USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=27 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 19 ASN : amide:sc= -3.65! C(o=-4.8!,f=-6.2!) USER MOD Set 1.2: A 111 MET CE :methyl -167:sc= -1.11 (180deg=-1.36!) USER MOD Set 2.1: A 46 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 72 HIS : no HD1:sc= -0.307 K(o=-0.31,f=-9.5!) USER MOD Set 3.1: A 44 SER OG : rot 180:sc= 0.931 USER MOD Set 3.2: A 74 LYS NZ :NH3+ 172:sc= 1.08 (180deg=-0.0149) USER MOD Set 4.1: A 33 ASN : amide:sc= 0.598 K(o=1.1,f=0.49) USER MOD Set 4.2: A 39 THR OG1 : rot -121:sc= 0.527 USER MOD Set 5.1: A 35 MET CE :methyl 165:sc= -1.4 (180deg=-0.685) USER MOD Set 5.2: A 86 ASN : amide:sc= 0.387 X(o=-1,f=-1.2) USER MOD Set 6.1: A 23 TYR OH : rot -153:sc= 1.24 USER MOD Set 6.2: A 25 SER OG : rot 153:sc= 1.3 USER MOD Set 6.3: A 62 CYS SG : rot -143:sc= 2.48 USER MOD Set 6.4: A 95 TYR OH : rot -164:sc= 0.338 USER MOD Single : A 18 HIS : no HD1:sc= -2.52 K(o=-2.5,f=-1.9!) USER MOD Single : A 27 GLN : amide:sc= -0.792 K(o=-0.79,f=-2!) USER MOD Single : A 51 GLN : amide:sc= 0.321 K(o=0.32,f=-4.7!) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0766) USER MOD Single : A 77 MET CE :methyl 156:sc= -0.372 (180deg=-1.74!) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0.362 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= -1.7! C(o=-1.7!,f=-9.7!) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ -168:sc= -0.0213 (180deg=-0.193) USER MOD Single : A 115 THR OG1 : rot 66:sc= 1.24 USER MOD Single : A 116 TYR OH : rot 0:sc= 0 USER MOD Single : A 117 MET CE :methyl -120:sc= -1.48 (180deg=-5.18!) USER MOD Single : A 120 ASN : amide:sc= -1.41 X(o=-1.4,f=-1.4) USER MOD Single : A 121 LYS NZ :NH3+ 164:sc= 0.222 (180deg=-0.179) USER MOD Single : A 126 MET CE :methyl 174:sc= -3.65 (180deg=-3.71!) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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+ -165:sc= -0.0353 (180deg=-0.278) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 MET CE :methyl 180:sc= 0 (180deg=0) 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 -23.872 -11.650 -11.601 1.00 50.45 N ATOM 94 CA LEU A 17 -23.431 -11.048 -10.404 1.00 45.11 C ATOM 95 C LEU A 17 -22.368 -10.063 -10.800 1.00 21.21 C ATOM 96 O LEU A 17 -21.686 -10.247 -11.816 1.00 31.22 O ATOM 97 CB LEU A 17 -22.909 -12.057 -9.392 1.00 41.14 C ATOM 98 CG LEU A 17 -23.925 -13.090 -8.884 1.00 63.20 C ATOM 99 CD1 LEU A 17 -23.265 -14.056 -7.915 1.00 15.15 C ATOM 100 CD2 LEU A 17 -25.100 -12.394 -8.211 1.00 70.02 C ATOM 0 HA LEU A 17 -24.264 -10.558 -9.900 1.00 45.11 H new ATOM 0 HB2 LEU A 17 -22.071 -12.591 -9.841 1.00 41.14 H new ATOM 0 HB3 LEU A 17 -22.516 -11.511 -8.534 1.00 41.14 H new ATOM 0 HG LEU A 17 -24.296 -13.654 -9.740 1.00 63.20 H new ATOM 0 HD11 LEU A 17 -24.001 -14.780 -7.566 1.00 15.15 H new ATOM 0 HD12 LEU A 17 -22.452 -14.579 -8.419 1.00 15.15 H new ATOM 0 HD13 LEU A 17 -22.868 -13.503 -7.064 1.00 15.15 H new ATOM 0 HD21 LEU A 17 -25.811 -13.141 -7.857 1.00 70.02 H new ATOM 0 HD22 LEU A 17 -24.740 -11.806 -7.367 1.00 70.02 H new ATOM 0 HD23 LEU A 17 -25.592 -11.736 -8.927 1.00 70.02 H new ATOM 112 N HIS A 18 -22.252 -9.035 -10.071 1.00 61.11 N ATOM 113 CA HIS A 18 -21.390 -7.962 -10.444 1.00 2.32 C ATOM 114 C HIS A 18 -20.323 -7.827 -9.442 1.00 74.21 C ATOM 115 O HIS A 18 -20.437 -8.340 -8.324 1.00 61.02 O ATOM 116 CB HIS A 18 -22.173 -6.645 -10.533 1.00 12.23 C ATOM 117 CG HIS A 18 -23.430 -6.760 -11.308 1.00 1.14 C ATOM 118 ND1 HIS A 18 -23.565 -6.378 -12.608 1.00 61.14 N ATOM 119 CD2 HIS A 18 -24.625 -7.241 -10.930 1.00 3.53 C ATOM 120 CE1 HIS A 18 -24.792 -6.613 -13.002 1.00 71.02 C ATOM 121 NE2 HIS A 18 -25.462 -7.143 -12.003 1.00 71.24 N ATOM 0 H HIS A 18 -22.748 -8.897 -9.190 1.00 61.11 H new ATOM 0 HA HIS A 18 -20.961 -8.180 -11.422 1.00 2.32 H new ATOM 0 HB2 HIS A 18 -22.406 -6.301 -9.525 1.00 12.23 H new ATOM 0 HB3 HIS A 18 -21.540 -5.885 -10.991 1.00 12.23 H new ATOM 0 HD2 HIS A 18 -24.877 -7.633 -9.956 1.00 3.53 H new ATOM 0 HE1 HIS A 18 -25.188 -6.406 -13.985 1.00 71.02 H new ATOM 0 HE2 HIS A 18 -26.440 -7.432 -12.026 1.00 71.24 H new ATOM 130 N ASN A 19 -19.300 -7.198 -9.821 1.00 74.20 N ATOM 131 CA ASN A 19 -18.241 -6.930 -8.953 1.00 71.11 C ATOM 132 C ASN A 19 -17.872 -5.473 -9.039 1.00 12.12 C ATOM 133 O ASN A 19 -17.731 -4.911 -10.124 1.00 63.01 O ATOM 134 CB ASN A 19 -17.073 -7.915 -9.138 1.00 1.44 C ATOM 135 CG ASN A 19 -16.469 -7.992 -10.522 1.00 32.13 C ATOM 136 OD1 ASN A 19 -17.111 -7.719 -11.535 1.00 64.35 O ATOM 137 ND2 ASN A 19 -15.232 -8.430 -10.577 1.00 72.22 N ATOM 0 H ASN A 19 -19.168 -6.844 -10.768 1.00 74.20 H new ATOM 0 HA ASN A 19 -18.556 -7.105 -7.924 1.00 71.11 H new ATOM 0 HB2 ASN A 19 -16.284 -7.645 -8.436 1.00 1.44 H new ATOM 0 HB3 ASN A 19 -17.419 -8.911 -8.861 1.00 1.44 H new ATOM 0 HD21 ASN A 19 -14.774 -8.553 -11.480 1.00 72.22 H new ATOM 0 HD22 ASN A 19 -14.729 -8.647 -9.717 1.00 72.22 H new ATOM 144 N VAL A 20 -17.792 -4.854 -7.896 1.00 3.45 N ATOM 145 CA VAL A 20 -17.593 -3.423 -7.795 1.00 32.33 C ATOM 146 C VAL A 20 -16.310 -3.122 -7.048 1.00 40.44 C ATOM 147 O VAL A 20 -15.999 -3.779 -6.065 1.00 44.34 O ATOM 148 CB VAL A 20 -18.801 -2.763 -7.039 1.00 74.15 C ATOM 149 CG1 VAL A 20 -18.617 -1.259 -6.868 1.00 44.13 C ATOM 150 CG2 VAL A 20 -20.112 -3.049 -7.761 1.00 65.41 C ATOM 0 H VAL A 20 -17.863 -5.327 -6.995 1.00 3.45 H new ATOM 0 HA VAL A 20 -17.527 -3.012 -8.802 1.00 32.33 H new ATOM 0 HB VAL A 20 -18.836 -3.209 -6.045 1.00 74.15 H new ATOM 0 HG11 VAL A 20 -19.476 -0.845 -6.340 1.00 44.13 H new ATOM 0 HG12 VAL A 20 -17.711 -1.066 -6.294 1.00 44.13 H new ATOM 0 HG13 VAL A 20 -18.532 -0.789 -7.848 1.00 44.13 H new ATOM 0 HG21 VAL A 20 -20.935 -2.582 -7.220 1.00 65.41 H new ATOM 0 HG22 VAL A 20 -20.067 -2.644 -8.772 1.00 65.41 H new ATOM 0 HG23 VAL A 20 -20.274 -4.126 -7.809 1.00 65.41 H new ATOM 160 N PHE A 21 -15.580 -2.138 -7.512 1.00 40.34 N ATOM 161 CA PHE A 21 -14.369 -1.724 -6.855 1.00 54.41 C ATOM 162 C PHE A 21 -14.728 -0.595 -5.923 1.00 33.12 C ATOM 163 O PHE A 21 -15.272 0.430 -6.352 1.00 11.23 O ATOM 164 CB PHE A 21 -13.343 -1.253 -7.904 1.00 12.04 C ATOM 165 CG PHE A 21 -12.007 -0.816 -7.357 1.00 42.44 C ATOM 166 CD1 PHE A 21 -11.066 -1.752 -6.978 1.00 3.44 C ATOM 167 CD2 PHE A 21 -11.682 0.532 -7.248 1.00 30.23 C ATOM 168 CE1 PHE A 21 -9.840 -1.365 -6.501 1.00 40.21 C ATOM 169 CE2 PHE A 21 -10.453 0.922 -6.767 1.00 50.24 C ATOM 170 CZ PHE A 21 -9.531 -0.029 -6.395 1.00 5.43 C ATOM 0 H PHE A 21 -15.808 -1.605 -8.351 1.00 40.34 H new ATOM 0 HA PHE A 21 -13.924 -2.548 -6.297 1.00 54.41 H new ATOM 0 HB2 PHE A 21 -13.178 -2.063 -8.614 1.00 12.04 H new ATOM 0 HB3 PHE A 21 -13.776 -0.423 -8.463 1.00 12.04 H new ATOM 0 HD1 PHE A 21 -11.299 -2.804 -7.058 1.00 3.44 H new ATOM 0 HD2 PHE A 21 -12.402 1.281 -7.544 1.00 30.23 H new ATOM 0 HE1 PHE A 21 -9.116 -2.111 -6.208 1.00 