00 51.51 O ATOM 1158 CB THR A 73 3.691 21.716 10.097 1.00 33.23 C ATOM 1159 OG1 THR A 73 4.914 22.421 10.110 1.00 12.32 O ATOM 1160 CG2 THR A 73 2.894 22.209 11.310 1.00 70.45 C ATOM 0 H THR A 73 1.916 19.936 10.379 1.00 61.42 H new ATOM 0 HA THR A 73 4.520 20.075 9.100 1.00 22.13 H new ATOM 0 HB THR A 73 3.081 21.905 9.214 1.00 33.23 H new ATOM 0 HG1 THR A 73 4.736 23.384 10.152 1.00 12.32 H new ATOM 0 HG21 THR A 73 2.767 23.290 11.247 1.00 70.45 H new ATOM 0 HG22 THR A 73 1.916 21.728 11.322 1.00 70.45 H new ATOM 0 HG23 THR A 73 3.432 21.960 12.225 1.00 70.45 H new ATOM 1168 N GLN A 74 6.053 19.229 10.804 1.00 11.14 N ATOM 1169 CA GLN A 74 7.165 18.965 11.692 1.00 30.44 C ATOM 1170 C GLN A 74 8.277 19.945 11.347 1.00 63.31 C ATOM 1171 O GLN A 74 8.282 20.558 10.278 1.00 1.42 O ATOM 1172 CB GLN A 74 7.729 17.564 11.446 1.00 10.50 C ATOM 1173 CG GLN A 74 6.701 16.475 11.224 1.00 72.31 C ATOM 1174 CD GLN A 74 7.388 15.144 10.924 1.00 62.45 C ATOM 1175 OE1 GLN A 74 8.613 15.024 10.960 1.00 42.32 O ATOM 1176 NE2 GLN A 74 6.615 14.115 10.621 1.00 1.31 N ATOM 0 H GLN A 74 6.292 19.054 9.828 1.00 11.14 H new ATOM 0 HA GLN A 74 6.824 19.057 12.723 1.00 30.44 H new ATOM 0 HB2 GLN A 74 8.384 17.603 10.576 1.00 10.50 H new ATOM 0 HB3 GLN A 74 8.348 17.286 12.299 1.00 10.50 H new ATOM 0 HG2 GLN A 74 6.072 16.375 12.108 1.00 72.31 H new ATOM 0 HG3 GLN A 74 6.046 16.748 10.396 1.00 72.31 H new ATOM 0 HE21 GLN A 74 5.602 14.229 10.595 1.00 1.31 H new ATOM 0 HE22 GLN A 74 7.032 13.208 10.413 1.00 1.31 H new ATOM 1185 N GLU A 75 9.291 20.010 12.200 1.00 5.51 N ATOM 1186 CA GLU A 75 10.405 20.932 12.020 1.00 73.24 C ATOM 1187 C GLU A 75 11.724 20.160 12.154 1.00 65.31 C ATOM 1188 O GLU A 75 12.786 20.579 11.694 1.00 14.20 O ATOM 1189 CB GLU A 75 10.153 22.085 12.969 1.00 54.15 C ATOM 1190 CG GLU A 75 10.914 21.969 14.241 1.00 23.11 C ATOM 1191 CD GLU A 75 10.644 20.750 15.104 1.00 71.34 C ATOM 1192 OE1 GLU A 75 9.452 20.405 15.287 1.00 42.32 O ATOM 1193 OE2 GLU A 75 11.643 20.137 15.541 1.00 42.43 O ATOM 0 H GLU A 75 9.365 19.427 13.034 1.00 5.51 H new ATOM 0 HA GLU A 75 10.489 21.376 11.028 1.00 73.24 H new ATOM 0 HB2 GLU A 75 10.421 23.019 12.476 1.00 54.15 H new ATOM 0 HB3 GLU A 75 9.088 22.137 13.193 1.00 54.15 H new ATOM 0 HG2 GLU A 75 11.977 21.984 14.001 1.00 23.11 H new ATOM 0 HG3 GLU A 75 10.710 22.857 14.839 1.00 23.11 H new ATOM 1200 N GLU A 76 11.661 19.000 12.802 1.00 54.32 N ATOM 1201 CA GLU A 76 12.737 18.004 12.716 1.00 24.14 C ATOM 1202 C GLU A 76 12.778 17.456 11.277 1.00 41.12 C ATOM 1203 O GLU A 76 13.804 16.944 10.836 1.00 70.23 O ATOM 1204 CB GLU A 76 12.782 16.986 13.867 1.00 73.35 C ATOM 1205 CG GLU A 76 12.110 15.708 13.454 1.00 72.22 C ATOM 1206 CD GLU A 76 12.298 14.545 14.430 1.00 1.10 C ATOM 1207 OE1 GLU A 76 13.462 14.144 14.686 1.00 63.11 O ATOM 1208 OE2 GLU A 76 11.287 13.998 14.915 1.00 50.41 O ATOM 0 H GLU A 76 10.878 18.722 13.394 1.00 54.32 H new ATOM 0 HA GLU A 76 13.698 18.486 12.896 1.00 24.14 H new ATOM 0 HB2 GLU A 76 13.817 16.788 14.147 1.00 73.35 H new ATOM 0 HB3 GLU A 76 12.287 17.398 14.747 1.00 73.35 H new ATOM 0 HG2 GLU A 76 11.043 15.896 13.335 1.00 72.22 H new ATOM 0 HG3 GLU A 76 12.492 15.411 12.477 1.00 72.22 H new ATOM 1215 N GLY A 77 11.681 17.589 10.532 1.00 5.11 N ATOM 1216 CA GLY A 77 11.588 17.317 9.114 1.00 63.22 C ATOM 1217 C GLY A 77 10.735 18.397 8.467 1.00 62.25 C ATOM 1218 O GLY A 77 11.137 19.559 8.390 1.00 14.40 O ATOM 0 H GLY A 77 10.796 17.905 10.928 1.00 5.11 H new ATOM 0 HA2 GLY A 77 12.582 17.301 8.666 1.00 63.22 H new ATOM 0 HA3 GLY A 77 11.146 16.335 8.945 1.00 63.22 H new ATOM 1222 N GLY A 78 9.535 18.021 8.037 1.00 2.32 N ATOM 1223 CA GLY A 78 8.796 18.749 7.018 1.00 14.43 C ATOM 1224 C GLY A 78 7.303 18.550 7.183 1.00 3.14 C ATOM 1225 O GLY A 78 6.839 18.101 8.232 1.00 12.23 O ATOM 0 H GLY A 78 9.047 17.197 8.389 1.00 2.32 H new ATOM 0 HA2 GLY A 78 9.034 19.811 7.080 1.00 14.43 H new ATOM 0 HA3 GLY A 78 9.104 18.411 6.029 1.00 14.43 H new ATOM 1229 N ILE A 79 6.547 18.867 6.138 1.00 43.12 N ATOM 1230 CA ILE A 79 5.112 18.681 6.117 1.00 51.54 C ATOM 1231 C ILE A 79 4.794 17.271 5.636 1.00 44.33 C ATOM 1232 O ILE A 79 4.774 17.042 4.436 1.00 10.24 O ATOM 1233 CB ILE A 79 4.438 19.809 5.303 1.00 14.51 C ATOM 1234 CG1 ILE A 79 4.800 21.199 5.873 1.00 42.14 C ATOM 1235 CG2 ILE A 79 2.916 19.631 5.312 1.00 44.23 C ATOM 1236 CD1 ILE A 79 4.140 22.377 5.149 1.00 13.23 C ATOM 0 H ILE A 79 6.922 19.264 5.276 1.00 43.12 H new ATOM 0 HA ILE A 79 4.692 18.763 7.120 1.00 51.54 H new ATOM 0 HB ILE A 79 4.805 19.748 4.278 1.00 14.51 H new ATOM 0 HG12 ILE A 79 4.516 21.231 6.925 1.00 42.14 H new ATOM 0 HG13 ILE A 79 5.882 21.324 5.831 1.00 42.14 H new ATOM 0 HG21 ILE A 79 2.453 20.432 4.735 1.00 44.23 H new ATOM 0 HG22 ILE A 79 2.660 18.669 4.868 1.00 44.23 H new ATOM 0 HG23 ILE A 79 2.552 19.666 6.339 1.00 44.23 H new ATOM 0 HD11 ILE A 79 4.451 23.311 5.616 1.00 13.23 H new ATOM 0 HD12 ILE A 79 4.443 22.377 4.102 1.00 13.23 H new ATOM 0 HD13 ILE A 79 3.056 22.282 5.213 1.00 13.23 H new ATOM 1248 N TYR A 80 4.571 16.326 6.545 1.00 12.43 N ATOM 1249 CA TYR A 80 4.101 14.983 6.220 1.00 44.14 C ATOM 1250 C TYR A 80 2.617 15.090 5.859 1.00 45.14 C ATOM 1251 O TYR A 80 1.826 15.521 6.700 1.00 61.35 O ATOM 1252 CB TYR A 80 4.325 14.073 7.437 1.00 73.44 C ATOM 1253 CG TYR A 80 4.361 12.588 7.134 1.00 33.31 C ATOM 1254 CD1 TYR A 80 5.551 12.012 6.656 1.00 32.21 C ATOM 1255 CD2 TYR A 80 3.225 11.775 7.330 1.00 22.00 C ATOM 1256 CE1 TYR A 80 5.645 10.627 6.452 1.00 72.41 C ATOM 1257 CE2 TYR A 80 3.301 10.388 7.085 1.00 50.43 C ATOM 1258 CZ TYR A 80 4.538 9.799 6.728 1.00 13.23 C ATOM 1259 OH TYR A 80 4.636 8.455 6.538 1.00 2.30 O ATOM 0 H TYR A 80 4.714 16.474 7.544 1.00 12.43 H new ATOM 0 HA TYR A 80 4.643 14.553 5.378 1.00 44.14 H new ATOM 0 HB2 TYR A 80 5.265 14.354 7.912 1.00 73.44 H new ATOM 0 HB3 TYR A 80 3.533 14.261 8.162 1.00 73.44 H new ATOM 0 HD1 TYR A 80 6.402 12.642 6.444 1.00 32.21 H new ATOM 0 HD2 TYR A 80 2.298 12.214 7.667 1.00 22.00 H new ATOM 0 HE1 TYR A 80 6.564 10.196 6.084 1.00 72.41 H new ATOM 0 HE2 TYR A 80 2.416 9.775 7.170 1.00 50.43 H new ATOM 0 HH TYR A 80 3.786 8.028 6.775 1.00 2.30 H new ATOM 1269 N VAL A 81 2.202 14.784 4.631 1.00 10.13 N ATOM 1270 CA VAL A 81 0.808 14.898 4.216 1.00 61.43 C ATOM 1271 C VAL A 81 0.396 13.763 3.278 1.00 70.31 C ATOM 1272 O VAL A 81 0.750 13.732 2.095 1.00 74.43 O ATOM 1273 CB VAL A 81 0.490 16.313 3.726 1.00 12.41 C ATOM 1274 CG1 VAL A 81 1.502 16.959 2.806 1.00 14.44 C ATOM 1275 CG2 VAL A 81 -0.909 16.425 3.102 1.00 71.13 C ATOM 0 H VAL A 81 2.825 14.450 3.896 1.00 10.13 H new ATOM 0 HA VAL A 81 0.167 14.759 5.086 1.00 61.43 H new ATOM 0 HB VAL A 81 0.536 16.881 4.655 1.00 12.41 H new ATOM 0 HG11 VAL A 81 1.159 17.957 2.532 1.00 14.44 H new ATOM 0 HG12 VAL A 81 2.463 17.033 3.316 1.00 14.44 H new ATOM 0 HG13 VAL A 81 1.614 16.354 1.906 1.00 14.44 H new ATOM 0 HG21 VAL A 81 -1.079 17.450 2.773 1.00 71.13 H new ATOM 0 HG22 VAL A 81 -0.981 15.752 2.247 1.00 71.13 H new ATOM 0 HG23 VAL A 81 -1.661 16.152 3.843 1.00 71.13 H new ATOM 1285 N SER A 82 -0.416 12.849 3.814 1.00 45.24 N ATOM 1286 CA SER A 82 -1.213 11.948 3.003 1.00 34.24 C ATOM 1287 C SER A 82 -2.352 12.741 2.371 1.00 65.35 C ATOM 1288 O SER A 82 -3.122 13.397 3.085 1.00 53.15 O ATOM 1289 CB SER A 82 -1.786 10.800 3.841 1.00 14.10 C ATOM 1290 OG SER A 82 -0.882 10.328 4.822 1.00 53.53 O ATOM 0 H SER A 82 -0.534 12.719 4.819 1.00 45.24 H new ATOM 0 HA SER A 82 -0.577 11.512 2.233 1.00 34.24 H new ATOM 0 HB2 SER A 82 -2.701 11.135 4.329 1.00 14.10 H new ATOM 0 HB3 SER A 82 -2.060 9.977 3.181 1.00 14.10 H new ATOM 0 HG SER A 82 -1.299 9.599 5.327 1.00 53.53 H new ATOM 1296 N LYS A 83 -2.514 12.658 1.052 1.00 23.12 N ATOM 1297 CA LYS A 83 -3.687 13.162 0.346 1.00 1.32 C ATOM 1298 C LYS A 83 -4.081 12.144 -0.717 1.00 5.33 C ATOM 1299 O LYS A 83 -3.318 11.254 -1.077 1.00 2.33 O ATOM 1300 CB LYS A 83 -3.425 14.580 -0.212 1.00 54.51 C ATOM 1301 CG LYS A 83 -2.239 14.695 -1.180 1.00 22.34 C ATOM 1302 CD LYS A 83 -1.961 16.127 -1.663 1.00 45.25 C ATOM 1303 CE LYS A 83 -1.107 16.852 -0.620 1.00 12.52 C ATOM 1304 NZ LYS A 83 -0.634 18.185 -1.064 1.00 4.34 N ATOM 0 H LYS A 83 -1.822 12.232 0.435 1.00 23.12 H new ATOM 0 HA LYS A 83 -4.532 13.276 1.025 1.00 1.32 H new ATOM 0 HB2 LYS A 83 -4.324 14.923 -0.723 1.00 54.51 H new ATOM 0 HB3 LYS A 83 -3.256 15.257 0.626 1.00 54.51 H new ATOM 0 HG2 LYS A 83 -1.345 14.308 -0.690 1.00 22.34 H new ATOM 0 HG3 LYS A 83 -2.428 14.061 -2.046 1.00 22.34 H new ATOM 0 HD2 LYS A 83 -1.445 16.106 -2.623 1.00 45.25 H new ATOM 0 HD3 LYS A 83 -2.899 16.660 -1.817 1.00 45.25 H new ATOM 0 HE2 LYS A 83 -1.687 16.968 0.296 1.00 12.52 H new ATOM 0 HE3 LYS A 83 -0.244 16.233 -0.375 1.00 12.52 H new ATOM 0 HZ1 LYS A 83 -0.063 18.619 -0.311 1.00 4.34 H new ATOM 0 HZ2 LYS A 83 -0.055 18.080 -1.921 1.00 4.34 H new ATOM 0 HZ3 LYS A 83 -1.452 18.792 -1.272 1.00 4.34 H new ATOM 1318 N PHE A 84 -5.300 12.225 -1.227 1.00 74.23 N ATOM 1319 CA PHE A 84 -5.598 11.565 -2.490 1.00 12.31 C ATOM 1320 C PHE A 84 -5.184 12.520 -3.603 1.00 10.11 C ATOM 1321 O PHE A 84 -5.219 13.740 -3.408 1.00 44.24 O ATOM 1322 CB PHE A 84 -7.071 11.165 -2.558 1.00 13.13 C ATOM 1323 CG PHE A 84 -8.018 12.296 -2.235 1.00 63.45 C ATOM 1324 CD1 PHE A 84 -8.462 13.149 -3.258 1.00 62.33 C ATOM 1325 CD2 PHE A 84 -8.412 12.523 -0.903 1.00 65.35 C ATOM 1326 CE1 PHE A 84 -9.312 14.215 -2.946 1.00 42.31 C ATOM 1327 CE2 PHE A 84 -9.244 13.609 -0.590 1.00 14.51 C ATOM 1328 CZ PHE A 84 -9.698 14.451 -1.618 1.00 61.34 C ATOM 0 H PHE A 84 -6.080 12.726 -0.801 1.00 74.23 H new ATOM 0 HA PHE A 84 -5.043 10.633 -2.596 1.00 12.31 H new ATOM 0 HB2 PHE A 84 -7.292 10.791 -3.558 1.00 13.13 H new ATOM 0 HB3 PHE A 84 -7.249 10.344 -1.864 1.00 13.13 H new ATOM 0 HD1 PHE A 84 -8.149 12.983 -4.278 1.00 62.33 H new ATOM 0 HD2 PHE A 84 -8.073 11.860 -0.120 1.00 65.35 H new ATOM 0 HE1 PHE A 84 -9.674 14.861 -3.733 1.00 42.31 H new ATOM 0 HE2 PHE A 84 -9.533 13.796 0.434 1.00 14.51 H new ATOM 0 HZ PHE A 84 -10.346 15.283 -1.386 1.00 61.34 H new ATOM 1338 N THR A 85 -4.809 11.964 -4.751 1.00 63.32 N ATOM 1339 CA THR A 85 -4.420 12.737 -5.931 1.00 64.54 C ATOM 1340 C THR A 85 -5.390 12.490 -7.099 1.00 45.45 C ATOM 1341 O THR A 85 -5.648 13.411 -7.879 1.00 44.23 O ATOM 1342 CB THR A 85 -2.926 12.505 -6.241 1.00 3.13 C ATOM 1343 OG1 THR A 85 -2.520 13.203 -7.393 1.00 2.21 O ATOM 1344 CG2 THR A 85 -2.582 11.035 -6.454 1.00 62.51 C ATOM 0 H THR A 85 -4.765 10.955 -4.892 1.00 63.32 H new ATOM 0 HA THR A 85 -4.511 13.805 -5.735 1.00 64.54 H new ATOM 0 HB THR A 85 -2.399 12.874 -5.361 1.00 3.13 H new ATOM 0 HG1 THR A 85 -1.569 13.035 -7.559 1.00 2.21 H new ATOM 0 HG21 THR A 85 -1.518 10.938 -6.668 1.00 62.51 H new ATOM 0 HG22 THR A 85 -2.824 10.470 -5.554 1.00 62.51 H new ATOM 0 HG23 THR A 85 -3.158 10.644 -7.293 1.00 62.51 H new ATOM 1352 N LEU A 86 -6.017 11.306 -7.186 1.00 31.11 N ATOM 1353 CA LEU A 86 -7.062 11.034 -8.170 1.00 53.05 C ATOM 1354 C LEU A 86 -8.368 10.776 -7.439 1.00 34.41 C ATOM 1355 O LEU A 86 -8.419 9.977 -6.500 1.00 22.52 O ATOM 1356 CB LEU A 86 -6.695 9.883 -9.113 1.00 31.10 C ATOM 1357 CG LEU A 86 -7.695 9.681 -10.270 1.00 11.23 C ATOM 1358 CD1 LEU A 86 -7.774 10.890 -11.212 1.00 45.43 C ATOM 1359 CD2 LEU A 86 -7.316 8.438 -11.080 1.00 70.51 C ATOM 0 H LEU A 86 -5.810 10.516 -6.575 1.00 31.11 H new ATOM 0 HA LEU A 86 -7.175 11.908 -8.812 1.00 53.05 H new ATOM 0 HB2 LEU A 86 -5.705 10.069 -9.530 1.00 31.10 H new ATOM 0 HB3 LEU A 86 -6.630 8.960 -8.536 1.00 31.10 H new ATOM 0 HG LEU A 86 -8.677 9.557 -9.813 1.00 11.23 H new ATOM 0 HD11 LEU A 86 -8.494 10.687 -12.005 1.00 45.43 H new ATOM 0 HD12 LEU A 86 -8.091 11.769 -10.650 1.00 45.43 H new ATOM 0 HD13 LEU A 86 -6.793 11.074 -11.651 1.00 45.43 H new ATOM 0 HD21 LEU A 86 -8.028 8.304 -11.895 1.00 70.51 H new ATOM 0 HD22 LEU A 86 -6.314 8.563 -11.490 1.00 70.51 H new ATOM 0 HD23 LEU A 86 -7.336 7.562 -10.432 1.00 70.51 H new ATOM 1371 N ASN A 87 -9.421 11.456 -7.881 1.00 53.31 N ATOM 1372 CA ASN A 87 -10.753 11.439 -7.290 1.00 33.10 C ATOM 1373 C ASN A 87 -11.779 10.807 -8.237 1.00 41.34 C ATOM 1374 O ASN A 87 -12.947 11.201 -8.263 1.00 23.31 O ATOM 1375 CB ASN A 87 -11.116 12.869 -6.861 1.00 32.41 C ATOM 1376 CG ASN A 87 -12.127 12.832 -5.732 1.00 31.32 C ATOM 1377 OD1 ASN A 87 -11.771 12.487 -4.612 1.00 33.31 O ATOM 1378 ND2 ASN A 87 -13.379 13.167 -5.989 1.00 74.25 N ATOM 0 H ASN A 87 -9.365 12.062 -8.699 1.00 53.31 H new ATOM 0 HA ASN A 87 -10.763 10.807 -6.402 1.00 33.10 H new ATOM 0 HB2 ASN A 87 -10.220 13.400 -6.540 1.00 32.41 H new ATOM 0 HB3 ASN A 87 -11.525 13.419 -7.709 1.00 32.41 H new ATOM 0 HD21 ASN A 87 -14.077 13.142 -5.245 1.00 74.25 H new ATOM 0 HD22 ASN A 87 -13.648 13.451 -6.931 1.00 74.25 H new ATOM 1385 N GLU A 88 -11.333 9.873 -9.077 1.00 5.33 N ATOM 1386 CA GLU A 88 -12.179 9.104 -9.979 1.00 51.15 C ATOM 1387 C GLU A 88 -13.060 8.129 -9.180 1.00 52.14 C ATOM 1388 O GLU A 88 -12.676 7.713 -8.085 1.00 33.11 O ATOM 1389 CB GLU A 88 -11.272 8.338 -10.956 1.00 53.21 C ATOM 1390 CG GLU A 88 -11.033 9.089 -12.264 1.00 42.15 C ATOM 1391 CD GLU A 88 -12.082 8.733 -13.305 1.00 62.12 C ATOM 1392 OE1 GLU A 88 -12.073 7.584 -13.805 1.00 25.22 O ATOM 1393 OE2 GLU A 88 -12.917 9.605 -13.630 1.00 11.33 O ATOM 0 H GLU A 88 -10.346 9.626 -9.148 1.00 5.33 H new ATOM 0 HA GLU A 88 -12.839 9.771 -10.534 1.00 51.15 H new ATOM 0 HB2 GLU A 88 -10.313 8.143 -10.476 1.00 53.21 H new ATOM 0 HB3 GLU A 88 -11.721 7.370 -11.177 1.00 53.21 H new ATOM 0 HG2 GLU A 88 -11.052 10.163 -12.078 1.00 42.15 H new ATOM 0 HG3 GLU A 88 -10.041 8.849 -12.647 1.00 42.15 H new ATOM 1400 N PRO A 89 -14.220 7.716 -9.723 1.00 14.03 N ATOM 1401 CA PRO A 89 -15.165 6.864 -9.010 1.00 64.32 C ATOM 1402 C PRO A 89 -14.622 5.453 -8.788 1.00 25.12 C ATOM 1403 O PRO A 89 -14.620 4.958 -7.664 1.00 53.03 O ATOM 1404 CB PRO A 89 -16.441 6.844 -9.858 1.00 10.43 C ATOM 1405 CG PRO A 89 -16.001 7.275 -11.255 1.00 3.42 C ATOM 1406 CD PRO A 89 -14.755 8.124 -11.013 1.00 54.25 C ATOM 0 HA PRO A 89 -15.355 7.256 -8.011 1.00 64.32 H new ATOM 0 HB2 PRO A 89 -16.887 5.849 -9.875 1.00 10.43 H new ATOM 0 HB3 PRO A 89 -17.192 7.523 -9.455 1.00 10.43 H new ATOM 0 HG2 PRO A 89 -15.779 6.414 -11.886 1.00 3.42 H new ATOM 0 HG3 PRO A 89 -16.780 7.847 -11.759 1.00 3.42 H new ATOM 0 HD2 PRO A 89 -14.021 7.969 -11.804 1.00 54.25 H new ATOM 0 HD3 PRO A 89 -15.003 9.185 -11.012 1.00 54.25 H new ATOM 1414 N LYS A 90 -14.212 4.767 -9.856 1.00 10.33 N ATOM 1415 CA LYS A 90 -13.747 3.377 -9.818 1.00 45.02 C ATOM 1416 C LYS A 90 -12.222 3.274 -9.709 1.00 33.44 C ATOM 1417 O LYS A 90 -11.714 2.152 -9.670 1.00 62.12 O ATOM 1418 CB LYS A 90 -14.288 2.603 -11.041 1.00 32.52 C ATOM 1419 CG LYS A 90 -15.508 1.714 -10.757 1.00 14.13 C ATOM 1420 CD LYS A 90 -16.800 2.455 -10.415 1.00 30.12 C ATOM 1421 CE LYS A 90 -16.950 2.702 -8.912 1.00 73.21 C ATOM 1422 NZ LYS A 90 -18.296 3.213 -8.601 1.00 61.23 N ATOM 0 H LYS A 90 -14.193 5.170 -10.793 1.00 10.33 H new ATOM 0 HA LYS A 90 -14.144 2.917 -8.913 1.00 45.02 H new ATOM 0 HB2 LYS A 90 -14.552 3.320 -11.818 1.00 32.52 H new ATOM 0 HB3 LYS A 90 -13.488 1.980 -11.441 1.00 32.52 H new ATOM 0 HG2 LYS A 90 -15.690 1.088 -11.630 1.00 14.13 H new ATOM 0 HG3 LYS A 90 -15.264 1.046 -9.931 1.00 14.13 H new ATOM 0 HD2 LYS A 90 -16.818 3.410 -10.941 1.00 30.12 H new ATOM 0 HD3 LYS A 90 -17.653 1.878 -10.773 1.00 30.12 H new ATOM 0 HE2 LYS A 90 -16.772 1.775 -8.366 1.00 73.21 H new ATOM 0 HE3 LYS A 90 -16.198 3.417 -8.579 1.00 73.21 H new ATOM 0 HZ1 LYS A 90 -18.378 3.374 -7.577 1.00 61.23 H new ATOM 0 HZ2 LYS A 90 -18.453 4.108 -9.106 1.00 61.23 H new ATOM 0 HZ3 LYS A 90 -19.009 2.518 -8.900 1.00 61.23 H new ATOM 1436 N HIS A 91 -11.493 4.392 -9.645 1.00 21.24 N ATOM 1437 CA HIS A 91 -10.036 4.431 -9.656 1.00 62.34 C ATOM 1438 C HIS A 91 -9.572 5.448 -8.606 1.00 3.31 C ATOM 1439 O HIS A 91 -9.426 6.627 -8.915 1.00 50.35 O ATOM 1440 CB HIS A 91 -9.566 4.783 -11.077 1.00 30.44 C ATOM 1441 CG HIS A 91 -8.083 4.681 -11.330 1.00 14.04 C ATOM 1442 ND1 HIS A 91 -7.479 5.058 -12.505 1.00 51.15 N ATOM 1443 CD2 HIS A 91 -7.115 4.159 -10.511 1.00 33.31 C ATOM 1444 CE1 HIS A 91 -6.174 4.754 -12.406 1.00 31.53 C ATOM 1445 NE2 HIS A 91 -5.903 4.223 -11.201 1.00 42.03 N ATOM 0 H HIS A 91 -11.916 5.318 -9.582 1.00 21.24 H new ATOM 0 HA HIS A 91 -9.600 3.466 -9.397 1.00 62.34 H new ATOM 0 HB2 HIS A 91 -10.080 4.128 -11.780 1.00 30.44 H new ATOM 0 HB3 HIS A 91 -9.883 5.802 -11.301 1.00 30.44 H new ATOM 0 HD2 HIS A 91 -7.263 3.770 -9.515 1.00 33.31 H new ATOM 0 HE1 HIS A 91 -5.444 4.914 -13.186 1.00 31.53 H new ATOM 0 HE2 HIS A 91 -4.990 3.925 -10.858 1.00 42.03 H new ATOM 1453 N LYS A 92 -9.381 5.041 -7.346 1.00 42.01 N ATOM 1454 CA LYS A 92 -9.054 5.992 -6.275 1.00 13.41 C ATOM 1455 C LYS A 92 -7.580 5.859 -5.922 1.00 53.34 C ATOM 1456 O LYS A 92 -7.115 4.745 -5.671 1.00 51.44 O ATOM 1457 CB LYS A 92 -9.994 5.818 -5.069 1.00 25.41 C ATOM 1458 CG LYS A 92 -9.999 7.107 -4.230 1.00 30.50 C ATOM 1459 CD LYS A 92 -10.966 7.065 -3.040 1.00 13.32 C ATOM 1460 CE LYS A 92 -10.973 8.444 -2.366 1.00 62.21 C ATOM 1461 NZ LYS A 92 -11.546 8.440 -1.007 1.00 50.44 N ATOM 0 H LYS A 92 -9.446 4.069 -7.044 1.00 42.01 H new ATOM 0 HA LYS A 92 -9.217 7.013 -6.620 1.00 13.41 H new ATOM 0 HB2 LYS A 92 -11.004 5.591 -5.412 1.00 25.41 H new ATOM 0 HB3 LYS A 92 -9.667 4.976 -4.459 1.00 25.41 H new ATOM 0 HG2 LYS A 92 -8.991 7.293 -3.861 1.00 30.50 H new ATOM 0 HG3 LYS A 92 -10.264 7.947 -4.872 1.00 30.50 H new ATOM 0 HD2 LYS A 92 -11.969 6.803 -3.377 1.00 13.32 H new ATOM 0 HD3 LYS A 92 -10.658 6.298 -2.329 1.00 13.32 H new ATOM 0 HE2 LYS A 92 -9.951 8.820 -2.318 1.00 62.21 H new ATOM 0 HE3 LYS A 92 -11.539 9.138 -2.987 1.00 62.21 H new ATOM 0 HZ1 LYS A 92 -11.518 9.403 -0.615 1.00 50.44 H new ATOM 0 HZ2 LYS A 92 -12.532 8.111 -1.047 1.00 50.44 H new ATOM 0 HZ3 LYS A 92 -10.993 7.803 -0.399 1.00 50.44 H new ATOM 1475 N ILE A 93 -6.850 6.975 -5.882 1.00 42.12 N ATOM 1476 CA ILE A 93 -5.397 6.986 -5.728 1.00 70.33 C ATOM 1477 C ILE A 93 -5.067 7.798 -4.487 1.00 54.42 C ATOM 1478 O ILE A 93 -5.404 8.985 -4.409 1.00 25.14 O ATOM 1479 CB ILE A 93 -4.702 7.529 -6.993 1.00 42.43 C ATOM 1480 CG1 ILE A 93 -5.116 6.669 -8.213 1.00 22.34 C ATOM 1481 CG2 ILE A 93 -3.178 7.606 -6.762 1.00 14.20 C ATOM 1482 CD1 ILE A 93 -4.462 7.092 -9.524 1.00 41.32 C ATOM 0 H ILE A 93 -7.258 7.907 -5.957 1.00 42.12 H new ATOM 0 HA ILE A 93 -5.020 5.971 -5.602 1.00 70.33 H new ATOM 0 HB ILE A 93 -5.022 8.548 -7.210 1.00 42.43 H new ATOM 0 HG12 ILE A 93 -4.863 5.628 -8.013 1.00 22.34 H new ATOM 0 HG13 ILE A 93 -6.199 6.718 -8.327 1.00 22.34 H new ATOM 0 HG21 ILE A 93 -2.693 7.990 -7.659 1.00 14.20 H new ATOM 0 HG22 ILE A 93 -2.970 8.271 -5.924 1.00 14.20 H new ATOM 0 HG23 ILE A 93 -2.793 6.611 -6.539 1.00 14.20 H new ATOM 0 