USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 963 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 35 MET CE :methyl 173:sc= -1.23 (180deg=-1.31) USER MOD Set 1.2: A 86 ASN : amide:sc= -2.55! K(o=-3.8!,f=-1.7) USER MOD Set 2.1: A 19 ASN : amide:sc= -4.37! C(o=-7!,f=-7.3!) USER MOD Set 2.2: A 77 MET CE :methyl 157:sc= -0.346 (180deg=-2.03) USER MOD Set 2.3: A 111 MET CE :methyl 157:sc= -2.26! (180deg=-1.13) USER MOD Set 3.1: A 51 GLN : amide:sc= 0.681 K(o=1.4,f=-1.7) USER MOD Set 3.2: A 66 SER OG : rot 171:sc= 0.763 USER MOD Set 4.1: A 46 THR OG1 : rot 180:sc=-0.000462 USER MOD Set 4.2: A 72 HIS : no HE2:sc= 0.781 K(o=0.78,f=-5.8!) USER MOD Set 5.1: A 33 ASN : amide:sc= -1.14 K(o=-0.97,f=0.48) USER MOD Set 5.2: A 39 THR OG1 : rot -123:sc= 0.176 USER MOD Single : A 18 HIS : no HE2:sc= -1.77 K(o=-1.8,f=-3!) USER MOD Single : A 23 TYR OH : rot 60:sc= 1.3 USER MOD Single : A 25 SER OG : rot 161:sc= 1.29 USER MOD Single : A 27 GLN : amide:sc= -1.23 K(o=-1.2,f=-0.018) USER MOD Single : A 44 SER OG : rot 80:sc= 0.816 USER MOD Single : A 60 TYR OH : rot -119:sc= 1.29 USER MOD Single : A 62 CYS SG : rot 166:sc= 1.29 USER MOD Single : A 68 LYS NZ :NH3+ 150:sc= 0.268 (180deg=0.07) USER MOD Single : A 74 LYS NZ :NH3+ 171:sc= -0.0056 (180deg=-0.0902) USER MOD Single : A 80 THR OG1 : rot 100:sc= 1.17 USER MOD Single : A 81 SER OG : rot 180:sc= 0.0117 USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 TYR OH : rot -120:sc= -0.156 USER MOD Single : A 99 THR OG1 : rot 42:sc= 0.0634 USER MOD Single : A 107 ASN : amide:sc= -2.66! C(o=-2.7!,f=-7.9!) USER MOD Single : A 108 SER OG : rot 4:sc= 1.13 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot 54:sc= -0.317 USER MOD Single : A 116 TYR OH : rot 165:sc= 0 USER MOD Single : A 117 MET CE :methyl -133:sc= -3.92! (180deg=-4.93!) USER MOD Single : A 120 ASN : amide:sc= -2.74! K(o=-2.7!,f=-0.82) USER MOD Single : A 121 LYS NZ :NH3+ -168:sc= -0.0329 (180deg=-0.18) USER MOD Single : A 126 MET CE :methyl -161:sc= -2.51 (180deg=-3.19!) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 169:sc= -0.0136 (180deg=-0.149) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 LYS NZ :NH3+ -172:sc=-0.00997 (180deg=-0.121) USER MOD Single : A 151 MET CE :methyl -175:sc= -0.419 (180deg=-0.53) USER MOD Single : A 153 CYS SG : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 93 N LEU A 17 -24.387 -12.102 -11.248 1.00 60.41 N ATOM 94 CA LEU A 17 -23.828 -11.323 -10.207 1.00 50.31 C ATOM 95 C LEU A 17 -22.901 -10.305 -10.789 1.00 14.42 C ATOM 96 O LEU A 17 -22.374 -10.481 -11.887 1.00 4.33 O ATOM 97 CB LEU A 17 -23.125 -12.144 -9.157 1.00 53.12 C ATOM 98 CG LEU A 17 -23.961 -13.169 -8.401 1.00 32.13 C ATOM 99 CD1 LEU A 17 -25.239 -12.566 -7.823 1.00 11.33 C ATOM 100 CD2 LEU A 17 -24.227 -14.395 -9.228 1.00 61.31 C ATOM 0 HA LEU A 17 -24.654 -10.828 -9.696 1.00 50.31 H new ATOM 0 HB2 LEU A 17 -22.298 -12.669 -9.636 1.00 53.12 H new ATOM 0 HB3 LEU A 17 -22.689 -11.460 -8.429 1.00 53.12 H new ATOM 0 HG LEU A 17 -23.366 -13.491 -7.547 1.00 32.13 H new ATOM 0 HD11 LEU A 17 -25.799 -13.338 -7.294 1.00 11.33 H new ATOM 0 HD12 LEU A 17 -24.982 -11.765 -7.130 1.00 11.33 H new ATOM 0 HD13 LEU A 17 -25.850 -12.165 -8.632 1.00 11.33 H new ATOM 0 HD21 LEU A 17 -24.826 -15.100 -8.651 1.00 61.31 H new ATOM 0 HD22 LEU A 17 -24.768 -14.114 -10.132 1.00 61.31 H new ATOM 0 HD23 LEU A 17 -23.281 -14.862 -9.502 1.00 61.31 H new ATOM 112 N HIS A 18 -22.726 -9.252 -10.081 1.00 31.21 N ATOM 113 CA HIS A 18 -21.974 -8.127 -10.548 1.00 1.43 C ATOM 114 C HIS A 18 -20.749 -7.955 -9.714 1.00 13.42 C ATOM 115 O HIS A 18 -20.665 -8.502 -8.605 1.00 14.33 O ATOM 116 CB HIS A 18 -22.824 -6.863 -10.441 1.00 53.53 C ATOM 117 CG HIS A 18 -24.105 -6.925 -11.210 1.00 24.32 C ATOM 118 ND1 HIS A 18 -24.285 -6.310 -12.411 1.00 12.24 N ATOM 119 CD2 HIS A 18 -25.283 -7.527 -10.918 1.00 55.30 C ATOM 120 CE1 HIS A 18 -25.506 -6.513 -12.835 1.00 44.23 C ATOM 121 NE2 HIS A 18 -26.139 -7.255 -11.949 1.00 34.10 N ATOM 0 H HIS A 18 -23.105 -9.136 -9.141 1.00 31.21 H new ATOM 0 HA HIS A 18 -21.690 -8.298 -11.586 1.00 1.43 H new ATOM 0 HB2 HIS A 18 -23.051 -6.678 -9.391 1.00 53.53 H new ATOM 0 HB3 HIS A 18 -22.240 -6.014 -10.795 1.00 53.53 H new ATOM 0 HD1 HIS A 18 -23.574 -5.771 -12.906 1.00 12.24 H new ATOM 0 HD2 HIS A 18 -25.504 -8.111 -10.037 1.00 55.30 H new ATOM 0 HE1 HIS A 18 -25.925 -6.136 -13.756 1.00 44.23 H new ATOM 130 N ASN A 19 -19.794 -7.246 -10.240 1.00 13.42 N ATOM 131 CA ASN A 19 -18.600 -6.953 -9.513 1.00 31.23 C ATOM 132 C ASN A 19 -18.276 -5.465 -9.590 1.00 70.42 C ATOM 133 O ASN A 19 -18.182 -4.877 -10.673 1.00 51.35 O ATOM 134 CB ASN A 19 -17.432 -7.856 -9.946 1.00 2.24 C ATOM 135 CG ASN A 19 -17.018 -7.750 -11.401 1.00 64.21 C ATOM 136 OD1 ASN A 19 -17.806 -7.420 -12.290 1.00 62.21 O ATOM 137 ND2 ASN A 19 -15.782 -8.076 -11.652 1.00 41.04 N ATOM 0 H ASN A 19 -19.823 -6.857 -11.182 1.00 13.42 H new ATOM 0 HA ASN A 19 -18.770 -7.183 -8.461 1.00 31.23 H new ATOM 0 HB2 ASN A 19 -16.568 -7.623 -9.324 1.00 2.24 H new ATOM 0 HB3 ASN A 19 -17.703 -8.892 -9.740 1.00 2.24 H new ATOM 0 HD21 ASN A 19 -15.436 -8.064 -12.611 1.00 41.04 H new ATOM 0 HD22 ASN A 19 -15.160 -8.344 -10.889 1.00 41.04 H new ATOM 144 N VAL A 20 -18.129 -4.866 -8.433 1.00 51.13 N ATOM 145 CA VAL A 20 -17.936 -3.428 -8.305 1.00 64.32 C ATOM 146 C VAL A 20 -16.672 -3.143 -7.508 1.00 20.12 C ATOM 147 O VAL A 20 -16.358 -3.863 -6.570 1.00 45.41 O ATOM 148 CB VAL A 20 -19.160 -2.783 -7.569 1.00 14.53 C ATOM 149 CG1 VAL A 20 -19.021 -1.275 -7.443 1.00 53.31 C ATOM 150 CG2 VAL A 20 -20.463 -3.136 -8.263 1.00 22.23 C ATOM 0 H VAL A 20 -18.139 -5.361 -7.541 1.00 51.13 H new ATOM 0 HA VAL A 20 -17.845 -3.000 -9.303 1.00 64.32 H new ATOM 0 HB VAL A 20 -19.177 -3.199 -6.562 1.00 14.53 H new ATOM 0 HG11 VAL A 20 -19.892 -0.871 -6.927 1.00 53.31 H new ATOM 0 HG12 VAL A 20 -18.121 -1.039 -6.876 1.00 53.31 H new ATOM 0 HG13 VAL A 20 -18.950 -0.832 -8.436 1.00 53.31 H new ATOM 0 HG21 VAL A 20 -21.295 -2.675 -7.731 1.00 22.23 H new ATOM 0 HG22 VAL A 20 -20.440 -2.768 -9.289 1.00 22.23 H new ATOM 0 HG23 VAL A 20 -20.591 -4.218 -8.268 1.00 22.23 H new ATOM 160 N PHE A 21 -15.959 -2.116 -7.889 1.00 33.22 N ATOM 161 CA PHE A 21 -14.759 -1.710 -7.204 1.00 65.44 C ATOM 162 C PHE A 21 -15.112 -0.625 -6.205 1.00 72.43 C ATOM 163 O PHE A 21 -15.690 0.402 -6.567 1.00 55.21 O ATOM 164 CB PHE A 21 -13.732 -1.196 -8.233 1.00 20.22 C ATOM 165 CG PHE A 21 -12.403 -0.722 -7.675 1.00 52.32 C ATOM 166 CD1 PHE A 21 -11.473 -1.629 -7.197 1.00 60.11 C ATOM 167 CD2 PHE A 21 -12.075 0.629 -7.664 1.00 70.44 C ATOM 168 CE1 PHE A 21 -10.255 -1.205 -6.718 1.00 41.52 C ATOM 169 CE2 PHE A 21 -10.855 1.053 -7.182 1.00 61.24 C ATOM 170 CZ PHE A 21 -9.946 0.136 -6.710 1.00 52.54 C ATOM 0 H PHE A 21 -16.197 -1.532 -8.691 1.00 33.22 H new ATOM 0 HA PHE A 21 -14.319 -2.553 -6.672 1.00 65.44 H new ATOM 0 HB2 PHE A 21 -13.537 -1.993 -8.950 1.00 20.22 H new ATOM 0 HB3 PHE A 21 -14.184 -0.373 -8.786 1.00 20.22 H new ATOM 0 HD1 PHE A 21 -11.707 -2.683 -7.200 1.00 60.11 H new ATOM 0 HD2 PHE A 21 -12.783 1.354 -8.037 1.00 70.44 H new ATOM 0 HE1 PHE A 21 -9.541 -1.925 -6.348 1.00 41.52 H new ATOM 0 HE2 PHE A 21 -10.613 2.106 -7.175 1.00 61.24 H new ATOM 0 HZ PHE A 21 -8.990 0.468 -6.333 1.00 52.54 H new ATOM 180 N VAL A 22 -14.793 -0.855 -4.962 1.00 52.13 N ATOM 181 CA VAL A 22 -15.057 0.113 -3.940 1.00 4.11 C ATOM 182 C VAL A 22 -13.769 0.840 -3.578 1.00 73.01 C ATOM 183 O VAL A 22 -12.701 0.224 -3.468 1.00 11.11 O ATOM 184 CB VAL A 22 -15.737 -0.502 -2.676 1.00 52.40 C ATOM 185 CG1 VAL A 22 -14.875 -1.574 -2.022 1.00 14.44 C ATOM 186 CG2 VAL A 22 -16.086 0.590 -1.685 1.00 12.44 C ATOM 0 H VAL A 22 -14.347 -1.711 -4.633 1.00 52.13 H new ATOM 0 HA VAL A 22 -15.775 0.828 -4.343 1.00 4.11 H new ATOM 0 HB VAL A 22 -16.655 -0.991 -3.002 1.00 52.40 H new ATOM 0 HG11 VAL A 22 -15.390 -1.972 -1.148 1.00 14.44 H new ATOM 0 HG12 VAL A 22 -14.694 -2.379 -2.734 1.00 14.44 H new ATOM 0 HG13 VAL A 22 -13.923 -1.139 -1.716 1.00 14.44 H new ATOM 0 HG21 VAL A 22 -16.559 0.148 -0.808 1.00 12.44 H new ATOM 0 HG22 VAL A 22 -15.178 1.111 -1.383 1.00 12.44 H new ATOM 0 HG23 VAL A 22 -16.772 1.298 -2.150 1.00 12.44 H new ATOM 196 N TYR A 23 -13.873 2.134 -3.410 1.00 22.24 N ATOM 197 CA TYR A 23 -12.713 2.956 -3.150 1.00 65.15 C ATOM 198 C TYR A 23 -12.362 3.063 -1.668 1.00 43.04 C ATOM 199 O TYR A 23 -11.196 3.244 -1.318 1.00 55.01 O ATOM 200 CB TYR A 23 -12.868 4.340 -3.793 1.00 70.25 C ATOM 201 CG TYR A 23 -14.092 5.140 -3.363 1.00 11.52 C ATOM 202 CD1 TYR A 23 -15.305 5.010 -4.035 1.00 72.32 C ATOM 203 CD2 TYR A 23 -14.028 6.029 -2.300 1.00 24.14 C ATOM 204 CE1 TYR A 23 -16.413 5.740 -3.655 1.00 5.33 C ATOM 205 CE2 TYR A 23 -15.131 6.762 -1.914 1.00 64.43 C ATOM 206 CZ TYR A 23 -16.321 6.614 -2.593 1.00 45.31 C ATOM 207 OH TYR A 23 -17.428 7.339 -2.201 1.00 74.21 O ATOM 0 H TYR A 23 -14.754 2.646 -3.449 1.00 22.24 H new ATOM 0 HA TYR A 23 -11.868 2.450 -3.616 1.00 65.15 H new ATOM 0 HB2 TYR A 23 -11.977 4.926 -3.567 1.00 70.25 H new ATOM 0 HB3 TYR A 23 -12.901 4.215 -4.875 1.00 70.25 H new ATOM 0 HD1 TYR A 23 -15.380 4.326 -4.868 1.00 72.32 H new ATOM 0 HD2 TYR A 23 -13.098 6.149 -1.765 1.00 24.14 H new ATOM 0 HE1 TYR A 23 -17.346 5.627 -4.186 1.00 5.33 H new ATOM 0 HE2 TYR A 23 -15.062 7.449 -1.083 1.00 64.43 H new ATOM 0 HH TYR A 23 -18.148 6.725 -1.946 1.00 74.21 H new ATOM 217 N GLY A 24 -13.348 2.946 -0.800 1.00 71.23 N ATOM 218 CA GLY A 24 -13.054 3.066 0.617 1.00 64.44 C ATOM 219 C GLY A 24 -14.276 3.336 1.453 1.00 12.22 C ATOM 220 O GLY A 24 -14.279 3.089 2.658 1.00 42.33 O ATOM 0 H GLY A 24 -14.325 2.774 -1.036 1.00 71.23 H new ATOM 0 HA2 GLY A 24 -12.580 2.147 0.963 1.00 64.44 H new ATOM 0 HA3 GLY A 24 -12.334 3.871 0.766 1.00 64.44 H new ATOM 224 N SER A 25 -15.311 3.837 0.819 1.00 63.31 N ATOM 225 CA SER A 25 -16.566 4.129 1.479 1.00 43.01 C ATOM 226 C SER A 25 -17.235 2.854 2.029 1.00 13.22 C ATOM 227 O SER A 25 -17.968 2.895 3.019 1.00 34.14 O ATOM 228 CB SER A 25 -17.463 4.845 0.486 1.00 45.21 C ATOM 229 OG SER A 25 -17.478 4.140 -0.754 1.00 23.33 O ATOM 0 H SER A 25 -15.307 4.056 -0.177 1.00 63.31 H new ATOM 0 HA SER A 25 -16.385 4.768 2.343 1.00 43.01 H new ATOM 0 HB2 SER A 25 -18.475 4.918 0.884 1.00 45.21 H new ATOM 0 HB3 SER A 25 -17.107 5.863 0.331 1.00 45.21 H new ATOM 0 HG SER A 25 -18.263 4.411 -1.275 1.00 23.33 H new ATOM 235 N PHE A 26 -16.962 1.739 1.376 1.00 32.43 N ATOM 236 CA PHE A 26 -17.477 0.436 1.762 1.00 75.01 C ATOM 237 C PHE A 26 -16.384 -0.606 1.588 1.00 11.50 C ATOM 238 O PHE A 26 -16.550 -1.577 0.864 1.00 45.01 O ATOM 239 CB PHE A 26 -18.687 0.061 0.892 1.00 3.12 C ATOM 240 CG PHE A 26 -19.880 0.929 1.078 1.00 10.45 C ATOM 241 CD1 PHE A 26 -20.633 0.840 2.233 1.00 13.24 C ATOM 242 CD2 PHE A 26 -20.258 1.830 0.101 1.00 61.35 C ATOM 243 CE1 PHE A 26 -21.738 1.631 2.412 1.00 72.22 C ATOM 244 CE2 PHE A 26 -21.365 2.625 0.275 1.00 43.22 C ATOM 245 CZ PHE A 26 -22.106 2.524 1.434 1.00 61.53 C ATOM 0 H PHE A 26 -16.366 1.712 0.549 1.00 32.43 H new ATOM 0 HA PHE A 26 -17.792 0.472 2.805 1.00 75.01 H new ATOM 0 HB2 PHE A 26 -18.389 0.097 -0.156 1.00 3.12 H new ATOM 0 HB3 PHE A 26 -18.967 -0.970 1.109 1.00 3.12 H new ATOM 0 HD1 PHE A 26 -20.348 0.139 3.004 1.00 13.24 H new ATOM 0 HD2 PHE A 26 -19.679 1.910 -0.807 1.00 61.35 H new ATOM 0 HE1 PHE A 26 -22.318 1.553 3.320 1.00 72.22 H new ATOM 0 HE2 PHE A 26 -21.654 3.327 -0.493 1.00 43.22 H new ATOM 0 HZ PHE A 26 -22.977 3.148 1.573 1.00 61.53 H new ATOM 255 N GLN A 27 -15.271 -0.393 2.244 1.00 50.02 N ATOM 256 CA GLN A 27 -14.126 -1.281 2.080 1.00 53.45 C ATOM 257 C GLN A 27 -14.156 -2.449 3.053 1.00 14.13 C ATOM 258 O GLN A 27 -13.523 -3.480 2.816 1.00 53.11 O ATOM 259 CB GLN A 27 -12.809 -0.516 2.199 1.00 52.11 C ATOM 260 CG GLN A 27 -12.631 0.255 3.505 1.00 1.11 C ATOM 261 CD GLN A 27 -11.287 0.952 3.597 1.00 51.10 C ATOM 262 OE1 GLN A 27 -11.157 2.010 4.219 1.00 4.41 O ATOM 263 NE2 GLN A 27 -10.277 0.371 3.001 1.00 5.20 N ATOM 0 H GLN A 27 -15.124 0.379 2.894 1.00 50.02 H new ATOM 0 HA GLN A 27 -14.195 -1.695 1.074 1.00 53.45 H new ATOM 0 HB2 GLN A 27 -11.985 -1.222 2.095 1.00 52.11 H new ATOM 0 HB3 GLN A 27 -12.736 0.185 1.367 1.00 52.11 H new ATOM 0 HG2 GLN A 27 -13.426 0.995 3.596 1.00 1.11 H new ATOM 0 HG3 GLN A 27 -12.737 -0.432 4.345 1.00 1.11 H new ATOM 0 HE21 GLN A 27 -10.418 -0.503 2.495 1.00 5.20 H new ATOM 0 HE22 GLN A 27 -9.349 0.792 3.043 1.00 5.20 H new ATOM 272 N ASP A 28 -14.878 -2.295 4.127 1.00 1.34 N ATOM 273 CA ASP A 28 -14.961 -3.336 5.130 1.00 54.01 C ATOM 274 C ASP A 28 -16.191 -4.204 4.900 1.00 64.43 C ATOM 275 O ASP A 28 -17.290 -3.698 4.758 1.00 25.24 O ATOM 276 CB ASP A 28 -14.985 -2.732 6.531 1.00 65.51 C ATOM 277 CG ASP A 28 -15.103 -3.777 7.609 1.00 22.51 C ATOM 278 OD1 ASP A 28 -14.081 -4.377 7.995 1.00 62.44 O ATOM 279 OD2 ASP A 28 -16.213 -4.006 8.092 1.00 44.43 O ATOM 0 H ASP A 28 -15.422 -1.458 4.337 1.00 1.34 H new ATOM 0 HA ASP A 28 -14.076 -3.966 5.044 1.00 54.01 H new ATOM 0 HB2 ASP A 28 -14.075 -2.153 6.689 1.00 65.51 H new ATOM 0 HB3 ASP A 28 -15.822 -2.038 6.609 1.00 65.51 H new ATOM 284 N PRO A 29 -16.026 -5.529 4.865 1.00 21.13 N ATOM 285 CA PRO A 29 -17.130 -6.458 4.604 1.00 2.24 C ATOM 286 C PRO A 29 -18.199 -6.452 5.696 1.00 50.24 C ATOM 287 O PRO A 29 -19.362 -6.746 5.438 1.00 42.25 O ATOM 288 CB PRO A 29 -16.443 -7.820 4.553 1.00 35.24 C ATOM 289 CG PRO A 29 -15.190 -7.644 5.320 1.00 34.04 C ATOM 290 CD PRO A 29 -14.752 -6.239 5.064 1.00 43.44 C ATOM 0 HA PRO A 29 -17.664 -6.188 3.693 1.00 2.24 H new ATOM 0 HB2 PRO A 29 -17.070 -8.595 4.993 1.00 35.24 H new ATOM 0 HB3 PRO A 29 -16.238 -8.121 3.526 1.00 35.24 H new ATOM 0 HG2 PRO A 29 -15.355 -7.815 6.384 1.00 34.04 H new ATOM 0 HG3 PRO A 29 -14.430 -8.356 4.997 1.00 34.04 H new ATOM 0 HD2 PRO A 29 -14.189 -5.832 5.904 1.00 43.44 H new ATOM 0 HD3 PRO A 29 -14.109 -6.170 4.186 1.00 43.44 H new ATOM 298 N ASP A 30 -17.837 -6.076 6.900 1.00 34.03 N ATOM 299 CA ASP A 30 -18.789 -6.131 7.990 1.00 45.50 C ATOM 300 C ASP A 30 -19.822 -5.021 7.867 1.00 54.11 C ATOM 301 O ASP A 30 -20.974 -5.190 8.260 1.00 24.42 O ATOM 302 CB ASP A 30 -18.101 -6.126 9.345 1.00 21.31 C ATOM 303 CG ASP A 30 -19.062 -6.283 10.493 1.00 10.21 C ATOM 304 OD1 ASP A 30 -19.613 -7.388 10.669 1.00 63.31 O ATOM 305 OD2 ASP A 30 -19.241 -5.325 11.263 1.00 2.53 O ATOM 0 H ASP A 30 -16.909 -5.734 7.150 1.00 34.03 H new ATOM 0 HA ASP A 30 -19.320 -7.080 7.918 1.00 45.50 H new ATOM 0 HB2 ASP A 30 -17.369 -6.933 9.378 1.00 21.31 H new ATOM 0 HB3 ASP A 30 -17.551 -5.192 9.464 1.00 21.31 H new ATOM 310 N VAL A 31 -19.428 -3.893 7.279 1.00 60.52 N ATOM 311 CA VAL A 31 -20.389 -2.822 7.024 1.00 12.14 C ATOM 312 C VAL A 31 -21.314 -3.237 5.885 1.00 4.32 C ATOM 313 O VAL A 31 -22.468 -2.820 5.820 1.00 25.51 O ATOM 314 CB VAL A 31 -19.755 -1.418 6.738 1.00 64.44 C ATOM 315 CG1 VAL A 31 -18.837 -0.996 7.858 1.00 11.41 C ATOM 316 CG2 VAL A 31 -19.047 -1.352 5.396 1.00 43.11 C ATOM 0 H VAL A 31 -18.473 -3.699 6.976 1.00 60.52 H new ATOM 0 HA VAL A 31 -20.948 -2.688 7.950 1.00 12.14 H new ATOM 0 HB VAL A 31 -20.583 -0.711 6.687 1.00 64.44 H new ATOM 0 HG11 VAL A 31 -18.412 -0.018 7.631 1.00 11.41 H new ATOM 0 HG12 VAL A 31 -19.401 -0.940 8.789 1.00 11.41 H new ATOM 0 HG13 VAL A 31 -18.034 -1.725 7.964 1.00 11.41 H new ATOM 0 HG21 VAL A 31 -18.628 -0.356 5.254 1.00 43.11 H new ATOM 0 HG22 VAL A 31 -18.245 -2.090 5.371 1.00 43.11 H new ATOM 0 HG23 VAL A 31 -19.759 -1.563 4.598 1.00 43.11 H new ATOM 326 N ILE A 32 -20.794 -4.082 4.998 1.00 73.32 N ATOM 327 CA ILE A 32 -21.530 -4.572 3.856 1.00 13.54 C ATOM 328 C ILE A 32 -22.730 -5.424 4.310 1.00 43.03 C ATOM 329 O ILE A 32 -23.826 -5.312 3.758 1.00 0.54 O ATOM 330 CB ILE A 32 -20.600 -5.380 2.917 1.00 63.12 C ATOM 331 CG1 ILE A 32 -19.440 -4.513 2.431 1.00 62.33 C ATOM 332 CG2 ILE A 32 -21.354 -5.924 1.741 1.00 23.22 C ATOM 333 CD1 ILE A 32 -19.871 -3.281 1.663 1.00 64.41 C ATOM 0 H ILE A 32 -19.842 -4.443 5.060 1.00 73.32 H new ATOM 0 HA ILE A 32 -21.914 -3.717 3.299 1.00 13.54 H new ATOM 0 HB ILE A 32 -20.203 -6.218 3.490 1.00 63.12 H new ATOM 0 HG12 ILE A 32 -18.846 -4.203 3.291 1.00 62.33 H new ATOM 0 HG13 ILE A 32 -18.791 -5.116 1.796 1.00 62.33 H new ATOM 0 HG21 ILE A 32 -20.674 -6.486 1.101 1.00 23.22 H new ATOM 0 HG22 ILE A 32 -22.149 -6.582 2.091 1.00 23.22 H new ATOM 0 HG23 ILE A 32 -21.788 -5.100 1.174 1.00 23.22 H new ATOM 0 HD11 ILE A 32 -18.990 -2.719 1.353 1.00 64.41 H new ATOM 0 HD12 ILE A 32 -20.439 -3.581 0.782 1.00 64.41 H new ATOM 0 HD13 ILE A 32 -20.495 -2.655 2.300 1.00 64.41 H new ATOM 345 N ASN A 33 -22.525 -6.245 5.336 1.00 25.35 N ATOM 346 CA ASN A 33 -23.612 -7.043 5.917 1.00 2.11 C ATOM 347 C ASN A 33 -24.700 -6.153 6.473 1.00 74.22 C ATOM 348 O ASN A 33 -25.865 -6.522 6.503 1.00 45.31 O ATOM 349 CB ASN A 33 -23.131 -7.991 7.023 1.00 12.41 C ATOM 350 CG ASN A 33 -22.234 -9.098 6.533 1.00 24.44 C ATOM 351 OD1 ASN A 33 -22.702 -10.149 6.102 1.00 64.51 O ATOM 352 ND2 ASN A 33 -20.959 -8.897 6.625 1.00 33.31 N ATOM 0 H ASN A 33 -21.619 -6.378 5.785 1.00 25.35 H new ATOM 0 HA ASN A 33 -24.005 -7.649 5.101 1.00 2.11 H new ATOM 0 HB2 ASN A 33 -22.598 -7.412 7.777 1.00 12.41 H new ATOM 0 HB3 ASN A 33 -23.999 -8.431 7.514 1.00 12.41 H new ATOM 0 HD21 ASN A 33 -20.306 -9.625 6.335 1.00 33.31 H new ATOM 0 HD22 ASN A 33 -20.607 -8.011 6.988 1.00 33.31 H new ATOM 359 N VAL A 34 -24.312 -4.994 6.916 1.00 22.31 N ATOM 360 CA VAL A 34 -25.239 -4.061 7.525 1.00 54.01 C ATOM 361 C VAL A 34 -25.975 -3.275 6.454 1.00 64.13 C ATOM 362 O VAL A 34 -27.202 -3.219 6.440 1.00 51.20 O ATOM 363 CB VAL A 34 -24.521 -3.080 8.498 1.00 63.03 C ATOM 364 CG1 VAL A 34 -25.514 -2.116 9.146 1.00 62.41 C ATOM 365 CG2 VAL A 34 -23.765 -3.849 9.567 1.00 10.22 C ATOM 0 H VAL A 34 -23.349 -4.661 6.870 1.00 22.31 H new ATOM 0 HA VAL A 34 -25.953 -4.645 8.105 1.00 54.01 H new ATOM 0 HB VAL A 34 -23.811 -2.494 7.915 1.00 63.03 H new ATOM 0 HG11 VAL A 34 -24.982 -1.444 9.820 1.00 62.41 H new ATOM 0 HG12 VAL A 34 -26.013 -1.533 8.372 1.00 62.41 H new ATOM 0 HG13 VAL A 34 -26.256 -2.682 9.709 1.00 62.41 H new ATOM 0 HG21 VAL A 34 -23.269 -3.147 10.238 1.00 10.22 H new ATOM 0 HG22 VAL A 34 -24.463 -4.463 10.136 1.00 10.22 H new ATOM 0 HG23 VAL A 34 -23.019 -4.489 9.096 1.00 10.22 H new ATOM 375 N MET A 35 -25.212 -2.705 5.532 1.00 41.41 N ATOM 376 CA MET A 35 -25.759 -1.848 4.500 1.00 32.24 C ATOM 377 C MET A 35 -26.629 -2.671 3.535 1.00 22.52 C ATOM 378 O MET A 35 -27.673 -2.209 3.076 1.00 51.34 O ATOM 379 CB MET A 35 -24.600 -1.119 3.771 1.00 32.13 C ATOM 380 CG MET A 35 -24.981 0.192 3.066 1.00 34.12 C ATOM 381 SD MET A 35 -26.057 0.030 1.635 1.00 11.14 S ATOM 382 CE MET A 35 -24.912 -0.633 0.454 1.00 51.04 C ATOM 0 H MET A 35 -24.200 -2.825 5.482 1.00 41.41 H new ATOM 0 HA MET A 35 -26.404 -1.090 4.944 1.00 32.24 H new ATOM 0 HB2 MET A 35 -23.815 -0.906 4.497 1.00 32.13 H new ATOM 0 HB3 MET A 35 -24.175 -1.798 3.032 1.00 32.13 H new ATOM 0 HG2 MET A 35 -25.469 0.843 3.791 1.00 34.12 H new ATOM 0 HG3 MET A 35 -24.065 0.693 2.753 1.00 34.12 H new ATOM 0 HE1 MET A 35 -25.446 -0.910 -0.455 1.00 51.04 H new ATOM 0 HE2 MET A 35 -24.158 0.118 0.217 1.00 51.04 H new ATOM 0 HE3 MET A 35 -24.427 -1.515 0.873 1.00 51.04 H new ATOM 392 N LEU A 36 -26.223 -3.906 3.276 1.00 64.00 N ATOM 393 CA LEU A 36 -26.978 -4.778 2.392 1.00 13.30 C ATOM 394 C LEU A 36 -27.740 -5.788 3.204 1.00 44.43 C ATOM 395 O LEU A 36 -28.939 -5.637 3.453 1.00 13.20 O ATOM 396 CB LEU A 36 -26.045 -5.551 1.447 1.00 61.41 C ATOM 397 CG LEU A 36 -25.094 -4.730 0.630 1.00 40.12 C ATOM 398 CD1 LEU A 36 -24.201 -5.619 -0.197 1.00 73.03 C ATOM 399 CD2 LEU A 36 -25.834 -3.743 -0.228 1.00 34.44 C ATOM 0 H LEU A 36 -25.378 -4.324 3.665 1.00 64.00 H new ATOM 0 HA LEU A 36 -27.654 -4.151 1.810 1.00 13.30 H new ATOM 0 HB2 LEU A 36 -25.464 -6.256 2.042 1.00 61.41 H new ATOM 0 HB3 LEU A 36 -26.660 -6.140 0.766 1.00 61.41 H new ATOM 0 HG LEU A 36 -24.461 -4.161 1.310 1.00 40.12 H new ATOM 0 HD11 LEU A 36 -23.518 -5.004 -0.783 1.00 73.03 H new ATOM 0 HD12 LEU A 36 -23.628 -6.272 0.461 1.00 73.03 H new ATOM 0 HD13 LEU A 36 -24.811 -6.224 -0.868 1.00 73.03 H new ATOM 0 HD21 LEU A 36 -25.120 -3.160 -0.810 1.00 34.44 H new ATOM 0 HD22 LEU A 36 -26.503 -4.277 -0.903 1.00 34.44 H new ATOM 0 HD23 LEU A 36 -26.416 -3.075 0.406 1.00 34.44 H new ATOM 411 N ASP A 37 -26.991 -6.788 3.664 1.00 41.43 N ATOM 412 CA ASP A 37 -27.491 -7.974 4.366 1.00 64.22 C ATOM 413 C ASP A 37 -26.401 -9.017 4.317 1.00 11.04 C ATOM 414 O ASP A 37 -26.234 -9.826 5.229 1.00 12.30 O ATOM 415 CB ASP A 37 -28.724 -8.564 3.657 1.00 23.04 C ATOM 416 CG ASP A 37 -29.252 -9.808 4.338 1.00 72.41 C ATOM 417 OD1 ASP A 37 -30.079 -9.688 5.268 1.00 11.20 O ATOM 418 OD2 ASP A 37 -28.851 -10.920 3.958 1.00 11.32 O ATOM 0 H ASP A 37 -25.977 -6.797 3.555 1.00 41.43 H new ATOM 0 HA ASP A 37 -27.766 -7.696 5.384 1.00 64.22 H new ATOM 0 HB2 ASP A 37 -29.512 -7.812 3.622 1.00 23.04 H new ATOM 0 HB3 ASP A 37 -28.465 -8.802 2.625 1.00 23.04 H new ATOM 423 N ARG A 38 -25.628 -8.953 3.255 1.00 30.21 N ATOM 424 CA ARG A 38 -24.629 -9.951 2.962 1.00 65.03 C ATOM 425 C ARG A 38 -23.459 -9.311 2.293 1.00 24.33 C ATOM 426 O ARG A 38 -23.586 -8.221 1.747 1.00 52.10 O ATOM 427 CB ARG A 38 -25.237 -11.017 2.047 1.00 53.44 C ATOM 428 CG ARG A 38 -25.887 -10.444 0.791 1.00 73.41 C ATOM 429 CD ARG A 38 -26.545 -11.521 -0.034 1.00 44.40 C ATOM 430 NE ARG A 38 -27.316 -10.958 -1.150 1.00 74.12 N ATOM 431 CZ ARG A 38 -28.320 -11.590 -1.763 1.00 62.21 C ATOM 432 NH1 ARG A 38 -28.619 -12.844 -1.443 1.00 22.30 N ATOM 433 NH2 ARG A 38 -29.017 -10.959 -2.696 1.00 41.11 N ATOM 0 H ARG A 38 -25.677 -8.201 2.567 1.00 30.21 H new ATOM 0 HA ARG A 38 -24.293 -10.417 3.888 1.00 65.03 H new ATOM 0 HB2 ARG A 38 -24.457 -11.720 1.754 1.00 53.44 H new ATOM 0 HB3 ARG A 38 -25.982 -11.582 2.606 1.00 53.44 H new ATOM 0 HG2 ARG A 38 -26.629 -9.697 1.073 1.00 73.41 H new ATOM 0 HG3 ARG A 38 -25.133 -9.934 0.191 1.00 73.41 H new ATOM 0 HD2 ARG A 38 -25.784 -12.197 -0.423 1.00 44.40 H new ATOM 0 HD3 ARG A 38 -27.204 -12.114 0.601 1.00 44.40 H new ATOM 0 HE ARG A 38 -27.069 -10.024 -1.478 1.00 74.12 H new ATOM 0 HH11 ARG A 38 -28.081 -13.329 -0.725 1.00 22.30 H new ATOM 0 HH12 ARG A 38 -29.387 -13.321 -1.915 1.00 22.30 H new ATOM 0 HH21 ARG A 38 -28.785 -9.997 -2.942 1.00 41.11 H new ATOM 0 HH22 ARG A 38 -29.785 -11.436 -3.168 1.00 41.11 H new ATOM 447 N THR A 39 -22.337 -9.962 2.344 1.00 11.14 N ATOM 448 CA THR A 39 -21.155 -9.460 1.725 1.00 41.44 C ATOM 449 C THR A 39 -20.814 -10.264 0.476 1.00 20.23 C ATOM 450 O THR A 39 -20.644 -11.489 0.545 1.00 31.11 O ATOM 451 CB THR A 39 -19.978 -9.540 2.693 1.00 4.33 C ATOM 452 OG1 THR A 39 -20.377 -8.956 3.913 1.00 53.20 O ATOM 453 CG2 THR A 39 -18.790 -8.762 2.158 1.00 42.11 C ATOM 0 H THR A 39 -22.218 -10.858 2.818 1.00 11.14 H new ATOM 0 HA THR A 39 -21.340 -8.422 1.448 1.00 41.44 H new ATOM 0 HB THR A 39 -19.689 -10.583 2.823 1.00 4.33 H new ATOM 0 HG1 THR A 39 -19.764 -8.227 4.143 1.00 53.20 H new ATOM 0 HG21 THR A 39 -17.962 -8.832 2.863 1.00 42.11 H new ATOM 0 HG22 THR A 39 -18.485 -9.178 1.198 1.00 42.11 H new ATOM 0 HG23 THR A 39 -19.069 -7.716 2.028 1.00 42.11 H new ATOM 461 N PRO A 40 -20.759 -9.606 -0.684 1.00 24.22 N ATOM 462 CA PRO A 40 -20.278 -10.219 -1.911 1.00 23.32 C ATOM 463 C PRO A 40 -18.804 -10.540 -1.765 1.00 31.54 C ATOM 464 O PRO A 40 -18.097 -9.885 -0.985 1.00 75.34 O ATOM 465 CB PRO A 40 -20.468 -9.121 -2.965 1.00 2.10 C ATOM 466 CG PRO A 40 -21.455 -8.202 -2.366 1.00 31.32 C ATOM 467 CD PRO A 40 -21.172 -8.219 -0.906 1.00 44.22 C ATOM 0 HA PRO A 40 -20.795 -11.144 -2.164 1.00 23.32 H new ATOM 0 HB2 PRO A 40 -19.529 -8.610 -3.180 1.00 2.10 H new ATOM 0 HB3 PRO A 40 -20.830 -9.533 -3.907 1.00 2.10 H new ATOM 0 HG2 PRO A 40 -21.354 -7.196 -2.774 1.00 31.32 H new ATOM 0 HG3 PRO A 40 -22.474 -8.530 -2.573 1.00 31.32 H new ATOM 0 HD2 PRO A 40 -20.387 -7.513 -0.636 1.00 44.22 H new ATOM 0 HD3 PRO A 40 -22.052 -7.958 -0.318 1.00 44.22 H new ATOM 475 N GLU A 41 -18.352 -11.545 -2.458 1.00 43.31 N ATOM 476 CA GLU A 41 -16.964 -11.919 -2.402 1.00 22.11 C ATOM 477 C GLU A 41 -16.055 -10.840 -2.858 1.00 51.13 C ATOM 478 O GLU A 41 -16.236 -10.236 -3.907 1.00 4.12 O ATOM 479 CB GLU A 41 -16.682 -13.224 -3.063 1.00 43.05 C ATOM 480 CG GLU A 41 -17.164 -14.366 -2.235 1.00 22.10 C ATOM 481 CD GLU A 41 -16.988 -15.676 -2.904 1.00 3.31 C ATOM 482 OE1 GLU A 41 -15.894 -16.259 -2.784 1.00 42.01 O ATOM 483 OE2 GLU A 41 -17.935 -16.144 -3.570 1.00 23.21 O ATOM 0 H GLU A 41 -18.925 -12.124 -3.072 1.00 43.31 H new ATOM 0 HA GLU A 41 -16.747 -12.069 -1.344 1.00 22.11 H new ATOM 0 HB2 GLU A 41 -17.165 -13.251 -4.040 1.00 43.05 H new ATOM 0 HB3 GLU A 41 -15.610 -13.323 -3.234 1.00 43.05 H new ATOM 0 HG2 GLU A 41 -16.627 -14.373 -1.286 1.00 22.10 H new ATOM 0 HG3 GLU A 41 -18.219 -14.221 -2.003 1.00 22.10 H new ATOM 490 N ILE A 42 -15.101 -10.600 -2.061 1.00 41.21 N ATOM 491 CA ILE A 42 -14.191 -9.517 -2.276 1.00 74.14 C ATOM 492 C ILE A 42 -12.873 -10.032 -2.812 1.00 23.04 C ATOM 493 O ILE A 42 -12.372 -11.080 -2.377 1.00 12.22 O ATOM 494 CB ILE A 42 -13.914 -8.750 -0.951 1.00 43.54 C ATOM 495 CG1 ILE A 42 -15.225 -8.332 -0.280 1.00 62.33 C ATOM 496 CG2 ILE A 42 -13.055 -7.524 -1.221 1.00 14.32 C ATOM 497 CD1 ILE A 42 -15.043 -7.607 1.042 1.00 63.43 C ATOM 0 H ILE A 42 -14.911 -11.148 -1.222 1.00 41.21 H new ATOM 0 HA ILE A 42 -14.652 -8.843 -2.998 1.00 74.14 H new ATOM 0 HB ILE A 42 -13.378 -9.418 -0.277 1.00 43.54 H new ATOM 0 HG12 ILE A 42 -15.780 -7.688 -0.962 1.00 62.33 H new ATOM 0 HG13 ILE A 42 -15.835 -9.220 -0.114 1.00 62.33 H new ATOM 0 HG21 ILE A 42 -12.869 -6.997 -0.285 1.00 14.32 H new ATOM 0 HG22 ILE A 42 -12.106 -7.834 -1.658 1.00 14.32 H new ATOM 0 HG23 ILE A 42 -13.574 -6.861 -1.914 1.00 14.32 H new ATOM 0 HD11 ILE A 42 -16.019 -7.346 1.451 1.00 63.43 H new ATOM 0 HD12 ILE A 42 -14.517 -8.255 1.743 1.00 63.43 H new ATOM 0 HD13 ILE A 42 -14.462 -6.699 0.882 1.00 63.43 H new ATOM 509 N VAL A 43 -12.333 -9.323 -3.746 1.00 0.22 N ATOM 510 CA VAL A 43 -11.015 -9.592 -4.242 1.00 2.52 C ATOM 511 C VAL A 43 -10.212 -8.307 -4.146 1.00 20.41 C ATOM 512 O VAL A 43 -10.777 -7.203 -4.270 1.00 45.24 O ATOM 513 CB VAL A 43 -11.014 -10.127 -5.712 1.00 3.03 C ATOM 514 CG1 VAL A 43 -11.575 -9.106 -6.677 1.00 24.21 C ATOM 515 CG2 VAL A 43 -9.616 -10.558 -6.139 1.00 40.45 C ATOM 0 H VAL A 43 -12.795 -8.532 -4.194 1.00 0.22 H new ATOM 0 HA VAL A 43 -10.570 -10.382 -3.637 1.00 2.52 H new ATOM 0 HB VAL A 43 -11.664 -11.001 -5.738 1.00 3.03 H new ATOM 0 HG11 VAL A 43 -11.558 -9.513 -7.688 1.00 24.21 H new ATOM 0 HG12 VAL A 43 -12.602 -8.868 -6.399 1.00 24.21 H new ATOM 0 HG13 VAL A 43 -10.970 -8.200 -6.641 1.00 24.21 H new ATOM 0 HG21 VAL A 43 -9.646 -10.925 -7.165 1.00 40.45 H new ATOM 0 HG22 VAL A 43 -8.938 -9.707 -6.078 1.00 40.45 H new ATOM 0 HG23 VAL A 43 -9.263 -11.351 -5.480 1.00 40.45 H new ATOM 525 N SER A 44 -8.944 -8.430 -3.889 1.00 61.45 N ATOM 526 CA SER A 44 -8.081 -7.295 -3.824 1.00 53.30 C ATOM 527 C SER A 44 -7.821 -6.872 -5.255 1.00 72.30 C ATOM 528 O SER A 44 -7.420 -7.703 -6.077 1.00 11.53 O ATOM 529 CB SER A 44 -6.780 -7.725 -3.176 1.00 74.43 C ATOM 530 OG SER A 44 -7.032 -8.441 -1.979 1.00 5.30 O ATOM 0 H SER A 44 -8.481 -9.323 -3.719 1.00 61.45 H new ATOM 0 HA SER A 44 -8.516 -6.478 -3.249 1.00 53.30 H new ATOM 0 HB2 SER A 44 -6.212 -8.349 -3.867 1.00 74.43 H new ATOM 0 HB3 SER A 44 -6.168 -6.849 -2.960 1.00 74.43 H new ATOM 0 HG SER A 44 -7.266 -9.368 -2.195 1.00 5.30 H new ATOM 536 N ALA A 45 -8.075 -5.640 -5.582 1.00 64.10 N ATOM 537 CA ALA A 45 -7.894 -5.218 -6.939 1.00 42.42 C ATOM 538 C ALA A 45 -7.283 -3.847 -7.061 1.00 24.52 C ATOM 539 O ALA A 45 -7.446 -2.988 -6.200 1.00 25.13 O ATOM 540 CB ALA A 45 -9.186 -5.292 -7.703 1.00 65.23 C ATOM 0 H ALA A 45 -8.403 -4.919 -4.939 1.00 64.10 H new ATOM 0 HA ALA A 45 -7.180 -5.915 -7.379 1.00 42.42 H new ATOM 0 HB1 ALA A 45 -9.021 -4.966 -8.730 1.00 65.23 H new ATOM 0 HB2 ALA A 45 -9.551 -6.319 -7.702 1.00 65.23 H new ATOM 0 HB3 ALA A 45 -9.925 -4.644 -7.232 1.00 65.23 H new ATOM 546 N THR A 46 -6.590 -3.662 -8.132 1.00 63.35 N ATOM 547 CA THR A 46 -5.940 -2.437 -8.442 1.00 30.32 C ATOM 548 C THR A 46 -6.567 -1.831 -9.688 1.00 72.42 C ATOM 549 O THR A 46 -6.673 -2.489 -10.709 1.00 34.41 O ATOM 550 CB THR A 