40.21 H new ATOM 0 HE2 PHE A 21 -10.213 1.972 -6.682 1.00 50.24 H new ATOM 0 HZ PHE A 21 -8.565 0.274 -6.020 1.00 5.43 H new ATOM 180 N VAL A 22 -14.438 -0.773 -4.672 1.00 51.40 N ATOM 181 CA VAL A 22 -14.792 0.197 -3.681 1.00 61.41 C ATOM 182 C VAL A 22 -13.596 1.005 -3.238 1.00 44.32 C ATOM 183 O VAL A 22 -12.547 0.465 -2.893 1.00 62.12 O ATOM 184 CB VAL A 22 -15.544 -0.428 -2.473 1.00 21.14 C ATOM 185 CG1 VAL A 22 -16.906 -0.933 -2.919 1.00 50.30 C ATOM 186 CG2 VAL A 22 -14.747 -1.576 -1.870 1.00 44.51 C ATOM 0 H VAL A 22 -13.951 -1.592 -4.309 1.00 51.40 H new ATOM 0 HA VAL A 22 -15.492 0.883 -4.158 1.00 61.41 H new ATOM 0 HB VAL A 22 -15.669 0.343 -1.713 1.00 21.14 H new ATOM 0 HG11 VAL A 22 -17.429 -1.370 -2.068 1.00 50.30 H new ATOM 0 HG12 VAL A 22 -17.490 -0.103 -3.316 1.00 50.30 H new ATOM 0 HG13 VAL A 22 -16.778 -1.689 -3.693 1.00 50.30 H new ATOM 0 HG21 VAL A 22 -15.295 -1.996 -1.027 1.00 44.51 H new ATOM 0 HG22 VAL A 22 -14.594 -2.348 -2.624 1.00 44.51 H new ATOM 0 HG23 VAL A 22 -13.780 -1.207 -1.527 1.00 44.51 H new ATOM 196 N TYR A 23 -13.770 2.302 -3.252 1.00 41.24 N ATOM 197 CA TYR A 23 -12.707 3.238 -2.935 1.00 43.12 C ATOM 198 C TYR A 23 -12.411 3.328 -1.446 1.00 35.03 C ATOM 199 O TYR A 23 -11.326 3.740 -1.055 1.00 51.32 O ATOM 200 CB TYR A 23 -13.012 4.622 -3.518 1.00 23.30 C ATOM 201 CG TYR A 23 -14.337 5.220 -3.092 1.00 4.12 C ATOM 202 CD1 TYR A 23 -14.440 5.994 -1.945 1.00 30.44 C ATOM 203 CD2 TYR A 23 -15.485 5.011 -3.844 1.00 3.24 C ATOM 204 CE1 TYR A 23 -15.637 6.537 -1.562 1.00 24.54 C ATOM 205 CE2 TYR A 23 -16.688 5.551 -3.466 1.00 33.42 C ATOM 206 CZ TYR A 23 -16.758 6.312 -2.323 1.00 22.41 C ATOM 207 OH TYR A 23 -17.953 6.846 -1.936 1.00 54.22 O ATOM 0 H TYR A 23 -14.658 2.747 -3.485 1.00 41.24 H new ATOM 0 HA TYR A 23 -11.802 2.848 -3.402 1.00 43.12 H new ATOM 0 HB2 TYR A 23 -12.213 5.305 -3.229 1.00 23.30 H new ATOM 0 HB3 TYR A 23 -12.995 4.553 -4.606 1.00 23.30 H new ATOM 0 HD1 TYR A 23 -13.560 6.171 -1.344 1.00 30.44 H new ATOM 0 HD2 TYR A 23 -15.430 4.413 -4.742 1.00 3.24 H new ATOM 0 HE1 TYR A 23 -15.699 7.138 -0.667 1.00 24.54 H new ATOM 0 HE2 TYR A 23 -17.573 5.380 -4.061 1.00 33.42 H new ATOM 0 HH TYR A 23 -18.685 6.289 -2.274 1.00 54.22 H new ATOM 217 N GLY A 24 -13.365 2.951 -0.620 1.00 21.13 N ATOM 218 CA GLY A 24 -13.139 3.028 0.808 1.00 33.11 C ATOM 219 C GLY A 24 -14.417 3.009 1.601 1.00 73.25 C ATOM 220 O GLY A 24 -14.476 2.421 2.676 1.00 74.24 O ATOM 0 H GLY A 24 -14.280 2.598 -0.902 1.00 21.13 H new ATOM 0 HA2 GLY A 24 -12.512 2.192 1.118 1.00 33.11 H new ATOM 0 HA3 GLY A 24 -12.589 3.941 1.036 1.00 33.11 H new ATOM 224 N SER A 25 -15.451 3.605 1.043 1.00 33.14 N ATOM 225 CA SER A 25 -16.749 3.732 1.697 1.00 64.24 C ATOM 226 C SER A 25 -17.349 2.372 2.069 1.00 30.30 C ATOM 227 O SER A 25 -17.976 2.216 3.123 1.00 54.23 O ATOM 228 CB SER A 25 -17.668 4.467 0.749 1.00 71.24 C ATOM 229 OG SER A 25 -17.642 3.849 -0.537 1.00 61.22 O ATOM 0 H SER A 25 -15.419 4.021 0.112 1.00 33.14 H new ATOM 0 HA SER A 25 -16.626 4.280 2.631 1.00 64.24 H new ATOM 0 HB2 SER A 25 -18.685 4.465 1.141 1.00 71.24 H new ATOM 0 HB3 SER A 25 -17.360 5.509 0.666 1.00 71.24 H new ATOM 0 HG SER A 25 -18.494 4.010 -0.994 1.00 61.22 H new ATOM 235 N PHE A 26 -17.132 1.403 1.217 1.00 20.45 N ATOM 236 CA PHE A 26 -17.618 0.066 1.425 1.00 61.04 C ATOM 237 C PHE A 26 -16.488 -0.932 1.284 1.00 22.45 C ATOM 238 O PHE A 26 -16.699 -2.070 0.910 1.00 21.02 O ATOM 239 CB PHE A 26 -18.742 -0.246 0.437 1.00 33.11 C ATOM 240 CG PHE A 26 -19.986 0.577 0.651 1.00 63.52 C ATOM 241 CD1 PHE A 26 -20.800 0.345 1.751 1.00 22.21 C ATOM 242 CD2 PHE A 26 -20.349 1.565 -0.242 1.00 74.14 C ATOM 243 CE1 PHE A 26 -21.945 1.081 1.956 1.00 25.11 C ATOM 244 CE2 PHE A 26 -21.496 2.307 -0.040 1.00 42.12 C ATOM 245 CZ PHE A 26 -22.294 2.065 1.059 1.00 5.13 C ATOM 0 H PHE A 26 -16.607 1.523 0.351 1.00 20.45 H new ATOM 0 HA PHE A 26 -18.017 -0.010 2.436 1.00 61.04 H new ATOM 0 HB2 PHE A 26 -18.378 -0.080 -0.577 1.00 33.11 H new ATOM 0 HB3 PHE A 26 -18.999 -1.302 0.515 1.00 33.11 H new ATOM 0 HD1 PHE A 26 -20.531 -0.426 2.458 1.00 22.21 H new ATOM 0 HD2 PHE A 26 -19.731 1.759 -1.106 1.00 74.14 H new ATOM 0 HE1 PHE A 26 -22.567 0.887 2.817 1.00 25.11 H new ATOM 0 HE2 PHE A 26 -21.769 3.079 -0.744 1.00 42.12 H new ATOM 0 HZ PHE A 26 -23.191 2.646 1.215 1.00 5.13 H new ATOM 255 N GLN A 27 -15.287 -0.511 1.674 1.00 4.20 N ATOM 256 CA GLN A 27 -14.098 -1.358 1.578 1.00 12.41 C ATOM 257 C GLN A 27 -14.011 -2.278 2.824 1.00 12.21 C ATOM 258 O GLN A 27 -12.971 -2.843 3.150 1.00 31.52 O ATOM 259 CB GLN A 27 -12.855 -0.458 1.447 1.00 54.03 C ATOM 260 CG GLN A 27 -11.570 -1.196 1.130 1.00 0.31 C ATOM 261 CD GLN A 27 -10.360 -0.290 0.976 1.00 14.43 C ATOM 262 OE1 GLN A 27 -9.445 -0.596 0.221 1.00 1.20 O ATOM 263 NE2 GLN A 27 -10.326 0.809 1.697 1.00 23.43 N ATOM 0 H GLN A 27 -15.110 0.416 2.061 1.00 4.20 H new ATOM 0 HA GLN A 27 -14.155 -1.998 0.698 1.00 12.41 H new ATOM 0 HB2 GLN A 27 -13.037 0.279 0.665 1.00 54.03 H new ATOM 0 HB3 GLN A 27 -12.722 0.092 2.378 1.00 54.03 H new ATOM 0 HG2 GLN A 27 -11.372 -1.918 1.923 1.00 0.31 H new ATOM 0 HG3 GLN A 27 -11.706 -1.763 0.209 1.00 0.31 H new ATOM 0 HE21 GLN A 27 -11.104 1.037 2.317 1.00 23.43 H new ATOM 0 HE22 GLN A 27 -9.522 1.434 1.637 1.00 23.43 H new ATOM 272 N ASP A 28 -15.131 -2.440 3.467 1.00 43.31 N ATOM 273 CA ASP A 28 -15.268 -3.251 4.649 1.00 2.23 C ATOM 274 C ASP A 28 -16.519 -4.090 4.485 1.00 33.12 C ATOM 275 O ASP A 28 -17.572 -3.558 4.149 1.00 2.35 O ATOM 276 CB ASP A 28 -15.392 -2.342 5.883 1.00 51.02 C ATOM 277 CG ASP A 28 -15.589 -3.098 7.181 1.00 54.42 C ATOM 278 OD1 ASP A 28 -16.733 -3.398 7.539 1.00 44.32 O ATOM 279 OD2 ASP A 28 -14.587 -3.374 7.874 1.00 24.32 O ATOM 0 H ASP A 28 -16.003 -1.999 3.176 1.00 43.31 H new ATOM 0 HA ASP A 28 -14.399 -3.895 4.785 1.00 2.23 H new ATOM 0 HB2 ASP A 28 -14.494 -1.729 5.963 1.00 51.02 H new ATOM 0 HB3 ASP A 28 -16.231 -1.661 5.739 1.00 51.02 H new ATOM 284 N PRO A 29 -16.439 -5.403 4.676 1.00 12.33 N ATOM 285 CA PRO A 29 -17.593 -6.281 4.494 1.00 73.34 C ATOM 286 C PRO A 29 -18.693 -6.040 5.512 1.00 45.31 C ATOM 287 O PRO A 29 -19.865 -6.163 5.202 1.00 3.03 O ATOM 288 CB PRO A 29 -17.029 -7.672 4.687 1.00 42.55 C ATOM 289 CG PRO A 29 -15.788 -7.487 5.480 1.00 52.53 C ATOM 290 CD PRO A 29 -15.228 -6.155 5.059 1.00 22.21 C ATOM 0 HA PRO A 29 -18.055 -6.113 3.521 1.00 73.34 H new ATOM 0 HB2 PRO A 29 -17.738 -8.314 5.210 1.00 42.55 H new ATOM 0 HB3 PRO A 29 -16.816 -8.146 3.729 1.00 42.55 H new ATOM 0 HG2 PRO A 29 -16.001 -7.502 6.549 1.00 52.53 H new ATOM 0 HG3 PRO A 29 -15.076 -8.290 5.286 1.00 52.53 H new ATOM 0 HD2 PRO A 29 -14.688 -5.668 5.871 1.00 22.21 H new ATOM 0 HD3 PRO A 29 -14.531 -6.253 4.226 1.00 22.21 H new ATOM 298 N ASP A 30 -18.313 -5.662 6.705 1.00 1.45 N ATOM 299 CA ASP A 30 -19.261 -5.483 7.783 1.00 14.22 C ATOM 300 C ASP A 