HD11 ILE A 93 -4.804 6.440 -10.328 1.00 41.32 H new ATOM 0 HD12 ILE A 93 -4.735 8.123 -9.751 1.00 41.32 H new ATOM 0 HD13 ILE A 93 -3.379 7.016 -9.431 1.00 41.32 H new ATOM 1494 N PHE A 94 -4.403 7.154 -3.531 1.00 31.22 N ATOM 1495 CA PHE A 94 -4.014 7.718 -2.251 1.00 4.14 C ATOM 1496 C PHE A 94 -2.490 7.702 -2.198 1.00 63.35 C ATOM 1497 O PHE A 94 -1.868 6.670 -2.469 1.00 53.44 O ATOM 1498 CB PHE A 94 -4.677 6.910 -1.129 1.00 14.51 C ATOM 1499 CG PHE A 94 -4.424 7.424 0.274 1.00 14.12 C ATOM 1500 CD1 PHE A 94 -4.962 8.659 0.686 1.00 14.50 C ATOM 1501 CD2 PHE A 94 -3.684 6.649 1.187 1.00 3.44 C ATOM 1502 CE1 PHE A 94 -4.771 9.109 2.006 1.00 72.05 C ATOM 1503 CE2 PHE A 94 -3.489 7.102 2.504 1.00 12.10 C ATOM 1504 CZ PHE A 94 -4.044 8.325 2.917 1.00 53.33 C ATOM 0 H PHE A 94 -4.111 6.182 -3.636 1.00 31.22 H new ATOM 0 HA PHE A 94 -4.347 8.748 -2.123 1.00 4.14 H new ATOM 0 HB2 PHE A 94 -5.753 6.892 -1.303 1.00 14.51 H new ATOM 0 HB3 PHE A 94 -4.327 5.880 -1.190 1.00 14.51 H new ATOM 0 HD1 PHE A 94 -5.523 9.262 -0.013 1.00 14.50 H new ATOM 0 HD2 PHE A 94 -3.265 5.704 0.875 1.00 3.44 H new ATOM 0 HE1 PHE A 94 -5.183 10.057 2.318 1.00 72.05 H new ATOM 0 HE2 PHE A 94 -2.912 6.509 3.199 1.00 12.10 H new ATOM 0 HZ PHE A 94 -3.912 8.662 3.934 1.00 53.33 H new ATOM 1514 N GLU A 95 -1.887 8.860 -1.943 1.00 61.15 N ATOM 1515 CA GLU A 95 -0.441 9.024 -1.916 1.00 33.13 C ATOM 1516 C GLU A 95 -0.049 9.787 -0.653 1.00 42.14 C ATOM 1517 O GLU A 95 -0.802 10.634 -0.167 1.00 12.13 O ATOM 1518 CB GLU A 95 0.015 9.682 -3.229 1.00 22.33 C ATOM 1519 CG GLU A 95 -0.392 11.155 -3.428 1.00 45.25 C ATOM 1520 CD GLU A 95 0.591 12.162 -2.817 1.00 1.41 C ATOM 1521 OE1 GLU A 95 1.814 11.926 -2.904 1.00 5.30 O ATOM 1522 OE2 GLU A 95 0.185 13.277 -2.423 1.00 30.34 O ATOM 0 H GLU A 95 -2.398 9.721 -1.747 1.00 61.15 H new ATOM 0 HA GLU A 95 0.076 8.066 -1.863 1.00 33.13 H new ATOM 0 HB2 GLU A 95 1.101 9.616 -3.286 1.00 22.33 H new ATOM 0 HB3 GLU A 95 -0.384 9.101 -4.060 1.00 22.33 H new ATOM 0 HG2 GLU A 95 -0.484 11.355 -4.496 1.00 45.25 H new ATOM 0 HG3 GLU A 95 -1.377 11.312 -2.988 1.00 45.25 H new ATOM 1529 N ALA A 96 1.108 9.461 -0.087 1.00 64.05 N ATOM 1530 CA ALA A 96 1.577 10.112 1.123 1.00 34.14 C ATOM 1531 C ALA A 96 3.094 10.200 1.131 1.00 50.54 C ATOM 1532 O ALA A 96 3.787 9.337 0.584 1.00 34.43 O ATOM 1533 CB ALA A 96 1.028 9.356 2.338 1.00 65.32 C ATOM 0 H ALA A 96 1.738 8.746 -0.451 1.00 64.05 H new ATOM 0 HA ALA A 96 1.209 11.137 1.164 1.00 34.14 H new ATOM 0 HB1 ALA A 96 1.374 9.837 3.253 1.00 65.32 H new ATOM 0 HB2 ALA A 96 -0.062 9.368 2.312 1.00 65.32 H new ATOM 0 HB3 ALA A 96 1.380 8.325 2.314 1.00 65.32 H new ATOM 1539 N GLY A 97 3.606 11.244 1.772 1.00 72.45 N ATOM 1540 CA GLY A 97 5.001 11.625 1.787 1.00 2.30 C ATOM 1541 C GLY A 97 5.115 13.037 2.337 1.00 43.52 C ATOM 1542 O GLY A 97 4.122 13.669 2.715 1.00 64.05 O ATOM 0 H GLY A 97 3.024 11.876 2.322 1.00 72.45 H new ATOM 0 HA2 GLY A 97 5.575 10.932 2.402 1.00 2.30 H new ATOM 0 HA3 GLY A 97 5.417 11.577 0.780 1.00 2.30 H new ATOM 1546 N TYR A 98 6.339 13.543 2.384 1.00 62.34 N ATOM 1547 CA TYR A 98 6.572 14.939 2.681 1.00 51.12 C ATOM 1548 C TYR A 98 6.123 15.798 1.506 1.00 45.51 C ATOM 1549 O TYR A 98 6.402 15.472 0.353 1.00 23.40 O ATOM 1550 CB TYR A 98 8.053 15.151 2.998 1.00 73.23 C ATOM 1551 CG TYR A 98 8.362 14.778 4.425 1.00 44.21 C ATOM 1552 CD1 TYR A 98 7.855 15.604 5.437 1.00 11.24 C ATOM 1553 CD2 TYR A 98 9.010 13.572 4.751 1.00 64.03 C ATOM 1554 CE1 TYR A 98 7.920 15.210 6.777 1.00 25.01 C ATOM 1555 CE2 TYR A 98 9.114 13.179 6.096 1.00 10.24 C ATOM 1556 CZ TYR A 98 8.547 13.989 7.107 1.00 74.14 C ATOM 1557 OH TYR A 98 8.509 13.583 8.392 1.00 23.44 O ATOM 0 H TYR A 98 7.187 13.000 2.219 1.00 62.34 H new ATOM 0 HA TYR A 98 5.991 15.237 3.554 1.00 51.12 H new ATOM 0 HB2 TYR A 98 8.662 14.551 2.322 1.00 73.23 H new ATOM 0 HB3 TYR A 98 8.319 16.194 2.826 1.00 73.23 H new ATOM 0 HD1 TYR A 98 7.410 16.554 5.180 1.00 11.24 H new ATOM 0 HD2 TYR A 98 9.425 12.951 3.971 1.00 64.03 H new ATOM 0 HE1 TYR A 98 7.495 15.833 7.551 1.00 25.01 H new ATOM 0 HE2 TYR A 98 9.624 12.263 6.356 1.00 10.24 H new ATOM 0 HH TYR A 98 8.978 12.727 8.479 1.00 23.44 H new ATOM 1567 N GLU A 99 5.526 16.956 1.800 1.00 61.33 N ATOM 1568 CA GLU A 99 5.165 17.943 0.784 1.00 1.40 C ATOM 1569 C GLU A 99 6.434 18.441 0.076 1.00 24.00 C ATOM 1570 O GLU A 99 6.372 18.944 -1.038 1.00 32.10 O ATOM 1571 CB GLU A 99 4.414 19.128 1.427 1.00 10.52 C ATOM 1572 CG GLU A 99 3.283 19.757 0.588 1.00 22.41 C ATOM 1573 CD GLU A 99 3.579 19.974 -0.905 1.00 32.31 C ATOM 1574 OE1 GLU A 99 3.327 19.043 -1.705 1.00 11.53 O ATOM 1575 OE2 GLU A 99 3.980 21.105 -1.281 1.00 21.30 O ATOM 0 H GLU A 99 5.280 17.234 2.750 1.00 61.33 H new ATOM 0 HA GLU A 99 4.506 17.475 0.053 1.00 1.40 H new ATOM 0 HB2 GLU A 99 3.991 18.792 2.374 1.00 10.52 H new ATOM 0 HB3 GLU A 99 5.140 19.907 1.661 1.00 10.52 H new ATOM 0 HG2 GLU A 99 2.401 19.122 0.673 1.00 22.41 H new ATOM 0 HG3 GLU A 99 3.026 20.720 1.029 1.00 22.41 H new ATOM 1582 N GLU A 100 7.608 18.302 0.700 1.00 12.34 N ATOM 1583 CA GLU A 100 8.893 18.700 0.144 1.00 70.15 C ATOM 1584 C GLU A 100 9.911 17.559 0.258 1.00 63.25 C ATOM 1585 O GLU A 100 11.099 17.826 0.450 1.00 53.14 O ATOM 1586 CB GLU A 100 9.375 20.011 0.794 1.00 64.13 C ATOM 1587 CG GLU A 100 8.478 21.212 0.464 1.00 31.42 C ATOM 1588 CD GLU A 100 8.983 22.480 1.150 1.00 74.21 C ATOM 1589 OE1 GLU A 100 9.831 23.205 0.573 1.00 71.34 O ATOM 1590 OE2 GLU A 100 8.533 22.778 2.281 1.00 54.43 O ATOM 0 H GLU A 100 7.686 17.897 1.633 1.00 12.34 H new ATOM 0 HA GLU A 100 8.779 18.902 -0.921 1.00 70.15 H new ATOM 0 HB2 GLU A 100 9.414 19.880 1.875 1.00 64.13 H new ATOM 0 HB3 GLU A 100 10.391 20.222 0.462 1.00 64.13 H new ATOM 0 HG2 GLU A 100 8.451 21.364 -0.615 1.00 31.42 H new ATOM 0 HG3 GLU A 100 7.456 21.005 0.782 1.00 31.42 H new ATOM 1597 N SER A 101 9.491 16.297 0.131 1.00 3.23 N ATOM 1598 CA SER A 101 10.414 15.190 -0.102 1.00 24.12 C ATOM 1599 C SER A 101 9.714 14.093 -0.904 1.00 61.25 C ATOM 1600 O SER A 101 8.629 14.308 -1.450 1.00 11.22 O ATOM 1601 CB SER A 101 11.014 14.674 1.216 1.00 22.04 C ATOM 1602 OG SER A 101 12.376 14.355 1.054 1.00 30.12 O ATOM 0 H SER A 101 8.511 16.019 0.187 1.00 3.23 H new ATOM 0 HA SER A 101 11.257 15.545 -0.695 1.00 24.12 H new ATOM 0 HB2 SER A 101 10.903 15.431 1.992 1.00 22.04 H new ATOM 0 HB3 SER A 101 10.467 13.792 1.550 1.00 22.04 H new ATOM 0 HG SER A 101 12.464 13.410 0.811 1.00 30.12 H new ATOM 1608 N GLU A 102 10.377 12.947 -1.040 1.00 32.22 N ATOM 1609 CA GLU A 102 9.842 11.768 -1.708 1.00 4.40 C ATOM 1610 C GLU A 102 8.573 11.234 -1.024 1.00 64.02 C ATOM 1611 O GLU A 102 8.309 11.517 0.152 1.00 2.21 O ATOM 1612 CB GLU A 102 10.959 10.748 -1.966 1.00 33.41 C ATOM 1613 CG GLU A 102 11.290 9.959 -0.719 1.00 3.53 C ATOM 1614 CD GLU A 102 12.003 10.758 0.373 1.00 72.02 C ATOM 1615 OE1 GLU A 102 12.943 11.522 0.054 1.00 70.14 O ATOM 1616 OE2 GLU A 102 11.636 10.628 1.560 1.00 2.44 O ATOM 0 H GLU A 102 11.322 12.811 -0.680 1.00 32.22 H new ATOM 0 HA GLU A 102 9.479 12.041 -2.699 1.00 4.40 H new ATOM 0 HB2 GLU A 102 10.653 10.065 -2.759 1.00 33.41 H new ATOM 0 HB3 GLU A 102 11.851 11.266 -2.318 1.00 33.41 H new ATOM 0 HG2 GLU A 102 10.367 9.552 -0.308 1.00 3.53 H new ATOM 0 HG3 GLU A 102 11.916 9.111 -0.997 1.00 3.53 H new ATOM 1623 N VAL A 103 7.806 10.422 -1.756 1.00 23.11 N ATOM 1624 CA VAL A 103 6.714 9.658 -1.175 1.00 12.11 C ATOM 1625 C VAL A 103 7.251 8.593 -0.230 1.00 23.13 C ATOM 1626 O VAL A 103 8.354 8.069 -0.386 1.00 32.33 O ATOM 1627 CB VAL A 103 5.801 9.015 -2.237 1.00 51.11 C ATOM 1628 CG1 VAL A 103 4.832 10.051 -2.792 1.00 30.14 C ATOM 1629 CG2 VAL A 103 6.562 8.352 -3.388 1.00 32.43 C ATOM 0 H VAL A 103 7.928 10.280 -2.759 1.00 23.11 H new ATOM 0 HA VAL A 103 6.102 10.366 -0.616 1.00 12.11 H new ATOM 0 HB VAL A 103 5.258 8.220 -1.726 1.00 51.11 H new ATOM 0 HG11 VAL A 103 4.192 9.586 -3.542 1.00 30.14 H new ATOM 0 HG12 VAL A 103 4.217 10.444 -1.983 1.00 30.14 H new ATOM 0 HG13 VAL A 103 5.393 10.866 -3.250 1.00 30.14 H new ATOM 0 HG21 VAL A 103 5.852 7.922 -4.094 1.00 32.43 H new ATOM 0 HG22 VAL A 103 7.174 9.097 -3.897 1.00 32.43 H new ATOM 0 HG23 VAL A 103 7.203 7.564 -2.994 1.00 32.43 H new ATOM 1639 N ASP A 104 6.392 8.211 0.702 1.00 74.01 N ATOM 1640 CA ASP A 104 6.570 7.078 1.590 1.00 42.33 C ATOM 1641 C ASP A 104 5.554 5.988 1.262 1.00 2.50 C ATOM 1642 O ASP A 104 5.764 4.839 1.616 1.00 63.24 O ATOM 1643 CB ASP A 104 6.376 7.561 3.022 1.00 54.35 C ATOM 1644 CG ASP A 104 6.798 6.508 4.044 1.00 23.14 C ATOM 1645 OD1 ASP A 104 5.981 5.631 4.416 1.00 72.34 O ATOM 1646 OD2 ASP A 104 7.930 6.627 4.566 1.00 34.11 O ATOM 0 H ASP A 104 5.515 8.705 0.865 1.00 74.01 H new ATOM 0 HA ASP A 104 7.569 6.660 1.467 1.00 42.33 H new ATOM 0 HB2 ASP A 104 6.955 8.471 3.179 1.00 54.35 H new ATOM 0 HB3 ASP A 104 5.329 7.819 3.179 1.00 54.35 H new ATOM 1651 N LEU A 105 4.461 6.311 0.561 1.00 10.44 N ATOM 1652 CA LEU A 105 3.345 5.403 0.317 1.00 44.33 C ATOM 1653 C LEU A 105 2.653 5.855 -0.957 1.00 11.21 C ATOM 1654 O LEU A 105 2.267 7.019 -1.060 1.00 44.42 O ATOM 1655 CB LEU A 105 2.348 5.490 1.488 1.00 64.42 C ATOM 1656 CG LEU A 105 1.110 4.576 1.348 1.00 52.32 C ATOM 1657 CD1 LEU A 105 1.432 3.151 1.807 1.00 23.22 C ATOM 1658 CD2 LEU A 105 -0.045 5.134 2.186 1.00 73.43 C ATOM 0 H LEU A 105 4.329 7.231 0.141 1.00 10.44 H new ATOM 0 HA LEU A 105 3.700 4.377 0.224 