46 -4.447 -2.688 -8.689 1.00 51.33 C ATOM 551 OG1 THR A 46 -3.897 -3.339 -7.546 1.00 21.25 O ATOM 552 CG2 THR A 46 -3.696 -1.388 -8.924 1.00 32.02 C ATOM 0 H THR A 46 -6.456 -4.385 -8.839 1.00 63.35 H new ATOM 0 HA THR A 46 -6.054 -1.748 -7.605 1.00 30.32 H new ATOM 0 HB THR A 46 -4.344 -3.308 -9.580 1.00 51.33 H new ATOM 0 HG1 THR A 46 -2.943 -3.506 -7.692 1.00 21.25 H new ATOM 0 HG21 THR A 46 -2.641 -1.603 -9.096 1.00 32.02 H new ATOM 0 HG22 THR A 46 -4.110 -0.881 -9.796 1.00 32.02 H new ATOM 0 HG23 THR A 46 -3.798 -0.746 -8.049 1.00 32.02 H new ATOM 560 N LEU A 47 -6.989 -0.612 -9.575 1.00 64.41 N ATOM 561 CA LEU A 47 -7.578 0.127 -10.658 1.00 3.43 C ATOM 562 C LEU A 47 -6.524 1.045 -11.287 1.00 11.32 C ATOM 563 O LEU A 47 -6.162 2.063 -10.700 1.00 3.31 O ATOM 564 CB LEU A 47 -8.766 0.947 -10.116 1.00 42.04 C ATOM 565 CG LEU A 47 -9.475 1.880 -11.089 1.00 44.13 C ATOM 566 CD1 LEU A 47 -10.003 1.121 -12.282 1.00 52.33 C ATOM 567 CD2 LEU A 47 -10.609 2.617 -10.394 1.00 64.13 C ATOM 0 H LEU A 47 -6.934 -0.084 -8.704 1.00 64.41 H new ATOM 0 HA LEU A 47 -7.940 -0.556 -11.427 1.00 3.43 H new ATOM 0 HB2 LEU A 47 -9.504 0.249 -9.720 1.00 42.04 H new ATOM 0 HB3 LEU A 47 -8.409 1.544 -9.277 1.00 42.04 H new ATOM 0 HG LEU A 47 -8.746 2.610 -11.442 1.00 44.13 H new ATOM 0 HD11 LEU A 47 -10.504 1.812 -12.960 1.00 52.33 H new ATOM 0 HD12 LEU A 47 -9.175 0.639 -12.802 1.00 52.33 H new ATOM 0 HD13 LEU A 47 -10.711 0.363 -11.947 1.00 52.33 H new ATOM 0 HD21 LEU A 47 -11.103 3.278 -11.106 1.00 64.13 H new ATOM 0 HD22 LEU A 47 -11.329 1.896 -10.009 1.00 64.13 H new ATOM 0 HD23 LEU A 47 -10.208 3.206 -9.569 1.00 64.13 H new ATOM 579 N PRO A 48 -5.975 0.670 -12.448 1.00 64.34 N ATOM 580 CA PRO A 48 -4.978 1.475 -13.127 1.00 1.41 C ATOM 581 C PRO A 48 -5.611 2.611 -13.929 1.00 20.04 C ATOM 582 O PRO A 48 -6.688 2.441 -14.530 1.00 50.22 O ATOM 583 CB PRO A 48 -4.288 0.476 -14.056 1.00 34.31 C ATOM 584 CG PRO A 48 -5.332 -0.549 -14.367 1.00 62.20 C ATOM 585 CD PRO A 48 -6.278 -0.578 -13.189 1.00 42.30 C ATOM 0 HA PRO A 48 -4.296 1.963 -12.430 1.00 1.41 H new ATOM 0 HB2 PRO A 48 -3.930 0.963 -14.963 1.00 34.31 H new ATOM 0 HB3 PRO A 48 -3.421 0.023 -13.575 1.00 34.31 H new ATOM 0 HG2 PRO A 48 -5.864 -0.294 -15.284 1.00 62.20 H new ATOM 0 HG3 PRO A 48 -4.879 -1.528 -14.523 1.00 62.20 H new ATOM 0 HD2 PRO A 48 -7.318 -0.606 -13.514 1.00 42.30 H new ATOM 0 HD3 PRO A 48 -6.115 -1.459 -12.569 1.00 42.30 H new ATOM 593 N GLY A 49 -4.966 3.760 -13.914 1.00 52.01 N ATOM 594 CA GLY A 49 -5.459 4.888 -14.663 1.00 41.12 C ATOM 595 C GLY A 49 -6.312 5.800 -13.819 1.00 61.54 C ATOM 596 O GLY A 49 -6.972 6.702 -14.334 1.00 60.42 O ATOM 0 H GLY A 49 -4.106 3.933 -13.394 1.00 52.01 H new ATOM 0 HA2 GLY A 49 -4.617 5.451 -15.067 1.00 41.12 H new ATOM 0 HA3 GLY A 49 -6.041 4.532 -15.513 1.00 41.12 H new ATOM 600 N PHE A 50 -6.298 5.575 -12.525 1.00 3.20 N ATOM 601 CA PHE A 50 -7.055 6.365 -11.576 1.00 43.44 C ATOM 602 C PHE A 50 -6.217 6.589 -10.364 1.00 44.01 C ATOM 603 O PHE A 50 -5.259 5.894 -10.163 1.00 22.33 O ATOM 604 CB PHE A 50 -8.396 5.694 -11.200 1.00 3.41 C ATOM 605 CG PHE A 50 -9.418 5.685 -12.310 1.00 2.02 C ATOM 606 CD1 PHE A 50 -9.418 4.698 -13.283 1.00 3.44 C ATOM 607 CD2 PHE A 50 -10.377 6.678 -12.376 1.00 31.22 C ATOM 608 CE1 PHE A 50 -10.349 4.707 -14.297 1.00 64.31 C ATOM 609 CE2 PHE A 50 -11.310 6.693 -13.388 1.00 65.32 C ATOM 610 CZ PHE A 50 -11.297 5.707 -14.353 1.00 42.22 C ATOM 0 H PHE A 50 -5.753 4.828 -12.094 1.00 3.20 H new ATOM 0 HA PHE A 50 -7.305 7.320 -12.038 1.00 43.44 H new ATOM 0 HB2 PHE A 50 -8.201 4.666 -10.893 1.00 3.41 H new ATOM 0 HB3 PHE A 50 -8.818 6.210 -10.338 1.00 3.41 H new ATOM 0 HD1 PHE A 50 -8.678 3.912 -13.245 1.00 3.44 H new ATOM 0 HD2 PHE A 50 -10.395 7.453 -11.624 1.00 31.22 H new ATOM 0 HE1 PHE A 50 -10.337 3.931 -15.048 1.00 64.31 H new ATOM 0 HE2 PHE A 50 -12.052 7.477 -13.427 1.00 65.32 H new ATOM 0 HZ PHE A 50 -12.027 5.718 -15.149 1.00 42.22 H new ATOM 620 N GLN A 51 -6.573 7.528 -9.559 1.00 13.51 N ATOM 621 CA GLN A 51 -5.797 7.836 -8.401 1.00 25.14 C ATOM 622 C GLN A 51 -6.700 8.089 -7.239 1.00 1.25 C ATOM 623 O GLN A 51 -7.803 8.640 -7.387 1.00 75.12 O ATOM 624 CB GLN A 51 -4.883 9.028 -8.672 1.00 40.12 C ATOM 625 CG GLN A 51 -4.032 9.470 -7.496 1.00 3.43 C ATOM 626 CD GLN A 51 -3.057 10.569 -7.865 1.00 73.24 C ATOM 627 OE1 GLN A 51 -2.590 10.653 -9.005 1.00 54.13 O ATOM 628 NE2 GLN A 51 -2.749 11.419 -6.919 1.00 41.35 N ATOM 0 H GLN A 51 -7.406 8.104 -9.680 1.00 13.51 H new ATOM 0 HA GLN A 51 -5.161 6.985 -8.157 1.00 25.14 H new ATOM 0 HB2 GLN A 51 -4.224 8.778 -9.503 1.00 40.12 H new ATOM 0 HB3 GLN A 51 -5.496 9.870 -8.993 1.00 40.12 H new ATOM 0 HG2 GLN A 51 -4.681 9.819 -6.693 1.00 3.43 H new ATOM 0 HG3 GLN A 51 -3.480 8.614 -7.109 1.00 3.43 H new ATOM 0 HE21 GLN A 51 -3.156 11.317 -5.989 1.00 41.35 H new ATOM 0 HE22 GLN A 51 -2.102 12.184 -7.111 1.00 41.35 H new ATOM 637 N ARG A 52 -6.248 7.659 -6.095 1.00 1.41 N ATOM 638 CA ARG A 52 -7.009 7.726 -4.905 1.00 33.21 C ATOM 639 C ARG A 52 -6.684 9.058 -4.247 1.00 12.41 C ATOM 640 O ARG A 52 -5.514 9.365 -3.999 1.00 64.11 O ATOM 641 CB ARG A 52 -6.546 6.557 -3.997 1.00 51.23 C ATOM 642 CG ARG A 52 -7.568 5.992 -2.997 1.00 72.42 C ATOM 643 CD ARG A 52 -8.118 7.003 -2.016 1.00 25.21 C ATOM 644 NE ARG A 52 -9.052 6.357 -1.088 1.00 12.04 N ATOM 645 CZ ARG A 52 -10.298 6.766 -0.826 1.00 33.11 C ATOM 646 NH1 ARG A 52 -10.809 7.828 -1.462 1.00 11.21 N ATOM 647 NH2 ARG A 52 -11.030 6.111 0.066 1.00 45.23 N ATOM 0 H ARG A 52 -5.323 7.247 -5.974 1.00 1.41 H new ATOM 0 HA ARG A 52 -8.081 7.650 -5.085 1.00 33.21 H new ATOM 0 HB2 ARG A 52 -6.217 5.741 -4.640 1.00 51.23 H new ATOM 0 HB3 ARG A 52 -5.674 6.892 -3.435 1.00 51.23 H new ATOM 0 HG2 ARG A 52 -8.398 5.557 -3.554 1.00 72.42 H new ATOM 0 HG3 ARG A 52 -7.100 5.182 -2.438 1.00 72.42 H new ATOM 0 HD2 ARG A 52 -7.301 7.461 -1.459 1.00 25.21 H new ATOM 0 HD3 ARG A 52 -8.625 7.803 -2.555 1.00 25.21 H new ATOM 0 HE ARG A 52 -8.723 5.524 -0.600 1.00 12.04 H new ATOM 0 HH11 ARG A 52 -10.247 8.329 -2.150 1.00 11.21 H new ATOM 0 HH12 ARG A 52 -11.760 8.136 -1.258 1.00 11.21 H new ATOM 0 HH21 ARG A 52 -10.642 5.300 0.548 1.00 45.23 H new ATOM 0 HH22 ARG A 52 -11.981 6.418 0.270 1.00 45.23 H new ATOM 661 N PHE A 53 -7.690 9.832 -3.982 1.00 0.12 N ATOM 662 CA PHE A 53 -7.526 11.084 -3.300 1.00 24.42 C ATOM 663 C PHE A 53 -8.094 10.972 -1.936 1.00 4.54 C ATOM 664 O PHE A 53 -9.052 10.224 -1.714 1.00 13.02 O ATOM 665 CB PHE A 53 -8.157 12.247 -4.073 1.00 51.54 C ATOM 666 CG PHE A 53 -7.323 12.744 -5.226 1.00 34.23 C ATOM 667 CD1 PHE A 53 -6.993 11.925 -6.296 1.00 1.13 C ATOM 668 CD2 PHE A 53 -6.852 14.045 -5.222 1.00 22.52 C ATOM 669 CE1 PHE A 53 -6.217 12.402 -7.331 1.00 13.41 C ATOM 670 CE2 PHE A 53 -6.077 14.523 -6.256 1.00 23.22 C ATOM 671 CZ PHE A 53 -5.761 13.702 -7.311 1.00 25.12 C ATOM 0 H PHE A 53 -8.654 9.615 -4.233 1.00 0.12 H new ATOM 0 HA PHE A 53 -6.461 11.305 -3.231 1.00 24.42 H new ATOM 0 HB2 PHE A 53 -9.130 11.933 -4.451 1.00 51.54 H new ATOM 0 HB3 PHE A 53 -8.335 13.073 -3.384 1.00 51.54 H new ATOM 0 HD1 PHE A 53 -7.347 10.905 -6.318 1.00 1.13 H new ATOM 0 HD2 PHE A 53 -7.096 14.696 -4.395 1.00 22.52 H new ATOM 0 HE1 PHE A 53 -5.966 11.755 -8.159 1.00 13.41 H new ATOM 0 HE2 PHE A 53 -5.719 15.542 -6.237 1.00 23.22 H new ATOM 0 HZ PHE A 53 -5.156 14.075 -8.124 1.00 25.12 H new ATOM 681 N ARG A 54 -7.513 11.672 -1.022 1.00 73.33 N ATOM 682 CA ARG A 54 -7.909 11.591 0.333 1.00 5.51 C ATOM 683 C ARG A 54 -8.016 12.980 0.894 1.00 61.25 C ATOM 684 O ARG A 54 -7.077 13.750 0.829 1.00 73.15 O ATOM 685 CB ARG A 54 -6.904 10.692 1.072 1.00 21.42 C ATOM 686 CG ARG A 54 -7.161 10.427 2.542 1.00 14.21 C ATOM 687 CD ARG A 54 -6.742 11.570 3.423 1.00 70.43 C ATOM 688 NE ARG A 54 -6.979 11.268 4.831 1.00 22.44 N ATOM 689 CZ ARG A 54 -6.646 12.046 5.849 1.00 3.30 C ATOM 690 NH1 ARG A 54 -6.132 13.248 5.626 1.00 74.23 N ATOM 691 NH2 ARG A 54 -6.850 11.631 7.094 1.00 0.45 N ATOM 0 H ARG A 54 -6.745 12.319 -1.200 1.00 73.33 H new ATOM 0 HA ARG A 54 -8.893 11.137 0.452 1.00 5.51 H new ATOM 0 HB2 ARG A 54 -6.868 9.732 0.557 1.00 21.42 H new ATOM 0 HB3 ARG A 54 -5.916 11.142 0.978 1.00 21.42 H new ATOM 0 HG2 ARG A 54 -8.223 10.230 2.691 1.00 14.21 H new ATOM 0 HG3 ARG A 54 -6.625 9.527 2.843 1.00 14.21 H new ATOM 0 HD2 ARG A 54 -5.684 11.783 3.268 1.00 70.43 H new ATOM 0 HD3 ARG A 54 -7.293 12.468 3.144 1.00 70.43 H new ATOM 0 HE ARG A 54 -7.439 10.384 5.049 1.00 22.44 H new ATOM 0 HH11 ARG A 54 -5.993 13.574 4.669 1.00 74.23 H new ATOM 0 HH12 ARG A 54 -5.876 13.847 6.411 1.00 74.23 H new ATOM 0 HH21 ARG A 54 -7.263 10.714 7.265 1.00 0.45 H new ATOM 0 HH22 ARG A 54 -6.594 12.229 7.879 1.00 0.45 H new ATOM 796 N TYR A 60 -15.114 15.085 -0.048 1.00 35.14 N ATOM 797 CA TYR A 60 -14.894 13.689 0.255 1.00 74.04 C ATOM 798 C TYR A 60 -13.611 13.192 -0.397 1.00 23.35 C ATOM 799 O TYR A 60 -13.106 13.819 -1.331 1.00 10.32 O ATOM 800 CB TYR A 60 -16.057 12.862 -0.317 1.00 44.54 C ATOM 801 CG TYR A 60 -17.429 13.362 0.038 1.00 63.44 C ATOM 802 CD1 TYR A 60 -18.041 13.012 1.229 1.00 52.40 C ATOM 803 CD2 TYR A 60 -18.112 14.195 -0.833 1.00 32.23 C ATOM 804 CE1 TYR A 60 -19.302 13.480 1.538 1.00 23.00 C ATOM 805 CE2 TYR A 60 -19.358 14.664 -0.535 1.00 63.13 C ATOM 806 CZ TYR A 60 -19.954 14.308 0.647 1.00 3.44 C ATOM 807 OH TYR A 60 -21.212 14.785 0.939 1.00 53.40 O ATOM 0 HA TYR A 60 -14.823 13.580 1.337 1.00 74.04 H new ATOM 0 HB2 TYR A 60 -15.966 12.838 -1.403 1.00 44.54 H new ATOM 0 HB3 TYR A 60 -15.959 11.835 0.034 1.00 44.54 H new ATOM 0 HD1 TYR A 60 -17.526 12.366 1.924 1.00 52.40 H new ATOM 0 HD2 TYR A 60 -17.649 14.479 -1.766 1.00 32.23 H new ATOM 0 HE1 TYR A 60 -19.774 13.201 2.468 1.00 23.00 H new ATOM 0 HE2 TYR A 60 -19.873 15.313 -1.228 1.00 63.13 H new ATOM 0 HH TYR A 60 -21.845 14.476 0.258 1.00 53.40 H new ATOM 817 N PRO A 61 -13.051 12.074 0.104 1.00 21.02 N ATOM 818 CA PRO A 61 -11.929 11.399 -0.538 1.00 52.52 C ATOM 819 C PRO A 61 -12.393 10.748 -1.852 1.00 13.23 C ATOM 820 O PRO A 61 -12.963 9.646 -1.843 1.00 73.03 O ATOM 821 CB PRO A 61 -11.537 10.304 0.482 1.00 3.32 C ATOM 822 CG PRO A 61 -12.186 10.713 1.752 1.00 73.31 C ATOM 823 CD PRO A 61 -13.445 11.398 1.352 1.00 3.21 C ATOM 0 HA PRO A 61 -11.107 12.071 -0.785 1.00 52.52 H new ATOM 0 HB2 PRO A 61 -11.884 9.322 0.160 1.00 3.32 H new ATOM 0 HB3 PRO A 61 -10.455 10.239 0.595 1.00 3.32 H new ATOM 0 HG2 PRO A 61 -12.393 9.849 2.383 1.00 73.31 H new ATOM 0 HG3 PRO A 61 -11.542 11.379 2.325 1.00 73.31 H new ATOM 0 HD2 PRO A 61 -14.259 10.691 1.192 1.00 3.21 H new ATOM 0 HD3 PRO A 61 -13.781 12.106 2.109 1.00 3.21 H new ATOM 831 N CYS A 62 -12.178 11.431 -2.950 1.00 14.15 N ATOM 832 CA CYS A 62 -12.688 11.010 -4.238 1.00 72.31 C ATOM 833 C CYS A 62 -11.689 10.145 -5.042 1.00 43.51 C ATOM 834 O CYS A 62 -10.571 9.833 -4.571 1.00 72.34 O ATOM 835 CB CYS A 62 -13.087 12.255 -5.029 1.00 73.25 C ATOM 836 SG CYS A 62 -11.736 13.440 -5.236 1.00 51.45 S ATOM 0 H CYS A 62 -11.642 12.299 -2.978 1.00 14.15 H new ATOM 0 HA CYS A 62 -13.552 10.369 -4.065 1.00 72.31 H new ATOM 0 HB2 CYS A 62 -13.448 11.952 -6.012 1.00 73.25 H new ATOM 0 HB3 CYS A 62 -13.917 12.747 -4.523 1.00 73.25 H new ATOM 0 HG CYS A 62 -12.058 14.311 -6.146 1.00 51.45 H new ATOM 842 N ILE A 63 -12.120 9.745 -6.247 1.00 34.43 N ATOM 843 CA ILE A 63 -11.330 8.946 -7.178 1.00 73.22 C ATOM 844 C ILE A 63 -11.411 9.597 -8.546 1.00 64.44 C ATOM 845 O ILE A 63 -12.518 9.770 -9.095 1.00 15.51 O ATOM 846 CB ILE A 63 -11.878 7.481 -7.298 1.00 30.52 C ATOM 847 CG1 ILE A 63 -11.854 6.765 -5.949 1.00 51.01 C ATOM 848 CG2 ILE A 63 -11.113 6.665 -8.350 1.00 35.33 C ATOM 849 CD1 ILE A 63 -10.473 6.631 -5.335 1.00 2.40 C ATOM 0 H ILE A 63 -13.047 9.976 -6.603 1.00 34.43 H new ATOM 0 HA ILE A 63 -10.305 8.900 -6.809 1.00 73.22 H new ATOM 0 HB ILE A 63 -12.914 7.561 -7.627 1.00 30.52 H new ATOM 0 HG12 ILE A 63 -12.497 7.305 -5.253 1.00 51.01 H new ATOM 0 HG13 ILE A 63 -12.282 5.770 -6.072 1.00 51.01 H new ATOM 0 HG21 ILE A 63 -11.526 5.657 -8.400 1.00 35.33 H new ATOM 0 HG22 ILE A 63 -11.210 7.145 -9.324 1.00 35.33 H new ATOM 0 HG23 ILE A 63 -10.060 6.613 -8.074 1.00 35.33 H new ATOM 0 HD11 ILE A 63 -10.548 6.111 -4.380 1.00 2.40 H new ATOM 0 HD12 ILE A 63 -9.829 6.064 -6.007 1.00 2.40 H new ATOM 0 HD13 ILE A 63 -10.048 7.622 -5.176 1.00 2.40 H new ATOM 861 N VAL A 64 -10.277 9.974 -9.089 1.00 70.33 N ATOM 862 CA VAL A 64 -10.238 10.604 -10.394 1.00 15.23 C ATOM 863 C VAL A 64 -9.188 9.931 -11.273 1.00 3.14 C ATOM 864 O VAL A 64 -8.206 9.387 -10.762 1.00 72.02 O ATOM 865 CB VAL A 64 -9.962 12.142 -10.315 1.00 53.53 C ATOM 866 CG1 VAL A 64 -11.033 12.846 -9.503 1.00 41.52 C ATOM 867 CG2 VAL A 64 -8.585 12.438 -9.752 1.00 63.43 C ATOM 0 H VAL A 64 -9.365 9.856 -8.648 1.00 70.33 H new ATOM 0 HA VAL A 64 -11.226 10.477 -10.836 1.00 15.23 H new ATOM 0 HB VAL A 64 -9.992 12.528 -11.334 1.00 53.53 H new ATOM 0 HG11 VAL A 64 -10.817 13.914 -9.464 1.00 41.52 H new ATOM 0 HG12 VAL A 64 -12.005 12.689 -9.970 1.00 41.52 H new ATOM 0 HG13 VAL A 64 -11.047 12.441 -8.491 1.00 41.52 H new ATOM 0 HG21 VAL A 64 -8.432 13.516 -9.713 1.00 63.43 H new ATOM 0 HG22 VAL A 64 -8.506 12.024 -8.747 1.00 63.43 H new ATOM 0 HG23 VAL A 64 -7.826 11.986 -10.391 1.00 63.43 H new ATOM 877 N PRO A 65 -9.410 9.908 -12.591 1.00 32.42 N ATOM 878 CA PRO A 65 -8.471 9.317 -13.552 1.00 53.01 C ATOM 879 C PRO A 65 -7.105 10.031 -13.593 1.00 12.51 C ATOM 880 O PRO A 65 -7.019 11.228 -13.883 1.00 41.10 O ATOM 881 CB PRO A 65 -9.194 9.460 -14.900 1.00 14.33 C ATOM 882 CG PRO A 65 -10.203 10.524 -14.685 1.00 74.13 C ATOM 883 CD PRO A 65 -10.613 10.424 -13.255 1.00 42.12 C ATOM 0 HA PRO A 65 -8.230 8.288 -13.284 1.00 53.01 H new ATOM 0 HB2 PRO A 65 -8.498 9.731 -15.694 1.00 14.33 H new ATOM 0 HB3 PRO A 65 -9.666 8.523 -15.196 1.00 14.33 H new ATOM 0 HG2 PRO A 65 -9.785 11.507 -14.902 1.00 74.13 H new ATOM 0 HG3 PRO A 65 -11.059 10.388 -15.346 1.00 74.13 H new ATOM 0 HD2 PRO A 65 -10.909 11.393 -12.853 1.00 42.12 H new ATOM 0 HD3 PRO A 65 -11.462 9.753 -13.127 1.00 42.12 H new ATOM 891 N SER A 66 -6.063 9.291 -13.282 1.00 54.14 N ATOM 892 CA SER A 66 -4.711 9.788 -13.310 1.00 23.02 C ATOM 893 C SER A 66 -3.868 8.869 -14.187 1.00 62.42 C ATOM 894 O SER A 66 -3.900 7.650 -14.016 1.00 11.31 O ATOM 895 CB SER A 66 -4.143 9.845 -11.888 1.00 45.51 C ATOM 896 OG SER A 66 -2.815 10.366 -11.851 1.00 65.31 O ATOM 0 H SER A 66 -6.136 8.314 -12.999 1.00 54.14 H new ATOM 0 HA SER A 66 -4.695 10.797 -13.722 1.00 23.02 H new ATOM 0 HB2 SER A 66 -4.790 10.464 -11.266 1.00 45.51 H new ATOM 0 HB3 SER A 66 -4.149 8.844 -11.457 1.00 45.51 H new ATOM 0 HG SER A 66 -2.550 10.519 -10.920 1.00 65.31 H new ATOM 902 N GLU A 67 -3.112 9.441 -15.099 1.00 71.15 N ATOM 903 CA GLU A 67 -2.274 8.669 -16.016 1.00 41.14 C ATOM 904 C GLU A 67 -1.170 7.959 -15.256 1.00 73.02 C ATOM 905 O GLU A 67 -0.768 6.848 -15.606 1.00 41.32 O ATOM 906 CB GLU A 67 -1.622 9.594 -17.009 1.00 64.14 C ATOM 907 CG GLU A 67 -2.563 10.415 -17.829 1.00 51.54 C ATOM 908 CD GLU A 67 -1.809 11.395 -18.656 1.00 41.42 C ATOM 909 OE1 GLU A 67 -1.338 12.401 -18.096 1.00 73.53 O ATOM 910 OE2 GLU A 67 -1.642 11.162 -19.866 1.00 54.44 O ATOM 0 H GLU A 67 -3.055 10.451 -15.233 1.00 71.15 H new ATOM 0 HA GLU A 67 -2.909 7.941 -16.522 1.00 41.14 H new ATOM 0 HB2 GLU A 67 -0.954 10.266 -16.470 1.00 64.14 H new ATOM 0 HB3 GLU A 67 -1.003 9.000 -17.682 1.00 64.14 H new ATOM 0 HG2 GLU A 67 -3.156 9.766 -18.473 1.00 51.54 H new ATOM 0 HG3 GLU A 67 -3.261 10.940 -17.177 1.00 51.54 H new ATOM 917 N LYS A 68 -0.692 8.607 -14.220 1.00 11.04 N ATOM 918 CA LYS A 68 0.414 8.106 -13.430 1.00 20.14 C ATOM 919 C LYS A 68 -0.071 7.498 -12.121 1.00 1.44 C ATOM 920 O LYS A 68 0.698 7.382 -11.167 1.00 50.54 O ATOM 921 CB LYS A 68 1.457 9.225 -13.125 1.00 1.42 C ATOM 922 CG LYS A 68 2.333 9.707 -14.309 1.00 4.24 C ATOM 923 CD LYS A 68 1.583 10.472 -15.407 1.00 22.21 C ATOM 924 CE LYS A 68 0.999 11.798 -14.903 1.00 65.01 C ATOM 925 NZ LYS A 68 0.408 12.617 -15.999 1.00 62.34 N ATOM 0 H LYS A 68 -1.060 9.502 -13.897 1.00 11.04 H new ATOM 0 HA LYS A 68 0.897 7.331 -14.025 1.00 20.14 H new ATOM 0 HB2 LYS A 68 0.923 10.087 -12.725 1.00 1.42 H new ATOM 0 HB3 LYS A 68 2.119 8.866 -12.337 1.00 1.42 H new ATOM 0 HG2 LYS A 68 3.124 10.347 -13.918 1.00 4.24 H new ATOM 0 HG3 LYS A 68 2.817 8.840 -14.758 1.00 4.24 H new ATOM 0 HD2 LYS A 68 2.262 10.669 -16.237 1.00 22.21 H new ATOM 0 HD3 LYS A 68 0.778 9.848 -15.795 1.00 22.21 H new ATOM 0 HE2 LYS A 68 0.234 11.593 -14.155 1.00 65.01 H new ATOM 0 HE3 LYS A 68 1.783 12.371 -14.408 1.00 65.01 H new ATOM 0 HZ1 LYS A 68 -0.373 13.191 -15.621 1.00 62.34 H new ATOM 0 HZ2 LYS A 68 1.137 13.243 -16.396 1.00 62.34 H new ATOM 0 HZ3 LYS A 68 0.047 11.989 -16.745 1.00 62.34 H new ATOM 939 N GLY A 69 -1.311 7.065 -12.076 1.00 44.32 N ATOM 940 CA GLY A 69 -1.817 6.535 -10.838 1.00 24.32 C ATOM 941 C GLY A 69 -2.532 5.210 -10.977 1.00 44.45 C ATOM 942 O GLY A 69 -2.867 4.768 -12.094 1.00 35.31 O ATOM 0 H GLY A 69 -1.967 7.069 -12.857 1.00 44.32 H new ATOM 0 HA2 GLY A 69 -0.988 6.416 -10.141 1.00 24.32 H new ATOM 0 HA3 GLY A 69 -2.502 7.260 -10.398 1.00 24.32 H new ATOM 946 N GLU A 70 -2.736 4.577 -9.849 1.00 52.22 N ATOM 947 CA GLU A 70 -3.494 3.362 -9.718 1.00 61.45 C ATOM 948 C GLU A 70 -4.085 3.307 -8.315 1.00 44.20 C ATOM 949 O GLU A 70 -3.473 3.788 -7.362 1.00 11.21 O ATOM 950 CB GLU A 70 -2.678 2.074 -10.042 1.00 62.53 C ATOM 951 CG GLU A 70 -1.408 1.826 -9.207 1.00 30.34 C ATOM 952 CD GLU A 70 -0.300 2.809 -9.496 1.00 71.02 C ATOM 953 OE1 GLU A 70 0.329 2.705 -10.561 1.00 53.11 O ATOM 954 OE2 GLU A 70 -0.046 3.709 -8.683 1.00 71.33 O ATOM 0 H GLU A 70 -2.362 4.910 -8.961 1.00 52.22 H new ATOM 0 HA GLU A 70 -4.289 3.383 -10.464 1.00 61.45 H new ATOM 0 HB2 GLU A 70 -3.338 1.215 -9.920 1.00 62.53 H new ATOM 0 HB3 GLU A 70 -2.392 2.109 -11.093 1.00 62.53 H new ATOM 0 HG2 GLU A 70 -1.662 1.877 -8.148 1.00 30.34 H new ATOM 0 HG3 GLU A 70 -1.047 0.816 -9.400 1.00 30.34 H new ATOM 961 N VAL A 71 -5.258 2.752 -8.187 1.00 70.44 N ATOM 962 CA VAL A 71 -5.931 2.689 -6.906 1.00 73.44 C ATOM 963 C VAL A 71 -6.024 1.255 -6.451 1.00 64.44 C ATOM 964 O VAL A 71 -6.510 0.407 -7.173 1.00 0.53 O ATOM 965 CB VAL A 71 -7.378 3.268 -6.988 1.00 31.42 C ATOM 966 CG1 VAL A 71 -8.049 3.275 -5.619 1.00 63.32 C ATOM 967 CG2 VAL A 71 -7.385 4.655 -7.591 1.00 11.11 C ATOM 0 H VAL A 71 -5.777 2.331 -8.958 1.00 70.44 H new ATOM 0 HA VAL A 71 -5.350 3.284 -6.202 1.00 73.44 H new ATOM 0 HB VAL A 71 -7.952 2.613 -7.644 1.00 31.42 H new ATOM 0 HG11 VAL A 71 -9.055 3.684 -5.709 1.00 63.32 H new ATOM 0 HG12 VAL A 71 -8.104 2.256 -5.236 1.00 63.32 H new ATOM 0 HG13 VAL A 71 -7.468 3.890 -4.932 1.00 63.32 H new ATOM 0 HG21 VAL A 71 -8.408 5.028 -7.633 1.00 11.11 H new ATOM 0 HG22 VAL A 71 -6.781 5.322 -6.976 1.00 11.11 H new ATOM 0 HG23 VAL A 71 -6.971 4.616 -8.599 1.00 11.11 H new ATOM 977 N HIS A 72 -5.539 0.981 -5.275 1.00 2.33 N ATOM 978 CA HIS A 72 -5.668 -0.345 -4.711 1.00 65.02 C ATOM 979 C HIS A 72 -6.871 -0.360 -3.813 1.00 44.52 C ATOM 980 O HIS A 72 -6.918 0.372 -2.824 1.00 23.14 O ATOM 981 CB HIS A 72 -4.400 -0.777 -3.940 1.00 24.03 C ATOM 982 CG HIS A 72 -3.185 -0.979 -4.806 1.00 74.32 C ATOM 983 ND1 HIS A 72 -2.547 -2.187 -4.943 1.00 53.31 N ATOM 984 CD2 HIS A 72 -2.480 -0.110 -5.564 1.00 23.12 C ATOM 985 CE1 HIS A 72 -1.513 -2.055 -5.742 1.00 22.00 C ATOM 986 NE2 HIS A 72 -1.450 -0.804 -6.133 1.00 54.11 N ATOM 0 H HIS A 72 -5.050 1.652 -4.683 1.00 2.33 H new ATOM 0 HA HIS A 72 -5.792 -1.063 -5.521 1.00 65.02 H new ATOM 0 HB2 HIS A 72 -4.173 -0.023 -3.187 1.00 24.03 H new ATOM 0 HB3 HIS A 72 -4.611 -1.705 -3.409 1.00 24.03 H new ATOM 0 HD1 HIS A 72 -2.833 -3.056 -4.492 1.00 53.31 H new ATOM 0 HD2 HIS A 72 -2.692 0.941 -5.696 1.00 23.12 H new ATOM 0 HE1 HIS A 72 -0.831 -2.842 -6.028 1.00 22.00 H new ATOM 995 N GLY A 73 -7.837 -1.152 -4.167 1.00 14.22 N ATOM 996 CA GLY A 73 -9.047 -1.216 -3.422 1.00 62.45 C ATOM 997 C GLY A 73 -9.598 -2.604 -3.420 1.00 12.34 C ATOM 998 O GLY A 73 -8.849 -3.576 -3.573 1.00 44.42 O ATOM 0 H GLY A 73 -7.804 -1.769 -4.979 1.00 14.22 H new ATOM 0 HA2 GLY A 73 -8.866 -0.891 -2.398 1.00 62.45 H new ATOM 0 HA3 GLY A 73 -9.779 -0.530 -3.849 1.00 62.45 H new ATOM 1002 N LYS A 74 -10.876 -2.722 -3.289 1.00 33.40 N ATOM 1003 CA LYS A 74 -11.495 -4.014 -3.196 1.00 63.42 C ATOM 1004 C LYS A 74 -12.632 -4.123 -4.187 1.00 12.23 C ATOM 1005 O LYS A 74 -13.328 -3.146 -4.448 1.00 15.32 O ATOM 1006 CB LYS A 74 -12.013 -4.252 -1.765 1.00 33.10 C ATOM 1007 CG LYS A 74 -10.936 -4.225 -0.671 1.00 34.51 C ATOM 1008 CD LYS A 74 -9.891 -5.322 -0.874 1.00 54.31 C ATOM 1009 CE LYS A 74 -8.797 -5.274 0.194 1.00 30.03 C ATOM 1010 NZ LYS A 74 -9.327 -5.479 1.564 1.00 70.11 N ATOM 0 H LYS A 74 -11.523 -1.935 -3.243 1.00 33.40 H new ATOM 0 HA LYS A 74 -10.752 -4.776 -3.432 1.00 63.42 H new ATOM 0 HB2 LYS A 74 -12.762 -3.494 -1.535 1.00 33.10 H new ATOM 0 HB3 LYS A 74 -12.517 -5.218 -1.733 1.00 33.10 H new ATOM 0 HG2 LYS A 74 -10.445 -3.252 -0.669 1.00 34.51 H new ATOM 0 HG3 LYS A 74 -11.406 -4.347 0.305 1.00 34.51 H new ATOM 0 HD2 LYS A 74 -10.379 -6.297 -0.850 1.00 54.31 H new ATOM 0 HD3 LYS A 74 -9.440 -5.215 -1.861 1.00 54.31 H new ATOM 0 HE2 LYS A 74 -8.051 -6.039 -0.021 1.00 30.03 H new ATOM 0 HE3 LYS A 74 -8.289 -4.311 0.145 1.00 30.03 H new ATOM 0 HZ1 LYS A 74 -8.535 -5.589 2.230 1.00 70.11 H new ATOM 0 HZ2 LYS A 74 -9.900 -4.657 1.841 1.00 70.11 H new ATOM 0 HZ3 LYS A 74 -9.918 -6.335 1.583 1.00 70.11 H new ATOM 1024 N VAL A 75 -12.805 -5.289 -4.748 1.00 22.41 N ATOM 1025 CA VAL A 75 -13.899 -5.547 -5.644 1.00 12.14 C ATOM 1026 C VAL A 75 -14.901 -6.480 -5.011 1.00 11.12 C ATOM 1027 O VAL A 75 -14.546 -7.552 -4.530 1.00 42.54 O ATOM 1028 CB VAL A 75 -13.413 -6.144 -6.986 1.00 14.13 C ATOM 1029 CG1 VAL A 75 -14.578 -6.679 -7.805 1.00 31.33 C ATOM 1030 CG2 VAL A 75 -12.663 -5.100 -7.778 1.00 3.41 C ATOM 0 H VAL A 75 -12.190 -6.088 -4.596 1.00 22.41 H new ATOM 0 HA VAL A 75 -14.376 -4.589 -5.848 1.00 12.14 H new ATOM 0 HB VAL A 75 -12.745 -6.975 -6.762 1.00 14.13 H new ATOM 0 HG11 VAL A 75 -14.205 -7.092 -8.742 1.00 31.33 H new ATOM 0 HG12 VAL A 75 -15.090 -7.460 -7.243 1.00 31.33 H new ATOM 0 HG13 VAL A 75 -15.276 -5.869 -8.018 1.00 31.33 H new ATOM 0 HG21 VAL A 75 -12.326 -5.531 -8.721 1.00 3.41 H new ATOM 0 HG22 VAL A 75 -13.321 -4.255 -7.981 1.00 3.41 H new ATOM 0 HG23 VAL A 75 -11.800 -4.759 -7.206 1.00 3.41 H new ATOM 1040 N LEU A 76 -16.138 -6.051 -5.023 1.00 62.21 N ATOM 1041 CA LEU A 76 -17.243 -6.806 -4.510 1.00 2.12 C ATOM 1042 C LEU A 76 -17.884 -7.545 -5.666 1.00 41.24 C ATOM 1043 O LEU A 76 -18.559 -6.937 -6.494 1.00 70.15 O ATOM 1044 CB LEU A 76 -18.291 -5.863 -3.890 1.00 71.11 C ATOM 1045 CG LEU A 76 -17.807 -4.910 -2.795 1.00 53.31 C ATOM 1046 CD1 LEU A 76 -18.953 -4.054 -2.284 1.00 31.10 C ATOM 1047 CD2 LEU A 76 -17.170 -5.678 -1.660 1.00 53.51 C ATOM 0 H LEU A 76 -16.407 -5.142 -5.401 1.00 62.21 H new ATOM 0 HA LEU A 76 -16.889 -7.498 -3.746 1.00 2.12 H new ATOM 0 HB2 LEU A 76 -18.725 -5.265 -4.692 1.00 71.11 H new ATOM 0 HB3 LEU A 76 -19.094 -6.474 -3.477 1.00 71.11 H new ATOM 0 HG LEU A 76 -17.053 -4.251 -3.227 1.00 53.31 H new ATOM 0 HD11 LEU A 76 -18.588 -3.384 -1.506 1.00 31.10 H new ATOM 0 HD12 LEU A 76 -19.363 -3.467 -3.106 1.00 31.10 H new ATOM 0 HD13 LEU A 76 -19.732 -4.696 -1.873 1.00 31.10 H new ATOM 0 HD21 LEU A 76 -16.833 -4.981 -0.893 1.00 53.51 H new ATOM 0 HD22 LEU A 76 -17.899 -6.365 -1.231 1.00 53.51 H new ATOM 0 HD23 LEU A 76 -16.317 -6.243 -2.036 1.00 53.51 H new ATOM 1059 N MET A 77 -17.640 -8.817 -5.750 1.00 64.10 N ATOM 1060 CA MET A 77 -18.211 -9.647 -6.796 1.00 71.21 C ATOM 1061 C MET A 77 -19.168 -10.633 -6.197 1.00 0.05 C ATOM 1062 O MET A 77 -18.983 -11.076 -5.078 1.00 31.44 O ATOM 1063 CB MET A 77 -17.129 -10.330 -7.644 1.00 34.42 C ATOM 1064 CG MET A 77 -16.119 -11.134 -6.870 1.00 32.31 C ATOM 1065 SD MET A 77 -14.878 -11.897 -7.937 1.00 21.02 S ATOM 1066 CE MET A 77 -14.205 -10.456 -8.766 1.00 52.44 C ATOM 0 H MET A 77 -17.039 -9.322 -5.099 1.00 64.10 H new ATOM 0 HA MET A 77 -18.766 -9.006 -7.481 1.00 71.21 H new ATOM 0 HB2 MET A 77 -17.616 -10.986 -8.365 1.00 34.42 H new ATOM 0 HB3 MET A 77 -16.601 -9.566 -8.214 1.00 34.42 H new ATOM 0 HG2 MET A 77 -15.623 -10.488 -6.146 1.00 32.31 H new ATOM 0 HG3 MET A 77 -16.634 -11.910 -6.304 1.00 32.31 H new ATOM 0 HE1 MET A 77 -13.201 -10.680 -9.128 1.00 52.44 H new ATOM 0 HE2 MET A 77 -14.843 -10.190 -9.609 1.00 52.44 H new ATOM 0 HE3 MET A 77 -14.161 -9.621 -8.066 1.00 52.44 H new ATOM 1076 N GLY A 78 -20.190 -10.980 -6.917 1.00 63.21 N ATOM 1077 CA GLY A 78 -21.205 -11.787 -6.340 1.00 31.44 C ATOM 1078 C GLY A 78 -22.303 -10.917 -5.787 1.00 31.32 C ATOM 1079 O GLY A 78 -23.155 -11.377 -5.015 1.00 11.34 O ATOM 0 H GLY A 78 -20.338 -10.718 -7.892 1.00 63.21 H new ATOM 0 HA2 GLY A 78 -21.611 -12.466 -7.090 1.00 31.44 H new ATOM 0 HA3 GLY A 78 -20.783 -12.403 -5.546 1.00 31.44 H new ATOM 1083 N VAL A 79 -22.280 -9.643 -6.170 1.00 54.04 N ATOM 1084 CA VAL A 79 -23.283 -8.711 -5.721 1.00 31.44 C ATOM 1085 C VAL A 79 -24.479 -8.777 -6.663 1.00 10.45 C ATOM 1086 O VAL A 79 -24.318 -8.780 -7.896 1.00 23.41 O ATOM 1087 CB VAL A 79 -22.734 -7.232 -5.586 1.00 31.41 C ATOM 1088 CG1 VAL A 79 -22.358 -6.612 -6.905 1.00 65.21 C ATOM 1089 CG2 VAL A 79 -23.704 -6.352 -4.853 1.00 42.53 C ATOM 0 H VAL A 79 -21.575 -9.243 -6.789 1.00 54.04 H new ATOM 0 HA VAL A 79 -23.590 -9.001 -4.716 1.00 31.44 H new ATOM 0 HB VAL A 79 -21.817 -7.311 -5.002 1.00 31.41 H new ATOM 0 HG11 VAL A 79 -21.990 -5.599 -6.739 1.00 65.21 H new ATOM 0 HG12 VAL A 79 -21.578 -7.209 -7.378 1.00 65.21 H new ATOM 0 HG13 VAL A 79 -23.233 -6.578 -7.554 1.00 65.21 H new ATOM 0 HG21 VAL A 79 -23.296 -5.344 -4.778 1.00 42.53 H new ATOM 0 HG22 VAL A 79 -24.649 -6.321 -5.395 1.00 42.53 H new ATOM 0 HG23 VAL A 79 -23.872 -6.751 -3.853 1.00 42.53 H new ATOM 1099 N THR A 80 -25.647 -8.883 -6.105 1.00 32.23 N ATOM 1100 CA THR A 80 -26.832 -8.985 -6.861 1.00 23.43 C ATOM 1101 C THR A 80 -27.166 -7.611 -7.450 1.00 4.21 C ATOM 1102 O THR A 80 -26.683 -6.583 -6.961 1.00 55.21 O ATOM 1103 CB THR A 80 -27.944 -9.415 -5.920 1.00 75.53 C ATOM 1104 OG1 THR A 80 -27.416 -10.405 -5.027 1.00 55.14 O ATOM 1105 CG2 THR A 80 -29.083 -10.023 -6.680 1.00 24.15 C ATOM 0 H THR A 80 -25.793 -8.900 -5.096 1.00 32.23 H new ATOM 0 HA THR A 80 -26.717 -9.705 -7.671 1.00 23.43 H new ATOM 0 HB THR A 80 -28.309 -8.542 -5.379 1.00 75.53 H new ATOM 0 HG1 THR A 80 -27.199 -9.988 -4.167 1.00 55.14 H new ATOM 0 HG21 THR A 80 -29.866 -10.323 -5.984 1.00 24.15 H new ATOM 0 HG22 THR A 80 -29.483 -9.292 -7.383 1.00 24.15 H new ATOM 0 HG23 THR A 80 -28.730 -10.897 -7.227 1.00 24.15 H new ATOM 1113 N SER A 81 -27.965 -7.601 -8.477 1.00 62.04 N ATOM 1114 CA SER A 81 -28.399 -6.397 -9.138 1.00 43.42 C ATOM 1115 C SER A 81 -29.097 -5.425 -8.161 1.00 71.02 C ATOM 1116 O SER A 81 -28.942 -4.211 -8.272 1.00 54.51 O ATOM 1117 CB SER A 81 -29.313 -6.798 -10.270 1.00 35.43 C ATOM 1118 OG SER A 81 -30.267 -7.732 -9.797 1.00 33.43 O ATOM 0 H SER A 81 -28.345 -8.452 -8.892 1.00 62.04 H new ATOM 0 HA SER A 81 -27.536 -5.858 -9.528 1.00 43.42 H new ATOM 0 HB2 SER A 81 -29.817 -5.920 -10.674 1.00 35.43 H new ATOM 0 HB3 SER A 81 -28.733 -7.234 -11.083 1.00 35.43 H new ATOM 0 HG SER A 81 -30.862 -7.992 -10.531 1.00 33.43 H new ATOM 1124 N ASP A 82 -29.827 -5.977 -7.189 1.00 25.31 N ATOM 1125 CA ASP A 82 -30.515 -5.161 -6.177 1.00 1.32 C ATOM 1126 C ASP A 82 -29.531 -4.429 -5.283 1.00 20.34 C ATOM 1127 O ASP A 82 -29.700 -3.251 -5.016 1.00 73.54 O ATOM 1128 CB ASP A 82 -31.501 -5.981 -5.335 1.00 62.54 C ATOM 1129 CG ASP A 82 -32.692 -6.468 -6.121 1.00 64.34 C ATOM 1130 OD1 ASP A 82 -33.695 -5.724 -6.216 1.00 43.55 O ATOM 1131 OD2 ASP A 82 -32.656 -7.596 -6.658 1.00 32.20 O ATOM 0 H ASP A 82 -29.959 -6.982 -7.079 1.00 25.31 H new ATOM 0 HA ASP A 82 -31.094 -4.419 -6.727 1.00 1.32 H new ATOM 0 HB2 ASP A 82 -30.980 -6.838 -4.909 1.00 62.54 H new ATOM 0 HB3 ASP A 82 -31.849 -5.373 -4.500 1.00 62.54 H new ATOM 1136 N GLU A 83 -28.519 -5.113 -4.807 1.00 65.12 N ATOM 1137 CA GLU A 83 -27.483 -4.465 -4.015 1.00 2.51 C ATOM 1138 C GLU A 83 -26.641 -3.552 -4.916 1.00 73.52 C ATOM 1139 O GLU A 83 -26.151 -2.541 -4.468 1.00 44.32 O ATOM 1140 CB GLU A 83 -26.566 -5.478 -3.285 1.00 2.44 C