30 -20.096 -4.221 7.580 1.00 34.00 C ATOM 301 O ASP A 30 -21.280 -4.201 7.899 1.00 12.22 O ATOM 302 CB ASP A 30 -18.546 -5.473 9.122 1.00 40.32 C ATOM 303 CG ASP A 30 -19.464 -5.219 10.284 1.00 15.11 C ATOM 304 OD1 ASP A 30 -20.182 -6.158 10.712 1.00 72.35 O ATOM 305 OD2 ASP A 30 -19.446 -4.085 10.820 1.00 71.14 O ATOM 0 H ASP A 30 -17.344 -5.470 6.960 1.00 1.45 H new ATOM 0 HA ASP A 30 -19.950 -6.327 7.778 1.00 14.22 H new ATOM 0 HB2 ASP A 30 -18.045 -6.431 9.266 1.00 40.32 H new ATOM 0 HB3 ASP A 30 -17.771 -4.707 9.106 1.00 40.32 H new ATOM 310 N VAL A 31 -19.495 -3.178 7.014 1.00 51.11 N ATOM 311 CA VAL A 31 -20.269 -1.971 6.699 1.00 62.35 C ATOM 312 C VAL A 31 -21.302 -2.281 5.605 1.00 52.34 C ATOM 313 O VAL A 31 -22.381 -1.680 5.560 1.00 14.24 O ATOM 314 CB VAL A 31 -19.402 -0.724 6.315 1.00 62.21 C ATOM 315 CG1 VAL A 31 -18.388 -0.404 7.398 1.00 32.33 C ATOM 316 CG2 VAL A 31 -18.731 -0.873 4.962 1.00 3.21 C ATOM 0 H VAL A 31 -18.506 -3.137 6.768 1.00 51.11 H new ATOM 0 HA VAL A 31 -20.776 -1.688 7.621 1.00 62.35 H new ATOM 0 HB VAL A 31 -20.089 0.119 6.232 1.00 62.21 H new ATOM 0 HG11 VAL A 31 -17.802 0.466 7.102 1.00 32.33 H new ATOM 0 HG12 VAL A 31 -18.908 -0.191 8.332 1.00 32.33 H new ATOM 0 HG13 VAL A 31 -17.725 -1.257 7.539 1.00 32.33 H new ATOM 0 HG21 VAL A 31 -18.144 0.020 4.747 1.00 3.21 H new ATOM 0 HG22 VAL A 31 -18.076 -1.744 4.975 1.00 3.21 H new ATOM 0 HG23 VAL A 31 -19.491 -1.002 4.191 1.00 3.21 H new ATOM 326 N ILE A 32 -20.968 -3.250 4.737 1.00 34.10 N ATOM 327 CA ILE A 32 -21.886 -3.725 3.713 1.00 53.41 C ATOM 328 C ILE A 32 -22.969 -4.560 4.363 1.00 53.31 C ATOM 329 O ILE A 32 -24.161 -4.437 4.061 1.00 22.25 O ATOM 330 CB ILE A 32 -21.115 -4.571 2.646 1.00 1.20 C ATOM 331 CG1 ILE A 32 -20.397 -3.676 1.636 1.00 54.51 C ATOM 332 CG2 ILE A 32 -21.991 -5.601 1.953 1.00 74.22 C ATOM 333 CD1 ILE A 32 -21.350 -2.872 0.764 1.00 2.55 C ATOM 0 H ILE A 32 -20.061 -3.716 4.732 1.00 34.10 H new ATOM 0 HA ILE A 32 -22.341 -2.872 3.210 1.00 53.41 H new ATOM 0 HB ILE A 32 -20.360 -5.135 3.194 1.00 1.20 H new ATOM 0 HG12 ILE A 32 -19.739 -2.991 2.171 1.00 54.51 H new ATOM 0 HG13 ILE A 32 -19.765 -4.294 0.998 1.00 54.51 H new ATOM 0 HG21 ILE A 32 -21.397 -6.154 1.226 1.00 74.22 H new ATOM 0 HG22 ILE A 32 -22.394 -6.293 2.693 1.00 74.22 H new ATOM 0 HG23 ILE A 32 -22.812 -5.097 1.443 1.00 74.22 H new ATOM 0 HD11 ILE A 32 -20.777 -2.258 0.069 1.00 2.55 H new ATOM 0 HD12 ILE A 32 -21.991 -3.552 0.203 1.00 2.55 H new ATOM 0 HD13 ILE A 32 -21.965 -2.229 1.394 1.00 2.55 H new ATOM 345 N ASN A 33 -22.532 -5.351 5.286 1.00 73.12 N ATOM 346 CA ASN A 33 -23.330 -6.297 6.020 1.00 71.03 C ATOM 347 C ASN A 33 -24.479 -5.577 6.739 1.00 54.45 C ATOM 348 O ASN A 33 -25.606 -6.061 6.797 1.00 50.40 O ATOM 349 CB ASN A 33 -22.408 -6.923 7.036 1.00 5.43 C ATOM 350 CG ASN A 33 -22.832 -8.245 7.501 1.00 51.14 C ATOM 351 OD1 ASN A 33 -23.590 -8.379 8.455 1.00 54.34 O ATOM 352 ND2 ASN A 33 -22.312 -9.242 6.850 1.00 31.03 N ATOM 0 H ASN A 33 -21.552 -5.361 5.570 1.00 73.12 H new ATOM 0 HA ASN A 33 -23.768 -7.043 5.357 1.00 71.03 H new ATOM 0 HB2 ASN A 33 -21.411 -7.006 6.602 1.00 5.43 H new ATOM 0 HB3 ASN A 33 -22.328 -6.257 7.895 1.00 5.43 H new ATOM 0 HD21 ASN A 33 -22.529 -10.200 7.126 1.00 31.03 H new ATOM 0 HD22 ASN A 33 -21.687 -9.067 6.063 1.00 31.03 H new ATOM 359 N VAL A 34 -24.172 -4.414 7.267 1.00 73.21 N ATOM 360 CA VAL A 34 -25.146 -3.591 7.958 1.00 1.42 C ATOM 361 C VAL A 34 -26.004 -2.778 6.963 1.00 14.12 C ATOM 362 O VAL A 34 -27.174 -2.492 7.226 1.00 75.42 O ATOM 363 CB VAL A 34 -24.458 -2.645 8.998 1.00 2.32 C ATOM 364 CG1 VAL A 34 -25.476 -1.778 9.733 1.00 74.13 C ATOM 365 CG2 VAL A 34 -23.644 -3.457 10.000 1.00 2.43 C ATOM 0 H VAL A 34 -23.237 -4.008 7.231 1.00 73.21 H new ATOM 0 HA VAL A 34 -25.809 -4.263 8.502 1.00 1.42 H new ATOM 0 HB VAL A 34 -23.791 -1.983 8.446 1.00 2.32 H new ATOM 0 HG11 VAL A 34 -24.959 -1.135 10.446 1.00 74.13 H new ATOM 0 HG12 VAL A 34 -26.016 -1.162 9.014 1.00 74.13 H new ATOM 0 HG13 VAL A 34 -26.181 -2.417 10.265 1.00 74.13 H new ATOM 0 HG21 VAL A 34 -23.172 -2.784 10.716 1.00 2.43 H new ATOM 0 HG22 VAL A 34 -24.302 -4.147 10.529 1.00 2.43 H new ATOM 0 HG23 VAL A 34 -22.876 -4.022 9.472 1.00 2.43 H new ATOM 375 N MET A 35 -25.428 -2.430 5.808 1.00 43.05 N ATOM 376 CA MET A 35 -26.112 -1.597 4.841 1.00 23.14 C ATOM 377 C MET A 35 -27.265 -2.369 4.197 1.00 33.02 C ATOM 378 O MET A 35 -28.303 -1.786 3.835 1.00 73.33 O ATOM 379 CB MET A 35 -25.100 -1.030 3.817 1.00 0.32 C ATOM 380 CG MET A 35 -25.644 0.066 2.901 1.00 3.33 C ATOM 381 SD MET A 35 -26.681 -0.512 1.534 1.00 43.10 S ATOM 382 CE MET A 35 -25.455 -1.321 0.518 1.00 0.23 C ATOM 0 H MET A 35 -24.490 -2.717 5.529 1.00 43.05 H new ATOM 0 HA MET A 35 -26.561 -0.738 5.340 1.00 23.14 H new ATOM 0 HB2 MET A 35 -24.242 -0.634 4.360 1.00 0.32 H new ATOM 0 HB3 MET A 35 -24.736 -1.850 3.198 1.00 0.32 H new ATOM 0 HG2 MET A 35 -26.223 0.766 3.504 1.00 3.33 H new ATOM 0 HG3 MET A 35 -24.802 0.622 2.487 1.00 3.33 H new ATOM 0 HE1 MET A 35 -25.952 -1.953 -0.218 1.00 0.23 H new ATOM 0 HE2 MET A 35 -24.855 -0.570 0.004 1.00 0.23 H new ATOM 0 HE3 MET A 35 -24.809 -1.934 1.146 1.00 0.23 H new ATOM 392 N LEU A 36 -27.097 -3.674 4.060 1.00 63.34 N ATOM 393 CA LEU A 36 -28.189 -4.505 3.620 1.00 3.12 C ATOM 394 C LEU A 36 -28.404 -5.714 4.531 1.00 24.55 C ATOM 395 O LEU A 36 -29.379 -5.749 5.270 1.00 30.43 O ATOM 396 CB LEU A 36 -28.142 -4.919 2.119 1.00 71.11 C ATOM 397 CG LEU A 36 -26.928 -5.699 1.600 1.00 34.33 C ATOM 398 CD1 LEU A 36 -27.278 -6.337 0.279 1.00 44.22 C ATOM 399 CD2 LEU A 36 -25.746 -4.778 1.389 1.00 23.44 C ATOM 0 H LEU A 36 -26.225 -4.169 4.246 1.00 63.34 H new ATOM 0 HA LEU A 36 -29.062 -3.858 3.704 1.00 3.12 H new ATOM 0 HB2 LEU A 36 -29.030 -5.518 1.915 1.00 71.11 H new ATOM 0 HB3 LEU A 36 -28.228 -4.010 1.524 1.00 71.11 H new ATOM 0 HG LEU A 36 -26.663 -6.456 2.338 1.00 34.33 H new ATOM 0 HD11 LEU A 36 -26.419 -6.893 -0.095 1.00 44.22 H new ATOM 0 HD12 LEU A 36 -28.119 -7.017 0.415 1.00 44.22 H new ATOM 0 HD13 LEU A 36 -27.550 -5.563 -0.438 1.00 44.22 H new ATOM 0 HD21 LEU A 36 -24.897 -5.354 1.021 1.00 23.44 H new ATOM 0 HD22 LEU A 36 -26.008 -4.011 0.660 1.00 23.44 H new ATOM 0 HD23 LEU A 36 -25.480 -4.304 2.334 1.00 23.44 H new ATOM 411 N ASP A 37 -27.466 -6.671 4.504 1.00 74.43 N ATOM 412 CA ASP A 37 -27.578 -7.958 5.249 1.00 63.22 C ATOM 413 C ASP A 37 -26.477 -8.886 4.800 1.00 13.32 C ATOM 414 O ASP A 37 -25.748 -9.482 5.605 1.00 13.34 O ATOM 415 CB ASP A 37 -28.927 -8.654 4.959 1.00 74.53 C ATOM 416 CG ASP A 37 -29.060 -10.010 5.634 1.00 0.45 C ATOM 417 OD1 ASP A 37 -29.336 -10.057 6.837 1.00 61.22 O ATOM 418 OD2 ASP A 37 -28.921 -11.049 4.944 1.00 0.15 O ATOM 0 H ASP A 37 -26.603 -6.586 3.968 1.00 74.43 H new ATOM 0 HA ASP A 37 -27.505 -7.739 6.314 1.00 63.22 H new ATOM 0 HB2 ASP A 37 -29.740 -8.009 5.292 1.00 74.53 H