1.00 44.33 H new ATOM 0 HB2 LEU A 105 2.869 5.235 2.411 1.00 64.42 H new ATOM 0 HB3 LEU A 105 2.012 6.522 1.586 1.00 64.42 H new ATOM 0 HG LEU A 105 0.821 4.548 0.297 1.00 52.32 H new ATOM 0 HD11 LEU A 105 0.546 2.525 1.700 1.00 23.22 H new ATOM 0 HD12 LEU A 105 2.239 2.746 1.196 1.00 23.22 H new ATOM 0 HD13 LEU A 105 1.741 3.166 2.852 1.00 23.22 H new ATOM 0 HD21 LEU A 105 -0.915 4.486 2.084 1.00 73.43 H new ATOM 0 HD22 LEU A 105 0.253 5.178 3.233 1.00 73.43 H new ATOM 0 HD23 LEU A 105 -0.296 6.136 1.838 1.00 73.43 H new ATOM 1670 N ARG A 106 2.419 4.939 -1.897 1.00 10.50 N ATOM 1671 CA ARG A 106 1.440 5.150 -2.961 1.00 71.11 C ATOM 1672 C ARG A 106 0.642 3.878 -3.149 1.00 12.22 C ATOM 1673 O ARG A 106 1.110 2.772 -2.850 1.00 2.50 O ATOM 1674 CB ARG A 106 2.071 5.628 -4.287 1.00 45.23 C ATOM 1675 CG ARG A 106 2.643 7.046 -4.149 1.00 65.11 C ATOM 1676 CD ARG A 106 2.696 7.848 -5.453 1.00 10.02 C ATOM 1677 NE ARG A 106 3.932 7.637 -6.218 1.00 62.53 N ATOM 1678 CZ ARG A 106 4.606 8.559 -6.918 1.00 25.11 C ATOM 1679 NH1 ARG A 106 4.264 9.841 -6.880 1.00 32.30 N ATOM 1680 NH2 ARG A 106 5.631 8.191 -7.669 1.00 24.30 N ATOM 0 H ARG A 106 2.898 4.039 -1.942 1.00 10.50 H new ATOM 0 HA ARG A 106 0.778 5.961 -2.655 1.00 71.11 H new ATOM 0 HB2 ARG A 106 2.863 4.941 -4.585 1.00 45.23 H new ATOM 0 HB3 ARG A 106 1.320 5.611 -5.077 1.00 45.23 H new ATOM 0 HG2 ARG A 106 2.042 7.596 -3.425 1.00 65.11 H new ATOM 0 HG3 ARG A 106 3.651 6.978 -3.740 1.00 65.11 H new ATOM 0 HD2 ARG A 106 1.842 7.575 -6.074 1.00 10.02 H new ATOM 0 HD3 ARG A 106 2.597 8.909 -5.223 1.00 10.02 H new ATOM 0 HE ARG A 106 4.316 6.692 -6.216 1.00 62.53 H new ATOM 0 HH11 ARG A 106 3.474 10.141 -6.309 1.00 32.30 H new ATOM 0 HH12 ARG A 106 4.792 10.526 -7.421 1.00 32.30 H new ATOM 0 HH21 ARG A 106 5.905 7.209 -7.713 1.00 24.30 H new ATOM 0 HH22 ARG A 106 6.148 8.889 -8.204 1.00 24.30 H new ATOM 1694 N VAL A 107 -0.598 4.043 -3.580 1.00 11.50 N ATOM 1695 CA VAL A 107 -1.501 2.951 -3.887 1.00 4.12 C ATOM 1696 C VAL A 107 -2.531 3.489 -4.886 1.00 64.24 C ATOM 1697 O VAL A 107 -2.956 4.646 -4.805 1.00 63.14 O ATOM 1698 CB VAL A 107 -2.132 2.383 -2.600 1.00 50.23 C ATOM 1699 CG1 VAL A 107 -2.781 3.493 -1.805 1.00 11.52 C ATOM 1700 CG2 VAL A 107 -3.104 1.238 -2.889 1.00 32.04 C ATOM 0 H VAL A 107 -1.012 4.963 -3.729 1.00 11.50 H new ATOM 0 HA VAL A 107 -0.976 2.109 -4.338 1.00 4.12 H new ATOM 0 HB VAL A 107 -1.335 1.952 -1.994 1.00 50.23 H new ATOM 0 HG11 VAL A 107 -3.223 3.080 -0.898 1.00 11.52 H new ATOM 0 HG12 VAL A 107 -2.030 4.236 -1.537 1.00 11.52 H new ATOM 0 HG13 VAL A 107 -3.559 3.964 -2.406 1.00 11.52 H new ATOM 0 HG21 VAL A 107 -3.523 0.871 -1.952 1.00 32.04 H new ATOM 0 HG22 VAL A 107 -3.909 1.597 -3.530 1.00 32.04 H new ATOM 0 HG23 VAL A 107 -2.574 0.429 -3.391 1.00 32.04 H new ATOM 1710 N GLU A 108 -2.989 2.627 -5.786 1.00 31.40 N ATOM 1711 CA GLU A 108 -3.989 2.906 -6.794 1.00 61.32 C ATOM 1712 C GLU A 108 -4.957 1.725 -6.697 1.00 1.13 C ATOM 1713 O GLU A 108 -4.541 0.562 -6.759 1.00 50.15 O ATOM 1714 CB GLU A 108 -3.327 3.091 -8.179 1.00 2.12 C ATOM 1715 CG GLU A 108 -2.283 4.228 -8.180 1.00 3.21 C ATOM 1716 CD GLU A 108 -1.793 4.696 -9.556 1.00 33.40 C ATOM 1717 OE1 GLU A 108 -2.050 4.018 -10.574 1.00 3.31 O ATOM 1718 OE2 GLU A 108 -1.102 5.747 -9.641 1.00 73.15 O ATOM 0 H GLU A 108 -2.651 1.666 -5.829 1.00 31.40 H new ATOM 0 HA GLU A 108 -4.528 3.842 -6.644 1.00 61.32 H new ATOM 0 HB2 GLU A 108 -2.847 2.159 -8.477 1.00 2.12 H new ATOM 0 HB3 GLU A 108 -4.096 3.305 -8.921 1.00 2.12 H new ATOM 0 HG2 GLU A 108 -2.709 5.085 -7.658 1.00 3.21 H new ATOM 0 HG3 GLU A 108 -1.419 3.900 -7.602 1.00 3.21 H new ATOM 1725 N PHE A 109 -6.223 2.013 -6.395 1.00 45.03 N ATOM 1726 CA PHE A 109 -7.277 1.029 -6.199 1.00 42.04 C ATOM 1727 C PHE A 109 -8.177 1.083 -7.428 1.00 61.41 C ATOM 1728 O PHE A 109 -8.718 2.150 -7.721 1.00 33.54 O ATOM 1729 CB PHE A 109 -8.088 1.377 -4.943 1.00 32.44 C ATOM 1730 CG PHE A 109 -7.365 1.233 -3.614 1.00 31.21 C ATOM 1731 CD1 PHE A 109 -6.598 2.286 -3.078 1.00 32.33 C ATOM 1732 CD2 PHE A 109 -7.500 0.040 -2.884 1.00 3.43 C ATOM 1733 CE1 PHE A 109 -5.994 2.143 -1.813 1.00 25.22 C ATOM 1734 CE2 PHE A 109 -6.930 -0.087 -1.605 1.00 53.43 C ATOM 1735 CZ PHE A 109 -6.176 0.966 -1.066 1.00 43.31 C ATOM 0 H PHE A 109 -6.550 2.972 -6.277 1.00 45.03 H new ATOM 0 HA PHE A 109 -6.858 0.031 -6.068 1.00 42.04 H new ATOM 0 HB2 PHE A 109 -8.435 2.406 -5.034 1.00 32.44 H new ATOM 0 HB3 PHE A 109 -8.974 0.743 -4.921 1.00 32.44 H new ATOM 0 HD1 PHE A 109 -6.473 3.202 -3.636 1.00 32.33 H new ATOM 0 HD2 PHE A 109 -8.047 -0.788 -3.310 1.00 3.43 H new ATOM 0 HE1 PHE A 109 -5.387 2.943 -1.415 1.00 25.22 H new ATOM 0 HE2 PHE A 109 -7.073 -0.995 -1.038 1.00 53.43 H new ATOM 0 HZ PHE A 109 -5.738 0.873 -0.083 1.00 43.31 H new ATOM 1745 N GLU A 110 -8.363 -0.043 -8.118 1.00 41.04 N ATOM 1746 CA GLU A 110 -9.236 -0.160 -9.283 1.00 51.43 C ATOM 1747 C GLU A 110 -10.260 -1.262 -9.022 1.00 54.30 C ATOM 1748 O GLU A 110 -9.908 -2.390 -8.658 1.00 32.43 O ATOM 1749 CB GLU A 110 -8.451 -0.474 -10.567 1.00 1.34 C ATOM 1750 CG GLU A 110 -7.739 0.733 -11.201 1.00 41.43 C ATOM 1751 CD GLU A 110 -6.881 0.340 -12.427 1.00 31.33 C ATOM 1752 OE1 GLU A 110 -6.932 -0.832 -12.871 1.00 11.15 O ATOM 1753 OE2 GLU A 110 -6.116 1.172 -12.964 1.00 73.34 O ATOM 0 H GLU A 110 -7.899 -0.918 -7.875 1.00 41.04 H new ATOM 0 HA GLU A 110 -9.732 0.799 -9.434 1.00 51.43 H new ATOM 0 HB2 GLU A 110 -7.708 -1.240 -10.343 1.00 1.34 H new ATOM 0 HB3 GLU A 110 -9.136 -0.899 -11.300 1.00 1.34 H new ATOM 0 HG2 GLU A 110 -8.482 1.471 -11.504 1.00 41.43 H new ATOM 0 HG3 GLU A 110 -7.103 1.209 -10.454 1.00 41.43 H new ATOM 1760 N LEU A 111 -11.536 -0.941 -9.232 1.00 63.53 N ATOM 1761 CA LEU A 111 -12.604 -1.941 -9.275 1.00 61.11 C ATOM 1762 C LEU A 111 -12.375 -2.825 -10.497 1.00 70.44 C ATOM 1763 O LEU A 111 -11.995 -2.324 -11.558 1.00 12.41 O ATOM 1764 CB LEU A 111 -13.973 -1.243 -9.308 1.00 73.22 C ATOM 1765 CG LEU A 111 -15.241 -2.049 -8.917 1.00 52.20 C ATOM 1766 CD1 LEU A 111 -16.176 -2.283 -10.094 1.00 65.41 C ATOM 1767 CD2 LEU A 111 -15.054 -3.325 -8.107 1.00 24.42 C ATOM 0 H LEU A 111 -11.859 0.016 -9.377 1.00 63.53 H new ATOM 0 HA LEU A 111 -12.592 -2.568 -8.383 1.00 61.11 H new ATOM 0 HB2 LEU A 111 -13.917 -0.378 -8.647 1.00 73.22 H new ATOM 0 HB3 LEU A 111 -14.124 -0.863 -10.318 1.00 73.22 H new ATOM 0 HG LEU A 111 -15.709 -1.368 -8.206 1.00 52.20 H new ATOM 0 HD11 LEU A 111 -17.045 -2.851 -9.761 1.00 65.41 H new ATOM 0 HD12 LEU A 111 -16.502 -1.324 -10.496 1.00 65.41 H new ATOM 0 HD13 LEU A 111 -15.652 -2.842 -10.869 1.00 65.41 H new ATOM 0 HD21 LEU A 111 -16.026 -3.777 -7.910 1.00 24.42 H new ATOM 0 HD22 LEU A 111 -14.435 -4.025 -8.668 1.00 24.42 H new ATOM 0 HD23 LEU A 111 -14.566 -3.088 -7.161 1.00 24.42 H new ATOM 1779 N GLN A 112 -12.563 -4.134 -10.350 1.00 65.53 N ATOM 1780 CA GLN A 112 -12.584 -5.076 -11.460 1.00 33.25 C ATOM 1781 C GLN A 112 -14.028 -5.413 -11.808 1.00 34.15 C ATOM 1782 O GLN A 112 -14.908 -5.301 -10.956 1.00 31.52 O ATOM 1783 CB GLN A 112 -11.834 -6.350 -11.073 1.00 51.02 C ATOM 1784 CG GLN A 112 -10.361 -6.062 -10.770 1.00 52.24 C ATOM 1785 CD GLN A 112 -9.619 -5.457 -11.960 1.00 72.23 C ATOM 1786 OE1 GLN A 112 -9.608 -6.015 -13.052 1.00 41.04 O ATOM 1787 NE2 GLN A 112 -8.955 -4.329 -11.774 1.00 13.24 N ATOM 0 H GLN A 112 -12.707 -4.574 -9.441 1.00 65.53 H new ATOM 0 HA GLN A 112 -12.097 -4.627 -12.326 1.00 33.25 H new ATOM 0 HB2 GLN A 112 -12.305 -6.800 -10.199 1.00 51.02 H new ATOM 0 HB3 GLN A 112 -11.905 -7.076 -11.883 1.00 51.02 H new ATOM 0 HG2 GLN A 112 -10.296 -5.380 -9.922 1.00 52.24 H new ATOM 0 HG3 GLN A 112 -9.868 -6.988 -10.473 1.00 52.24 H new ATOM 0 HE21 GLN A 112 -8.970 -3.873 -10.862 1.00 13.24 H new ATOM 0 HE22 GLN A 112 -8.427 -3.915 -12.543 1.00 13.24 H new ATOM 1796 N ALA A 113 -14.260 -5.909 -13.024 1.00 45.12 N ATOM 1797 CA ALA A 113 -15.593 -6.252 -13.513 1.00 65.34 C ATOM 1798 C ALA A 113 -16.261 -7.316 -12.637 1.00 71.40 C ATOM 1799 O ALA A 113 -17.477 -7.316 -12.454 1.00 44.30 O ATOM 1800 CB ALA A 113 -15.458 -6.744 -14.952 1.00 31.22 C ATOM 0 H ALA A 113 -13.519 -6.085 -13.703 1.00 45.12 H new ATOM 0 HA ALA A 113 -16.231 -5.369 -13.473 1.00 65.34 H new ATOM 0 HB1 ALA A 113 -16.442 -7.007 -15.340 1.00 31.22 H new ATOM 0 HB2 ALA A 113 -15.024 -5.956 -15.567 1.00 31.22 H new ATOM 0 HB3 ALA A 113 -14.812 -7.621 -14.977 1.00 31.22 H new ATOM 1806 N ASP A 114 -15.449 -8.192 -12.038 1.00 51.23 N ATOM 1807 CA ASP A 114 -15.890 -9.214 -11.098 1.00 23.11 C ATOM 1808 C ASP A 114 -16.517 -8.603 -9.833 1.00 23.24 C ATOM 1809 O ASP A 114 -17.207 -9.301 -9.087 1.00 51.40 O ATOM 1810 CB ASP A 114 -14.689 -10.105 -10.757 1.00 50.04 C ATOM 1811 CG ASP A 114 -15.058 -11.340 -9.935 1.00 30.21 C ATOM 1812 OD1 ASP A 114 -16.107 -11.982 -10.178 1.00 23.12 O ATOM 1813 OD2 ASP A 114 -14.264 -11.721 -9.052 1.00 2.33 O ATOM 0 H ASP A 114 -14.442 -8.206 -12.201 1.00 51.23 H new ATOM 0 HA ASP A 114 -16.675 -9.813 -11.560 1.00 23.11 H new ATOM 0 HB2 ASP A 114 -14.210 -10.425 -11.682 1.00 50.04 H new ATOM 0 HB3 ASP A 114 -13.956 -9.517 -10.205 1.00 50.04 H new ATOM 1818 N GLY A 115 -16.361 -7.295 -9.588 1.00 5.12 N ATOM 1819 CA GLY A 115 -17.010 -6.603 -8.499 1.00 52.40 C ATOM 1820 C GLY A 115 -16.192 -6.646 -7.218 1.00 3.32 C ATOM 1821 O GLY A 115 -16.631 -6.070 -6.225 1.00 1.04 O ATOM 0 H GLY A 115 -15.768 -6.691 -10.158 1.00 5.12 H new ATOM 0 HA2 