ATOM 1141 CG GLU A 83 -27.254 -6.476 -2.341 1.00 70.50 C ATOM 1142 CD GLU A 83 -27.857 -7.664 -3.045 1.00 12.14 C ATOM 1143 OE1 GLU A 83 -28.917 -7.539 -3.656 1.00 1.01 O ATOM 1144 OE2 GLU A 83 -27.247 -8.766 -2.999 1.00 12.14 O ATOM 0 H GLU A 83 -28.384 -6.114 -4.949 1.00 65.12 H new ATOM 0 HA GLU A 83 -27.984 -3.877 -3.245 1.00 2.51 H new ATOM 0 HB2 GLU A 83 -26.018 -6.044 -4.038 1.00 2.44 H new ATOM 0 HB3 GLU A 83 -25.830 -4.917 -2.709 1.00 2.44 H new ATOM 0 HG2 GLU A 83 -26.527 -6.830 -1.609 1.00 70.50 H new ATOM 0 HG3 GLU A 83 -28.037 -5.958 -1.788 1.00 70.50 H new ATOM 1151 N LEU A 84 -26.496 -3.922 -6.195 1.00 32.03 N ATOM 1152 CA LEU A 84 -25.778 -3.088 -7.184 1.00 31.33 C ATOM 1153 C LEU A 84 -26.439 -1.719 -7.289 1.00 52.11 C ATOM 1154 O LEU A 84 -25.783 -0.679 -7.157 1.00 23.52 O ATOM 1155 CB LEU A 84 -25.826 -3.746 -8.576 1.00 1.04 C ATOM 1156 CG LEU A 84 -25.218 -2.940 -9.737 1.00 43.43 C ATOM 1157 CD1 LEU A 84 -23.713 -2.836 -9.628 1.00 13.21 C ATOM 1158 CD2 LEU A 84 -25.632 -3.506 -11.076 1.00 50.24 C ATOM 0 H LEU A 84 -26.865 -4.794 -6.575 1.00 32.03 H new ATOM 0 HA LEU A 84 -24.744 -2.987 -6.853 1.00 31.33 H new ATOM 0 HB2 LEU A 84 -25.310 -4.704 -8.519 1.00 1.04 H new ATOM 0 HB3 LEU A 84 -26.867 -3.959 -8.817 1.00 1.04 H new ATOM 0 HG LEU A 84 -25.616 -1.928 -9.665 1.00 43.43 H new ATOM 0 HD11 LEU A 84 -23.326 -2.259 -10.468 1.00 13.21 H new ATOM 0 HD12 LEU A 84 -23.449 -2.339 -8.694 1.00 13.21 H new ATOM 0 HD13 LEU A 84 -23.277 -3.835 -9.643 1.00 13.21 H new ATOM 0 HD21 LEU A 84 -25.186 -2.914 -11.875 1.00 50.24 H new ATOM 0 HD22 LEU A 84 -25.291 -4.538 -11.156 1.00 50.24 H new ATOM 0 HD23 LEU A 84 -26.718 -3.474 -11.164 1.00 50.24 H new ATOM 1170 N GLU A 85 -27.748 -1.733 -7.503 1.00 63.24 N ATOM 1171 CA GLU A 85 -28.520 -0.513 -7.609 1.00 31.14 C ATOM 1172 C GLU A 85 -28.583 0.190 -6.263 1.00 30.11 C ATOM 1173 O GLU A 85 -28.686 1.401 -6.196 1.00 2.24 O ATOM 1174 CB GLU A 85 -29.921 -0.770 -8.193 1.00 14.34 C ATOM 1175 CG GLU A 85 -30.782 -1.719 -7.406 1.00 11.43 C ATOM 1176 CD GLU A 85 -32.133 -1.910 -8.030 1.00 24.12 C ATOM 1177 OE1 GLU A 85 -32.252 -2.671 -9.008 1.00 64.13 O ATOM 1178 OE2 GLU A 85 -33.102 -1.286 -7.570 1.00 51.13 O ATOM 0 H GLU A 85 -28.297 -2.587 -7.607 1.00 63.24 H new ATOM 0 HA GLU A 85 -28.014 0.150 -8.311 1.00 31.14 H new ATOM 0 HB2 GLU A 85 -30.442 0.184 -8.276 1.00 14.34 H new ATOM 0 HB3 GLU A 85 -29.809 -1.161 -9.204 1.00 14.34 H new ATOM 0 HG2 GLU A 85 -30.280 -2.683 -7.329 1.00 11.43 H new ATOM 0 HG3 GLU A 85 -30.903 -1.340 -6.391 1.00 11.43 H new ATOM 1185 N ASN A 86 -28.505 -0.600 -5.202 1.00 50.11 N ATOM 1186 CA ASN A 86 -28.498 -0.112 -3.825 1.00 12.40 C ATOM 1187 C ASN A 86 -27.216 0.696 -3.598 1.00 54.33 C ATOM 1188 O ASN A 86 -27.254 1.790 -3.064 1.00 21.32 O ATOM 1189 CB ASN A 86 -28.566 -1.337 -2.874 1.00 14.23 C ATOM 1190 CG ASN A 86 -28.628 -1.073 -1.373 1.00 1.02 C ATOM 1191 OD1 ASN A 86 -29.261 -1.829 -0.632 1.00 3.05 O ATOM 1192 ND2 ASN A 86 -27.966 -0.083 -0.908 1.00 22.31 N ATOM 0 H ASN A 86 -28.444 -1.616 -5.272 1.00 50.11 H new ATOM 0 HA ASN A 86 -29.353 0.535 -3.628 1.00 12.40 H new ATOM 0 HB2 ASN A 86 -29.443 -1.924 -3.147 1.00 14.23 H new ATOM 0 HB3 ASN A 86 -27.693 -1.960 -3.068 1.00 14.23 H new ATOM 0 HD21 ASN A 86 -27.954 0.096 0.096 1.00 22.31 H new ATOM 0 HD22 ASN A 86 -27.450 0.528 -1.541 1.00 22.31 H new ATOM 1199 N LEU A 87 -26.094 0.138 -4.012 1.00 31.40 N ATOM 1200 CA LEU A 87 -24.787 0.802 -3.919 1.00 12.54 C ATOM 1201 C LEU A 87 -24.822 2.074 -4.738 1.00 62.35 C ATOM 1202 O LEU A 87 -24.425 3.150 -4.278 1.00 74.01 O ATOM 1203 CB LEU A 87 -23.682 -0.115 -4.469 1.00 55.33 C ATOM 1204 CG LEU A 87 -23.436 -1.433 -3.735 1.00 71.32 C ATOM 1205 CD1 LEU A 87 -22.430 -2.278 -4.503 1.00 3.32 C ATOM 1206 CD2 LEU A 87 -22.922 -1.171 -2.333 1.00 32.13 C ATOM 0 H LEU A 87 -26.053 -0.793 -4.426 1.00 31.40 H new ATOM 0 HA LEU A 87 -24.576 1.028 -2.874 1.00 12.54 H new ATOM 0 HB2 LEU A 87 -23.921 -0.346 -5.507 1.00 55.33 H new ATOM 0 HB3 LEU A 87 -22.748 0.448 -4.475 1.00 55.33 H new ATOM 0 HG LEU A 87 -24.380 -1.973 -3.667 1.00 71.32 H new ATOM 0 HD11 LEU A 87 -22.261 -3.215 -3.972 1.00 3.32 H new ATOM 0 HD12 LEU A 87 -22.818 -2.490 -5.499 1.00 3.32 H new ATOM 0 HD13 LEU A 87 -21.489 -1.735 -4.589 1.00 3.32 H new ATOM 0 HD21 LEU A 87 -22.752 -2.120 -1.824 1.00 32.13 H new ATOM 0 HD22 LEU A 87 -21.986 -0.615 -2.387 1.00 32.13 H new ATOM 0 HD23 LEU A 87 -23.658 -0.589 -1.778 1.00 32.13 H new ATOM 1218 N ASP A 88 -25.346 1.935 -5.941 1.00 2.22 N ATOM 1219 CA ASP A 88 -25.482 3.028 -6.890 1.00 32.12 C ATOM 1220 C ASP A 88 -26.405 4.117 -6.348 1.00 73.32 C ATOM 1221 O ASP A 88 -26.252 5.279 -6.654 1.00 75.21 O ATOM 1222 CB ASP A 88 -26.002 2.479 -8.219 1.00 23.20 C ATOM 1223 CG ASP A 88 -26.174 3.528 -9.282 1.00 62.31 C ATOM 1224 OD1 ASP A 88 -25.182 3.900 -9.929 1.00 11.32 O ATOM 1225 OD2 ASP A 88 -27.314 3.961 -9.521 1.00 12.01 O ATOM 0 H ASP A 88 -25.696 1.044 -6.294 1.00 2.22 H new ATOM 0 HA ASP A 88 -24.505 3.484 -7.049 1.00 32.12 H new ATOM 0 HB2 ASP A 88 -25.312 1.717 -8.582 1.00 23.20 H new ATOM 0 HB3 ASP A 88 -26.960 1.987 -8.049 1.00 23.20 H new ATOM 1230 N ALA A 89 -27.347 3.719 -5.532 1.00 61.34 N ATOM 1231 CA ALA A 89 -28.270 4.639 -4.902 1.00 64.42 C ATOM 1232 C ALA A 89 -27.588 5.402 -3.768 1.00 2.54 C ATOM 1233 O ALA A 89 -27.803 6.602 -3.597 1.00 12.24 O ATOM 1234 CB ALA A 89 -29.473 3.877 -4.368 1.00 41.31 C ATOM 0 H ALA A 89 -27.499 2.742 -5.282 1.00 61.34 H new ATOM 0 HA ALA A 89 -28.602 5.361 -5.648 1.00 64.42 H new ATOM 0 HB1 ALA A 89 -30.165 4.574 -3.895 1.00 41.31 H new ATOM 0 HB2 ALA A 89 -29.976 3.369 -5.191 1.00 41.31 H new ATOM 0 HB3 ALA A 89 -29.142 3.141 -3.635 1.00 41.31 H new ATOM 1240 N VAL A 90 -26.767 4.706 -3.001 1.00 3.25 N ATOM 1241 CA VAL A 90 -26.079 5.300 -1.852 1.00 71.40 C ATOM 1242 C VAL A 90 -24.936 6.260 -2.281 1.00 73.32 C ATOM 1243 O VAL A 90 -24.840 7.388 -1.784 1.00 72.40 O ATOM 1244 CB VAL A 90 -25.556 4.210 -0.857 1.00 15.20 C ATOM 1245 CG1 VAL A 90 -24.865 4.845 0.338 1.00 0.41 C ATOM 1246 CG2 VAL A 90 -26.702 3.318 -0.381 1.00 53.01 C ATOM 0 H VAL A 90 -26.555 3.719 -3.150 1.00 3.25 H new ATOM 0 HA VAL A 90 -26.822 5.899 -1.326 1.00 71.40 H new ATOM 0 HB VAL A 90 -24.830 3.598 -1.391 1.00 15.20 H new ATOM 0 HG11 VAL A 90 -24.512 4.064 1.012 1.00 0.41 H new ATOM 0 HG12 VAL A 90 -24.017 5.439 -0.005 1.00 0.41 H new ATOM 0 HG13 VAL A 90 -25.569 5.489 0.866 1.00 0.41 H new ATOM 0 HG21 VAL A 90 -26.316 2.568 0.309 1.00 53.01 H new ATOM 0 HG22 VAL A 90 -27.451 3.927 0.126 1.00 53.01 H new ATOM 0 HG23 VAL A 90 -27.157 2.822 -1.238 1.00 53.01 H new ATOM 1256 N GLU A 91 -24.083 5.807 -3.171 1.00 45.31 N ATOM 1257 CA GLU A 91 -22.968 6.626 -3.680 1.00 2.20 C ATOM 1258 C GLU A 91 -23.413 7.638 -4.785 1.00 4.34 C ATOM 1259 O GLU A 91 -22.827 8.720 -4.937 1.00 21.21 O ATOM 1260 CB GLU A 91 -21.859 5.712 -4.223 1.00 42.23 C ATOM 1261 CG GLU A 91 -21.283 4.727 -3.197 1.00 22.12 C ATOM 1262 CD GLU A 91 -20.560 5.405 -2.047 1.00 41.31 C ATOM 1263 OE1 GLU A 91 -21.218 5.840 -1.082 1.00 3.01 O ATOM 1264 OE2 GLU A 91 -19.315 5.506 -2.096 1.00 15.50 O ATOM 0 H GLU A 91 -24.128 4.869 -3.570 1.00 45.31 H new ATOM 0 HA GLU A 91 -22.594 7.215 -2.843 1.00 2.20 H new ATOM 0 HB2 GLU A 91 -22.253 5.147 -5.068 1.00 42.23 H new ATOM 0 HB3 GLU A 91 -21.049 6.333 -4.605 1.00 42.23 H new ATOM 0 HG2 GLU A 91 -22.092 4.116 -2.797 1.00 22.12 H new ATOM 0 HG3 GLU A 91 -20.593 4.051 -3.702 1.00 22.12 H new ATOM 1271 N GLY A 92 -24.469 7.273 -5.502 1.00 33.03 N ATOM 1272 CA GLY A 92 -24.904 7.949 -6.746 1.00 50.41 C ATOM 1273 C GLY A 92 -25.214 9.450 -6.723 1.00 52.00 C ATOM 1274 O GLY A 92 -25.205 10.081 -7.779 1.00 53.30 O ATOM 0 H GLY A 92 -25.065 6.488 -5.242 1.00 33.03 H new ATOM 0 HA2 GLY A 92 -24.127 7.788 -7.494 1.00 50.41 H new ATOM 0 HA3 GLY A 92 -25.799 7.437 -7.100 1.00 50.41 H new ATOM 1278 N ASN A 93 -25.502 10.031 -5.587 1.00 71.02 N ATOM 1279 CA ASN A 93 -25.816 11.468 -5.576 1.00 55.52 C ATOM 1280 C ASN A 93 -24.624 12.353 -5.831 1.00 3.23 C ATOM 1281 O ASN A 93 -24.749 13.392 -6.483 1.00 53.44 O ATOM 1282 CB ASN A 93 -26.617 11.938 -4.352 1.00 65.34 C ATOM 1283 CG ASN A 93 -28.120 11.716 -4.492 1.00 22.54 C ATOM 1284 OD1 ASN A 93 -28.836 12.584 -4.987 1.00 1.22 O ATOM 1285 ND2 ASN A 93 -28.608 10.601 -4.049 1.00 30.22 N ATOM 0 H ASN A 93 -25.530 9.567 -4.679 1.00 71.02 H new ATOM 0 HA ASN A 93 -26.483 11.583 -6.431 1.00 55.52 H new ATOM 0 HB2 ASN A 93 -26.260 11.410 -3.468 1.00 65.34 H new ATOM 0 HB3 ASN A 93 -26.427 12.999 -4.188 1.00 65.34 H new ATOM 0 HD21 ASN A 93 -29.611 10.425 -4.106 1.00 30.22 H new ATOM 0 HD22 ASN A 93 -27.989 9.899 -3.643 1.00 30.22 H new ATOM 1292 N GLU A 94 -23.468 11.966 -5.349 1.00 40.23 N ATOM 1293 CA GLU A 94 -22.286 12.784 -5.561 1.00 63.33 C ATOM 1294 C GLU A 94 -21.184 12.047 -6.315 1.00 51.54 C ATOM 1295 O GLU A 94 -20.134 12.610 -6.591 1.00 23.32 O ATOM 1296 CB GLU A 94 -21.788 13.402 -4.248 1.00 63.25 C ATOM 1297 CG GLU A 94 -22.818 14.337 -3.621 1.00 12.30 C ATOM 1298 CD GLU A 94 -22.359 14.978 -2.342 1.00 14.44 C ATOM 1299 OE1 GLU A 94 -22.549 14.370 -1.270 1.00 13.23 O ATOM 1300 OE2 GLU A 94 -21.820 16.113 -2.385 1.00 21.03 O ATOM 0 H GLU A 94 -23.315 11.109 -4.817 1.00 40.23 H new ATOM 0 HA GLU A 94 -22.585 13.607 -6.210 1.00 63.33 H new ATOM 0 HB2 GLU A 94 -21.546 12.606 -3.543 1.00 63.25 H new ATOM 0 HB3 GLU A 94 -20.866 13.953 -4.435 1.00 63.25 H new ATOM 0 HG2 GLU A 94 -23.069 15.119 -4.338 1.00 12.30 H new ATOM 0 HG3 GLU A 94 -23.733 13.777 -3.427 1.00 12.30 H new ATOM 1307 N TYR A 95 -21.441 10.802 -6.664 1.00 40.35 N ATOM 1308 CA TYR A 95 -20.505 9.993 -7.433 1.00 53.31 C ATOM 1309 C TYR A 95 -21.219 9.345 -8.609 1.00 75.11 C ATOM 1310 O TYR A 95 -22.444 9.229 -8.602 1.00 31.42 O ATOM 1311 CB TYR A 95 -19.815 8.930 -6.558 1.00 12.43 C ATOM 1312 CG TYR A 95 -18.790 9.479 -5.574 1.00 23.30 C ATOM 1313 CD1 TYR A 95 -19.164 10.035 -4.347 1.00 4.24 C ATOM 1314 CD2 TYR A 95 -17.435 9.432 -5.881 1.00 33.33 C ATOM 1315 CE1 TYR A 95 -18.209 10.525 -3.466 1.00 51.11 C ATOM 1316 CE2 TYR A 95 -16.484 9.919 -5.008 1.00 52.43 C ATOM 1317 CZ TYR A 95 -16.873 10.461 -3.806 1.00 0.05 C ATOM 1318 OH TYR A 95 -15.919 10.941 -2.942 1.00 40.14 O ATOM 0 H TYR A 95 -22.306 10.318 -6.424 1.00 40.35 H new ATOM 0 HA TYR A 95 -19.724 10.652 -7.812 1.00 53.31 H new ATOM 0 HB2 TYR A 95 -20.578 8.387 -6.001 1.00 12.43 H new ATOM 0 HB3 TYR A 95 -19.322 8.208 -7.209 1.00 12.43 H new ATOM 0 HD1 TYR A 95 -20.210 10.084 -4.081 1.00 4.24 H new ATOM 0 HD2 TYR A 95 -17.120 9.006 -6.822 1.00 33.33 H new ATOM 0 HE1 TYR A 95 -18.510 10.953 -2.521 1.00 51.11 H new ATOM 0 HE2 TYR A 95 -15.437 9.875 -5.268 1.00 52.43 H new ATOM 0 HH TYR A 95 -15.413 11.658 -3.379 1.00 40.14 H new ATOM 1328 N GLU A 96 -20.468 8.947 -9.616 1.00 54.53 N ATOM 1329 CA GLU A 96 -21.039 8.323 -10.793 1.00 30.11 C ATOM 1330 C GLU A 96 -20.424 6.955 -11.023 1.00 22.11 C ATOM 1331 O GLU A 96 -19.217 6.775 -10.883 1.00 61.41 O ATOM 1332 CB GLU A 96 -20.830 9.236 -12.013 1.00 2.24 C ATOM 1333 CG GLU A 96 -21.314 8.671 -13.338 1.00 71.41 C ATOM 1334 CD GLU A 96 -21.214 9.673 -14.464 1.00 22.15 C ATOM 1335 OE1 GLU A 96 -20.116 9.854 -15.044 1.00 24.24 O ATOM 1336 OE2 GLU A 96 -22.252 10.285 -14.800 1.00 31.13 O ATOM 0 H GLU A 96 -19.453 9.046 -9.642 1.00 54.53 H new ATOM 0 HA GLU A 96 -22.109 8.183 -10.641 1.00 30.11 H new ATOM 0 HB2 GLU A 96 -21.342 10.181 -11.831 1.00 2.24 H new ATOM 0 HB3 GLU A 96 -19.767 9.461 -12.100 1.00 2.24 H new ATOM 0 HG2 GLU A 96 -20.727 7.787 -13.589 1.00 71.41 H new ATOM 0 HG3 GLU A 96 -22.350 8.347 -13.235 1.00 71.41 H new ATOM 1343 N ARG A 97 -21.261 6.001 -11.357 1.00 54.12 N ATOM 1344 CA ARG A 97 -20.833 4.644 -11.584 1.00 44.53 C ATOM 1345 C ARG A 97 -20.402 4.452 -13.031 1.00 14.23 C ATOM 1346 O ARG A 97 -21.206 4.553 -13.959 1.00 64.14 O ATOM 1347 CB ARG A 97 -21.953 3.663 -11.177 1.00 12.11 C ATOM 1348 CG ARG A 97 -21.709 2.207 -11.542 1.00 53.44 C ATOM 1349 CD ARG A 97 -22.808 1.297 -10.991 1.00 54.42 C ATOM 1350 NE ARG A 97 -24.170 1.778 -11.308 1.00 14.32 N ATOM 1351 CZ ARG A 97 -25.178 1.034 -11.801 1.00 50.21 C ATOM 1352 NH1 ARG A 97 -24.968 -0.217 -12.192 1.00 53.32 N ATOM 1353 NH2 ARG A 97 -26.384 1.561 -11.927 1.00 24.34 N ATOM 0 H ARG A 97 -22.263 6.147 -11.479 1.00 54.12 H new ATOM 0 HA ARG A 97 -19.964 4.432 -10.961 1.00 44.53 H new ATOM 0 HB2 ARG A 97 -22.098 3.730 -10.099 1.00 12.11 H new ATOM 0 HB3 ARG A 97 -22.883 3.986 -11.644 1.00 12.11 H new ATOM 0 HG2 ARG A 97 -21.662 2.106 -12.626 1.00 53.44 H new ATOM 0 HG3 ARG A 97 -20.743 1.890 -11.150 1.00 53.44 H new ATOM 0 HD2 ARG A 97 -22.679 0.294 -11.398 1.00 54.42 H new ATOM 0 HD3 ARG A 97 -22.699 1.219 -9.909 1.00 54.42 H new ATOM 0 HE ARG A 97 -24.364 2.765 -11.137 1.00 14.32 H new ATOM 0 HH11 ARG A 97 -24.035 -0.624 -12.120 1.00 53.32 H new ATOM 0 HH12 ARG A 97 -25.739 -0.771 -12.564 1.00 53.32 H new ATOM 0 HH21 ARG A 97 -26.549 2.529 -11.651 1.00 24.34 H new ATOM 0 HH22 ARG A 97 -27.149 1.000 -12.300 1.00 24.34 H new ATOM 1367 N VAL A 98 -19.133 4.184 -13.211 1.00 30.15 N ATOM 1368 CA VAL A 98 -18.550 4.023 -14.524 1.00 54.32 C ATOM 1369 C VAL A 98 -17.916 2.658 -14.691 1.00 52.12 C ATOM 1370 O VAL A 98 -17.622 1.974 -13.705 1.00 63.24 O ATOM 1371 CB VAL A 98 -17.529 5.133 -14.866 1.00 75.01 C ATOM 1372 CG1 VAL A 98 -18.219 6.486 -14.890 1.00 51.43 C ATOM 1373 CG2 VAL A 98 -16.373 5.140 -13.867 1.00 74.24 C ATOM 0 H VAL A 98 -18.468 4.070 -12.446 1.00 30.15 H new ATOM 0 HA VAL A 98 -19.376 4.111 -15.229 1.00 54.32 H new ATOM 0 HB VAL A 98 -17.117 4.929 -15.854 1.00 75.01 H new ATOM 0 HG11 VAL A 98 -17.492 7.261 -15.132 1.00 51.43 H new ATOM 0 HG12 VAL A 98 -19.006 6.480 -15.644 1.00 51.43 H new ATOM 0 HG13 VAL A 98 -18.655 6.690 -13.912 1.00 51.43 H new ATOM 0 HG21 VAL A 98 -15.669 5.930 -14.130 1.00 74.24 H new ATOM 0 HG22 VAL A 98 -16.760 5.318 -12.864 1.00 74.24 H new ATOM 0 HG23 VAL A 98 -15.864 4.177 -13.893 1.00 74.24 H new ATOM 1383 N THR A 99 -17.712 2.276 -15.919 1.00 2.50 N ATOM 1384 CA THR A 99 -17.178 0.990 -16.265 1.00 74.42 C ATOM 1385 C THR A 99 -15.655 1.048 -16.403 1.00 23.52 C ATOM 1386 O THR A 99 -15.126 1.842 -17.178 1.00 