new ATOM 0 HB3 ASP A 37 -29.040 -8.779 3.882 1.00 74.53 H new ATOM 423 N ARG A 38 -26.359 -8.991 3.501 1.00 3.43 N ATOM 424 CA ARG A 38 -25.412 -9.875 2.878 1.00 51.15 C ATOM 425 C ARG A 38 -24.127 -9.145 2.612 1.00 43.32 C ATOM 426 O ARG A 38 -24.018 -7.946 2.886 1.00 45.14 O ATOM 427 CB ARG A 38 -25.977 -10.412 1.568 1.00 74.21 C ATOM 428 CG ARG A 38 -27.275 -11.164 1.729 1.00 12.52 C ATOM 429 CD ARG A 38 -27.785 -11.658 0.398 1.00 50.51 C ATOM 430 NE ARG A 38 -29.065 -12.336 0.534 1.00 33.23 N ATOM 431 CZ ARG A 38 -29.704 -12.957 -0.443 1.00 31.20 C ATOM 432 NH1 ARG A 38 -29.133 -13.083 -1.632 1.00 21.40 N ATOM 433 NH2 ARG A 38 -30.904 -13.489 -0.223 1.00 22.54 N ATOM 0 H ARG A 38 -26.925 -8.458 2.840 1.00 3.43 H new ATOM 0 HA ARG A 38 -25.218 -10.710 3.551 1.00 51.15 H new ATOM 0 HB2 ARG A 38 -26.133 -9.580 0.882 1.00 74.21 H new ATOM 0 HB3 ARG A 38 -25.240 -11.071 1.108 1.00 74.21 H new ATOM 0 HG2 ARG A 38 -27.128 -12.009 2.402 1.00 12.52 H new ATOM 0 HG3 ARG A 38 -28.020 -10.515 2.189 1.00 12.52 H new ATOM 0 HD2 ARG A 38 -27.889 -10.817 -0.288 1.00 50.51 H new ATOM 0 HD3 ARG A 38 -27.056 -12.339 -0.042 1.00 50.51 H new ATOM 0 HE ARG A 38 -29.504 -12.332 1.455 1.00 33.23 H new ATOM 0 HH11 ARG A 38 -28.201 -12.701 -1.793 1.00 21.40 H new ATOM 0 HH12 ARG A 38 -29.625 -13.562 -2.386 1.00 21.40 H new ATOM 0 HH21 ARG A 38 -31.332 -13.418 0.700 1.00 22.54 H new ATOM 0 HH22 ARG A 38 -31.396 -13.968 -0.978 1.00 22.54 H new ATOM 447 N THR A 39 -23.156 -9.850 2.106 1.00 34.10 N ATOM 448 CA THR A 39 -21.892 -9.268 1.778 1.00 20.21 C ATOM 449 C THR A 39 -21.262 -10.011 0.589 1.00 55.44 C ATOM 450 O THR A 39 -21.144 -11.240 0.615 1.00 41.05 O ATOM 451 CB THR A 39 -20.936 -9.337 2.991 1.00 14.33 C ATOM 452 OG1 THR A 39 -21.564 -8.707 4.123 1.00 24.42 O ATOM 453 CG2 THR A 39 -19.642 -8.611 2.682 1.00 43.04 C ATOM 0 H THR A 39 -23.222 -10.849 1.910 1.00 34.10 H new ATOM 0 HA THR A 39 -22.053 -8.224 1.509 1.00 20.21 H new ATOM 0 HB THR A 39 -20.718 -10.382 3.211 1.00 14.33 H new ATOM 0 HG1 THR A 39 -21.004 -7.967 4.438 1.00 24.42 H new ATOM 0 HG21 THR A 39 -18.978 -8.667 3.545 1.00 43.04 H new ATOM 0 HG22 THR A 39 -19.160 -9.076 1.822 1.00 43.04 H new ATOM 0 HG23 THR A 39 -19.856 -7.566 2.457 1.00 43.04 H new ATOM 461 N PRO A 40 -20.918 -9.295 -0.488 1.00 4.44 N ATOM 462 CA PRO A 40 -20.204 -9.867 -1.627 1.00 31.42 C ATOM 463 C PRO A 40 -18.787 -10.270 -1.228 1.00 0.11 C ATOM 464 O PRO A 40 -18.214 -9.690 -0.311 1.00 23.11 O ATOM 465 CB PRO A 40 -20.142 -8.721 -2.639 1.00 10.10 C ATOM 466 CG PRO A 40 -21.156 -7.749 -2.187 1.00 5.40 C ATOM 467 CD PRO A 40 -21.208 -7.871 -0.705 1.00 11.14 C ATOM 0 HA PRO A 40 -20.694 -10.761 -2.014 1.00 31.42 H new ATOM 0 HB2 PRO A 40 -19.149 -8.271 -2.664 1.00 10.10 H new ATOM 0 HB3 PRO A 40 -20.357 -9.074 -3.647 1.00 10.10 H new ATOM 0 HG2 PRO A 40 -20.886 -6.736 -2.486 1.00 5.40 H new ATOM 0 HG3 PRO A 40 -22.128 -7.964 -2.631 1.00 5.40 H new ATOM 0 HD2 PRO A 40 -20.472 -7.229 -0.220 1.00 11.14 H new ATOM 0 HD3 PRO A 40 -22.185 -7.592 -0.310 1.00 11.14 H new ATOM 475 N GLU A 41 -18.250 -11.260 -1.898 1.00 61.43 N ATOM 476 CA GLU A 41 -16.906 -11.745 -1.623 1.00 31.11 C ATOM 477 C GLU A 41 -15.900 -10.676 -2.063 1.00 65.31 C ATOM 478 O GLU A 41 -16.038 -10.096 -3.135 1.00 34.22 O ATOM 479 CB GLU A 41 -16.661 -13.060 -2.364 1.00 74.45 C ATOM 480 CG GLU A 41 -15.348 -13.737 -2.010 1.00 73.41 C ATOM 481 CD GLU A 41 -15.277 -14.100 -0.550 1.00 13.52 C ATOM 482 OE1 GLU A 41 -15.870 -15.130 -0.155 1.00 3.30 O ATOM 483 OE2 GLU A 41 -14.614 -13.376 0.229 1.00 10.15 O ATOM 0 H GLU A 41 -18.727 -11.757 -2.651 1.00 61.43 H new ATOM 0 HA GLU A 41 -16.787 -11.935 -0.556 1.00 31.11 H new ATOM 0 HB2 GLU A 41 -17.481 -13.745 -2.147 1.00 74.45 H new ATOM 0 HB3 GLU A 41 -16.681 -12.869 -3.437 1.00 74.45 H new ATOM 0 HG2 GLU A 41 -15.230 -14.637 -2.614 1.00 73.41 H new ATOM 0 HG3 GLU A 41 -14.519 -13.074 -2.260 1.00 73.41 H new ATOM 490 N ILE A 42 -14.909 -10.422 -1.254 1.00 63.22 N ATOM 491 CA ILE A 42 -14.001 -9.317 -1.519 1.00 75.45 C ATOM 492 C ILE A 42 -12.654 -9.826 -2.027 1.00 65.42 C ATOM 493 O ILE A 42 -12.144 -10.844 -1.559 1.00 21.01 O ATOM 494 CB ILE A 42 -13.737 -8.431 -0.239 1.00 41.54 C ATOM 495 CG1 ILE A 42 -15.023 -7.972 0.460 1.00 64.31 C ATOM 496 CG2 ILE A 42 -12.913 -7.222 -0.588 1.00 54.20 C ATOM 497 CD1 ILE A 42 -15.684 -9.012 1.344 1.00 74.41 C ATOM 0 H ILE A 42 -14.702 -10.955 -0.409 1.00 63.22 H new ATOM 0 HA ILE A 42 -14.490 -8.706 -2.278 1.00 75.45 H new ATOM 0 HB ILE A 42 -13.195 -9.072 0.456 1.00 41.54 H new ATOM 0 HG12 ILE A 42 -14.795 -7.095 1.066 1.00 64.31 H new ATOM 0 HG13 ILE A 42 -15.738 -7.657 -0.300 1.00 64.31 H new ATOM 0 HG21 ILE A 42 -12.743 -6.626 0.309 1.00 54.20 H new ATOM 0 HG22 ILE A 42 -11.955 -7.541 -0.998 1.00 54.20 H new ATOM 0 HG23 ILE A 42 -13.443 -6.622 -1.328 1.00 54.20 H new ATOM 0 HD11 ILE A 42 -16.584 -8.590 1.792 1.00 74.41 H new ATOM 0 HD12 ILE A 42 -15.951 -9.882 0.745 1.00 74.41 H new ATOM 0 HD13 ILE A 42 -14.993 -9.312 2.132 1.00 74.41 H new ATOM 509 N VAL A 43 -12.114 -9.137 -2.986 1.00 71.21 N ATOM 510 CA VAL A 43 -10.796 -9.430 -3.493 1.00 50.22 C ATOM 511 C VAL A 43 -9.970 -8.135 -3.576 1.00 62.45 C ATOM 512 O VAL A 43 -10.526 -7.057 -3.812 1.00 21.32 O ATOM 513 CB VAL A 43 -10.846 -10.135 -4.884 1.00 42.31 C ATOM 514 CG1 VAL A 43 -11.487 -9.251 -5.940 1.00 22.10 C ATOM 515 CG2 VAL A 43 -9.461 -10.575 -5.318 1.00 24.30 C ATOM 0 H VAL A 43 -12.573 -8.350 -3.445 1.00 71.21 H new ATOM 0 HA VAL A 43 -10.319 -10.122 -2.800 1.00 50.22 H new ATOM 0 HB VAL A 43 -11.470 -11.022 -4.777 1.00 42.31 H new ATOM 0 HG11 VAL A 43 -11.503 -9.777 -6.894 1.00 22.10 H new ATOM 0 HG12 VAL A 43 -12.507 -9.009 -5.642 1.00 22.10 H new ATOM 0 HG13 VAL A 43 -10.911 -8.331 -6.043 1.00 22.10 H new ATOM 0 HG21 VAL A 43 -9.523 -11.064 -6.290 1.00 24.30 H new ATOM 0 HG22 VAL A 43 -8.809 -9.705 -5.390 1.00 24.30 H new ATOM 0 HG23 VAL A 43 -9.055 -11.273 -4.586 1.00 24.30 H new ATOM 525 N SER A 44 -8.682 -8.229 -3.344 1.00 23.14 N ATOM 526 CA SER A 44 -7.794 -7.102 -3.511 1.00 72.02 C ATOM 527 C SER A 44 -7.505 -6.903 -5.008 1.00 53.32 C ATOM 528 O SER A 44 -7.048 -7.831 -5.695 1.00 75.42 O ATOM 529 CB SER A 44 -6.500 -7.368 -2.752 1.00 21.00 C ATOM 530 OG SER A 44 -6.760 -7.521 -1.360 1.00 74.33 O ATOM 0 H SER A 44 -8.221 -9.085 -3.035 1.00 23.14 H new ATOM 0 HA SER A 44 -8.257 -6.197 -3.117 1.00 72.02 H new ATOM 0 HB2 SER A 44 -6.023 -8.268 -3.140 1.00 21.00 H new ATOM 0 HB3 SER A 44 -5.803 -6.545 -2.909 1.00 21.00 H new ATOM 0 HG SER A 44 -5.919 -7.693 -0.887 1.00 74.33 H new ATOM 536 N ALA A 45 -7.789 -5.729 -5.507 1.00 75.25 N ATOM 537 CA ALA A 45 -7.590 -5.428 -6.898 1.00 44.32 C ATOM 538 C ALA A 45 -6.953 -4.077 -7.074 1.00 11.32 C ATOM 539 O ALA A 45 -7.029 -3.212 -6.202 1.00 71.32 O ATOM 540 CB ALA A 45 -8.900 -5.487 -7.645 1.00 60.42 C ATOM 0 H ALA A 45 -8.165 -4.955 -4.959 1.00 75.25 H new ATOM 0 HA ALA A 45 -6.916 -6.179 -7.310 1.00 44.32 H new ATOM 0 HB1 ALA A 45 -8.730 -5.256 -8.697 1.00 60.42 H new ATOM 0 HB2 ALA A 45 -9.324 -6.487 -7.557 1.00 60.42 H new ATOM 0 HB3 ALA A 45 -9.593 -4.760 -7.222 1.00 60.42 H new ATOM 546 N THR A 46 -6.330 -3.905 -8.186 1.00 33.15 N ATOM 547 CA THR A 46 -5.676 -2.682 -8.519 1.00 43.22 C ATOM 548 C THR A 46 -6.426 -1.992 -9.631 1.00 0.13 C ATOM 549 O THR A 46 -6.703 -2.600 -10.650 1.00 14.44 O ATOM 550 CB THR A 46 -4.237 -2.958 -8.987 1.00 51.11 C ATOM 551 OG1 THR A 46 -3.529 -3.628 -7.945 1.00 21.32 O ATOM 552 CG2 THR A 46 -3.516 -1.663 -9.345 1.00 42.33 C ATOM 0 H THR A 46 -6.257 -4.623 -8.907 1.00 33.15 H new ATOM 0 HA THR A 46 -5.654 -2.047 -7.633 1.00 43.22 H new ATOM 0 HB THR A 46 -4.274 -3.582 -9.880 1.00 51.11 H new ATOM 0 HG1 THR A 46 -2.611 -3.808 -8.237 1.00 21.32 H new ATOM 0 HG21 THR A 46 -2.501 -1.890 -9.672 1.00 42.33 H new ATOM 0 HG22 THR A 46 -4.052 -1.158 -10.149 1.00 42.33 H new ATOM 0 HG23 THR A 46 -3.478 -1.014 -8.470 1.00 42.33 H new ATOM 560 N LEU A 47 -6.769 -0.754 -9.421 1.00 30.30 N ATOM 561 CA LEU A 47 -7.401 0.046 -10.422 1.00 4.05 C ATOM 562 C LEU A 47 -6.372 1.002 -11.027 1.00 60.23 C ATOM 563 O LEU A 47 -6.056 2.033 -10.432 1.00 13.24 O ATOM 564 CB LEU A 47 -8.580 0.820 -9.808 1.00 34.53 C ATOM 565 CG LEU A 47 -9.317 1.782 -10.729 1.00 1.01 C ATOM 566 CD1 LEU A 47 -9.835 1.067 -11.951 1.00 63.10 C ATOM 567 CD2 LEU A 47 -10.455 2.467 -9.992 1.00 72.43 C ATOM 0 H LEU A 47 -6.614 -0.268 -8.537 1.00 30.30 H new ATOM 0 HA LEU A 47 -7.793 -0.593 -11.213 1.00 4.05 H new ATOM 0 HB2 LEU A 47 -9.300 0.097 -9.425 1.00 34.53 H new ATOM 0 HB3 LEU A 47 -8.209 1.384 -8.953 1.00 34.53 H new ATOM 0 HG LEU A 47 -8.609 2.544 -11.054 1.00 1.01 H new ATOM 0 HD11 LEU A 47 -10.358 1.776 -12.593 1.00 63.10 H new ATOM 0 HD12 LEU A 47 -9.000 0.629 -12.498 1.00 63.10 H new ATOM 0 HD13 LEU A 47 -10.523 0.278 -11.647 1.00 63.10 H new ATOM 0 HD21 LEU A 47 -10.968 3.150 -10.669 1.00 72.43 H new ATOM 0 HD22 LEU A 47 -11.159 1.717 -9.631 1.00 72.43 H new ATOM 0 HD23 LEU A 47 -10.056 3.026 -9.146 1.00 72.43 H new ATOM 579 N PRO A 48 -5.788 0.648 -12.173 1.00 72.21 N ATOM 580 CA PRO A 48 -4.815 1.487 -12.832 1.00 41.13 C ATOM 581 C PRO A 48 -5.492 2.551 -13.684 1.00 11.33 C ATOM 582 O PRO A 48 -6.555 2.312 -14.276 1.00 43.42 O ATOM 583 CB PRO A 48 -4.028 0.508 -13.700 1.00 54.23 C ATOM 584 CG PRO A 48 -4.982 -0.601 -14.009 1.00 3.42 C ATOM 585 CD PRO A 48 -6.025 -0.607 -12.918 1.00 14.23 C ATOM 0 HA PRO A 48 -4.185 2.033 -12.130 1.00 41.13 H new ATOM 0 HB2 PRO A 48 -3.674 0.988 -14.612 1.00 54.23 H new ATOM 0 HB3 PRO A 48 -3.149 0.135 -13.174 1.00 54.23 H new ATOM 0 HG2 PRO A 48 -5.445 -0.450 -14.984 1.00 3.42 H new ATOM 0 HG3 PRO A 48 -4.461 -1.557 -14.049 1.00 3.42 H new ATOM 0 HD2 PRO A 48 -7.033 -0.638 -13.332 1.00 14.23 H new ATOM 0 HD3 PRO A 48 -5.919 -1.478 -12.272 1.00 14.23 H new ATOM 593 N GLY A 49 -4.906 3.718 -13.719 1.00 12.02 N ATOM 594 CA GLY A 49 -5.454 4.784 -14.502 1.00 44.13 C ATOM 595 C GLY A 49 -6.387 5.652 -13.696 1.00 64.43 C ATOM 596 O GLY A 49 -7.092 6.491 -14.248 1.00 5.23 O ATOM 0 H GLY A 49 -4.051 3.951 -13.214 1.00 12.02 H new ATOM 0 HA2 GLY A 49 -4.644 5.395 -14.901 1.00 44.13 H new ATOM 0 HA3 GLY A 49 -5.991 4.369 -15.355 1.00 44.13 H new ATOM 600 N PHE A 50 -6.391 5.462 -12.387 1.00 51.23 N ATOM 601 CA PHE A 50 -7.251 6.217 -11.484 1.00 72.40 C ATOM 602 C PHE A 50 -6.511 6.533 -10.209 1.00 70.22 C ATOM 603 O PHE A 50 -5.503 5.904 -9.912 1.00 12.54 O ATOM 604 CB PHE A 50 -8.561 5.464 -11.179 1.00 14.32 C ATOM 605 CG PHE A 50 -9.489 5.325 -12.365 1.00 61.12 C ATOM 606 CD1 PHE A 50 -9.341 4.293 -13.275 1.00 2.31 C ATOM 607 CD2 PHE A 50 -10.500 6.241 -12.567 1.00 62.53 C ATOM 608 CE1 PHE A 50 -10.181 4.184 -14.358 1.00 34.41 C ATOM 609 CE2 PHE A 50 -11.345 6.137 -13.648 1.00 3.12 C ATOM 610 CZ PHE A 50 -11.186 5.109 -14.545 1.00 45.31 C ATOM 0 H PHE A 50 -5.797 4.779 -11.917 1.00 51.23 H new ATOM 0 HA PHE A 50 -7.521 7.149 -11.980 1.00 72.40 H new ATOM 0 HB2 PHE A 50 -8.316 4.470 -10.805 1.00 14.32 H new ATOM 0 HB3 PHE A 50 -9.088 5.984 -10.379 1.00 14.32 H new ATOM 0 HD1 PHE A 50 -8.556 3.565 -13.133 1.00 2.31 H new ATOM 0 HD2 PHE A 50 -10.630 7.052 -11.866 1.00 62.53 H new ATOM 0 HE1 PHE A 50 -10.054 3.375 -15.062 1.00 34.41 H new ATOM 0 HE2 PHE A 50 -12.132 6.863 -13.791 1.00 3.12 H new ATOM 0 HZ PHE A 50 -11.847 5.026 -15.395 1.00 45.31 H new ATOM 620 N GLN A 51 -6.990 7.508 -9.472 1.00 3.21 N ATOM 621 CA GLN A 51 -6.348 7.920 -8.246 1.00 2.22 C ATOM 622 C GLN A 51 -7.380 8.252 -7.181 1.00 14.15 C ATOM 623 O GLN A 51 -8.493 8.680 -7.502 1.00 61.31 O ATOM 624 CB GLN A 51 -5.473 9.149 -8.507 1.00 74.10 C ATOM 625 CG GLN A 51 -4.705 9.640 -7.295 1.00 71.44 C ATOM 626 CD GLN A 51 -3.755 8.602 -6.770 1.00 63.35 C ATOM 627 OE1 GLN A 51 -4.106 7.788 -5.908 1.00 30.54 O ATOM 628 NE2 GLN A 51 -2.564 8.606 -7.283 1.00 10.25 N ATOM 0 H GLN A 51 -7.832 8.036 -9.704 1.00 3.21 H new ATOM 0 HA GLN A 51 -5.730 7.096 -7.889 1.00 2.22 H new ATOM 0 HB2 GLN A 51 -4.764 8.913 -9.300 1.00 74.10 H new ATOM 0 HB3 GLN A 51 -6.104 9.958 -8.874 1.00 74.10 H new ATOM 0 HG2 GLN A 51 -4.149 10.540 -7.559 1.00 71.44 H new ATOM 0 HG3 GLN A 51 -5.408 9.918 -6.509 1.00 71.44 H new ATOM 0 HE21 GLN A 51 -2.317 9.296 -7.992 1.00 10.25 H new ATOM 0 HE22 GLN A 51 -1.875 7.919 -6.977 1.00 10.25 H new ATOM 637 N ARG A 52 -7.008 8.024 -5.924 1.00 11.51 N ATOM 638 CA ARG A 52 -7.817 8.418 -4.799 1.00 11.44 C ATOM 639 C ARG A 52 -7.170 9.603 -4.117 1.00 52.40 C ATOM 640 O ARG A 52 -5.961 9.595 -3.822 1.00 54.54 O ATOM 641 CB ARG A 52 -8.049 7.282 -3.758 1.00 65.20 C ATOM 642 CG ARG A 52 -6.781 6.638 -3.211 1.00 0.33 C ATOM 643 CD ARG A 52 -6.854 6.407 -1.693 1.00 73.42 C ATOM 644 NE ARG A 52 -7.985 5.582 -1.233 1.00 20.34 N ATOM 645 CZ ARG A 52 -8.235 5.312 0.080 1.00 73.44 C ATOM 646 NH1 ARG A 52 -7.415 5.759 1.027 1.00 62.42 N ATOM 647 NH2 ARG A 52 -9.293 4.603 0.437 1.00 61.20 N ATOM 0 H ARG A 52 -6.136 7.561 -5.668 1.00 11.51 H new ATOM 0 HA ARG A 52 -8.800 8.674 -5.194 1.00 11.44 H new ATOM 0 HB2 ARG A 52 -8.622 7.687 -2.923 1.00 65.20 H new ATOM 0 HB3 ARG A 52 -8.662 6.507 -4.219 1.00 65.20 H new ATOM 0 HG2 ARG A 52 -6.614 5.686 -3.714 1.00 0.33 H new ATOM 0 HG3 ARG A 52 -5.925 7.274 -3.439 1.00 0.33 H new ATOM 0 HD2 ARG A 52 -5.926 5.935 -1.369 1.00 73.42 H new ATOM 0 HD3 ARG A 52 -6.908 7.376 -1.197 1.00 73.42 H new ATOM 0 HE ARG A 52 -8.615 5.192 -1.934 1.00 20.34 H new ATOM 0 HH11 ARG A 52 -6.593 6.307 0.773 1.00 62.42 H new ATOM 0 HH12 ARG A 52 -7.608 5.553 2.007 1.00 62.42 H new ATOM 0 HH21 ARG A 52 -9.934 4.251 -0.274 1.00 61.20 H new ATOM 0 HH22 ARG A 52 -9.468 4.409 1.423 1.00 61.20 H new ATOM 661 N PHE A 53 -7.943 10.595 -3.872 1.00 20.32 N ATOM 662 CA PHE A 53 -7.473 11.780 -3.197 1.00 74.33 C ATOM 663 C PHE A 53 -8.063 11.778 -1.829 1.00 