GLY A 115 -17.182 -5.565 -8.783 1.00 52.40 H new ATOM 0 HA3 GLY A 115 -17.987 -7.050 -8.318 1.00 52.40 H new ATOM 1825 N LYS A 116 -15.017 -7.286 -7.190 1.00 43.40 N ATOM 1826 CA LYS A 116 -14.051 -6.980 -6.139 1.00 32.24 C ATOM 1827 C LYS A 116 -13.239 -5.788 -6.594 1.00 45.01 C ATOM 1828 O LYS A 116 -12.883 -5.670 -7.769 1.00 72.24 O ATOM 1829 CB LYS A 116 -13.064 -8.111 -5.841 1.00 61.13 C ATOM 1830 CG LYS A 116 -13.664 -9.330 -5.142 1.00 24.35 C ATOM 1831 CD LYS A 116 -14.312 -10.286 -6.145 1.00 65.33 C ATOM 1832 CE LYS A 116 -14.335 -11.711 -5.593 1.00 31.54 C ATOM 1833 NZ LYS A 116 -14.851 -12.647 -6.603 1.00 65.53 N ATOM 0 H LYS A 116 -14.722 -7.995 -7.861 1.00 43.40 H new ATOM 0 HA LYS A 116 -14.624 -6.803 -5.229 1.00 32.24 H new ATOM 0 HB2 LYS A 116 -12.613 -8.435 -6.779 1.00 61.13 H new ATOM 0 HB3 LYS A 116 -12.260 -7.716 -5.221 1.00 61.13 H new ATOM 0 HG2 LYS A 116 -12.885 -9.854 -4.589 1.00 24.35 H new ATOM 0 HG3 LYS A 116 -14.408 -9.005 -4.414 1.00 24.35 H new ATOM 0 HD2 LYS A 116 -15.328 -9.958 -6.363 1.00 65.33 H new ATOM 0 HD3 LYS A 116 -13.761 -10.263 -7.085 1.00 65.33 H new ATOM 0 HE2 LYS A 116 -13.330 -12.008 -5.294 1.00 31.54 H new ATOM 0 HE3 LYS A 116 -14.958 -11.751 -4.700 1.00 31.54 H new ATOM 0 HZ1 LYS A 116 -14.185 -13.438 -6.715 1.00 65.53 H new ATOM 0 HZ2 LYS A 116 -15.775 -13.013 -6.297 1.00 65.53 H new ATOM 0 HZ3 LYS A 116 -14.958 -12.153 -7.512 1.00 65.53 H new ATOM 1847 N TRP A 117 -12.873 -4.957 -5.637 1.00 61.41 N ATOM 1848 CA TRP A 117 -11.857 -3.946 -5.814 1.00 12.32 C ATOM 1849 C TRP A 117 -10.505 -4.617 -5.629 1.00 13.05 C ATOM 1850 O TRP A 117 -10.321 -5.388 -4.683 1.00 73.53 O ATOM 1851 CB TRP A 117 -12.110 -2.847 -4.793 1.00 63.50 C ATOM 1852 CG TRP A 117 -13.380 -2.091 -4.986 1.00 74.54 C ATOM 1853 CD1 TRP A 117 -14.609 -2.495 -4.583 1.00 71.33 C ATOM 1854 CD2 TRP A 117 -13.564 -0.792 -5.617 1.00 53.14 C ATOM 1855 NE1 TRP A 117 -15.538 -1.564 -4.986 1.00 51.33 N ATOM 1856 CE2 TRP A 117 -14.952 -0.478 -5.587 1.00 63.20 C ATOM 1857 CE3 TRP A 117 -12.699 0.171 -6.182 1.00 10.13 C ATOM 1858 CZ2 TRP A 117 -15.461 0.724 -6.084 1.00 53.21 C ATOM 1859 CZ3 TRP A 117 -13.189 1.420 -6.609 1.00 21.43 C ATOM 1860 CH2 TRP A 117 -14.566 1.700 -6.546 1.00 2.00 C ATOM 0 H TRP A 117 -13.281 -4.968 -4.702 1.00 61.41 H new ATOM 0 HA TRP A 117 -11.878 -3.493 -6.805 1.00 12.32 H new ATOM 0 HB2 TRP A 117 -12.116 -3.291 -3.797 1.00 63.50 H new ATOM 0 HB3 TRP A 117 -11.278 -2.144 -4.824 1.00 63.50 H new ATOM 0 HD1 TRP A 117 -14.824 -3.400 -4.035 1.00 71.33 H new ATOM 0 HE1 TRP A 117 -16.544 -1.668 -4.854 1.00 51.33 H new ATOM 0 HE3 TRP A 117 -11.648 -0.054 -6.288 1.00 10.13 H new ATOM 0 HZ2 TRP A 117 -16.526 0.899 -6.112 1.00 53.21 H new ATOM 0 HZ3 TRP A 117 -12.505 2.166 -6.986 1.00 21.43 H new ATOM 0 HH2 TRP A 117 -14.934 2.667 -6.854 1.00 2.00 H new ATOM 1871 N TYR A 118 -9.570 -4.330 -6.528 1.00 71.34 N ATOM 1872 CA TYR A 118 -8.207 -4.825 -6.483 1.00 54.23 C ATOM 1873 C TYR A 118 -7.277 -3.629 -6.295 1.00 74.21 C ATOM 1874 O TYR A 118 -7.624 -2.479 -6.575 1.00 51.30 O ATOM 1875 CB TYR A 118 -7.880 -5.586 -7.779 1.00 32.21 C ATOM 1876 CG TYR A 118 -8.280 -7.056 -7.801 1.00 14.41 C ATOM 1877 CD1 TYR A 118 -9.631 -7.456 -7.817 1.00 52.01 C ATOM 1878 CD2 TYR A 118 -7.278 -8.040 -7.860 1.00 45.02 C ATOM 1879 CE1 TYR A 118 -9.962 -8.823 -7.904 1.00 2.23 C ATOM 1880 CE2 TYR A 118 -7.596 -9.405 -7.905 1.00 53.00 C ATOM 1881 CZ TYR A 118 -8.949 -9.805 -7.920 1.00 41.41 C ATOM 1882 OH TYR A 118 -9.278 -11.124 -7.942 1.00 64.51 O ATOM 0 H TYR A 118 -9.749 -3.728 -7.331 1.00 71.34 H new ATOM 0 HA TYR A 118 -8.077 -5.521 -5.654 1.00 54.23 H new ATOM 0 HB2 TYR A 118 -8.374 -5.082 -8.609 1.00 32.21 H new ATOM 0 HB3 TYR A 118 -6.807 -5.518 -7.958 1.00 32.21 H new ATOM 0 HD1 TYR A 118 -10.414 -6.714 -7.763 1.00 52.01 H new ATOM 0 HD2 TYR A 118 -6.241 -7.738 -7.871 1.00 45.02 H new ATOM 0 HE1 TYR A 118 -10.999 -9.121 -7.959 1.00 2.23 H new ATOM 0 HE2 TYR A 118 -6.810 -10.146 -7.928 1.00 53.00 H new ATOM 0 HH TYR A 118 -8.461 -11.665 -7.952 1.00 64.51 H new ATOM 1892 N VAL A 119 -6.068 -3.919 -5.837 1.00 12.41 N ATOM 1893 CA VAL A 119 -4.986 -2.965 -5.693 1.00 64.33 C ATOM 1894 C VAL A 119 -4.054 -3.162 -6.880 1.00 51.04 C ATOM 1895 O VAL A 119 -3.570 -4.275 -7.087 1.00 5.31 O ATOM 1896 CB VAL A 119 -4.343 -3.210 -4.319 1.00 30.44 C ATOM 1897 CG1 VAL A 119 -2.999 -2.526 -4.125 1.00 71.44 C ATOM 1898 CG2 VAL A 119 -5.311 -2.674 -3.262 1.00 62.42 C ATOM 0 H VAL A 119 -5.807 -4.861 -5.546 1.00 12.41 H new ATOM 0 HA VAL A 119 -5.300 -1.921 -5.709 1.00 64.33 H new ATOM 0 HB VAL A 119 -4.157 -4.281 -4.234 1.00 30.44 H new ATOM 0 HG11 VAL A 119 -2.616 -2.751 -3.130 1.00 71.44 H new ATOM 0 HG12 VAL A 119 -2.295 -2.888 -4.875 1.00 71.44 H new ATOM 0 HG13 VAL A 119 -3.121 -1.448 -4.232 1.00 71.44 H new ATOM 0 HG21 VAL A 119 -4.889 -2.830 -2.269 1.00 62.42 H new ATOM 0 HG22 VAL A 119 -5.473 -1.608 -3.424 1.00 62.42 H new ATOM 0 HG23 VAL A 119 -6.262 -3.201 -3.339 1.00 62.42 H new ATOM 1908 N VAL A 120 -3.840 -2.108 -7.665 1.00 31.43 N ATOM 1909 CA VAL A 120 -2.976 -2.091 -8.841 1.00 5.34 C ATOM 1910 C VAL A 120 -1.690 -1.307 -8.561 1.00 71.30 C ATOM 1911 O VAL A 120 -0.889 -1.140 -9.475 1.00 5.33 O ATOM 1912 CB VAL A 120 -3.744 -1.563 -10.077 1.00 71.31 C ATOM 1913 CG1 VAL A 120 -4.822 -2.545 -10.542 1.00 61.54 C ATOM 1914 CG2 VAL A 120 -4.397 -0.196 -9.856 1.00 13.13 C ATOM 0 H VAL A 120 -4.283 -1.206 -7.491 1.00 31.43 H new ATOM 0 HA VAL A 120 -2.674 -3.113 -9.072 1.00 5.34 H new ATOM 0 HB VAL A 120 -2.980 -1.455 -10.847 1.00 71.31 H new ATOM 0 HG11 VAL A 120 -5.337 -2.136 -11.411 1.00 61.54 H new ATOM 0 HG12 VAL A 120 -4.358 -3.495 -10.809 1.00 61.54 H new ATOM 0 HG13 VAL A 120 -5.540 -2.705 -9.737 1.00 61.54 H new ATOM 0 HG21 VAL A 120 -4.917 0.110 -10.764 1.00 13.13 H new ATOM 0 HG22 VAL A 120 -5.110 -0.262 -9.034 1.00 13.13 H new ATOM 0 HG23 VAL A 120 -3.630 0.539 -9.612 1.00 13.13 H new ATOM 1924 N ASP A 121 -1.439 -0.878 -7.318 1.00 63.42 N ATOM 1925 CA ASP A 121 -0.175 -0.257 -6.943 1.00 24.14 C ATOM 1926 C ASP A 121 0.194 -0.577 -5.506 1.00 54.40 C ATOM 1927 O ASP A 121 -0.690 -0.712 -4.660 1.00 21.43 O ATOM 1928 CB ASP A 121 -0.205 1.267 -7.095 1.00 13.23 C ATOM 1929 CG ASP A 121 1.223 1.799 -7.214 1.00 32.30 C ATOM 1930 OD1 ASP A 121 2.086 1.045 -7.740 1.00 51.44 O ATOM 1931 OD2 ASP A 121 1.438 2.951 -6.788 1.00 11.30 O ATOM 0 H ASP A 121 -2.107 -0.954 -6.551 1.00 63.42 H new ATOM 0 HA ASP A 121 0.568 -0.670 -7.625 1.00 24.14 H new ATOM 0 HB2 ASP A 121 -0.781 1.543 -7.978 1.00 13.23 H new ATOM 0 HB3 ASP A 121 -0.702 1.718 -6.236 1.00 13.23 H new ATOM 1936 N CYS A 122 1.483 -0.677 -5.202 1.00 52.12 N ATOM 1937 CA CYS A 122 1.957 -0.762 -3.833 1.00 42.50 C ATOM 1938 C CYS A 122 3.359 -0.179 -3.787 1.00 31.20 C ATOM 1939 O CYS A 122 4.321 -0.906 -4.037 1.00 53.10 O ATOM 1940 CB CYS A 122 1.911 -2.210 -3.312 1.00 22.13 C ATOM 1941 SG CYS A 122 2.311 -2.229 -1.540 1.00 64.02 S ATOM 0 H CYS A 122 2.226 -0.701 -5.900 1.00 52.12 H new ATOM 0 HA CYS A 122 1.306 -0.189 -3.172 1.00 42.50 H new ATOM 0 HB2 CYS A 122 0.921 -2.636 -3.477 1.00 22.13 H new ATOM 0 HB3 CYS A 122 2.620 -2.829 -3.862 1.00 22.13 H new ATOM 0 HG CYS A 122 2.271 -3.451 -1.099 1.00 64.02 H new ATOM 1947 N TYR A 123 3.472 1.112 -3.486 1.00 14.52 N ATOM 1948 CA TYR A 123 4.714 1.687 -2.998 1.00 5.14 C ATOM 1949 C TYR A 123 4.599 1.829 -1.484 1.00 44.32 C ATOM 1950 O TYR A 123 3.508 2.068 -0.954 1.00 42.52 O ATOM 1951 CB TYR A 123 4.967 3.043 -3.653 1.00 61.22 C ATOM 1952 CG TYR A 123 6.351 3.599 -3.401 1.00 64.15 C ATOM 1953 CD1 TYR A 123 7.425 3.154 -4.193 1.00 10.52 C ATOM 1954 CD2 TYR A 123 6.565 4.585 -2.419 1.00 12.13 C ATOM 1955 CE1 TYR A 123 8.707 3.692 -4.003 1.00 61.42 C ATOM 1956 CE2 TYR A 123 7.849 5.123 -2.225 1.00 2.34 C ATOM 1957 CZ TYR A 123 8.930 4.677 -3.020 1.00 2.52 C ATOM 1958 OH TYR A 123 10.186 5.179 -2.880 1.00 24.43 O ATOM 0 H TYR A 123 2.708 1.782 -3.574 1.00 14.52 H new ATOM 0 HA TYR A 123 5.556 1.042 -3.249 1.00 5.14 H new ATOM 0 HB2 TYR A 123 4.814 2.950 -4.728 1.00 61.22 H new ATOM 0 HB3 TYR A 123 4.228 3.756 -3.287 1.00 61.22 H new ATOM 0 HD1 TYR A 123 7.263 2.398 -4.947 1.00 10.52 H new ATOM 0 HD2 TYR A 123 5.740 4.929 -1.813 1.00 12.13 H new ATOM 0 HE1 TYR A 123 9.529 3.349 -4.614 1.00 61.42 H new ATOM 0 HE2 TYR A 123 8.010 5.877 -1.469 1.00 2.34 H new ATOM 0 HH TYR A 123 10.192 5.850 -2.166 1.00 24.43 H new ATOM 1968 N THR A 124 5.721 1.684 -0.798 1.00 30.32 N ATOM 1969 CA THR A 124 5.891 1.847 0.635 1.00 12.22 C ATOM 1970 C THR A 124 7.388 2.073 0.882 1.00 1.30 C ATOM 1971 O THR A 124 8.211 1.504 0.150 1.00 54.11 O ATOM 1972 CB THR A 124 5.291 0.639 1.387 1.00 61.33 C ATOM 1973 OG1 THR A 124 5.684 0.609 2.740 1.00 31.22 O ATOM 1974 CG2 THR A 124 5.648 -0.724 0.777 1.00 31.30 C ATOM 0 H THR A 124 6.595 1.432 -1.259 1.00 30.32 H new ATOM 0 HA THR A 124 5.349 2.708 1.026 1.00 12.22 H new ATOM 0 HB THR A 124 4.215 0.791 1.296 1.00 61.33 H new ATOM 0 HG1 THR A 124 5.282 -0.169 3.180 1.00 31.22 H new ATOM 0 HG21 THR A 124 5.187 -1.518 1.365 1.00 31.30 H new ATOM 0 HG22 THR A 124 5.280 -0.771 -0.248 1.00 31.30 H new ATOM 0 HG23 THR A 124 6.730 -0.852 0.780 1.00 31.30 H new ATOM 1982 N GLY A 125 7.743 2.859 1.902 1.00 42.55 N ATOM 1983 CA GLY A 125 9.115 3.157 2.297 1.00 23.32 C ATOM 1984 C GLY A 125 9.912 1.892 2.620 1.00 54.35 C ATOM 1985 O GLY A 125 11.119 1.852 2.372 1.00 53.41 O ATOM 0 H GLY A 125 