30.33 O ATOM 1387 CB THR A 99 -17.841 0.506 -17.564 1.00 60.25 C ATOM 1388 OG1 THR A 99 -17.905 1.590 -18.515 1.00 72.42 O ATOM 1389 CG2 THR A 99 -19.237 -0.036 -17.306 1.00 62.21 C ATOM 0 H THR A 99 -17.917 2.864 -16.727 1.00 2.50 H new ATOM 0 HA THR A 99 -17.398 0.279 -15.468 1.00 74.42 H new ATOM 0 HB THR A 99 -17.234 -0.303 -17.971 1.00 60.25 H new ATOM 0 HG1 THR A 99 -17.065 2.094 -18.493 1.00 72.42 H new ATOM 0 HG21 THR A 99 -19.677 -0.370 -18.246 1.00 62.21 H new ATOM 0 HG22 THR A 99 -19.179 -0.876 -16.614 1.00 62.21 H new ATOM 0 HG23 THR A 99 -19.858 0.749 -16.873 1.00 62.21 H new ATOM 1397 N VAL A 100 -14.956 0.221 -15.637 1.00 23.13 N ATOM 1398 CA VAL A 100 -13.479 0.257 -15.602 1.00 35.14 C ATOM 1399 C VAL A 100 -12.848 -1.145 -15.558 1.00 12.33 C ATOM 1400 O VAL A 100 -13.542 -2.155 -15.423 1.00 61.30 O ATOM 1401 CB VAL A 100 -12.947 1.072 -14.389 1.00 53.31 C ATOM 1402 CG1 VAL A 100 -13.342 2.539 -14.483 1.00 10.35 C ATOM 1403 CG2 VAL A 100 -13.443 0.468 -13.083 1.00 12.33 C ATOM 0 H VAL A 100 -15.375 -0.484 -15.030 1.00 23.13 H new ATOM 0 HA VAL A 100 -13.186 0.745 -16.532 1.00 35.14 H new ATOM 0 HB VAL A 100 -11.858 1.022 -14.408 1.00 53.31 H new ATOM 0 HG11 VAL A 100 -12.953 3.077 -13.618 1.00 10.35 H new ATOM 0 HG12 VAL A 100 -12.928 2.970 -15.395 1.00 10.35 H new ATOM 0 HG13 VAL A 100 -14.429 2.623 -14.503 1.00 10.35 H new ATOM 0 HG21 VAL A 100 -13.061 1.051 -12.245 1.00 12.33 H new ATOM 0 HG22 VAL A 100 -14.533 0.480 -13.067 1.00 12.33 H new ATOM 0 HG23 VAL A 100 -13.091 -0.560 -13.001 1.00 12.33 H new ATOM 1413 N GLY A 101 -11.530 -1.187 -15.683 1.00 74.32 N ATOM 1414 CA GLY A 101 -10.796 -2.432 -15.599 1.00 23.03 C ATOM 1415 C GLY A 101 -9.859 -2.437 -14.403 1.00 33.40 C ATOM 1416 O GLY A 101 -9.180 -1.441 -14.142 1.00 24.04 O ATOM 0 H GLY A 101 -10.947 -0.365 -15.844 1.00 74.32 H new ATOM 0 HA2 GLY A 101 -11.495 -3.265 -15.520 1.00 23.03 H new ATOM 0 HA3 GLY A 101 -10.223 -2.582 -16.514 1.00 23.03 H new ATOM 1420 N ILE A 102 -9.824 -3.539 -13.684 1.00 31.45 N ATOM 1421 CA ILE A 102 -9.005 -3.690 -12.486 1.00 4.34 C ATOM 1422 C ILE A 102 -8.131 -4.917 -12.570 1.00 62.51 C ATOM 1423 O ILE A 102 -8.387 -5.796 -13.358 1.00 2.42 O ATOM 1424 CB ILE A 102 -9.875 -3.718 -11.173 1.00 32.43 C ATOM 1425 CG1 ILE A 102 -11.016 -4.773 -11.197 1.00 61.24 C ATOM 1426 CG2 ILE A 102 -10.448 -2.366 -10.881 1.00 64.35 C ATOM 1427 CD1 ILE A 102 -10.630 -6.222 -10.977 1.00 53.21 C ATOM 0 H ILE A 102 -10.369 -4.370 -13.913 1.00 31.45 H new ATOM 0 HA ILE A 102 -8.361 -2.812 -12.434 1.00 4.34 H new ATOM 0 HB ILE A 102 -9.189 -4.012 -10.379 1.00 32.43 H new ATOM 0 HG12 ILE A 102 -11.745 -4.499 -10.434 1.00 61.24 H new ATOM 0 HG13 ILE A 102 -11.521 -4.701 -12.160 1.00 61.24 H new ATOM 0 HG21 ILE A 102 -11.044 -2.413 -9.970 1.00 64.35 H new ATOM 0 HG22 ILE A 102 -9.638 -1.649 -10.749 1.00 64.35 H new ATOM 0 HG23 ILE A 102 -11.079 -2.051 -11.712 1.00 64.35 H new ATOM 0 HD11 ILE A 102 -11.522 -6.847 -11.019 1.00 53.21 H new ATOM 0 HD12 ILE A 102 -9.931 -6.534 -11.753 1.00 53.21 H new ATOM 0 HD13 ILE A 102 -10.158 -6.329 -10.000 1.00 53.21 H new ATOM 1439 N VAL A 103 -7.105 -4.964 -11.774 1.00 61.42 N ATOM 1440 CA VAL A 103 -6.233 -6.117 -11.731 1.00 63.11 C ATOM 1441 C VAL A 103 -6.293 -6.745 -10.349 1.00 55.44 C ATOM 1442 O VAL A 103 -6.167 -6.052 -9.347 1.00 73.40 O ATOM 1443 CB VAL A 103 -4.771 -5.752 -12.086 1.00 5.13 C ATOM 1444 CG1 VAL A 103 -3.881 -6.990 -12.103 1.00 4.02 C ATOM 1445 CG2 VAL A 103 -4.701 -5.018 -13.418 1.00 65.34 C ATOM 0 H VAL A 103 -6.843 -4.212 -11.136 1.00 61.42 H new ATOM 0 HA VAL A 103 -6.580 -6.830 -12.479 1.00 63.11 H new ATOM 0 HB VAL A 103 -4.399 -5.083 -11.310 1.00 5.13 H new ATOM 0 HG11 VAL A 103 -2.861 -6.701 -12.355 1.00 4.02 H new ATOM 0 HG12 VAL A 103 -3.892 -7.460 -11.120 1.00 4.02 H new ATOM 0 HG13 VAL A 103 -4.253 -7.695 -12.846 1.00 4.02 H new ATOM 0 HG21 VAL A 103 -3.663 -4.773 -13.644 1.00 65.34 H new ATOM 0 HG22 VAL A 103 -5.104 -5.655 -14.206 1.00 65.34 H new ATOM 0 HG23 VAL A 103 -5.286 -4.100 -13.359 1.00 65.34 H new ATOM 1455 N ARG A 104 -6.504 -8.039 -10.307 1.00 62.01 N ATOM 1456 CA ARG A 104 -6.616 -8.776 -9.065 1.00 31.13 C ATOM 1457 C ARG A 104 -5.254 -8.918 -8.416 1.00 2.20 C ATOM 1458 O ARG A 104 -4.358 -9.567 -8.962 1.00 42.55 O ATOM 1459 CB ARG A 104 -7.196 -10.171 -9.314 1.00 41.25 C ATOM 1460 CG ARG A 104 -8.541 -10.174 -10.004 1.00 24.41 C ATOM 1461 CD ARG A 104 -9.043 -11.591 -10.268 1.00 12.02 C ATOM 1462 NE ARG A 104 -9.286 -12.354 -9.032 1.00 43.43 N ATOM 1463 CZ ARG A 104 -10.357 -13.165 -8.844 1.00 40.40 C ATOM 1464 NH1 ARG A 104 -11.233 -13.359 -9.822 1.00 2.41 N ATOM 1465 NH2 ARG A 104 -10.533 -13.792 -7.688 1.00 72.24 N ATOM 0 H ARG A 104 -6.604 -8.618 -11.141 1.00 62.01 H new ATOM 0 HA ARG A 104 -7.283 -8.222 -8.404 1.00 31.13 H new ATOM 0 HB2 ARG A 104 -6.490 -10.742 -9.917 1.00 41.25 H new ATOM 0 HB3 ARG A 104 -7.290 -10.688 -8.359 1.00 41.25 H new ATOM 0 HG2 ARG A 104 -9.266 -9.641 -9.389 1.00 24.41 H new ATOM 0 HG3 ARG A 104 -8.466 -9.634 -10.948 1.00 24.41 H new ATOM 0 HD2 ARG A 104 -9.966 -11.542 -10.846 1.00 12.02 H new ATOM 0 HD3 ARG A 104 -8.312 -12.122 -10.879 1.00 12.02 H new ATOM 0 HE ARG A 104 -8.610 -12.268 -8.273 1.00 43.43 H new ATOM 0 HH11 ARG A 104 -11.103 -12.897 -10.722 1.00 2.41 H new ATOM 0 HH12 ARG A 104 -12.036 -13.970 -9.674 1.00 2.41 H new ATOM 0 HH21 ARG A 104 -9.860 -13.666 -6.932 1.00 72.24 H new ATOM 0 HH22 ARG A 104 -11.341 -14.400 -7.555 1.00 72.24 H new ATOM 1479 N GLU A 105 -5.116 -8.336 -7.254 1.00 65.24 N ATOM 1480 CA GLU A 105 -3.886 -8.380 -6.492 1.00 5.31 C ATOM 1481 C GLU A 105 -3.703 -9.751 -5.884 1.00 0.45 C ATOM 1482 O GLU A 105 -2.593 -10.138 -5.531 1.00 60.54 O ATOM 1483 CB GLU A 105 -3.916 -7.344 -5.377 1.00 43.20 C ATOM 1484 CG GLU A 105 -4.075 -5.925 -5.850 1.00 5.15 C ATOM 1485 CD GLU A 105 -4.213 -4.955 -4.708 1.00 25.14 C ATOM 1486 OE1 GLU A 105 -3.195 -4.576 -4.102 1.00 72.14 O ATOM 1487 OE2 GLU A 105 -5.323 -4.539 -4.415 1.00 35.32 O ATOM 0 H GLU A 105 -5.862 -7.810 -6.800 1.00 65.24 H new ATOM 0 HA GLU A 105 -3.057 -8.162 -7.166 1.00 5.31 H new ATOM 0 HB2 GLU A 105 -4.736 -7.582 -4.699 1.00 43.20 H new ATOM 0 HB3 GLU A 105 -2.994 -7.421 -4.801 1.00 43.20 H new ATOM 0 HG2 GLU A 105 -3.213 -5.648 -6.457 1.00 5.15 H new ATOM 0 HG3 GLU A 105 -4.953 -5.854 -6.492 1.00 5.15 H new ATOM 1494 N ASP A 106 -4.799 -10.496 -5.768 1.00 53.41 N ATOM 1495 CA ASP A 106 -4.746 -11.819 -5.173 1.00 21.31 C ATOM 1496 C ASP A 106 -4.110 -12.838 -6.088 1.00 41.31 C ATOM 1497 O ASP A 106 -3.725 -13.918 -5.644 1.00 33.43 O ATOM 1498 CB ASP A 106 -6.105 -12.300 -4.642 1.00 61.22 C ATOM 1499 CG ASP A 106 -6.562 -11.546 -3.407 1.00 53.42 C ATOM 1500 OD1 ASP A 106 -6.008 -11.783 -2.317 1.00 25.44 O ATOM 1501 OD2 ASP A 106 -7.501 -10.727 -3.491 1.00 73.43 O ATOM 0 H ASP A 106 -5.726 -10.205 -6.077 1.00 53.41 H new ATOM 0 HA ASP A 106 -4.097 -11.720 -4.303 1.00 21.31 H new ATOM 0 HB2 ASP A 106 -6.854 -12.190 -5.426 1.00 61.22 H new ATOM 0 HB3 ASP A 106 -6.042 -13.363 -4.409 1.00 61.22 H new ATOM 1506 N ASN A 107 -4.006 -12.517 -7.368 1.00 24.51 N ATOM 1507 CA ASN A 107 -3.294 -13.383 -8.280 1.00 54.13 C ATOM 1508 C ASN A 107 -2.424 -12.568 -9.249 1.00 64.54 C ATOM 1509 O ASN A 107 -1.257 -12.342 -8.954 1.00 1.12 O ATOM 1510 CB ASN A 107 -4.202 -14.463 -8.986 1.00 15.25 C ATOM 1511 CG ASN A 107 -5.222 -13.934 -9.996 1.00 13.13 C ATOM 1512 OD1 ASN A 107 -5.679 -12.803 -9.918 1.00 11.33 O ATOM 1513 ND2 ASN A 107 -5.573 -14.751 -10.948 1.00 21.12 N ATOM 0 H ASN A 107 -4.400 -11.676 -7.789 1.00 24.51 H new ATOM 0 HA ASN A 107 -2.616 -13.985 -7.675 1.00 54.13 H new ATOM 0 HB2 ASN A 107 -3.553 -15.175 -9.496 1.00 15.25 H new ATOM 0 HB3 ASN A 107 -4.739 -15.016 -8.215 1.00 15.25 H new ATOM 0 HD21 ASN A 107 -6.246 -14.452 -11.654 1.00 21.12 H new ATOM 0 HD22 ASN A 107 -5.175 -15.689 -10.988 1.00 21.12 H new ATOM 1520 N SER A 108 -3.019 -12.066 -10.343 1.00 53.12 N ATOM 1521 CA SER A 108 -2.332 -11.298 -11.421 1.00 0.14 C ATOM 1522 C SER A 108 -3.309 -10.931 -12.551 1.00 0.43 C ATOM 1523 O SER A 108 -2.989 -10.104 -13.407 1.00 62.40 O ATOM 1524 CB SER A 108 -1.163 -12.088 -12.077 1.00 23.23 C ATOM 1525 OG SER A 108 -0.074 -12.331 -11.191 1.00 10.11 O ATOM 0 H SER A 108 -4.018 -12.180 -10.517 1.00 53.12 H new ATOM 0 HA SER A 108 -1.941 -10.408 -10.929 1.00 0.14 H new ATOM 0 HB2 SER A 108 -1.541 -13.042 -12.445 1.00 23.23 H new ATOM 0 HB3 SER A 108 -0.800 -11.533 -12.942 1.00 23.23 H new ATOM 0 HG SER A 108 -0.302 -12.005 -10.295 1.00 10.11 H new ATOM 1531 N GLU A 109 -4.480 -11.551 -12.563 1.00 43.45 N ATOM 1532 CA GLU A 109 -5.419 -11.369 -13.663 1.00 51.03 C ATOM 1533 C GLU A 109 -6.174 -10.072 -13.587 1.00 12.15 C ATOM 1534 O GLU A 109 -6.436 -9.556 -12.510 1.00 64.42 O ATOM 1535 CB GLU A 109 -6.373 -12.536 -13.754 1.00 2.45 C ATOM 1536 CG GLU A 109 -5.680 -13.837 -14.072 1.00 14.30 C ATOM 1537 CD GLU A 109 -4.955 -13.773 -15.391 1.00 44.32 C ATOM 1538 OE1 GLU A 109 -5.594 -14.002 -16.432 1.00 62.53 O ATOM 1539 OE2 GLU A 109 -3.744 -13.485 -15.407 1.00 22.21 O ATOM 0 H GLU A 109 -4.802 -12.181 -11.829 1.00 43.45 H new ATOM 0 HA GLU A 109 -4.820 -11.327 -14.573 1.00 51.03 H new ATOM 0 HB2 GLU A 109 -6.908 -12.636 -12.809 1.00 2.45 H new ATOM 0 HB3 GLU A 109 -7.119 -12.330 -14.522 1.00 2.45 H new ATOM 0 HG2 GLU A 109 -4.972 -14.076 -13.279 1.00 14.30 H new ATOM 0 HG3 GLU A 109 -6.413 -14.643 -14.098 1.00 14.30 H new ATOM 1546 N LYS A 110 -6.519 -9.554 -14.734 1.00 64.25 N ATOM 1547 CA LYS A 110 -7.246 -8.323 -14.817 1.00 12.05 C ATOM 1548 C LYS A 110 -8.706 -8.596 -15.147 1.00 74.40 C ATOM 1549 O LYS A 110 -9.028 -9.554 -15.853 1.00 22.15 O ATOM 1550 CB LYS A 110 -6.606 -7.365 -15.828 1.00 34.02 C ATOM 1551 CG LYS A 110 -6.552 -7.878 -17.247 1.00 51.31 C ATOM 1552 CD LYS A 110 -5.842 -6.886 -18.137 1.00 15.33 C ATOM 1553 CE LYS A 110 -5.784 -7.361 -19.571 1.00 61.43 C ATOM 1554 NZ LYS A 110 -5.086 -6.390 -20.441 1.00 53.25 N ATOM 0 H LYS A 110 -6.302 -9.976 -15.637 1.00 64.25 H new ATOM 0 HA LYS A 110 -7.205 -7.831 -13.845 1.00 12.05 H new ATOM 0 HB2 LYS A 110 -7.160 -6.426 -15.818 1.00 34.02 H new ATOM 0 HB3 LYS A 110 -5.591 -7.140 -15.500 1.00 34.02 H new ATOM 0 HG2 LYS A 110 -6.034 -8.837 -17.275 1.00 51.31 H new ATOM 0 HG3 LYS A 110 -7.563 -8.050 -17.617 1.00 51.31 H new ATOM 0 HD2 LYS A 110 -6.355 -5.925 -18.093 1.00 15.33 H new ATOM 0 HD3 LYS A 110 -4.830 -6.724 -17.766 1.00 15.33 H new ATOM 0 HE2 LYS A 110 -5.273 -8.323 -19.615 1.00 61.43 H new ATOM 0 HE3 LYS A 110 -6.796 -7.521 -19.943 1.00 61.43 H new ATOM 0 HZ1 LYS A 110 -5.066 -6.750 -21.417 1.00 53.25 H new ATOM 0 HZ2 LYS A 110 -5.588 -5.480 -20.418 1.00 53.25 H new ATOM 0 HZ3 LYS A 110 -4.112 -6.257 -20.101 1.00 53.25 H new ATOM 1568 N MET A 111 -9.565 -7.771 -14.635 1.00 73.31 N ATOM 1569 CA MET A 111 -11.001 -7.935 -14.762 1.00 23.42 C ATOM 1570 C MET A 111 -11.693 -6.647 -15.016 1.00 51.25 C ATOM 1571 O MET A 111 -11.158 -5.579 -14.782 1.00 55.52 O ATOM 1572 CB MET A 111 -11.612 -8.541 -13.519 1.00 22.50 C ATOM 1573 CG MET A 111 -11.198 -9.948 -13.245 1.00 22.24 C ATOM 1574 SD MET A 111 -11.951 -10.609 -11.755 1.00 30.15 S ATOM 1575 CE MET A 111 -13.667 -10.488 -12.213 1.00 33.24 C ATOM 0 H MET A 111 -9.294 -6.944 -14.104 1.00 73.31 H new ATOM 0 HA MET A 111 -11.138 -8.603 -15.612 1.00 23.42 H new ATOM 0 HB2 MET A 111 -11.345 -7.924 -12.661 1.00 22.50 H new ATOM 0 HB3 MET A 111 -12.698 -8.507 -13.610 1.00 22.50 H new ATOM 0 HG2 MET A 111 -11.469 -10.575 -14.094 1.00 22.24 H new ATOM 0 HG3 MET A 111 -10.113 -9.992 -13.150 1.00 22.24 H new ATOM 0 HE1 MET A 111 -14.251 -11.197 -11.626 1.00 33.24 H new ATOM 0 HE2 MET A 111 -14.024 -9.476 -12.021 1.00 33.24 H new ATOM 0 HE3 MET A 111 -13.778 -10.717 -13.273 1.00 33.24 H new ATOM 1585 N ALA A 112 -12.878 -6.768 -15.484 1.00 55.32 N ATOM 1586 CA ALA A 112 -13.727 -5.638 -15.751 1.00 64.35 C ATOM 1587 C ALA A 112 -14.720 -5.473 -14.611 1.00 5.25 C ATOM 1588 O ALA A 112 -15.372 -6.442 -14.195 1.00 22.04 O ATOM 1589 CB ALA A 112 -14.457 -5.816 -17.064 1.00 23.00 C ATOM 0 H ALA A 112 -13.307 -7.668 -15.701 1.00 55.32 H new ATOM 0 HA ALA A 112 -13.112 -4.741 -15.827 1.00 64.35 H new ATOM 0 HB1 ALA A 112 -15.094 -4.950 -17.247 1.00 23.00 H new ATOM 0 HB2 ALA A 112 -13.733 -5.911 -17.873 1.00 23.00 H new ATOM 0 HB3 ALA A 112 -15.071 -6.715 -17.020 1.00 23.00 H new ATOM 1595 N VAL A 113 -14.827 -4.266 -14.110 1.00 74.04 N ATOM 1596 CA VAL A 113 -15.698 -3.938 -12.989 1.00 42.41 C ATOM 1597 C VAL A 113 -16.294 -2.571 -13.192 1.00 73.42 C ATOM 1598 O VAL A 113 -16.009 -1.901 -14.188 1.00 34.33 O ATOM 1599 CB VAL A 113 -14.960 -3.924 -11.616 1.00 24.10 C ATOM 1600 CG1 VAL A 113 -14.396 -5.274 -11.262 1.00 11.23 C ATOM 1601 CG2 VAL A 113 -13.876 -2.866 -11.603 1.00 1.50 C ATOM 0 H VAL A 113 -14.306 -3.466 -14.470 1.00 74.04 H new ATOM 0 HA VAL A 113 -16.459 -4.718 -12.963 1.00 42.41 H new ATOM 0 HB VAL A 113 -15.698 -3.676 -10.854 1.00 24.10 H new ATOM 0 HG11 VAL A 113 -13.891 -5.216 -10.298 1.00 11.23 H new ATOM 0 HG12 VAL A 113 -15.205 -6.003 -11.205 1.00 11.23 H new ATOM 0 HG13 VAL A 113 -13.683 -5.582 -12.027 1.00 11.23 H new ATOM 0 HG21 VAL A 113 -13.373 -2.872 -10.636 1.00 1.50 H new ATOM 0 HG22 VAL A 113 -13.152 -3.077 -12.390 1.00 1.50 H new ATOM 0 HG23 VAL A 113 -14.322 -1.886 -11.773 1.00 1.50 H new ATOM 1611 N LYS A 114 -17.155 -2.182 -12.312 1.00 0.42 N ATOM 1612 CA LYS A 114 -17.657 -0.844 -12.329 1.00 33.01 C ATOM 1613 C LYS A 114 -17.220 -0.158 -11.051 1.00 62.14 C ATOM 1614 O LYS A 114 -17.120 -0.803 -10.018 1.00 13.35 O ATOM 1615 CB LYS A 114 -19.171 -0.827 -12.480 1.00 32.43 C ATOM 1616 CG LYS A 114 -19.653 -1.638 -13.668 1.00 12.41 C ATOM 1617 CD LYS A 114 -21.108 -1.409 -13.944 1.00 4.44 C ATOM 1618 CE LYS A 114 -21.608 -2.326 -15.050 1.00 1.03 C ATOM 1619 NZ LYS A 114 -23.001 -2.026 -15.457 1.00 43.35 N ATOM 0 H LYS A 114 -17.528 -2.772 -11.568 1.00 0.42 H new ATOM 0 HA LYS A 114 -17.254 -0.308 -13.188 1.00 33.01 H new ATOM 0 HB2 LYS A 114 -19.627 -1.218 -11.570 1.00 32.43 H new ATOM 0 HB3 LYS A 114 -19.509 0.204 -12.588 1.00 32.43 H new ATOM 0 HG2 LYS A 114 -19.070 -1.373 -14.550 1.00 12.41 H new ATOM 0 HG3 LYS