73.12 C ATOM 664 O PHE A 53 -9.244 11.489 -1.680 1.00 14.22 O ATOM 665 CB PHE A 53 -7.920 13.037 -3.951 1.00 70.53 C ATOM 666 CG PHE A 53 -7.277 13.197 -5.290 1.00 13.42 C ATOM 667 CD1 PHE A 53 -7.642 12.397 -6.355 1.00 72.03 C ATOM 668 CD2 PHE A 53 -6.301 14.147 -5.483 1.00 35.22 C ATOM 669 CE1 PHE A 53 -7.042 12.540 -7.579 1.00 21.43 C ATOM 670 CE2 PHE A 53 -5.700 14.299 -6.707 1.00 63.23 C ATOM 671 CZ PHE A 53 -6.069 13.493 -7.758 1.00 2.13 C ATOM 0 H PHE A 53 -8.929 10.623 -4.130 1.00 20.32 H new ATOM 0 HA PHE A 53 -6.384 11.783 -3.152 1.00 74.33 H new ATOM 0 HB2 PHE A 53 -9.002 13.007 -4.079 1.00 70.53 H new ATOM 0 HB3 PHE A 53 -7.695 13.913 -3.343 1.00 70.53 H new ATOM 0 HD1 PHE A 53 -8.410 11.649 -6.222 1.00 72.03 H new ATOM 0 HD2 PHE A 53 -6.004 14.781 -4.661 1.00 35.22 H new ATOM 0 HE1 PHE A 53 -7.334 11.904 -8.402 1.00 21.43 H new ATOM 0 HE2 PHE A 53 -4.938 15.051 -6.845 1.00 63.23 H new ATOM 0 HZ PHE A 53 -5.595 13.609 -8.722 1.00 2.13 H new ATOM 681 N ARG A 54 -7.285 12.072 -0.818 1.00 63.33 N ATOM 682 CA ARG A 54 -7.839 12.000 0.487 1.00 24.00 C ATOM 683 C ARG A 54 -7.912 13.371 1.137 1.00 41.42 C ATOM 684 O ARG A 54 -6.920 14.107 1.217 1.00 23.14 O ATOM 685 CB ARG A 54 -7.153 10.913 1.387 1.00 74.44 C ATOM 686 CG ARG A 54 -5.900 11.300 2.200 1.00 41.14 C ATOM 687 CD ARG A 54 -4.689 11.771 1.408 1.00 15.23 C ATOM 688 NE ARG A 54 -3.668 12.267 2.355 1.00 10.41 N ATOM 689 CZ ARG A 54 -2.403 12.619 2.085 1.00 40.15 C ATOM 690 NH1 ARG A 54 -1.898 12.486 0.885 1.00 23.21 N ATOM 691 NH2 ARG A 54 -1.643 13.105 3.050 1.00 43.42 N ATOM 0 H ARG A 54 -6.306 12.352 -0.878 1.00 63.33 H new ATOM 0 HA ARG A 54 -8.868 11.656 0.379 1.00 24.00 H new ATOM 0 HB2 ARG A 54 -7.902 10.547 2.090 1.00 74.44 H new ATOM 0 HB3 ARG A 54 -6.883 10.075 0.744 1.00 74.44 H new ATOM 0 HG2 ARG A 54 -6.178 12.090 2.898 1.00 41.14 H new ATOM 0 HG3 ARG A 54 -5.602 10.438 2.796 1.00 41.14 H new ATOM 0 HD2 ARG A 54 -4.286 10.953 0.812 1.00 15.23 H new ATOM 0 HD3 ARG A 54 -4.975 12.561 0.713 1.00 15.23 H new ATOM 0 HE ARG A 54 -3.960 12.351 3.329 1.00 10.41 H new ATOM 0 HH11 ARG A 54 -2.470 12.107 0.130 1.00 23.21 H new ATOM 0 HH12 ARG A 54 -0.933 12.761 0.705 1.00 23.21 H new ATOM 0 HH21 ARG A 54 -2.020 13.210 3.992 1.00 43.42 H new ATOM 0 HH22 ARG A 54 -0.679 13.375 2.853 1.00 43.42 H new ATOM 796 N TYR A 60 -14.476 12.885 0.777 1.00 55.03 N ATOM 797 CA TYR A 60 -14.165 11.488 0.902 1.00 11.05 C ATOM 798 C TYR A 60 -12.975 11.164 0.008 1.00 60.32 C ATOM 799 O TYR A 60 -12.555 12.022 -0.774 1.00 74.21 O ATOM 800 CB TYR A 60 -15.404 10.681 0.488 1.00 72.41 C ATOM 801 CG TYR A 60 -16.665 11.105 1.225 1.00 60.20 C ATOM 802 CD1 TYR A 60 -16.931 10.653 2.509 1.00 63.43 C ATOM 803 CD2 TYR A 60 -17.578 11.977 0.636 1.00 43.03 C ATOM 804 CE1 TYR A 60 -18.068 11.051 3.182 1.00 51.15 C ATOM 805 CE2 TYR A 60 -18.713 12.382 1.305 1.00 5.23 C ATOM 806 CZ TYR A 60 -18.954 11.916 2.577 1.00 23.14 C ATOM 807 OH TYR A 60 -20.084 12.321 3.253 1.00 63.33 O ATOM 0 HA TYR A 60 -13.902 11.233 1.929 1.00 11.05 H new ATOM 0 HB2 TYR A 60 -15.562 10.793 -0.585 1.00 72.41 H new ATOM 0 HB3 TYR A 60 -15.220 9.623 0.674 1.00 72.41 H new ATOM 0 HD1 TYR A 60 -16.237 9.979 2.990 1.00 63.43 H new ATOM 0 HD2 TYR A 60 -17.393 12.342 -0.363 1.00 43.03 H new ATOM 0 HE1 TYR A 60 -18.263 10.686 4.180 1.00 51.15 H new ATOM 0 HE2 TYR A 60 -19.409 13.061 0.834 1.00 5.23 H new ATOM 0 HH TYR A 60 -20.603 12.931 2.688 1.00 63.33 H new ATOM 817 N PRO A 61 -12.363 9.964 0.130 1.00 60.20 N ATOM 818 CA PRO A 61 -11.311 9.552 -0.779 1.00 75.42 C ATOM 819 C PRO A 61 -11.908 9.187 -2.135 1.00 63.33 C ATOM 820 O PRO A 61 -12.153 8.013 -2.433 1.00 13.21 O ATOM 821 CB PRO A 61 -10.665 8.323 -0.105 1.00 11.12 C ATOM 822 CG PRO A 61 -11.286 8.248 1.260 1.00 61.42 C ATOM 823 CD PRO A 61 -12.612 8.947 1.160 1.00 34.12 C ATOM 0 HA PRO A 61 -10.580 10.339 -0.962 1.00 75.42 H new ATOM 0 HB2 PRO A 61 -10.858 7.415 -0.676 1.00 11.12 H new ATOM 0 HB3 PRO A 61 -9.583 8.434 -0.039 1.00 11.12 H new ATOM 0 HG2 PRO A 61 -11.416 7.212 1.572 1.00 61.42 H new ATOM 0 HG3 PRO A 61 -10.649 8.727 2.004 1.00 61.42 H new ATOM 0 HD2 PRO A 61 -13.410 8.263 0.870 1.00 34.12 H new ATOM 0 HD3 PRO A 61 -12.906 9.395 2.109 1.00 34.12 H new ATOM 831 N CYS A 62 -12.197 10.201 -2.904 1.00 75.24 N ATOM 832 CA CYS A 62 -12.862 10.047 -4.161 1.00 72.34 C ATOM 833 C CYS A 62 -11.887 9.602 -5.253 1.00 51.13 C ATOM 834 O CYS A 62 -10.680 9.892 -5.192 1.00 14.24 O ATOM 835 CB CYS A 62 -13.577 11.356 -4.526 1.00 21.31 C ATOM 836 SG CYS A 62 -14.643 11.992 -3.211 1.00 54.22 S ATOM 0 H CYS A 62 -11.973 11.168 -2.669 1.00 75.24 H new ATOM 0 HA CYS A 62 -13.611 9.260 -4.076 1.00 72.34 H new ATOM 0 HB2 CYS A 62 -12.831 12.111 -4.774 1.00 21.31 H new ATOM 0 HB3 CYS A 62 -14.177 11.195 -5.422 1.00 21.31 H new ATOM 0 HG CYS A 62 -15.711 12.517 -3.734 1.00 54.22 H new ATOM 842 N ILE A 63 -12.412 8.877 -6.223 1.00 54.25 N ATOM 843 CA ILE A 63 -11.629 8.335 -7.321 1.00 2.14 C ATOM 844 C ILE A 63 -11.871 9.158 -8.568 1.00 54.11 C ATOM 845 O ILE A 63 -12.986 9.566 -8.813 1.00 53.11 O ATOM 846 CB ILE A 63 -12.066 6.860 -7.632 1.00 52.22 C ATOM 847 CG1 ILE A 63 -11.892 5.955 -6.418 1.00 54.42 C ATOM 848 CG2 ILE A 63 -11.315 6.283 -8.832 1.00 71.20 C ATOM 849 CD1 ILE A 63 -10.466 5.835 -5.931 1.00 23.15 C ATOM 0 H ILE A 63 -13.404 8.645 -6.273 1.00 54.25 H new ATOM 0 HA ILE A 63 -10.578 8.360 -7.034 1.00 2.14 H new ATOM 0 HB ILE A 63 -13.126 6.898 -7.883 1.00 52.22 H new ATOM 0 HG12 ILE A 63 -12.511 6.335 -5.605 1.00 54.42 H new ATOM 0 HG13 ILE A 63 -12.264 4.961 -6.664 1.00 54.42 H new ATOM 0 HG21 ILE A 63 -11.648 5.261 -9.012 1.00 71.20 H new ATOM 0 HG22 ILE A 63 -11.516 6.891 -9.714 1.00 71.20 H new ATOM 0 HG23 ILE A 63 -10.245 6.285 -8.627 1.00 71.20 H new ATOM 0 HD11 ILE A 63 -10.432 5.174 -5.065 1.00 23.15 H new ATOM 0 HD12 ILE A 63 -9.843 5.425 -6.726 1.00 23.15 H new ATOM 0 HD13 ILE A 63 -10.093 6.820 -5.650 1.00 23.15 H new ATOM 861 N VAL A 64 -10.833 9.422 -9.316 1.00 71.01 N ATOM 862 CA VAL A 64 -10.935 10.058 -10.636 1.00 2.41 C ATOM 863 C VAL A 64 -9.840 9.484 -11.518 1.00 30.13 C ATOM 864 O VAL A 64 -8.841 8.972 -10.992 1.00 2.55 O ATOM 865 CB VAL A 64 -10.788 11.625 -10.605 1.00 54.43 C ATOM 866 CG1 VAL A 64 -11.939 12.283 -9.895 1.00 35.41 C ATOM 867 CG2 VAL A 64 -9.471 12.040 -9.971 1.00 22.05 C ATOM 0 H VAL A 64 -9.876 9.206 -9.038 1.00 71.01 H new ATOM 0 HA VAL A 64 -11.934 9.849 -11.018 1.00 2.41 H new ATOM 0 HB VAL A 64 -10.798 11.964 -11.641 1.00 54.43 H new ATOM 0 HG11 VAL A 64 -11.798 13.364 -9.897 1.00 35.41 H new ATOM 0 HG12 VAL A 64 -12.870 12.038 -10.406 1.00 35.41 H new ATOM 0 HG13 VAL A 64 -11.985 11.925 -8.867 1.00 35.41 H new ATOM 0 HG21 VAL A 64 -9.398 13.127 -9.963 1.00 22.05 H new ATOM 0 HG22 VAL A 64 -9.426 11.666 -8.948 1.00 22.05 H new ATOM 0 HG23 VAL A 64 -8.643 11.624 -10.546 1.00 22.05 H new ATOM 877 N PRO A 