7.054 3.321 2.495 1.00 42.55 H new ATOM 0 HA2 GLY A 125 9.612 3.702 1.494 1.00 23.32 H new ATOM 0 HA3 GLY A 125 9.106 3.811 3.169 1.00 23.32 H new ATOM 1989 N TRP A 126 9.222 0.826 3.047 1.00 74.02 N ATOM 1990 CA TRP A 126 9.763 -0.521 3.203 1.00 74.05 C ATOM 1991 C TRP A 126 10.596 -0.966 2.007 1.00 30.00 C ATOM 1992 O TRP A 126 11.605 -1.642 2.176 1.00 4.21 O ATOM 1993 CB TRP A 126 8.603 -1.510 3.364 1.00 41.43 C ATOM 1994 CG TRP A 126 8.279 -1.891 4.763 1.00 14.31 C ATOM 1995 CD1 TRP A 126 7.060 -1.887 5.348 1.00 54.42 C ATOM 1996 CD2 TRP A 126 9.207 -2.401 5.755 1.00 10.44 C ATOM 1997 NE1 TRP A 126 7.164 -2.433 6.613 1.00 12.23 N ATOM 1998 CE2 TRP A 126 8.459 -2.813 6.889 1.00 5.33 C ATOM 1999 CE3 TRP A 126 10.601 -2.602 5.787 1.00 30.33 C ATOM 2000 CZ2 TRP A 126 9.061 -3.479 7.960 1.00 44.44 C ATOM 2001 CZ3 TRP A 126 11.223 -3.180 6.901 1.00 22.25 C ATOM 2002 CH2 TRP A 126 10.456 -3.642 7.985 1.00 2.32 C ATOM 0 H TRP A 126 8.236 0.886 3.301 1.00 74.02 H new ATOM 0 HA TRP A 126 10.410 -0.505 4.080 1.00 74.05 H new ATOM 0 HB2 TRP A 126 7.713 -1.077 2.908 1.00 41.43 H new ATOM 0 HB3 TRP A 126 8.839 -2.415 2.804 1.00 41.43 H new ATOM 0 HD1 TRP A 126 6.151 -1.516 4.898 1.00 54.42 H new ATOM 0 HE1 TRP A 126 6.382 -2.541 7.259 1.00 12.23 H new ATOM 0 HE3 TRP A 126 11.200 -2.306 4.939 1.00 30.33 H new ATOM 0 HZ2 TRP A 126 8.456 -3.867 8.766 1.00 44.44 H new ATOM 0 HZ3 TRP A 126 12.299 -3.271 6.927 1.00 22.25 H new ATOM 0 HH2 TRP A 126 10.935 -4.117 8.828 1.00 2.32 H new ATOM 2013 N TYR A 127 10.154 -0.614 0.802 1.00 1.12 N ATOM 2014 CA TYR A 127 10.814 -0.964 -0.439 1.00 5.31 C ATOM 2015 C TYR A 127 11.006 0.325 -1.254 1.00 71.14 C ATOM 2016 O TYR A 127 10.693 0.369 -2.452 1.00 64.02 O ATOM 2017 CB TYR A 127 10.026 -2.075 -1.151 1.00 12.55 C ATOM 2018 CG TYR A 127 9.897 -3.389 -0.396 1.00 34.43 C ATOM 2019 CD1 TYR A 127 10.884 -4.387 -0.514 1.00 22.31 C ATOM 2020 CD2 TYR A 127 8.767 -3.624 0.411 1.00 23.02 C ATOM 2021 CE1 TYR A 127 10.766 -5.596 0.195 1.00 14.45 C ATOM 2022 CE2 TYR A 127 8.637 -4.830 1.119 1.00 42.12 C ATOM 2023 CZ TYR A 127 9.644 -5.813 1.015 1.00 30.43 C ATOM 2024 OH TYR A 127 9.542 -6.987 1.691 1.00 4.45 O ATOM 0 H TYR A 127 9.306 -0.064 0.666 1.00 1.12 H new ATOM 0 HA TYR A 127 11.807 -1.385 -0.278 1.00 5.31 H new ATOM 0 HB2 TYR A 127 9.024 -1.702 -1.366 1.00 12.55 H new ATOM 0 HB3 TYR A 127 10.504 -2.275 -2.110 1.00 12.55 H new ATOM 0 HD1 TYR A 127 11.738 -4.223 -1.154 1.00 22.31 H new ATOM 0 HD2 TYR A 127 7.995 -2.872 0.486 1.00 23.02 H new ATOM 0 HE1 TYR A 127 11.532 -6.353 0.110 1.00 14.45 H new ATOM 0 HE2 TYR A 127 7.771 -5.004 1.740 1.00 42.12 H new ATOM 0 HH TYR A 127 9.842 -7.722 1.117 1.00 4.45 H new ATOM 2034 N GLY A 128 11.408 1.404 -0.574 1.00 3.13 N ATOM 2035 CA GLY A 128 11.606 2.742 -1.114 1.00 44.43 C ATOM 2036 C GLY A 128 13.064 2.991 -1.501 1.00 21.21 C ATOM 2037 O GLY A 128 13.896 2.080 -1.449 1.00 71.42 O ATOM 0 H GLY A 128 11.614 1.358 0.424 1.00 3.13 H new ATOM 0 HA2 GLY A 128 10.970 2.878 -1.989 1.00 44.43 H new ATOM 0 HA3 GLY A 128 11.295 3.481 -0.376 1.00 44.43 H new ATOM 2041 N TYR A 129 13.377 4.233 -1.876 1.00 52.45 N ATOM 2042 CA TYR A 129 14.699 4.743 -2.270 1.00 53.12 C ATOM 2043 C TYR A 129 15.652 4.897 -1.061 1.00 2.52 C ATOM 2044 O TYR A 129 16.455 5.833 -0.969 1.00 12.11 O ATOM 2045 CB TYR A 129 14.494 6.066 -3.039 1.00 23.02 C ATOM 2046 CG TYR A 129 14.364 5.969 -4.555 1.00 64.13 C ATOM 2047 CD1 TYR A 129 13.469 5.066 -5.168 1.00 22.12 C ATOM 2048 CD2 TYR A 129 15.155 6.810 -5.367 1.00 34.11 C ATOM 2049 CE1 TYR A 129 13.366 5.012 -6.570 1.00 45.45 C ATOM 2050 CE2 TYR A 129 15.051 6.767 -6.768 1.00 50.35 C ATOM 2051 CZ TYR A 129 14.146 5.871 -7.377 1.00 44.11 C ATOM 2052 OH TYR A 129 14.014 5.833 -8.731 1.00 23.14 O ATOM 0 H TYR A 129 12.666 4.963 -1.916 1.00 52.45 H new ATOM 0 HA TYR A 129 15.191 4.022 -2.922 1.00 53.12 H new ATOM 0 HB2 TYR A 129 13.596 6.548 -2.652 1.00 23.02 H new ATOM 0 HB3 TYR A 129 15.333 6.724 -2.812 1.00 23.02 H new ATOM 0 HD1 TYR A 129 12.861 4.414 -4.558 1.00 22.12 H new ATOM 0 HD2 TYR A 129 15.850 7.496 -4.905 1.00 34.11 H new ATOM 0 HE1 TYR A 129 12.687 4.310 -7.032 1.00 45.45 H new ATOM 0 HE2 TYR A 129 15.662 7.417 -7.377 1.00 50.35 H new ATOM 0 HH TYR A 129 14.483 6.597 -9.127 1.00 23.14 H new ATOM 2062 N ASP A 130 15.557 3.971 -0.116 1.00 31.23 N ATOM 2063 CA ASP A 130 15.895 4.166 1.289 1.00 61.41 C ATOM 2064 C ASP A 130 16.899 3.111 1.768 1.00 10.30 C ATOM 2065 O ASP A 130 17.545 3.301 2.807 1.00 70.41 O ATOM 2066 CB ASP A 130 14.602 4.103 2.124 1.00 41.14 C ATOM 2067 CG ASP A 130 13.700 5.333 1.981 1.00 25.24 C ATOM 2068 OD1 ASP A 130 12.973 5.441 0.968 1.00 32.12 O ATOM 2069 OD2 ASP A 130 13.696 6.169 2.917 1.00 72.43 O ATOM 0 H ASP A 130 15.229 3.026 -0.315 1.00 31.23 H new ATOM 0 HA ASP A 130 16.366 5.141 1.412 1.00 61.41 H new ATOM 0 HB2 ASP A 130 14.038 3.217 1.833 1.00 41.14 H new ATOM 0 HB3 ASP A 130 14.867 3.981 3.174 1.00 41.14 H new ATOM 2074 N LEU A 131 17.089 2.018 1.012 1.00 24.34 N ATOM 2075 CA LEU A 131 17.976 0.911 1.366 1.00 23.31 C ATOM 2076 C LEU A 131 18.636 0.344 0.100 1.00 1.44 C ATOM 2077 O LEU A 131 18.057 0.419 -0.988 1.00 70.12 O ATOM 2078 CB LEU A 131 17.173 -0.191 2.084 1.00 23.32 C ATOM 2079 CG LEU A 131 17.055 -0.028 3.614 1.00 54.25 C ATOM 2080 CD1 LEU A 131 16.163 -1.139 4.179 1.00 71.05 C ATOM 2081 CD2 LEU A 131 18.409 -0.123 4.330 1.00 5.10 C ATOM 0 H LEU A 131 16.617 1.881 0.118 1.00 24.34 H new ATOM 0 HA LEU A 131 18.755 1.276 2.036 1.00 23.31 H new ATOM 0 HB2 LEU A 131 16.169 -0.222 1.660 1.00 23.32 H new ATOM 0 HB3 LEU A 131 17.638 -1.154 1.872 1.00 23.32 H new ATOM 0 HG LEU A 131 16.636 0.963 3.788 1.00 54.25 H new ATOM 0 HD11 LEU A 131 16.079 -1.024 5.260 1.00 71.05 H new ATOM 0 HD12 LEU A 131 15.172 -1.074 3.729 1.00 71.05 H new ATOM 0 HD13 LEU A 131 16.602 -2.110 3.950 1.00 71.05 H new ATOM 0 HD21 LEU A 131 18.262 -0.001 5.403 1.00 5.10 H new ATOM 0 HD22 LEU A 131 18.857 -1.097 4.133 1.00 5.10 H new ATOM 0 HD23 LEU A 131 19.071 0.661 3.963 1.00 5.10 H new ATOM 2093 N PRO A 132 19.845 -0.232 0.199 1.00 25.31 N ATOM 2094 CA PRO A 132 20.642 -0.624 -0.960 1.00 30.33 C ATOM 2095 C PRO A 132 20.168 -1.932 -1.576 1.00 12.44 C ATOM 2096 O PRO A 132 19.464 -2.719 -0.943 1.00 44.11 O ATOM 2097 CB PRO A 132 22.059 -0.825 -0.400 1.00 71.33 C ATOM 2098 CG PRO A 132 21.778 -1.345 1.002 1.00 74.12 C ATOM 2099 CD PRO A 132 20.598 -0.474 1.420 1.00 13.31 C ATOM 0 HA PRO A 132 20.575 0.129 -1.745 1.00 30.33 H new ATOM 0 HB2 PRO A 132 22.633 -1.538 -0.991 1.00 71.33 H new ATOM 0 HB3 PRO A 132 22.626 0.106 -0.383 1.00 71.33 H new ATOM 0 HG2 PRO A 132 21.526 -2.405 1.003 1.00 74.12 H new ATOM 0 HG3 PRO A 132 22.634 -1.221 1.665 1.00 74.12 H new ATOM 0 HD2 PRO A 132 19.984 -0.977 2.167 1.00 13.31 H new ATOM 0 HD3 PRO A 132 20.938 0.462 1.864 1.00 13.31 H new ATOM 2107 N ILE A 133 20.658 -2.216 -2.782 1.00 30.24 N ATOM 2108 CA ILE A 133 20.315 -3.381 -3.577 1.00 53.40 C ATOM 2109 C ILE A 133 20.494 -4.693 -2.798 1.00 70.24 C ATOM 2110 O ILE A 133 19.751 -5.667 -2.985 1.00 14.31 O ATOM 2111 CB ILE A 133 21.063 -3.314 -4.928 1.00 65.33 C ATOM 2112 CG1 ILE A 133 20.593 -4.472 -5.820 1.00 32.01 C ATOM 2113 CG2 ILE A 133 22.597 -3.377 -4.787 1.00 44.21 C ATOM 2114 CD1 ILE A 133 20.838 -4.314 -7.313 1.00 64.11 C ATOM 0 H ILE A 133 21.334 -1.610 -3.247 1.00 30.24 H new ATOM 0 HA ILE A 133 19.250 -3.371 -3.807 1.00 53.40 H new ATOM 0 HB ILE A 133 20.827 -2.347 -5.372 1.00 65.33 H new ATOM 0 HG12 ILE A 133 21.088 -5.384 -5.486 1.00 32.01 H new ATOM 0 HG13 ILE A 133 19.524 -4.614 -5.662 1.00 32.01 H new ATOM 0 HG21 ILE A 133 23.056 -3.325 -5.774 1.00 44.21 H new ATOM 0 HG22 ILE A 133 22.942 -2.538 -4.182 1.00 44.21 H new ATOM 0 HG23 ILE A 133 22.880 -4.313 -4.304 1.00 44.21 H new ATOM 0 HD11 ILE A 133 20.464 -5.193 -7.838 1.00 64.11 H new ATOM 0 HD12 ILE A 133 20.318 -3.427 -7.675 1.00 64.11 H new ATOM 0 HD13 ILE A 133 21.907 -4.209 -7.497 1.00 64.11 H new ATOM 2126 N GLY A 134 21.479 -4.735 -1.907 1.00 25.25 N ATOM 2127 CA GLY A 134 21.812 -5.913 -1.136 1.00 13.22 C ATOM 2128 C GLY A 134 20.933 -6.117 0.094 1.00 22.12 C ATOM 2129 O GLY A 134 20.864 -7.256 0.559 1.00 65.43 O ATOM 0 H GLY A 134 22.075 -3.933 -1.702 1.00 25.25 H new ATOM 0 HA2 GLY A 134 21.730 -6.790 -1.778 1.00 13.22 H new ATOM 0 HA3 GLY A 134 22.853 -5.845 -0.819 1.00 13.22 H new ATOM 2133 N GLU A 135 20.210 -5.110 0.590 1.00 11.55 N ATOM 2134 CA GLU A 135 19.397 -5.260 1.799 1.00 22.22 C ATOM 2135 C GLU A 135 18.023 -5.824 1.479 1.00 2.31 C ATOM 2136 O GLU A 135 17.396 -6.388 2.362 1.00 50.20 O ATOM 2137 CB GLU A 135 19.288 -3.956 2.604 1.00 30.12 C ATOM 2138 CG GLU A 135 20.473 -3.775 3.560 1.00 24.24 C ATOM 2139 CD GLU A 135 20.546 -4.864 4.643 1.00 32.34 C ATOM 2140 OE1 GLU A 135 21.208 -5.905 4.397 1.00 14.42 O ATOM 2141 OE2 GLU A 135 20.018 -4.670 5.757 1.00 54.54 O ATOM 0 H GLU A 135 20.171 -4.180 0.172 1.00 11.55 H new ATOM 0 HA GLU A 135 19.917 -5.978 2.433 1.00 22.22 H new ATOM 0 HB2 GLU A 135 19.241 -3.109 1.919 1.00 30.12 H new ATOM 0 HB3 GLU A 135 18.359 -3.957 3.174 1.00 30.12 H new ATOM 0 HG2 GLU A 135 21.399 -3.779 2.986 1.00 24.24 H new ATOM 0 HG3 GLU A 135 20.400 -2.799 4.039 1.00 24.24 H new ATOM 2148 N LEU A 136 17.586 -5.797 0.223 1.00 64.30 N ATOM 2149 CA LEU A 136 16.266 -6.248 -0.204 1.00 4.33 C ATOM 2150 C LEU A 136 15.901 -7.591 0.442 1.00 10.53 C ATOM 2151 O LEU A 136 14.915 -7.686 1.168 1.00 43.23 