A 114 -19.481 -2.698 -13.479 1.00 12.41 H new ATOM 0 HD2 LYS A 114 -21.685 -1.582 -13.036 1.00 4.44 H new ATOM 0 HD3 LYS A 114 -21.268 -0.369 -14.230 1.00 4.44 H new ATOM 0 HE2 LYS A 114 -20.953 -2.234 -15.916 1.00 1.03 H new ATOM 0 HE3 LYS A 114 -21.547 -3.361 -14.713 1.00 1.03 H new ATOM 0 HZ1 LYS A 114 -23.290 -2.680 -16.212 1.00 43.35 H new ATOM 0 HZ2 LYS A 114 -23.634 -2.140 -14.639 1.00 43.35 H new ATOM 0 HZ3 LYS A 114 -23.058 -1.048 -15.805 1.00 43.35 H new ATOM 1633 N THR A 115 -16.933 1.111 -11.115 1.00 41.41 N ATOM 1634 CA THR A 115 -16.486 1.840 -9.944 1.00 0.10 C ATOM 1635 C THR A 115 -17.199 3.178 -9.888 1.00 24.51 C ATOM 1636 O THR A 115 -17.905 3.557 -10.828 1.00 32.10 O ATOM 1637 CB THR A 115 -14.937 2.084 -9.952 1.00 20.42 C ATOM 1638 OG1 THR A 115 -14.513 2.619 -8.684 1.00 4.44 O ATOM 1639 CG2 THR A 115 -14.561 3.088 -11.028 1.00 62.43 C ATOM 0 H THR A 115 -16.998 1.671 -11.965 1.00 41.41 H new ATOM 0 HA THR A 115 -16.723 1.236 -9.068 1.00 0.10 H new ATOM 0 HB THR A 115 -14.451 1.128 -10.145 1.00 20.42 H new ATOM 0 HG1 THR A 115 -14.816 2.029 -7.962 1.00 4.44 H new ATOM 0 HG21 THR A 115 -13.482 3.245 -11.018 1.00 62.43 H new ATOM 0 HG22 THR A 115 -14.864 2.707 -12.003 1.00 62.43 H new ATOM 0 HG23 THR A 115 -15.067 4.034 -10.835 1.00 62.43 H new ATOM 1647 N TYR A 116 -17.020 3.875 -8.807 1.00 10.43 N ATOM 1648 CA TYR A 116 -17.597 5.169 -8.630 1.00 62.05 C ATOM 1649 C TYR A 116 -16.534 6.220 -8.812 1.00 73.03 C ATOM 1650 O TYR A 116 -15.535 6.252 -8.090 1.00 55.10 O ATOM 1651 CB TYR A 116 -18.272 5.265 -7.273 1.00 13.33 C ATOM 1652 CG TYR A 116 -19.370 4.251 -7.135 1.00 51.21 C ATOM 1653 CD1 TYR A 116 -20.664 4.549 -7.525 1.00 63.32 C ATOM 1654 CD2 TYR A 116 -19.104 2.984 -6.645 1.00 63.30 C ATOM 1655 CE1 TYR A 116 -21.665 3.613 -7.428 1.00 74.41 C ATOM 1656 CE2 TYR A 116 -20.101 2.040 -6.539 1.00 1.52 C ATOM 1657 CZ TYR A 116 -21.381 2.360 -6.932 1.00 5.42 C ATOM 1658 OH TYR A 116 -22.374 1.421 -6.850 1.00 2.12 O ATOM 0 H TYR A 116 -16.462 3.556 -8.015 1.00 10.43 H new ATOM 0 HA TYR A 116 -18.368 5.337 -9.382 1.00 62.05 H new ATOM 0 HB2 TYR A 116 -17.533 5.113 -6.486 1.00 13.33 H new ATOM 0 HB3 TYR A 116 -18.680 6.267 -7.138 1.00 13.33 H new ATOM 0 HD1 TYR A 116 -20.890 5.532 -7.911 1.00 63.32 H new ATOM 0 HD2 TYR A 116 -18.099 2.732 -6.341 1.00 63.30 H new ATOM 0 HE1 TYR A 116 -22.670 3.859 -7.739 1.00 74.41 H new ATOM 0 HE2 TYR A 116 -19.881 1.057 -6.151 1.00 1.52 H new ATOM 0 HH TYR A 116 -21.977 0.536 -6.713 1.00 2.12 H new ATOM 1668 N MET A 117 -16.741 7.045 -9.788 1.00 0.02 N ATOM 1669 CA MET A 117 -15.820 8.076 -10.150 1.00 1.14 C ATOM 1670 C MET A 117 -16.428 9.435 -9.836 1.00 12.31 C ATOM 1671 O MET A 117 -17.657 9.594 -9.862 1.00 41.42 O ATOM 1672 CB MET A 117 -15.482 7.951 -11.652 1.00 13.14 C ATOM 1673 CG MET A 117 -14.526 9.006 -12.188 1.00 62.23 C ATOM 1674 SD MET A 117 -14.055 8.740 -13.917 1.00 64.04 S ATOM 1675 CE MET A 117 -15.648 8.765 -14.726 1.00 63.02 C ATOM 0 H MET A 117 -17.577 7.020 -10.371 1.00 0.02 H new ATOM 0 HA MET A 117 -14.898 7.975 -9.577 1.00 1.14 H new ATOM 0 HB2 MET A 117 -15.049 6.967 -11.831 1.00 13.14 H new ATOM 0 HB3 MET A 117 -16.409 8.000 -12.223 1.00 13.14 H new ATOM 0 HG2 MET A 117 -14.990 9.988 -12.093 1.00 62.23 H new ATOM 0 HG3 MET A 117 -13.627 9.017 -11.572 1.00 62.23 H new ATOM 0 HE1 MET A 117 -15.721 7.921 -15.411 1.00 63.02 H new ATOM 0 HE2 MET A 117 -16.437 8.695 -13.978 1.00 63.02 H new ATOM 0 HE3 MET A 117 -15.758 9.695 -15.283 1.00 63.02 H new ATOM 1685 N TRP A 118 -15.581 10.381 -9.503 1.00 24.34 N ATOM 1686 CA TRP A 118 -16.001 11.732 -9.214 1.00 65.51 C ATOM 1687 C TRP A 118 -16.370 12.400 -10.541 1.00 44.21 C ATOM 1688 O TRP A 118 -15.604 12.314 -11.505 1.00 51.24 O ATOM 1689 CB TRP A 118 -14.844 12.449 -8.514 1.00 23.20 C ATOM 1690 CG TRP A 118 -15.177 13.792 -7.975 1.00 42.42 C ATOM 1691 CD1 TRP A 118 -14.682 14.983 -8.378 1.00 72.43 C ATOM 1692 CD2 TRP A 118 -16.091 14.073 -6.928 1.00 44.31 C ATOM 1693 NE1 TRP A 118 -15.230 15.994 -7.639 1.00 12.34 N ATOM 1694 CE2 TRP A 118 -16.099 15.459 -6.744 1.00 33.12 C ATOM 1695 CE3 TRP A 118 -16.903 13.283 -6.130 1.00 1.25 C ATOM 1696 CZ2 TRP A 118 -16.885 16.073 -5.790 1.00 23.52 C ATOM 1697 CZ3 TRP A 118 -17.685 13.887 -5.186 1.00 63.25 C ATOM 1698 CH2 TRP A 118 -17.677 15.268 -5.020 1.00 53.12 C ATOM 0 H TRP A 118 -14.575 10.234 -9.425 1.00 24.34 H new ATOM 0 HA TRP A 118 -16.870 11.765 -8.557 1.00 65.51 H new ATOM 0 HB2 TRP A 118 -14.489 11.823 -7.696 1.00 23.20 H new ATOM 0 HB3 TRP A 118 -14.019 12.550 -9.219 1.00 23.20 H new ATOM 0 HD1 TRP A 118 -13.959 15.117 -9.169 1.00 72.43 H new ATOM 0 HE1 TRP A 118 -15.020 16.987 -7.743 1.00 12.34 H new ATOM 0 HE3 TRP A 118 -16.918 12.210 -6.252 1.00 1.25 H new ATOM 0 HZ2 TRP A 118 -16.875 17.145 -5.657 1.00 23.52 H new ATOM 0 HZ3 TRP A 118 -18.321 13.281 -4.557 1.00 63.25 H new ATOM 0 HH2 TRP A 118 -18.310 15.714 -4.267 1.00 53.12 H new ATOM 1709 N ILE A 119 -17.540 13.031 -10.604 1.00 31.11 N ATOM 1710 CA ILE A 119 -18.031 13.537 -11.893 1.00 12.35 C ATOM 1711 C ILE A 119 -17.253 14.776 -12.334 1.00 55.30 C ATOM 1712 O ILE A 119 -16.831 14.883 -13.495 1.00 43.30 O ATOM 1713 CB ILE A 119 -19.575 13.877 -11.922 1.00 15.44 C ATOM 1714 CG1 ILE A 119 -20.467 12.716 -11.448 1.00 24.52 C ATOM 1715 CG2 ILE A 119 -19.986 14.229 -13.330 1.00 64.31 C ATOM 1716 CD1 ILE A 119 -20.434 12.431 -9.967 1.00 73.53 C ATOM 0 H ILE A 119 -18.153 13.203 -9.807 1.00 31.11 H new ATOM 0 HA ILE A 119 -17.870 12.710 -12.585 1.00 12.35 H new ATOM 0 HB ILE A 119 -19.716 14.711 -11.234 1.00 15.44 H new ATOM 0 HG12 ILE A 119 -21.496 12.931 -11.735 1.00 24.52 H new ATOM 0 HG13 ILE A 119 -20.170 11.812 -11.980 1.00 24.52 H new ATOM 0 HG21 ILE A 119 -21.050 14.463 -13.351 1.00 64.31 H new ATOM 0 HG22 ILE A 119 -19.417 15.095 -13.669 1.00 64.31 H new ATOM 0 HG23 ILE A 119 -19.788 13.384 -13.989 1.00 64.31 H new ATOM 0 HD11 ILE A 119 -21.097 11.596 -9.742 1.00 73.53 H new ATOM 0 HD12 ILE A 119 -19.417 12.177 -9.668 1.00 73.53 H new ATOM 0 HD13 ILE A 119 -20.764 13.314 -9.419 1.00 73.53 H new ATOM 1728 N ASN A 120 -17.019 15.676 -11.412 1.00 53.54 N ATOM 1729 CA ASN A 120 -16.268 16.886 -11.703 1.00 21.05 C ATOM 1730 C ASN A 120 -14.816 16.627 -11.363 1.00 74.01 C ATOM 1731 O ASN A 120 -14.249 17.156 -10.415 1.00 41.12 O ATOM 1732 CB ASN A 120 -16.880 18.124 -10.984 1.00 34.43 C ATOM 1733 CG ASN A 120 -16.125 19.438 -11.208 1.00 61.02 C ATOM 1734 OD1 ASN A 120 -16.343 20.148 -12.200 1.00 52.13 O ATOM 1735 ND2 ASN A 120 -15.295 19.798 -10.278 1.00 42.13 N ATOM 0 H ASN A 120 -17.337 15.599 -10.446 1.00 53.54 H new ATOM 0 HA ASN A 120 -16.327 17.135 -12.763 1.00 21.05 H new ATOM 0 HB2 ASN A 120 -17.909 18.251 -11.322 1.00 34.43 H new ATOM 0 HB3 ASN A 120 -16.919 17.922 -9.914 1.00 34.43 H new ATOM 0 HD21 ASN A 120 -14.801 20.687 -10.352 1.00 42.13 H new ATOM 0 HD22 ASN A 120 -15.137 19.192 -9.473 1.00 42.13 H new ATOM 1742 N LYS A 121 -14.245 15.758 -12.150 1.00 31.23 N ATOM 1743 CA LYS A 121 -12.934 15.189 -11.922 1.00 32.01 C ATOM 1744 C LYS A 121 -11.780 16.071 -12.372 1.00 42.33 C ATOM 1745 O LYS A 121 -10.649 15.610 -12.493 1.00 23.32 O ATOM 1746 CB LYS A 121 -12.883 13.773 -12.518 1.00 1.10 C ATOM 1747 CG LYS A 121 -13.332 13.661 -13.970 1.00 63.55 C ATOM 1748 CD LYS A 121 -13.416 12.201 -14.392 1.00 54.34 C ATOM 1749 CE LYS A 121 -13.917 12.023 -15.820 1.00 11.44 C ATOM 1750 NZ LYS A 121 -15.264 12.598 -16.016 1.00 1.32 N ATOM 0 H LYS A 121 -14.690 15.410 -12.999 1.00 31.23 H new ATOM 0 HA LYS A 121 -12.788 15.122 -10.844 1.00 32.01 H new ATOM 0 HB2 LYS A 121 -11.861 13.401 -12.441 1.00 1.10 H new ATOM 0 HB3 LYS A 121 -13.507 13.118 -11.910 1.00 1.10 H new ATOM 0 HG2 LYS A 121 -14.304 14.138 -14.094 1.00 63.55 H new ATOM 0 HG3 LYS A 121 -12.632 14.192 -14.615 1.00 63.55 H new ATOM 0 HD2 LYS A 121 -12.431 11.744 -14.299 1.00 54.34 H new ATOM 0 HD3 LYS A 121 -14.080 11.669 -13.711 1.00 54.34 H new ATOM 0 HE2 LYS A 121 -13.218 12.496 -16.510 1.00 11.44 H new ATOM 0 HE3 LYS A 121 -13.938 10.961 -16.066 1.00 11.44 H new ATOM 0 HZ1 LYS A 121 -15.647 12.281 -16.929 1.00 1.32 H new ATOM 0 HZ2 LYS A 121 -15.891 12.282 -15.249 1.00 1.32 H new ATOM 0 HZ3 LYS A 121 -15.203 13.636 -16.008 1.00 1.32 H new ATOM 1764 N ALA A 122 -12.052 17.334 -12.577 1.00 14.02 N ATOM 1765 CA ALA A 122 -11.015 18.292 -12.888 1.00 33.33 C ATOM 1766 C ALA A 122 -11.027 19.407 -11.843 1.00 34.30 C ATOM 1767 O ALA A 122 -10.494 20.498 -12.066 1.00 34.12 O ATOM 1768 CB ALA A 122 -11.185 18.848 -14.297 1.00 32.54 C ATOM 0 H ALA A 122 -12.992 17.729 -12.534 1.00 14.02 H new ATOM 0 HA ALA A 122 -10.047 17.792 -12.859 1.00 33.33 H new ATOM 0 HB1 ALA A 122 -10.391 19.566 -14.503 1.00 32.54 H new ATOM 0 HB2 ALA A 122 -11.133 18.033 -15.019 1.00 32.54 H new ATOM 0 HB3 ALA A 122 -12.152 19.344 -14.378 1.00 32.54 H new ATOM 1774 N ASP A 123 -11.633 19.112 -10.691 1.00 14.14 N ATOM 1775 CA ASP A 123 -11.712 20.059 -9.569 1.00 40.42 C ATOM 1776 C ASP A 123 -10.311 20.361 -9.006 1.00 14.24 C ATOM 1777 O ASP A 123 -9.561 19.446 -8.671 1.00 3.00 O ATOM 1778 CB ASP A 123 -12.610 19.494 -8.451 1.00 44.14 C ATOM 1779 CG ASP A 123 -12.719 20.421 -7.267 1.00 33.13 C ATOM 1780 OD1 ASP A 123 -11.845 20.384 -6.402 1.00 4.50 O ATOM 1781 OD2 ASP A 123 -13.695 21.218 -7.200 1.00 62.14 O ATOM 0 H ASP A 123 -12.082 18.215 -10.507 1.00 14.14 H new ATOM 0 HA ASP A 123 -12.146 20.987 -9.942 1.00 40.42 H new ATOM 0 HB2 ASP A 123 -13.606 19.305 -8.852 1.00 44.14 H new ATOM 0 HB3 ASP A 123 -12.211 18.535 -8.121 1.00 44.14 H new ATOM 1786 N PRO A 124 -9.939 21.645 -8.899 1.00 31.55 N ATOM 1787 CA PRO A 124 -8.622 22.038 -8.418 1.00 33.04 C ATOM 1788 C PRO A 124 -8.571 22.297 -6.892 1.00 33.43 C ATOM 1789 O PRO A 124 -7.621 22.911 -6.386 1.00 21.10 O ATOM 1790 CB PRO A 124 -8.386 23.335 -9.180 1.00 33.14 C ATOM 1791 CG PRO A 124 -9.747 23.960 -9.278 1.00 32.25 C ATOM 1792 CD PRO A 124 -10.749 22.823 -9.272 1.00 32.50 C ATOM 0 HA PRO A 124 -7.877 21.259 -8.579 1.00 33.04 H new ATOM 0 HB2 PRO A 124 -7.687 23.984 -8.653 1.00 33.14 H new ATOM 0 HB3 PRO A 124 -7.963 23.146 -10.167 1.00 33.14 H new ATOM 0 HG2 PRO A 124 -9.924 24.636 -8.441 1.00 32.25 H new ATOM 0 HG3 PRO A 124 -9.837 24.551 -10.190 1.00 32.25 H new ATOM 0 HD2 PRO A 124 -11.552 23.000 -8.556 1.00 32.50 H new ATOM 0 HD3 PRO A 124 -11.216 22.695 -10.249 1.00 32.50 H new ATOM 1800 N ASP A 125 -9.562 21.830 -6.172 1.00 43.23 N ATOM 1801 CA ASP A 125 -9.631 22.061 -4.732 1.00 12.42 C ATOM 1802 C ASP A 125 -9.479 20.750 -3.963 1.00 33.15 C ATOM 1803 O ASP A 125 -8.878 20.713 -2.882 1.00 73.41 O ATOM 1804 CB ASP A 125 -10.963 22.731 -4.389 1.00 34.22 C ATOM 1805 CG ASP A 125 -11.109 23.094 -2.932 1.00 14.22 C ATOM 1806 OD1 ASP A 125 -11.599 22.279 -2.148 1.00 2.21 O ATOM 1807 OD2 ASP A 125 -10.741 24.237 -2.560 1.00 13.22 O ATOM 0 H ASP A 125 -10.337 21.286 -6.551 1.00 43.23 H new ATOM 0 HA ASP A 125 -8.811 22.717 -4.439 1.00 12.42 H new ATOM 0 HB2 ASP A 125 -11.070 23.634 -4.990 1.00 34.22 H new ATOM 0 HB3 ASP A 125 -11.777 22.063 -4.670 1.00 34.22 H new ATOM 1812 N MET A 126 -9.976 19.668 -4.553 1.00 44.42 N ATOM 1813 CA MET A 126 -9.978 18.319 -3.938 1.00 13.33 C ATOM 1814 C MET A 126 -8.575 17.683 -3.834 1.00 11.20 C ATOM 1815 O MET A 126 -8.464 16.484 -3.568 1.00 10.42 O ATOM 1816 CB MET A 126 -10.886 17.388 -4.745 1.00 52.02 C ATOM 1817 CG MET A 126 -10.432 17.241 -6.177 1.00 21.54 C ATOM 1818 SD MET A 126 -11.480 16.184 -7.173 1.00 5.13 S ATOM 1819 CE MET A 126 -10.642 16.379 -8.729 1.00 63.11 C ATOM 0 H MET A 126 -10.396 19.689 -5.482 1.00 44.42 H new ATOM 0 HA MET A 126 -10.347 18.447 -2.920 1.00 13.33 H new ATOM 0 HB2 MET A 126 -10.909 16.407 -4.271 1.00 52.02 H new ATOM 0 HB3 MET A 126 -11.905 17.774 -4.728 1.00 52.02 H new ATOM 0 HG2 MET A 126 -10.389 18.229 -6.636 1.00 21.54 H new ATOM 0 HG3 MET A 126 -9.418 16.841 -6.186 1.00 21.54 H new ATOM 0 HE1 MET A 126 -11.308 16.085 -9.540 1.00 63.11 H new ATOM 0 HE2 MET A 126 -10.351 17.422 -8.857 1.00 63.11 H new ATOM 0 HE3 MET A 126 -9.752 15.750 -8.744 1.00 63.11 H new ATOM 2066 N LYS A 140 9.162 4.174 -6.569 1.00 23.05 N ATOM 2067 CA LYS A 140 9.475 4.542 -7.940 1.00 44.33 C ATOM 2068 C LYS A 140 10.950 4.292 -8.225 1.00 4.30 C ATOM 2069 O LYS A 140 11.324 3.876 -9.326 1.00 1.20 O ATOM 2070 CB LYS A 140 9.178 6.042 -8.118 1.00 1.03 C ATOM 2071 CG LYS A 140 9.256 6.578 -9.532 1.00 24.45 C ATOM 2072 CD LYS A 140 8.134 6.031 -10.392 1.00 21.04 C ATOM 2073 CE LYS A 140 8.205 6.583 -11.796 1.00 44.02 C ATOM 2074 NZ LYS A 140 7.070 6.133 -12.616 1.00 4.15 N ATOM 0 HA LYS A 140 8.875 3.945 -8.626 1.00 44.33 H new ATOM 0 HB2 LYS A 140 8.179 6.241 -7.731 1.00 1.03 H new ATOM 0 HB3 LYS A 140 9.877 6.605 -7.500 1.00 1.03 H new ATOM 0 HG2 LYS A 140 9.205 7.667 -9.514 1.00 24.45 H new ATOM 0 HG3 LYS A 140 10.217 6.311 -9.972 1.00 24.45 H new ATOM 0 HD2 LYS A 140 8.193 4.943 -10.423 1.00 21.04 H new ATOM 0 HD3 LYS A 140 7.173 6.286 -9.946 1.00 21.04 H new ATOM 0 HE2 LYS A 140 8.217 7.672 -11.758 1.00 44.02 H new ATOM 0 HE3 LYS A 140 9.138 6.269 -12.263 1.00 44.02 H new ATOM 0 HZ1 LYS A 140 7.153 6.532 -13.573 1.00 4.15 H new ATOM 0 HZ2 LYS A 140 7.073 5.095 -12.673 1.00 4.15 H new ATOM 0 HZ3 LYS A 140 6.180 6.454 -12.183 1.00 4.15 H new ATOM 2088 N LYS A 141 11.773 4.511 -7.201 1.00 45.41 N ATOM 2089 CA LYS A 141 13.227 4.432 -7.309 1.00 50.33 C ATOM 2090 C LYS A 141 13.755 3.117 -7.885 1.00 33.41 C ATOM 2091 O LYS A 141 14.791 3.123 -8.554 1.00 22.30 O ATOM 2092 CB LYS A 141 13.925 4.790 -5.996 1.00 44.31 C ATOM 2093 CG LYS A 141 13.682 6.226 -5.531 1.00 60.11 C ATOM 2094 CD LYS A 141 14.083 7.233 -6.612 1.00 1.15 C ATOM 2095 CE LYS A 141 13.964 8.675 -6.132 1.00 11.22 C ATOM 2096 NZ LYS A 141 14.900 8.986 -5.031 1.00 71.24 N ATOM 0 H LYS A 141 11.445 4.750 -6.265 1.00 45.41 H new ATOM 0 HA LYS A 141 13.485 5.191 -8.047 1.00 50.33 H new ATOM 0 HB2 LYS A 141 13.586 4.105 -5.218 1.00 44.31 H new ATOM 0 HB3 LYS A 141 14.997 4.634 -6.113 1.00 44.31 H new ATOM 0 HG2 LYS A 141 12.629 6.357 -5.281 1.00 60.11 H new ATOM 0 HG3 LYS A 141 14.252 6.418 -4.622 1.00 60.11 H new ATOM 0 HD2 LYS A 141 15.110 7.039 -6.923 1.00 1.15 H new ATOM 0 HD3 LYS A 141 13.452 