65 -10.014 9.505 -12.850 1.00 35.52 N ATOM 878 CA PRO A 65 -8.995 9.021 -13.777 1.00 40.14 C ATOM 879 C PRO A 65 -7.676 9.794 -13.657 1.00 25.40 C ATOM 880 O PRO A 65 -7.641 11.023 -13.753 1.00 33.32 O ATOM 881 CB PRO A 65 -9.618 9.219 -15.167 1.00 12.11 C ATOM 882 CG PRO A 65 -10.757 10.156 -14.958 1.00 4.25 C ATOM 883 CD PRO A 65 -11.224 9.956 -13.551 1.00 3.44 C ATOM 0 HA PRO A 65 -8.733 7.983 -13.571 1.00 40.14 H new ATOM 0 HB2 PRO A 65 -8.893 9.632 -15.868 1.00 12.11 H new ATOM 0 HB3 PRO A 65 -9.960 8.271 -15.583 1.00 12.11 H new ATOM 0 HG2 PRO A 65 -10.444 11.188 -15.119 1.00 4.25 H new ATOM 0 HG3 PRO A 65 -11.561 9.952 -15.665 1.00 4.25 H new ATOM 0 HD2 PRO A 65 -11.616 10.879 -13.123 1.00 3.44 H new ATOM 0 HD3 PRO A 65 -12.021 9.215 -13.494 1.00 3.44 H new ATOM 891 N SER A 66 -6.616 9.070 -13.449 1.00 60.40 N ATOM 892 CA SER A 66 -5.302 9.623 -13.313 1.00 71.20 C ATOM 893 C SER A 66 -4.423 8.958 -14.342 1.00 32.14 C ATOM 894 O SER A 66 -4.373 7.740 -14.417 1.00 32.41 O ATOM 895 CB SER A 66 -4.773 9.378 -11.900 1.00 72.01 C ATOM 896 OG SER A 66 -3.476 9.913 -11.726 1.00 33.53 O ATOM 0 H SER A 66 -6.643 8.054 -13.367 1.00 60.40 H new ATOM 0 HA SER A 66 -5.315 10.701 -13.474 1.00 71.20 H new ATOM 0 HB2 SER A 66 -5.452 9.827 -11.175 1.00 72.01 H new ATOM 0 HB3 SER A 66 -4.755 8.307 -11.699 1.00 72.01 H new ATOM 0 HG SER A 66 -3.171 9.739 -10.811 1.00 33.53 H new ATOM 902 N GLU A 67 -3.734 9.740 -15.110 1.00 61.50 N ATOM 903 CA GLU A 67 -2.977 9.231 -16.231 1.00 35.43 C ATOM 904 C GLU A 67 -1.710 8.482 -15.787 1.00 10.43 C ATOM 905 O GLU A 67 -1.113 7.731 -16.568 1.00 21.51 O ATOM 906 CB GLU A 67 -2.630 10.376 -17.175 1.00 42.03 C ATOM 907 CG GLU A 67 -3.845 11.202 -17.608 1.00 42.04 C ATOM 908 CD GLU A 67 -4.931 10.370 -18.263 1.00 35.03 C ATOM 909 OE1 GLU A 67 -4.758 9.967 -19.431 1.00 1.40 O ATOM 910 OE2 GLU A 67 -5.970 10.099 -17.611 1.00 63.50 O ATOM 0 H GLU A 67 -3.674 10.751 -14.986 1.00 61.50 H new ATOM 0 HA GLU A 67 -3.599 8.505 -16.755 1.00 35.43 H new ATOM 0 HB2 GLU A 67 -1.910 11.033 -16.687 1.00 42.03 H new ATOM 0 HB3 GLU A 67 -2.142 9.970 -18.061 1.00 42.03 H new ATOM 0 HG2 GLU A 67 -4.260 11.709 -16.737 1.00 42.04 H new ATOM 0 HG3 GLU A 67 -3.521 11.976 -18.303 1.00 42.04 H new ATOM 917 N LYS A 68 -1.299 8.687 -14.542 1.00 34.13 N ATOM 918 CA LYS A 68 -0.104 8.029 -14.020 1.00 51.10 C ATOM 919 C LYS A 68 -0.368 7.365 -12.660 1.00 3.44 C ATOM 920 O LYS A 68 0.570 6.962 -11.969 1.00 43.40 O ATOM 921 CB LYS A 68 1.039 9.039 -13.865 1.00 25.33 C ATOM 922 CG LYS A 68 1.453 9.726 -15.107 1.00 54.53 C ATOM 923 CD LYS A 68 2.561 10.667 -14.774 1.00 40.41 C ATOM 924 CE LYS A 68 3.135 11.274 -15.998 1.00 43.53 C ATOM 925 NZ LYS A 68 2.165 12.112 -16.733 1.00 61.00 N ATOM 0 H LYS A 68 -1.771 9.300 -13.877 1.00 34.13 H new ATOM 0 HA LYS A 68 0.175 7.257 -14.737 1.00 51.10 H new ATOM 0 HB2 LYS A 68 0.739 9.792 -13.136 1.00 25.33 H new ATOM 0 HB3 LYS A 68 1.904 8.522 -13.451 1.00 25.33 H new ATOM 0 HG2 LYS A 68 1.782 9.000 -15.851 1.00 54.53 H new ATOM 0 HG3 LYS A 68 0.612 10.268 -15.540 1.00 54.53 H new ATOM 0 HD2 LYS A 68 2.189 11.452 -14.116 1.00 40.41 H new ATOM 0 HD3 LYS A 68 3.341 10.136 -14.228 1.00 40.41 H new ATOM 0 HE2 LYS A 68 3.999 11.881 -15.726 1.00 43.53 H new ATOM 0 HE3 LYS A 68 3.495 10.483 -16.655 1.00 43.53 H new ATOM 0 HZ1 LYS A 68 2.653 12.617 -17.500 1.00 61.00 H new ATOM 0 HZ2 LYS A 68 1.420 11.508 -17.136 1.00 61.00 H new ATOM 0 HZ3 LYS A 68 1.738 12.801 -16.082 1.00 61.00 H new ATOM 939 N GLY A 69 -1.624 7.221 -12.291 1.00 43.53 N ATOM 940 CA GLY A 69 -1.930 6.683 -10.974 1.00 5.24 C ATOM 941 C GLY A 69 -2.562 5.303 -11.000 1.00 33.34 C ATOM 942 O GLY A 69 -2.949 4.801 -12.070 1.00 72.32 O ATOM 0 H GLY A 69 -2.433 7.461 -12.864 1.00 43.53 H new ATOM 0 HA2 GLY A 69 -1.011 6.639 -10.389 1.00 5.24 H new ATOM 0 HA3 GLY A 69 -2.603 7.369 -10.460 1.00 5.24 H new ATOM 946 N GLU A 70 -2.659 4.692 -9.832 1.00 21.33 N ATOM 947 CA GLU A 70 -3.297 3.409 -9.658 1.00 63.52 C ATOM 948 C GLU A 70 -3.784 3.298 -8.217 1.00 42.21 C ATOM 949 O GLU A 70 -3.090 3.712 -7.282 1.00 53.33 O ATOM 950 CB GLU A 70 -2.354 2.230 -10.016 1.00 51.11 C ATOM 951 CG GLU A 70 -1.114 2.080 -9.131 1.00 11.35 C ATOM 952 CD GLU A 70 -0.227 0.954 -9.586 1.00 30.41 C ATOM 953 OE1 GLU A 70 -0.442 -0.194 -9.158 1.00 2.24 O ATOM 954 OE2 GLU A 70 0.702 1.200 -10.382 1.00 1.10 O ATOM 0 H GLU A 70 -2.289 5.084 -8.966 1.00 21.33 H new ATOM 0 HA GLU A 70 -4.141 3.344 -10.344 1.00 63.52 H new ATOM 0 HB2 GLU A 70 -2.926 1.304 -9.968 1.00 51.11 H new ATOM 0 HB3 GLU A 70 -2.028 2.350 -11.049 1.00 51.11 H new ATOM 0 HG2 GLU A 70 -0.549 3.012 -9.139 1.00 11.35 H new ATOM 0 HG3 GLU A 70 -1.424 1.903 -8.101 1.00 11.35 H new ATOM 961 N VAL A 71 -4.960 2.775 -8.039 1.00 55.13 N ATOM 962 CA VAL A 71 -5.533 2.621 -6.722 1.00 34.44 C ATOM 963 C VAL A 71 -5.654 1.160 -6.387 1.00 4.13 C ATOM 964 O VAL A 71 -6.274 0.406 -7.111 1.00 64.11 O ATOM 965 CB VAL A 71 -6.944 3.282 -6.617 1.00 22.42 C ATOM 966 CG1 VAL A 71 -7.525 3.101 -5.222 1.00 70.51 C ATOM 967 CG2 VAL A 71 -6.867 4.752 -6.964 1.00 50.44 C ATOM 0 H VAL A 71 -5.554 2.441 -8.798 1.00 55.13 H new ATOM 0 HA VAL A 71 -4.868 3.121 -6.018 1.00 34.44 H new ATOM 0 HB VAL A 71 -7.603 2.787 -7.330 1.00 22.42 H new ATOM 0 HG11 VAL A 71 -8.508 3.570 -5.174 1.00 70.51 H new ATOM 0 HG12 VAL A 71 -7.619 2.038 -5.002 1.00 70.51 H new ATOM 0 HG13 VAL A 71 -6.865 3.566 -4.490 1.00 70.51 H new ATOM 0 HG21 VAL A 71 -7.859 5.197 -6.886 1.00 50.44 H new ATOM 0 HG22 VAL A 71 -6.189 5.254 -6.274 1.00 50.44 H new ATOM 0 HG23 VAL A 71 -6.498 4.866 -7.983 1.00 50.44 H new ATOM 977 N HIS A 72 -5.046 0.758 -5.316 1.00 3.32 N ATOM 978 CA HIS A 72 -5.170 -0.610 -4.869 1.00 34.12 C ATOM 979 C HIS A 72 -6.246 -0.643 -3.843 1.00 44.05 C ATOM 980 O HIS A 72 -6.141 0.005 -2.809 1.00 14.14 O ATOM 981 CB HIS A 72 -3.849 -1.160 -4.301 1.00 34.24 C ATOM 982 CG HIS A 72 -2.743 -1.251 -5.310 1.00 3.42 C ATOM 983 ND1 HIS A 72 -2.003 -2.384 -5.529 1.00 54.55 N ATOM 984 CD2 HIS A 72 -2.222 -0.318 -6.123 1.00 54.20 C ATOM 985 CE1 HIS A 72 -1.079 -2.128 -6.423 1.00 62.34 C ATOM 986 NE2 HIS A 72 -1.194 -0.888 -6.795 1.00 4.21 N ATOM 0 H HIS A 72 -4.458 1.350 -4.730 1.00 3.32 H new ATOM 0 HA HIS A 72 -5.419 -1.251 -5.715 1.00 34.12 H new ATOM 0 HB2 HIS A 72 -3.525 -0.522 -3.479 1.00 34.24 H new ATOM 0 HB3 HIS A 72 -4.029 -2.151 -3.884 1.00 34.24 H new ATOM 0 HD2 HIS A 72 -2.561 0.702 -6.223 1.00 54.20 H new ATOM 0 HE1 HIS A 72 -0.345 -2.830 -6.789 1.00 62.34 H new ATOM 0 HE2 HIS A 72 -0.604 -0.419 -7.483 1.00 4.21 H new ATOM 995 N GLY A 73 -7.282 -1.350 -4.141 1.00 64.45 N ATOM 996 CA GLY A 73 -8.403 -1.394 -3.275 1.00 35.23 C ATOM 997 C GLY A 73 -9.047 -2.732 -3.309 1.00 31.14 C ATOM 998 O GLY A 73 -8.405 -3.733 -3.655 1.00 71.54 O ATOM 0 H GLY A 73 -7.373 -1.910 -4.988 1.00 64.45 H new ATOM 0 HA2 GLY A 73 -8.090 -1.162 -2.257 1.00 35.23 