O ATOM 2152 CB LEU A 136 16.261 -6.315 -1.737 1.00 30.11 C ATOM 2153 CG LEU A 136 14.885 -6.186 -2.425 1.00 25.32 C ATOM 2154 CD1 LEU A 136 14.925 -6.954 -3.753 1.00 11.45 C ATOM 2155 CD2 LEU A 136 13.675 -6.694 -1.643 1.00 51.20 C ATOM 0 H LEU A 136 18.157 -5.451 -0.548 1.00 64.30 H new ATOM 0 HA LEU A 136 15.501 -5.545 0.125 1.00 4.33 H new ATOM 0 HB2 LEU A 136 16.908 -5.524 -2.116 1.00 30.11 H new ATOM 0 HB3 LEU A 136 16.707 -7.263 -2.039 1.00 30.11 H new ATOM 0 HG LEU A 136 14.738 -5.111 -2.533 1.00 25.32 H new ATOM 0 HD11 LEU A 136 13.959 -6.871 -4.250 1.00 11.45 H new ATOM 0 HD12 LEU A 136 15.700 -6.533 -4.394 1.00 11.45 H new ATOM 0 HD13 LEU A 136 15.145 -8.004 -3.560 1.00 11.45 H new ATOM 0 HD21 LEU A 136 12.771 -6.547 -2.235 1.00 51.20 H new ATOM 0 HD22 LEU A 136 13.800 -7.756 -1.429 1.00 51.20 H new ATOM 0 HD23 LEU A 136 13.589 -6.143 -0.707 1.00 51.20 H new ATOM 2167 N LYS A 137 16.736 -8.618 0.254 1.00 32.34 N ATOM 2168 CA LYS A 137 16.617 -9.929 0.909 1.00 2.31 C ATOM 2169 C LYS A 137 16.323 -9.842 2.405 1.00 14.42 C ATOM 2170 O LYS A 137 15.377 -10.474 2.874 1.00 65.42 O ATOM 2171 CB LYS A 137 17.819 -10.814 0.628 1.00 63.13 C ATOM 2172 CG LYS A 137 19.150 -10.174 1.027 1.00 2.24 C ATOM 2173 CD LYS A 137 20.257 -10.625 0.091 1.00 32.34 C ATOM 2174 CE LYS A 137 21.030 -11.823 0.641 1.00 5.21 C ATOM 2175 NZ LYS A 137 22.110 -12.227 -0.278 1.00 31.43 N ATOM 0 H LYS A 137 17.537 -8.561 -0.375 1.00 32.34 H new ATOM 0 HA LYS A 137 15.743 -10.400 0.460 1.00 2.31 H new ATOM 0 HB2 LYS A 137 17.701 -11.755 1.165 1.00 63.13 H new ATOM 0 HB3 LYS A 137 17.844 -11.054 -0.435 1.00 63.13 H new ATOM 0 HG2 LYS A 137 19.061 -9.088 0.999 1.00 2.24 H new ATOM 0 HG3 LYS A 137 19.399 -10.447 2.053 1.00 2.24 H new ATOM 0 HD2 LYS A 137 19.828 -10.886 -0.877 1.00 32.34 H new ATOM 0 HD3 LYS A 137 20.946 -9.798 -0.078 1.00 32.34 H new ATOM 0 HE2 LYS A 137 21.452 -11.572 1.614 1.00 5.21 H new ATOM 0 HE3 LYS A 137 20.348 -12.659 0.796 1.00 5.21 H new ATOM 0 HZ1 LYS A 137 22.618 -13.042 0.120 1.00 31.43 H new ATOM 0 HZ2 LYS A 137 21.703 -12.489 -1.198 1.00 31.43 H new ATOM 0 HZ3 LYS A 137 22.772 -11.435 -0.405 1.00 31.43 H new ATOM 2189 N GLN A 138 17.142 -9.083 3.129 1.00 13.13 N ATOM 2190 CA GLN A 138 17.039 -8.849 4.558 1.00 5.54 C ATOM 2191 C GLN A 138 15.679 -8.233 4.881 1.00 23.12 C ATOM 2192 O GLN A 138 14.972 -8.721 5.764 1.00 70.22 O ATOM 2193 CB GLN A 138 18.211 -7.942 5.000 1.00 51.13 C ATOM 2194 CG GLN A 138 18.235 -7.623 6.491 1.00 1.25 C ATOM 2195 CD GLN A 138 18.412 -8.893 7.293 1.00 43.14 C ATOM 2196 OE1 GLN A 138 19.530 -9.378 7.452 1.00 4.52 O ATOM 2197 NE2 GLN A 138 17.319 -9.503 7.702 1.00 14.14 N ATOM 0 H GLN A 138 17.932 -8.593 2.710 1.00 13.13 H new ATOM 0 HA GLN A 138 17.109 -9.787 5.109 1.00 5.54 H new ATOM 0 HB2 GLN A 138 19.150 -8.425 4.729 1.00 51.13 H new ATOM 0 HB3 GLN A 138 18.161 -7.007 4.442 1.00 51.13 H new ATOM 0 HG2 GLN A 138 19.048 -6.930 6.709 1.00 1.25 H new ATOM 0 HG3 GLN A 138 17.308 -7.128 6.780 1.00 1.25 H new ATOM 0 HE21 GLN A 138 16.407 -9.070 7.553 1.00 14.14 H new ATOM 0 HE22 GLN A 138 17.384 -10.408 8.168 1.00 14.14 H new ATOM 2206 N THR A 139 15.304 -7.182 4.160 1.00 41.13 N ATOM 2207 CA THR A 139 14.066 -6.458 4.363 1.00 25.01 C ATOM 2208 C THR A 139 12.841 -7.348 4.148 1.00 30.35 C ATOM 2209 O THR A 139 11.886 -7.229 4.907 1.00 1.32 O ATOM 2210 CB THR A 139 14.076 -5.230 3.452 1.00 50.53 C ATOM 2211 OG1 THR A 139 15.235 -4.455 3.718 1.00 74.24 O ATOM 2212 CG2 THR A 139 12.846 -4.355 3.656 1.00 50.24 C ATOM 0 H THR A 139 15.871 -6.805 3.400 1.00 41.13 H new ATOM 0 HA THR A 139 13.995 -6.128 5.400 1.00 25.01 H new ATOM 0 HB THR A 139 14.073 -5.586 2.422 1.00 50.53 H new ATOM 0 HG1 THR A 139 15.244 -3.668 3.134 1.00 74.24 H new ATOM 0 HG21 THR A 139 12.896 -3.495 2.988 1.00 50.24 H new ATOM 0 HG22 THR A 139 11.948 -4.933 3.437 1.00 50.24 H new ATOM 0 HG23 THR A 139 12.812 -4.010 4.689 1.00 50.24 H new ATOM 2220 N ILE A 140 12.862 -8.298 3.206 1.00 44.43 N ATOM 2221 CA ILE A 140 11.745 -9.229 3.027 1.00 71.14 C ATOM 2222 C ILE A 140 11.522 -9.991 4.337 1.00 51.40 C ATOM 2223 O ILE A 140 10.387 -10.207 4.763 1.00 13.32 O ATOM 2224 CB ILE A 140 11.974 -10.190 1.833 1.00 41.51 C ATOM 2225 CG1 ILE A 140 12.188 -9.460 0.488 1.00 4.45 C ATOM 2226 CG2 ILE A 140 10.753 -11.109 1.673 1.00 45.10 C ATOM 2227 CD1 ILE A 140 12.796 -10.357 -0.601 1.00 3.22 C ATOM 0 H ILE A 140 13.637 -8.441 2.559 1.00 44.43 H new ATOM 0 HA ILE A 140 10.846 -8.662 2.784 1.00 71.14 H new ATOM 0 HB ILE A 140 12.881 -10.748 2.063 1.00 41.51 H new ATOM 0 HG12 ILE A 140 11.232 -9.072 0.137 1.00 4.45 H new ATOM 0 HG13 ILE A 140 12.841 -8.602 0.648 1.00 4.45 H new ATOM 0 HG21 ILE A 140 10.914 -11.785 0.833 1.00 45.10 H new ATOM 0 HG22 ILE A 140 10.613 -11.690 2.585 1.00 45.10 H new ATOM 0 HG23 ILE A 140 9.865 -10.505 1.487 1.00 45.10 H new ATOM 0 HD11 ILE A 140 12.920 -9.782 -1.519 1.00 3.22 H new ATOM 0 HD12 ILE A 140 13.767 -10.724 -0.269 1.00 3.22 H new ATOM 0 HD13 ILE A 140 12.133 -11.202 -0.789 1.00 3.22 H new ATOM 2239 N GLN A 141 12.609 -10.412 4.979 1.00 30.21 N ATOM 2240 CA GLN A 141 12.554 -11.196 6.200 1.00 73.31 C ATOM 2241 C GLN A 141 11.994 -10.328 7.330 1.00 51.13 C ATOM 2242 O GLN A 141 11.101 -10.774 8.047 1.00 42.34 O ATOM 2243 CB GLN A 141 13.934 -11.811 6.506 1.00 25.04 C ATOM 2244 CG GLN A 141 14.623 -12.477 5.294 1.00 61.04 C ATOM 2245 CD GLN A 141 14.479 -13.986 5.218 1.00 23.42 C ATOM 2246 OE1 GLN A 141 15.271 -14.741 5.771 1.00 25.01 O ATOM 2247 NE2 GLN A 141 13.527 -14.478 4.442 1.00 63.21 N ATOM 0 H GLN A 141 13.558 -10.215 4.660 1.00 30.21 H new ATOM 0 HA GLN A 141 11.876 -12.042 6.086 1.00 73.31 H new ATOM 0 HB2 GLN A 141 14.587 -11.030 6.895 1.00 25.04 H new ATOM 0 HB3 GLN A 141 13.820 -12.553 7.296 1.00 25.04 H new ATOM 0 HG2 GLN A 141 14.216 -12.043 4.381 1.00 61.04 H new ATOM 0 HG3 GLN A 141 15.684 -12.230 5.319 1.00 61.04 H new ATOM 0 HE21 GLN A 141 12.868 -13.850 3.982 1.00 63.21 H new ATOM 0 HE22 GLN A 141 13.452 -15.486 4.304 1.00 63.21 H new ATOM 2256 N ASN A 142 12.455 -9.079 7.409 1.00 1.53 N ATOM 2257 CA ASN A 142 12.033 -8.075 8.399 1.00 74.11 C ATOM 2258 C ASN A 142 10.563 -7.677 8.236 1.00 52.13 C ATOM 2259 O ASN A 142 9.864 -7.473 9.227 1.00 63.13 O ATOM 2260 CB ASN A 142 12.902 -6.808 8.310 1.00 14.45 C ATOM 2261 CG ASN A 142 14.227 -6.825 9.046 1.00 14.51 C ATOM 2262 OD1 ASN A 142 14.734 -5.770 9.411 1.00 53.21 O ATOM 2263 ND2 ASN A 142 14.879 -7.963 9.167 1.00 32.05 N ATOM 0 H ASN A 142 13.159 -8.721 6.763 1.00 1.53 H new ATOM 0 HA ASN A 142 12.159 -8.543 9.375 1.00 74.11 H new ATOM 0 HB2 ASN A 142 13.103 -6.609 7.257 1.00 14.45 H new ATOM 0 HB3 ASN A 142 12.317 -5.969 8.687 1.00 14.45 H new ATOM 0 HD21 ASN A 142 15.817 -7.973 9.568 1.00 32.05 H new ATOM 0 HD22 ASN A 142 14.446 -8.834 8.860 1.00 32.05 H new ATOM 2270 N VAL A 143 10.061 -7.570 7.003 1.00 4.13 N ATOM 2271 CA VAL A 143 8.676 -7.185 6.736 1.00 72.40 C ATOM 2272 C VAL A 143 7.724 -8.178 7.389 1.00 41.33 C ATOM 2273 O VAL A 143 6.694 -7.790 7.944 1.00 63.02 O ATOM 2274 CB VAL A 143 8.476 -7.023 5.212 1.00 11.55 C ATOM 2275 CG1 VAL A 143 7.009 -7.015 4.755 1.00 11.55 C ATOM 2276 CG2 VAL A 143 9.047 -5.655 4.811 1.00 21.44 C ATOM 0 H VAL A 143 10.607 -7.749 6.160 1.00 4.13 H new ATOM 0 HA VAL A 143 8.446 -6.218 7.183 1.00 72.40 H new ATOM 0 HB VAL A 143 8.967 -7.879 4.749 1.00 11.55 H new ATOM 0 HG11 VAL A 143 6.966 -6.897 3.672 1.00 11.55 H new ATOM 0 HG12 VAL A 143 6.535 -7.955 5.037 1.00 11.55 H new ATOM 0 HG13 VAL A 143 6.484 -6.187 5.231 1.00 11.55 H new ATOM 0 HG21 VAL A 143 8.921 -5.509 3.738 1.00 21.44 H new ATOM 0 HG22 VAL A 143 8.518 -4.868 5.349 1.00 21.44 H new ATOM 0 HG23 VAL A 143 10.107 -5.616 5.061 1.00 21.44 H new ATOM 2286 N LYS A 144 8.068 -9.463 7.356 1.00 64.01 N ATOM 2287 CA LYS A 144 7.242 -10.501 7.946 1.00 34.44 C ATOM 2288 C LYS A 144 7.234 -10.481 9.475 1.00 11.14 C ATOM 2289 O LYS A 144 6.492 -11.264 10.065 1.00 5.15 O ATOM 2290 CB LYS A 144 7.702 -11.859 7.410 1.00 31.33 C ATOM 2291 CG LYS A 144 7.457 -11.977 5.898 1.00 65.04 C ATOM 2292 CD LYS A 144 8.034 -13.278 5.340 1.00 54.50 C ATOM 2293 CE LYS A 144 9.571 -13.244 5.340 1.00 42.14 C ATOM 2294 NZ LYS A 144 10.130 -14.539 4.901 1.00 14.12 N ATOM 0 H LYS A 144 8.924 -9.808 6.921 1.00 64.01 H new ATOM 0 HA LYS A 144 6.209 -10.311 7.655 1.00 34.44 H new ATOM 0 HB2 LYS A 144 8.763 -11.994 7.620 1.00 31.33 H new ATOM 0 HB3 LYS A 144 7.170 -12.656 7.930 1.00 31.33 H new ATOM 0 HG2 LYS A 144 6.386 -11.936 5.697 1.00 65.04 H new ATOM 0 HG3 LYS A 144 7.910 -11.127 5.387 1.00 65.04 H new ATOM 0 HD2 LYS A 144 7.685 -14.120 5.938 1.00 54.50 H new ATOM 0 HD3 LYS A 144 7.670 -13.435 4.325 1.00 54.50 H new ATOM 0 HE2 LYS A 144 9.921 -12.451 4.680 1.00 42.14 H new ATOM 0 HE3 LYS A 144 9.933 -13.008 6.341 1.00 42.14 H new ATOM 0 HZ1 LYS A 144 10.951 -14.781 5.492 1.00 14.12 H new ATOM 0 HZ2 LYS A 144 9.406 -15.279 4.994 1.00 14.12 H new ATOM 0 HZ3 LYS A 144 10.428 -14.469 3.907 1.00 14.12 H new ATOM 2308 N GLU A 145 8.042 -9.652 10.127 1.00 5.12 N ATOM 2309 CA GLU A 145 8.066 -9.515 11.572 1.00 3.33 C ATOM 2310 C GLU A 145 7.026 -8.478 11.966 1.00 34.11 C ATOM 2311 O GLU A 145 6.068 -8.816 12.662 1.00 44.43 O ATOM 2312 CB GLU A 145 9.485 -9.146 12.058 1.00 54.54 C ATOM 2313 CG GLU A 145 10.571 -9.998 11.375 1.00 71.13 C ATOM 2314 CD GLU A 145 12.019 -9.631 11.711 1.00 11.55 C ATOM 2315 OE1 GLU A 145 12.349 -8.433 11.828 1.00 