7.091 -7.490 1.00 1.15 H new ATOM 0 HE2 LYS A 141 14.154 9.349 -6.967 1.00 11.22 H new ATOM 0 HE3 LYS A 141 12.943 8.860 -5.799 1.00 11.22 H new ATOM 0 HZ1 LYS A 141 14.914 10.013 -4.867 1.00 71.24 H new ATOM 0 HZ2 LYS A 141 14.590 8.501 -4.165 1.00 71.24 H new ATOM 0 HZ3 LYS A 141 15.855 8.663 -5.286 1.00 71.24 H new ATOM 2110 N LYS A 142 13.055 2.003 -7.641 1.00 43.50 N ATOM 2111 CA LYS A 142 13.471 0.709 -8.197 1.00 35.30 C ATOM 2112 C LYS A 142 13.531 0.818 -9.705 1.00 30.33 C ATOM 2113 O LYS A 142 14.496 0.412 -10.348 1.00 34.24 O ATOM 2114 CB LYS A 142 12.470 -0.402 -7.850 1.00 52.40 C ATOM 2115 CG LYS A 142 12.955 -1.795 -8.269 1.00 53.51 C ATOM 2116 CD LYS A 142 11.962 -2.901 -7.921 1.00 1.43 C ATOM 2117 CE LYS A 142 10.633 -2.761 -8.661 1.00 10.11 C ATOM 2118 NZ LYS A 142 9.708 -3.878 -8.343 1.00 35.51 N ATOM 0 H LYS A 142 12.210 1.970 -7.071 1.00 43.50 H new ATOM 0 HA LYS A 142 14.443 0.460 -7.772 1.00 35.30 H new ATOM 0 HB2 LYS A 142 12.285 -0.395 -6.776 1.00 52.40 H new ATOM 0 HB3 LYS A 142 11.518 -0.192 -8.338 1.00 52.40 H new ATOM 0 HG2 LYS A 142 13.137 -1.802 -9.344 1.00 53.51 H new ATOM 0 HG3 LYS A 142 13.908 -2.004 -7.783 1.00 53.51 H new ATOM 0 HD2 LYS A 142 12.405 -3.868 -8.159 1.00 1.43 H new ATOM 0 HD3 LYS A 142 11.777 -2.891 -6.847 1.00 1.43 H new ATOM 0 HE2 LYS A 142 10.165 -1.814 -8.393 1.00 10.11 H new ATOM 0 HE3 LYS A 142 10.816 -2.734 -9.735 1.00 10.11 H new ATOM 0 HZ1 LYS A 142 8.817 -3.749 -8.863 1.00 35.51 H new ATOM 0 HZ2 LYS A 142 10.144 -4.780 -8.621 1.00 35.51 H new ATOM 0 HZ3 LYS A 142 9.514 -3.888 -7.321 1.00 35.51 H new ATOM 2132 N PHE A 143 12.500 1.398 -10.251 1.00 62.11 N ATOM 2133 CA PHE A 143 12.356 1.518 -11.660 1.00 13.31 C ATOM 2134 C PHE A 143 13.265 2.633 -12.169 1.00 44.34 C ATOM 2135 O PHE A 143 13.818 2.551 -13.267 1.00 33.11 O ATOM 2136 CB PHE A 143 10.897 1.813 -11.986 1.00 72.33 C ATOM 2137 CG PHE A 143 10.534 1.536 -13.397 1.00 12.25 C ATOM 2138 CD1 PHE A 143 10.228 0.244 -13.765 1.00 21.43 C ATOM 2139 CD2 PHE A 143 10.493 2.537 -14.350 1.00 13.55 C ATOM 2140 CE1 PHE A 143 9.884 -0.061 -15.069 1.00 44.11 C ATOM 2141 CE2 PHE A 143 10.151 2.249 -15.659 1.00 25.31 C ATOM 2142 CZ PHE A 143 9.845 0.946 -16.019 1.00 23.20 C ATOM 0 H PHE A 143 11.731 1.803 -9.717 1.00 62.11 H new ATOM 0 HA PHE A 143 12.644 0.589 -12.151 1.00 13.31 H new ATOM 0 HB2 PHE A 143 10.260 1.217 -11.332 1.00 72.33 H new ATOM 0 HB3 PHE A 143 10.689 2.860 -11.765 1.00 72.33 H new ATOM 0 HD1 PHE A 143 10.257 -0.542 -13.024 1.00 21.43 H new ATOM 0 HD2 PHE A 143 10.730 3.553 -14.070 1.00 13.55 H new ATOM 0 HE1 PHE A 143 9.647 -1.078 -15.345 1.00 44.11 H new ATOM 0 HE2 PHE A 143 10.123 3.036 -16.398 1.00 25.31 H new ATOM 0 HZ PHE A 143 9.576 0.716 -17.039 1.00 23.20 H new ATOM 2152 N ILE A 144 13.434 3.654 -11.341 1.00 61.24 N ATOM 2153 CA ILE A 144 14.251 4.812 -11.679 1.00 15.41 C ATOM 2154 C ILE A 144 15.717 4.440 -11.883 1.00 54.32 C ATOM 2155 O ILE A 144 16.356 5.002 -12.734 1.00 43.41 O ATOM 2156 CB ILE A 144 14.108 5.966 -10.638 1.00 33.13 C ATOM 2157 CG1 ILE A 144 12.659 6.437 -10.559 1.00 63.42 C ATOM 2158 CG2 ILE A 144 15.017 7.145 -10.969 1.00 44.45 C ATOM 2159 CD1 ILE A 144 12.102 6.983 -11.870 1.00 41.33 C ATOM 0 H ILE A 144 13.009 3.703 -10.415 1.00 61.24 H new ATOM 0 HA ILE A 144 13.868 5.184 -12.630 1.00 15.41 H new ATOM 0 HB ILE A 144 14.413 5.568 -9.670 1.00 33.13 H new ATOM 0 HG12 ILE A 144 12.036 5.604 -10.232 1.00 63.42 H new ATOM 0 HG13 ILE A 144 12.582 7.211 -9.795 1.00 63.42 H new ATOM 0 HG21 ILE A 144 14.887 7.926 -10.220 1.00 44.45 H new ATOM 0 HG22 ILE A 144 16.056 6.814 -10.972 1.00 44.45 H new ATOM 0 HG23 ILE A 144 14.759 7.538 -11.952 1.00 44.45 H new ATOM 0 HD11 ILE A 144 11.068 7.295 -11.724 1.00 41.33 H new ATOM 0 HD12 ILE A 144 12.697 7.838 -12.190 1.00 41.33 H new ATOM 0 HD13 ILE A 144 12.143 6.207 -12.634 1.00 41.33 H new ATOM 2171 N GLU A 145 16.231 3.469 -11.128 1.00 31.25 N ATOM 2172 CA GLU A 145 17.635 3.034 -11.311 1.00 73.21 C ATOM 2173 C GLU A 145 17.879 2.588 -12.767 1.00 14.52 C ATOM 2174 O GLU A 145 18.949 2.794 -13.330 1.00 1.52 O ATOM 2175 CB GLU A 145 18.009 1.917 -10.333 1.00 13.21 C ATOM 2176 CG GLU A 145 17.891 2.314 -8.869 1.00 22.11 C ATOM 2177 CD GLU A 145 18.327 1.226 -7.924 1.00 24.55 C ATOM 2178 OE1 GLU A 145 17.571 0.258 -7.716 1.00 25.52 O ATOM 2179 OE2 GLU A 145 19.429 1.328 -7.346 1.00 22.11 O ATOM 0 H GLU A 145 15.719 2.973 -10.398 1.00 31.25 H new ATOM 0 HA GLU A 145 18.277 3.888 -11.097 1.00 73.21 H new ATOM 0 HB2 GLU A 145 17.368 1.055 -10.518 1.00 13.21 H new ATOM 0 HB3 GLU A 145 19.033 1.601 -10.532 1.00 13.21 H new ATOM 0 HG2 GLU A 145 18.494 3.205 -8.691 1.00 22.11 H new ATOM 0 HG3 GLU A 145 16.856 2.581 -8.654 1.00 22.11 H new ATOM 2186 N THR A 146 16.863 1.996 -13.352 1.00 13.23 N ATOM 2187 CA THR A 146 16.886 1.607 -14.737 1.00 21.34 C ATOM 2188 C THR A 146 16.577 2.803 -15.640 1.00 70.44 C ATOM 2189 O THR A 146 17.290 3.080 -16.606 1.00 64.34 O ATOM 2190 CB THR A 146 15.835 0.497 -14.984 1.00 64.05 C ATOM 2191 OG1 THR A 146 16.191 -0.676 -14.231 1.00 13.04 O ATOM 2192 CG2 THR A 146 15.684 0.165 -16.477 1.00 14.03 C ATOM 0 H THR A 146 15.991 1.770 -12.873 1.00 13.23 H new ATOM 0 HA THR A 146 17.883 1.234 -14.974 1.00 21.34 H new ATOM 0 HB THR A 146 14.866 0.865 -14.646 1.00 64.05 H new ATOM 0 HG1 THR A 146 15.525 -1.378 -14.385 1.00 13.04 H new ATOM 0 HG21 THR A 146 14.937 -0.618 -16.602 1.00 14.03 H new ATOM 0 HG22 THR A 146 15.368 1.057 -17.018 1.00 14.03 H new ATOM 0 HG23 THR A 146 16.640 -0.179 -16.872 1.00 14.03 H new ATOM 2200 N PHE A 147 15.540 3.528 -15.284 1.00 41.54 N ATOM 2201 CA PHE A 147 15.018 4.568 -16.128 1.00 35.10 C ATOM 2202 C PHE A 147 15.948 5.779 -16.202 1.00 23.33 C ATOM 2203 O PHE A 147 15.988 6.462 -17.213 1.00 65.34 O ATOM 2204 CB PHE A 147 13.616 4.962 -15.682 1.00 42.42 C ATOM 2205 CG PHE A 147 12.762 5.381 -16.830 1.00 54.02 C ATOM 2206 CD1 PHE A 147 12.305 4.420 -17.703 1.00 0.53 C ATOM 2207 CD2 PHE A 147 12.418 6.699 -17.050 1.00 35.34 C ATOM 2208 CE1 PHE A 147 11.528 4.746 -18.770 1.00 22.32 C ATOM 2209 CE2 PHE A 147 11.629 7.047 -18.130 1.00 60.04 C ATOM 2210 CZ PHE A 147 11.181 6.065 -18.995 1.00 3.14 C ATOM 0 H PHE A 147 15.039 3.410 -14.403 1.00 41.54 H new ATOM 0 HA PHE A 147 14.956 4.169 -17.141 1.00 35.10 H new ATOM 0 HB2 PHE A 147 13.148 4.121 -15.170 1.00 42.42 H new ATOM 0 HB3 PHE A 147 13.680 5.777 -14.961 1.00 42.42 H new ATOM 0 HD1 PHE A 147 12.569 3.386 -17.537 1.00 0.53 H new ATOM 0 HD2 PHE A 147 12.768 7.464 -16.373 1.00 35.34 H new ATOM 0 HE1 PHE A 147 11.182 3.974 -19.442 1.00 22.32 H new ATOM 0 HE2 PHE A 147 11.364 8.080 -18.298 1.00 60.04 H new ATOM 0 HZ PHE A 147 10.564 6.327 -19.841 1.00 3.14 H new ATOM 2220 N LYS A 148 16.691 6.030 -15.136 1.00 61.21 N ATOM 2221 CA LYS A 148 17.656 7.133 -15.070 1.00 41.45 C ATOM 2222 C LYS A 148 18.684 7.002 -16.184 1.00 52.51 C ATOM 2223 O LYS A 148 19.036 7.985 -16.826 1.00 51.34 O ATOM 2224 CB LYS A 148 18.353 7.144 -13.699 1.00 73.43 C ATOM 2225 CG LYS A 148 19.399 8.236 -13.512 1.00 13.32 C ATOM 2226 CD LYS A 148 20.017 8.159 -12.122 1.00 11.24 C ATOM 2227 CE LYS A 148 21.097 9.213 -11.929 1.00 21.42 C ATOM 2228 NZ LYS A 148 21.682 9.157 -10.571 1.00 64.32 N ATOM 0 H LYS A 148 16.646 5.474 -14.282 1.00 61.21 H new ATOM 0 HA LYS A 148 17.122 8.074 -15.199 1.00 41.45 H new ATOM 0 HB2 LYS A 148 17.594 7.254 -12.924 1.00 73.43 H new ATOM 0 HB3 LYS A 148 18.830 6.176 -13.544 1.00 73.43 H new ATOM 0 HG2 LYS A 148 20.178 8.133 -14.268 1.00 13.32 H new ATOM 0 HG3 LYS A 148 18.941 9.214 -13.658 1.00 13.32 H new ATOM 0 HD2 LYS A 148 19.239 8.292 -11.370 1.00 11.24 H new ATOM 0 HD3 LYS A 148 20.444 7.168 -11.967 1.00 11.24 H new ATOM 0 HE2 LYS A 148 21.883 9.068 -12.670 1.00 21.42 H new ATOM 0 HE3 LYS A 148 20.674 10.203 -12.102 1.00 21.42 H new ATOM 0 HZ1 LYS A 148 22.414 9.890 -10.478 1.00 64.32 H new ATOM 0 HZ2 LYS A 148 20.936 9.320 -9.865 1.00 64.32 H new ATOM 0 HZ3 LYS A 148 22.108 8.221 -10.415 1.00 64.32 H new ATOM 2242 N LYS A 149 19.114 5.772 -16.437 1.00 52.31 N ATOM 2243 CA LYS A 149 20.099 5.488 -17.475 1.00 13.01 C ATOM 2244 C LYS A 149 19.505 5.845 -18.830 1.00 51.42 C ATOM 2245 O LYS A 149 20.175 6.399 -19.701 1.00 21.35 O ATOM 2246 CB LYS A 149 20.464 4.002 -17.455 1.00 51.35 C ATOM 2247 CG LYS A 149 20.991 3.505 -16.121 1.00 41.31 C ATOM 2248 CD LYS A 149 21.272 2.012 -16.172 1.00 12.01 C ATOM 2249 CE LYS A 149 21.740 1.481 -14.828 1.00 21.52 C ATOM 2250 NZ LYS A 149 23.005 2.101 -14.384 1.00 55.25 N ATOM 0 H LYS A 149 18.792 4.947 -15.932 1.00 52.31 H new ATOM 0 HA LYS A 149 20.998 6.077 -17.295 1.00 13.01 H new ATOM 0 HB2 LYS A 149 19.582 3.420 -17.724 1.00 51.35 H new ATOM 0 HB3 LYS A 149 21.216 3.814 -18.222 1.00 51.35 H new ATOM 0 HG2 LYS A 149 21.903 4.042 -15.863 1.00 41.31 H new ATOM 0 HG3 LYS A 149 20.264 3.716 -15.337 1.00 41.31 H new ATOM 0 HD2 LYS A 149 20.370 1.482 -16.478 1.00 12.01 H new ATOM 0 HD3 LYS A 149 22.032 1.810 -16.927 1.00 12.01 H new ATOM 0 HE2 LYS A 149 20.968 1.663 -14.080 1.00 21.52 H new ATOM 0 HE3 LYS A 149 21.872 0.401 -14.894 1.00 21.52 H new ATOM 0 HZ1 LYS A 149 23.352 1.612 -13.534 1.00 55.25 H new ATOM 0 HZ2 LYS A 149 23.714 2.024 -15.141 1.00 55.25 H new ATOM 0 HZ3 LYS A 149 22.841 3.104 -14.164 1.00 55.25 H new ATOM 2264 N ILE A 150 18.226 5.550 -18.970 1.00 62.45 N ATOM 2265 CA ILE A 150 17.471 5.837 -20.173 1.00 14.40 C ATOM 2266 C ILE A 150 17.302 7.361 -20.331 1.00 31.44 C ATOM 2267 O ILE A 150 17.390 7.900 -21.438 1.00 30.22 O ATOM 2268 CB ILE A 150 16.085 5.134 -20.118 1.00 42.54 C ATOM 2269 CG1 ILE A 150 16.282 3.615 -19.957 1.00 72.02 C ATOM 2270 CG2 ILE A 150 15.261 5.442 -21.367 1.00 62.35 C ATOM 2271 CD1 ILE A 150 14.999 2.827 -19.809 1.00 51.20 C ATOM 0 H ILE A 150 17.676 5.098 -18.240 1.00 62.45 H new ATOM 0 HA ILE A 150 18.014 5.454 -21.037 1.00 14.40 H new ATOM 0 HB ILE A 150 15.534 5.516 -19.259 1.00 42.54 H new ATOM 0 HG12 ILE A 150 16.827 3.238 -20.823 1.00 72.02 H new ATOM 0 HG13 ILE A 150 16.908 3.433 -19.083 1.00 72.02 H new ATOM 0 HG21 ILE A 150 14.297 4.937 -21.301 1.00 62.35 H new ATOM 0 HG22 ILE A 150 15.103 6.518 -21.442 1.00 62.35 H new ATOM 0 HG23 ILE A 150 15.794 5.091 -22.250 1.00 62.35 H new ATOM 0 HD11 ILE A 150 15.233 1.768 -19.701 1.00 51.20 H new ATOM 0 HD12 ILE A 150 14.460 3.171 -18.926 1.00 51.20 H new ATOM 0 HD13 ILE A 150 14.378 2.973 -20.693 1.00 51.20 H new ATOM 2283 N MET A 151 17.094 8.045 -19.211 1.00 72.02 N ATOM 2284 CA MET A 151 16.965 9.508 -19.194 1.00 44.52 C ATOM 2285 C MET A 151 18.265 10.142 -19.651 1.00 43.22 C ATOM 2286 O MET A 151 18.262 11.113 -20.400 1.00 40.13 O ATOM 2287 CB MET A 151 16.659 10.033 -17.787 1.00 21.13 C ATOM 2288 CG MET A 151 15.397 9.505 -17.148 1.00 51.13 C ATOM 2289 SD MET A 151 15.163 10.188 -15.498 1.00 44.52 S ATOM 2290 CE MET A 151 13.701 9.304 -14.963 1.00 32.20 C ATOM 0 H MET A 151 17.010 7.610 -18.292 1.00 72.02 H new ATOM 0 HA MET A 151 16.143 9.768 -19.861 1.00 44.52 H new ATOM 0 HB2 MET A 151 17.501 9.791 -17.138 1.00 21.13 H new ATOM 0 HB3 MET A 151 16.594 11.120 -17.832 1.00 21.13 H new ATOM 0 HG2 MET A 151 14.539 9.755 -17.772 1.00 51.13 H new ATOM 0 HG3 MET A 151 15.444 8.418 -17.090 1.00 51.13 H new ATOM 0 HE1 MET A 151 13.381 9.684 -13.993 1.00 32.20 H new ATOM 0 HE2 MET A 151 12.902 9.448 -15.691 1.00 32.20 H new ATOM 0 HE3 MET A 151 13.929 8.241 -14.879 1.00 32.20 H new ATOM 2300 N GLU A 152 19.373 9.590 -19.181 1.00 1.30 N ATOM 2301 CA GLU A 152 20.693 10.072 -19.547 1.00 4.42 C ATOM 2302 C GLU A 152 20.999 9.735 -21.003 1.00 71.40 C ATOM 2303 O GLU A 152 21.673 10.499 -21.698 1.00 32.15 O ATOM 2304 CB GLU A 152 21.755 9.490 -18.621 1.00 70.13 C ATOM 2305 CG GLU A 152 21.548 9.835 -17.157 1.00 42.10 C ATOM 2306 CD GLU A 152 22.600 9.235 -16.270 1.00 12.15 C ATOM 2307 OE1 GLU A 152 22.571 8.019 -16.040 1.00 2.22 O ATOM 2308 OE2 GLU A 152 23.501 9.975 -15.811 1.00 1.23 O ATOM 0 H GLU A 152 19.381 8.798 -18.538 1.00 1.30 H new ATOM 0 HA GLU A 152 20.707 11.156 -19.437 1.00 4.42 H new ATOM 0 HB2 GLU A 152 21.765 8.406 -18.731 1.00 70.13 H new ATOM 0 HB3 GLU A 152 22.734 9.851 -18.935 1.00 70.13 H new ATOM 0 HG2 GLU A 152 21.552 10.919 -17.038 1.00 42.10 H new ATOM 0 HG3 GLU A 152 20.566 9.484 -16.840 1.00 42.10 H new ATOM 2315 N CYS A 153 20.491 8.595 -21.448 1.00 62.34 N ATOM 2316 CA CYS A 153 20.617 8.154 -22.829 1.00 44.31 C ATOM 2317 C CYS A 153 19.922 9.149 -23.769 1.00 10.01 C ATOM 2318 O CYS A 153 20.511 9.609 -24.758 1.00 24.15 O ATOM 2319 CB CYS A 153 20.018 6.742 -22.982 1.00 31.41 C ATOM 2320 SG CYS A 153 20.070 6.061 -24.653 1.00 42.32 S ATOM 0 H CYS A 153 19.975 7.945 -20.855 1.00 62.34 H new ATOM 0 HA CYS A 153 21.672 8.114 -23.099 1.00 44.31 H new ATOM 0 HB2 CYS A 153 20.550 6.065 -22.314 1.00 31.41 H new ATOM 0 HB3 CYS A 153 18.980 6.767 -22.649 1.00 31.41 H new ATOM 0 HG CYS A 153 19.541 4.873 -24.654 1.00 42.32 H new ATOM 2326 N LYS A 154 18.680 9.493 -23.443 1.00 62.14 N ATOM 2327 CA LYS A 154 17.918 10.473 -24.215 1.00 44.40 C ATOM 2328 C LYS A 154 18.485 11.861 -24.010 1.00 44.42 C ATOM 2329 O LYS A 154 18.307 12.754 -24.843 1.00 11.23 O ATOM 2330 CB LYS A 154 16.474 10.472 -23.767 1.00 31.14 C ATOM 2331 CG LYS A 154 15.790 9.150 -23.948 1.00 44.04 C ATOM 2332 CD LYS A 154 14.364 9.243 -23.517 1.00 20.23 C ATOM 2333 CE LYS A 154 13.647 7.920 -23.683 1.00 20.14 C ATOM 2334 NZ LYS A 154 12.239 7.980 -23.246 1.00 73.35 N ATOM 0 H LYS A 154 18.176 9.106 -22.645 1.00 62.14 H new ATOM 0 HA LYS A 154 17.983 10.203 -25.269 1.00 44.40 H new ATOM 0 HB2 LYS A 154 16.429 10.754 -22.715 1.00 31.14 H new ATOM 0 HB3 LYS A 154 15.929 11.233 -24.325 1.00 31.14 H new ATOM 0 HG2 LYS A 154 15.842 8.846 -24.993 1.00 44.04 H new ATOM 0 HG3 LYS A 154 16.304 8.384 -23.367 1.00 44.04 H new ATOM 0 HD2 LYS A 154 14.318 9.555 -22.474 1.00 20.23 H new ATOM 0 HD3 LYS A 154 13.855 10.010 -24.102 1.00 20.23 H new ATOM 0 HE2 LYS A 154 13.686 7.618 -24.730 1.00 20.14 H new ATOM 0 HE3 LYS A 154 14.169 7.153 -23.110 1.00 20.14 H new ATOM 0 HZ1 LYS A 154 11.794 7.050 -23.380 1.00 73.35 H new ATOM 0 HZ2 LYS A 154 12.199 8.241 -22.240 1.00 73.35 H new ATOM 0 HZ3 LYS A 154 11.731 8.691 -23.809 1.00 73.35 H new