52.40 O ATOM 2316 OE2 GLU A 145 12.878 -10.544 11.664 1.00 11.52 O ATOM 0 H GLU A 145 8.711 -9.046 9.652 1.00 5.12 H new ATOM 0 HA GLU A 145 7.816 -10.460 12.054 1.00 3.33 H new ATOM 0 HB2 GLU A 145 9.673 -8.091 11.858 1.00 54.54 H new ATOM 0 HB3 GLU A 145 9.544 -9.281 13.138 1.00 54.54 H new ATOM 0 HG2 GLU A 145 10.409 -11.042 11.644 1.00 71.13 H new ATOM 0 HG3 GLU A 145 10.439 -9.923 10.296 1.00 71.13 H new ATOM 2323 N GLU A 146 7.160 -7.249 11.463 1.00 13.54 N ATOM 2324 CA GLU A 146 6.205 -6.174 11.723 1.00 31.13 C ATOM 2325 C GLU A 146 4.799 -6.592 11.266 1.00 34.21 C ATOM 2326 O GLU A 146 3.822 -6.464 12.006 1.00 71.14 O ATOM 2327 CB GLU A 146 6.663 -4.910 10.989 1.00 32.05 C ATOM 2328 CG GLU A 146 7.984 -4.309 11.498 1.00 70.20 C ATOM 2329 CD GLU A 146 7.885 -3.449 12.758 1.00 32.12 C ATOM 2330 OE1 GLU A 146 6.976 -2.587 12.836 1.00 23.11 O ATOM 2331 OE2 GLU A 146 8.798 -3.543 13.615 1.00 53.42 O ATOM 0 H GLU A 146 7.937 -6.972 10.862 1.00 13.54 H new ATOM 0 HA GLU A 146 6.163 -5.969 12.793 1.00 31.13 H new ATOM 0 HB2 GLU A 146 6.770 -5.141 9.929 1.00 32.05 H new ATOM 0 HB3 GLU A 146 5.881 -4.155 11.073 1.00 32.05 H new ATOM 0 HG2 GLU A 146 8.681 -5.124 11.692 1.00 70.20 H new ATOM 0 HG3 GLU A 146 8.416 -3.703 10.701 1.00 70.20 H new ATOM 2338 N ASN A 147 4.683 -7.161 10.058 1.00 44.44 N ATOM 2339 CA ASN A 147 3.383 -7.540 9.505 1.00 72.24 C ATOM 2340 C ASN A 147 2.675 -8.616 10.301 1.00 71.24 C ATOM 2341 O ASN A 147 1.453 -8.760 10.215 1.00 74.04 O ATOM 2342 CB ASN A 147 3.483 -7.928 8.030 1.00 41.14 C ATOM 2343 CG ASN A 147 3.950 -9.290 7.573 1.00 52.40 C ATOM 2344 OD1 ASN A 147 3.910 -10.297 8.264 1.00 63.31 O ATOM 2345 ND2 ASN A 147 4.307 -9.350 6.296 1.00 42.43 N ATOM 0 H ASN A 147 5.475 -7.367 9.449 1.00 44.44 H new ATOM 0 HA ASN A 147 2.766 -6.645 9.583 1.00 72.24 H new ATOM 0 HB2 ASN A 147 2.492 -7.780 7.602 1.00 41.14 H new ATOM 0 HB3 ASN A 147 4.145 -7.199 7.561 1.00 41.14 H new ATOM 0 HD21 ASN A 147 4.553 -10.247 5.877 1.00 42.43 H new ATOM 0 HD22 ASN A 147 4.335 -8.499 5.734 1.00 42.43 H new ATOM 2352 N ALA A 148 3.438 -9.384 11.063 1.00 21.21 N ATOM 2353 CA ALA A 148 2.867 -10.437 11.868 1.00 73.22 C ATOM 2354 C ALA A 148 2.326 -9.932 13.214 1.00 25.05 C ATOM 2355 O ALA A 148 1.460 -10.588 13.801 1.00 44.44 O ATOM 2356 CB ALA A 148 3.922 -11.521 11.994 1.00 14.35 C ATOM 0 H ALA A 148 4.451 -9.293 11.137 1.00 21.21 H new ATOM 0 HA ALA A 148 1.981 -10.850 11.386 1.00 73.22 H new ATOM 0 HB1 ALA A 148 3.531 -12.340 12.597 1.00 14.35 H new ATOM 0 HB2 ALA A 148 4.182 -11.892 11.003 1.00 14.35 H new ATOM 0 HB3 ALA A 148 4.811 -11.110 12.472 1.00 14.35 H new ATOM 2362 N ALA A 149 2.748 -8.746 13.666 1.00 5.53 N ATOM 2363 CA ALA A 149 2.100 -8.067 14.783 1.00 64.11 C ATOM 2364 C ALA A 149 0.752 -7.496 14.338 1.00 24.44 C ATOM 2365 O ALA A 149 -0.228 -7.668 15.056 1.00 64.33 O ATOM 2366 CB ALA A 149 3.031 -6.989 15.347 1.00 2.35 C ATOM 0 H ALA A 149 3.539 -8.238 13.270 1.00 5.53 H new ATOM 0 HA ALA A 149 1.901 -8.779 15.584 1.00 64.11 H new ATOM 0 HB1 ALA A 149 2.542 -6.485 16.181 1.00 2.35 H new ATOM 0 HB2 ALA A 149 3.955 -7.452 15.694 1.00 2.35 H new ATOM 0 HB3 ALA A 149 3.260 -6.262 14.568 1.00 2.35 H new ATOM 2372 N PHE A 150 0.653 -6.907 13.139 1.00 43.23 N ATOM 2373 CA PHE A 150 -0.622 -6.369 12.652 1.00 13.23 C ATOM 2374 C PHE A 150 -1.722 -7.440 12.668 1.00 30.02 C ATOM 2375 O PHE A 150 -2.828 -7.204 13.163 1.00 2.12 O ATOM 2376 CB PHE A 150 -0.471 -5.774 11.243 1.00 33.11 C ATOM 2377 CG PHE A 150 -1.810 -5.513 10.571 1.00 14.24 C ATOM 2378 CD1 PHE A 150 -2.590 -4.400 10.940 1.00 25.43 C ATOM 2379 CD2 PHE A 150 -2.334 -6.455 9.665 1.00 21.05 C ATOM 2380 CE1 PHE A 150 -3.880 -4.241 10.404 1.00 44.33 C ATOM 2381 CE2 PHE A 150 -3.608 -6.269 9.103 1.00 45.34 C ATOM 2382 CZ PHE A 150 -4.384 -5.163 9.475 1.00 45.42 C ATOM 0 H PHE A 150 1.434 -6.792 12.494 1.00 43.23 H new ATOM 0 HA PHE A 150 -0.918 -5.569 13.331 1.00 13.23 H new ATOM 0 HB2 PHE A 150 0.088 -4.840 11.305 1.00 33.11 H new ATOM 0 HB3 PHE A 150 0.114 -6.456 10.626 1.00 33.11 H new ATOM 0 HD1 PHE A 150 -2.198 -3.670 11.633 1.00 25.43 H new ATOM 0 HD2 PHE A 150 -1.753 -7.326 9.400 1.00 21.05 H new ATOM 0 HE1 PHE A 150 -4.488 -3.402 10.710 1.00 44.33 H new ATOM 0 HE2 PHE A 150 -3.990 -6.979 8.384 1.00 45.34 H new ATOM 0 HZ PHE A 150 -5.366 -5.021 9.048 1.00 45.42 H new ATOM 2392 N LYS A 151 -1.425 -8.632 12.132 1.00 13.25 N ATOM 2393 CA LYS A 151 -2.419 -9.699 12.023 1.00 13.41 C ATOM 2394 C LYS A 151 -2.870 -10.223 13.385 1.00 10.31 C ATOM 2395 O LYS A 151 -3.869 -10.922 13.456 1.00 22.12 O ATOM 2396 CB LYS A 151 -1.908 -10.817 11.108 1.00 71.31 C ATOM 2397 CG LYS A 151 -1.110 -11.868 11.880 1.00 22.15 C ATOM 2398 CD LYS A 151 -0.014 -12.573 11.099 1.00 14.22 C ATOM 2399 CE LYS A 151 -0.550 -13.179 9.846 1.00 51.13 C ATOM 2400 NZ LYS A 151 0.357 -14.177 9.243 1.00 64.34 N ATOM 0 H LYS A 151 -0.504 -8.878 11.769 1.00 13.25 H new ATOM 0 HA LYS A 151 -3.311 -9.273 11.564 1.00 13.41 H new ATOM 0 HB2 LYS A 151 -2.753 -11.295 10.613 1.00 71.31 H new ATOM 0 HB3 LYS A 151 -1.281 -10.388 10.326 1.00 71.31 H new ATOM 0 HG2 LYS A 151 -0.660 -11.388 12.749 1.00 22.15 H new ATOM 0 HG3 LYS A 151 -1.804 -12.620 12.255 1.00 22.15 H new ATOM 0 HD2 LYS A 151 0.776 -11.863 10.854 1.00 14.22 H new ATOM 0 HD3 LYS A 151 0.436 -13.349 11.718 1.00 14.22 H new ATOM 0 HE2 LYS A 151 -1.508 -13.652 10.061 1.00 51.13 H new ATOM 0 HE3 LYS A 151 -0.741 -12.388 9.121 1.00 51.13 H new ATOM 0 HZ1 LYS A 151 -0.074 -14.559 8.377 1.00 64.34 H new ATOM 0 HZ2 LYS A 151 1.264 -13.725 9.008 1.00 64.34 H new ATOM 0 HZ3 LYS A 151 0.521 -14.950 9.919 1.00 64.34 H new ATOM 2414 N GLU A 152 -2.133 -9.931 14.452 1.00 1.13 N ATOM 2415 CA GLU A 152 -2.556 -10.275 15.795 1.00 13.32 C ATOM 2416 C GLU A 152 -3.874 -9.575 16.133 1.00 13.44 C ATOM 2417 O GLU A 152 -4.750 -10.160 16.770 1.00 52.30 O ATOM 2418 CB GLU A 152 -1.445 -9.851 16.752 1.00 2.13 C ATOM 2419 CG GLU A 152 -1.582 -10.576 18.082 1.00 21.44 C ATOM 2420 CD GLU A 152 -0.477 -10.132 19.023 1.00 23.35 C ATOM 2421 OE1 GLU A 152 0.704 -10.354 18.675 1.00 14.35 O ATOM 2422 OE2 GLU A 152 -0.822 -9.597 20.103 1.00 12.54 O ATOM 0 H GLU A 152 -1.233 -9.453 14.406 1.00 1.13 H new ATOM 0 HA GLU A 152 -2.731 -11.347 15.882 1.00 13.32 H new ATOM 0 HB2 GLU A 152 -0.473 -10.070 16.310 1.00 2.13 H new ATOM 0 HB3 GLU A 152 -1.487 -8.774 16.912 1.00 2.13 H new ATOM 0 HG2 GLU A 152 -2.556 -10.365 18.524 1.00 21.44 H new ATOM 0 HG3 GLU A 152 -1.530 -11.654 17.927 1.00 21.44 H new ATOM 2429 N ILE A 153 -4.012 -8.320 15.702 1.00 50.32 N ATOM 2430 CA ILE A 153 -5.179 -7.492 15.953 1.00 71.42 C ATOM 2431 C ILE A 153 -6.279 -7.883 14.965 1.00 54.20 C ATOM 2432 O ILE A 153 -7.414 -8.117 15.388 1.00 11.32 O ATOM 2433 CB ILE A 153 -4.813 -5.999 15.860 1.00 14.53 C ATOM 2434 CG1 ILE A 153 -3.483 -5.675 16.591 1.00 4.24 C ATOM 2435 CG2 ILE A 153 -5.970 -5.158 16.433 1.00 21.13 C ATOM 2436 CD1 ILE A 153 -3.091 -4.194 16.584 1.00 64.42 C ATOM 0 H ILE A 153 -3.294 -7.845 15.155 1.00 50.32 H new ATOM 0 HA ILE A 153 -5.549 -7.658 16.965 1.00 71.42 H new ATOM 0 HB ILE A 153 -4.660 -5.749 14.810 1.00 14.53 H new ATOM 0 HG12 ILE A 153 -3.562 -6.011 17.625 1.00 4.24 H new ATOM 0 HG13 ILE A 153 -2.681 -6.251 16.129 1.00 4.24 H new ATOM 0 HG21 ILE A 153 -5.717 -4.100 16.370 1.00 21.13 H new ATOM 0 HG22 ILE A 153 -6.877 -5.349 15.860 1.00 21.13 H new ATOM 0 HG23 ILE A 153 -6.136 -5.430 17.475 1.00 21.13 H new ATOM 0 HD11 ILE A 153 -2.149 -4.064 17.118 1.00 64.42 H new ATOM 0 HD12 ILE A 153 -2.975 -3.853 15.555 1.00 64.42 H new ATOM 0 HD13 ILE A 153 -3.869 -3.609 17.074 1.00 64.42 H new ATOM 2448 N HIS A 154 -5.946 -8.020 13.679 1.00 63.21 N ATOM 2449 CA HIS A 154 -6.916 -8.299 12.630 1.00 74.44 C ATOM 2450 C HIS A 154 -6.508 -9.533 11.822 1.00 73.01 C ATOM 2451 O HIS A 154 -5.992 -9.391 10.712 1.00 2.15 O ATOM 2452 CB HIS A 154 -7.096 -7.042 11.787 1.00 53.32 C ATOM 2453 CG HIS A 154 -7.812 -5.921 12.500 1.00 10.13 C ATOM 2454 ND1 HIS A 154 -8.811 -6.057 13.440 1.00 2.45 N ATOM 2455 CD2 HIS A 154 -7.618 -4.584 12.290 1.00 65.11 C ATOM 2456 CE1 HIS A 154 -9.194 -4.828 13.813 1.00 43.23 C ATOM 2457 NE2 HIS A 154 -8.512 -3.896 13.119 1.00 50.23 N ATOM 0 H HIS A 154 -4.988 -7.939 13.339 1.00 63.21 H new ATOM 0 HA HIS A 154 -7.886 -8.549 13.059 1.00 74.44 H new ATOM 0 HB2 HIS A 154 -6.116 -6.688 11.468 1.00 53.32 H new ATOM 0 HB3 HIS A 154 -7.652 -7.298 10.885 1.00 53.32 H new ATOM 0 HD2 HIS A 154 -6.906 -4.140 11.610 1.00 65.11 H new ATOM 0 HE1 HIS A 154 -9.942 -4.615 14.562 1.00 43.23 H new ATOM 0 HE2 HIS A 154 -8.625 -2.884 13.185 1.00 50.23 H new ATOM 2465 N PRO A 155 -6.675 -10.744 12.381 1.00 14.44 N ATOM 2466 CA PRO A 155 -6.226 -11.973 11.745 1.00 11.13 C ATOM 2467 C PRO A 155 -7.068 -12.328 10.523 1.00 11.41 C ATOM 2468 O PRO A 155 -8.305 -12.515 10.652 1.00 61.01 O ATOM 2469 CB PRO A 155 -6.262 -13.054 12.834 1.00 45.52 C ATOM 2470 CG PRO A 155 -7.117 -12.483 13.968 1.00 65.40 C ATOM 2471 CD PRO A 155 -7.091 -10.974 13.758 1.00 1.55 C ATOM 0 HA PRO A 155 -5.216 -11.868 11.350 1.00 11.13 H new ATOM 0 HB2 PRO A 155 -6.691 -13.980 12.450 1.00 45.52 H new ATOM 0 HB3 PRO A 155 -5.257 -13.289 13.184 1.00 45.52 H new ATOM 0 HG2 PRO A 155 -8.135 -12.870 13.928 1.00 65.40 H new ATOM 0 HG3 PRO A 155 -6.711 -12.753 14.943 1.00 65.40 H new ATOM 0 HD2 PRO A 155 -8.075 -10.542 13.941 1.00 1.55 H new ATOM 0 HD3 PRO A 155 -6.400 -10.499 14.454 1.00 1.55 H new