H new ATOM 0 HA3 GLY A 73 -9.124 -0.631 -3.568 1.00 35.23 H new ATOM 1002 N LYS A 74 -10.292 -2.775 -2.988 1.00 62.40 N ATOM 1003 CA LYS A 74 -11.006 -4.019 -2.891 1.00 11.03 C ATOM 1004 C LYS A 74 -12.200 -4.053 -3.801 1.00 41.12 C ATOM 1005 O LYS A 74 -12.852 -3.037 -4.048 1.00 33.04 O ATOM 1006 CB LYS A 74 -11.444 -4.299 -1.445 1.00 25.11 C ATOM 1007 CG LYS A 74 -10.395 -4.917 -0.490 1.00 54.24 C ATOM 1008 CD LYS A 74 -9.095 -4.166 -0.460 1.00 55.33 C ATOM 1009 CE LYS A 74 -8.217 -4.577 0.706 1.00 32.25 C ATOM 1010 NZ LYS A 74 -7.852 -6.011 0.670 1.00 10.15 N ATOM 0 H LYS A 74 -10.855 -1.950 -2.782 1.00 62.40 H new ATOM 0 HA LYS A 74 -10.315 -4.801 -3.208 1.00 11.03 H new ATOM 0 HB2 LYS A 74 -11.785 -3.360 -1.009 1.00 25.11 H new ATOM 0 HB3 LYS A 74 -12.305 -4.967 -1.477 1.00 25.11 H new ATOM 0 HG2 LYS A 74 -10.809 -4.951 0.518 1.00 54.24 H new ATOM 0 HG3 LYS A 74 -10.203 -5.947 -0.791 1.00 54.24 H new ATOM 0 HD2 LYS A 74 -8.558 -4.337 -1.393 1.00 55.33 H new ATOM 0 HD3 LYS A 74 -9.298 -3.097 -0.400 1.00 55.33 H new ATOM 0 HE2 LYS A 74 -7.308 -3.975 0.701 1.00 32.25 H new ATOM 0 HE3 LYS A 74 -8.736 -4.362 1.640 1.00 32.25 H new ATOM 0 HZ1 LYS A 74 -7.146 -6.208 1.408 1.00 10.15 H new ATOM 0 HZ2 LYS A 74 -8.700 -6.589 0.839 1.00 10.15 H new ATOM 0 HZ3 LYS A 74 -7.453 -6.244 -0.262 1.00 10.15 H new ATOM 1024 N VAL A 75 -12.448 -5.213 -4.311 1.00 0.51 N ATOM 1025 CA VAL A 75 -13.583 -5.479 -5.148 1.00 13.53 C ATOM 1026 C VAL A 75 -14.587 -6.388 -4.448 1.00 70.31 C ATOM 1027 O VAL A 75 -14.219 -7.417 -3.890 1.00 23.42 O ATOM 1028 CB VAL A 75 -13.150 -6.131 -6.482 1.00 5.14 C ATOM 1029 CG1 VAL A 75 -14.348 -6.626 -7.252 1.00 41.54 C ATOM 1030 CG2 VAL A 75 -12.373 -5.145 -7.321 1.00 72.22 C ATOM 0 H VAL A 75 -11.854 -6.028 -4.156 1.00 0.51 H new ATOM 0 HA VAL A 75 -14.058 -4.520 -5.355 1.00 13.53 H new ATOM 0 HB VAL A 75 -12.511 -6.983 -6.249 1.00 5.14 H new ATOM 0 HG11 VAL A 75 -14.018 -7.080 -8.186 1.00 41.54 H new ATOM 0 HG12 VAL A 75 -14.882 -7.367 -6.657 1.00 41.54 H new ATOM 0 HG13 VAL A 75 -15.011 -5.789 -7.470 1.00 41.54 H new ATOM 0 HG21 VAL A 75 -12.075 -5.619 -8.257 1.00 72.22 H new ATOM 0 HG22 VAL A 75 -12.998 -4.278 -7.536 1.00 72.22 H new ATOM 0 HG23 VAL A 75 -11.484 -4.825 -6.777 1.00 72.22 H new ATOM 1040 N LEU A 76 -15.838 -5.987 -4.493 1.00 23.20 N ATOM 1041 CA LEU A 76 -16.942 -6.745 -3.952 1.00 74.42 C ATOM 1042 C LEU A 76 -17.567 -7.554 -5.080 1.00 5.53 C ATOM 1043 O LEU A 76 -18.225 -6.993 -5.947 1.00 52.13 O ATOM 1044 CB LEU A 76 -18.003 -5.790 -3.381 1.00 42.31 C ATOM 1045 CG LEU A 76 -17.551 -4.832 -2.285 1.00 52.31 C ATOM 1046 CD1 LEU A 76 -18.714 -3.979 -1.820 1.00 24.24 C ATOM 1047 CD2 LEU A 76 -16.955 -5.595 -1.127 1.00 12.45 C ATOM 0 H LEU A 76 -16.122 -5.104 -4.917 1.00 23.20 H new ATOM 0 HA LEU A 76 -16.583 -7.400 -3.158 1.00 74.42 H new ATOM 0 HB2 LEU A 76 -18.405 -5.199 -4.204 1.00 42.31 H new ATOM 0 HB3 LEU A 76 -18.824 -6.390 -2.989 1.00 42.31 H new ATOM 0 HG LEU A 76 -16.782 -4.176 -2.693 1.00 52.31 H new ATOM 0 HD11 LEU A 76 -18.377 -3.300 -1.037 1.00 24.24 H new ATOM 0 HD12 LEU A 76 -19.100 -3.402 -2.660 1.00 24.24 H new ATOM 0 HD13 LEU A 76 -19.502 -4.621 -1.428 1.00 24.24 H new ATOM 0 HD21 LEU A 76 -16.638 -4.895 -0.354 1.00 12.45 H new ATOM 0 HD22 LEU A 76 -17.702 -6.275 -0.716 1.00 12.45 H new ATOM 0 HD23 LEU A 76 -16.094 -6.167 -1.473 1.00 12.45 H new ATOM 1059 N MET A 77 -17.314 -8.841 -5.104 1.00 75.30 N ATOM 1060 CA MET A 77 -17.821 -9.708 -6.121 1.00 4.22 C ATOM 1061 C MET A 77 -19.032 -10.466 -5.633 1.00 64.13 C ATOM 1062 O MET A 77 -19.058 -10.957 -4.514 1.00 12.05 O ATOM 1063 CB MET A 77 -16.756 -10.697 -6.485 1.00 41.12 C ATOM 1064 CG MET A 77 -15.453 -10.061 -6.894 1.00 21.04 C ATOM 1065 SD MET A 77 -14.200 -11.261 -7.309 1.00 14.32 S ATOM 1066 CE MET A 77 -15.091 -12.118 -8.571 1.00 30.41 C ATOM 0 H MET A 77 -16.742 -9.314 -4.405 1.00 75.30 H new ATOM 0 HA MET A 77 -18.107 -9.104 -6.982 1.00 4.22 H new ATOM 0 HB2 MET A 77 -16.578 -11.355 -5.635 1.00 41.12 H new ATOM 0 HB3 MET A 77 -17.117 -11.322 -7.302 1.00 41.12 H new ATOM 0 HG2 MET A 77 -15.625 -9.410 -7.751 1.00 21.04 H new ATOM 0 HG3 MET A 77 -15.091 -9.430 -6.082 1.00 21.04 H new ATOM 0 HE1 MET A 77 -14.388 -12.607 -9.245 1.00 30.41 H new ATOM 0 HE2 MET A 77 -15.738 -12.868 -8.115 1.00 30.41 H new ATOM 0 HE3 MET A 77 -15.698 -11.409 -9.133 1.00 30.41 H new ATOM 1076 N GLY A 78 -20.002 -10.595 -6.473 1.00 73.32 N ATOM 1077 CA GLY A 78 -21.203 -11.304 -6.100 1.00 30.34 C ATOM 1078 C GLY A 78 -22.349 -10.365 -5.864 1.00 13.34 C ATOM 1079 O GLY A 78 -23.339 -10.716 -5.218 1.00 0.03 O ATOM 0 H GLY A 78 -19.998 -10.224 -7.423 1.00 73.32 H new ATOM 0 HA2 GLY A 78 -21.468 -12.011 -6.886 1.00 30.34 H new ATOM 0 HA3 GLY A 78 -21.017 -11.886 -5.197 1.00 30.34 H new ATOM 1083 N VAL A 79 -22.210 -9.176 -6.381 1.00 51.40 N ATOM 1084 CA VAL A 79 -23.221 -8.159 -6.274 1.00 32.04 C ATOM 1085 C VAL A 79 -24.409 -8.532 -7.127 1.00 52.14 C ATOM 1086 O VAL A 79 -24.253 -8.842 -8.309 1.00 4.13 O ATOM 1087 CB VAL A 79 -22.670 -6.787 -6.739 1.00 54.53 C ATOM 1088 CG1 VAL A 79 -23.721 -5.721 -6.702 1.00 14.04 C ATOM 1089 CG2 VAL A 79 -21.516 -6.366 -5.891 1.00 10.41 C ATOM 0 H VAL A 79 -21.380 -8.881 -6.896 1.00 51.40 H new ATOM 0 HA VAL A 79 -23.523 -8.082 -5.229 1.00 32.04 H new ATOM 0 HB VAL A 79 -22.342 -6.913 -7.771 1.00 54.53 H new ATOM 0 HG11 VAL A 79 -23.293 -4.776 -7.035 1.00 14.04 H new ATOM 0 HG12 VAL A 79 -24.544 -5.999 -7.360 1.00 14.04 H new ATOM 0 HG13 VAL A 79 -24.092 -5.611 -5.683 1.00 14.04 H new ATOM 0 HG21 VAL A 79 -21.145 -5.401 -6.235 1.00 10.41 H new ATOM 0 HG22 VAL A 79 -21.839 -6.282 -4.853 1.00 10.41 H new ATOM 0 HG23 VAL A 79 -20.721 -7.108 -5.965 1.00 10.41 H new ATOM 1099 N THR A 80 -25.569 -8.518 -6.556 1.00 74.53 N ATOM 1100 CA THR A 80 -26.755 -8.822 -7.297 1.00 63.52 C ATOM 1101 C THR A 80 -27.141 -7.599 -8.132 1.00 31.20 C ATOM 1102 O THR A 80 -26.582 -6.509 -7.935 1.00 30.42 O ATOM 1103 CB THR A 80 -27.911 -9.226 -6.353 1.00 61.02 C ATOM 1104 OG1 THR A 80 -28.177 -8.175 -5.417 1.00 61.34 O ATOM 1105 CG2 THR A 80 -27.561 -10.498 -5.597 1.00 35.51 C ATOM 0 H THR A 80 -25.724 -8.298 -5.572 1.00 74.53 H new ATOM 0 HA THR A 80 -26.562 -9.669 -7.955 1.00 63.52 H new ATOM 0 HB THR A 80 -28.799 -9.404 -6.959 1.00 61.02 H new ATOM 0 HG1 THR A 80 -28.912 -8.442 -4.826 1.00 61.34 H new ATOM 0 HG21 THR A 80 -28.386 -10.768 -4.937 1.00 35.51 H new ATOM 0 HG22 THR A 80 -27.385 -11.306 -6.307 1.00 35.51 H new ATOM 0 HG23 THR A 80 -26.661 -10.333 -5.004 1.00 35.51 H new ATOM 1113 N SER A 81 -28.053 -7.751 -9.063 1.00 11.33 N ATOM 1114 CA SER A 81 -28.469 -6.617 -9.860 1.00 55.25 C ATOM 1115 C SER A 81 -29.155 -5.566 -8.974 1.00 42.34 C ATOM 1116 O SER A 81 -29.028 -4.355 -9.207 1.00 32.35 O ATOM 1117 CB SER A 81 -29.347 -7.074 -11.030 1.00 30.30 C ATOM 1118 OG SER A 81 -30.416 -7.880 -10.582 1.00 71.50 O ATOM 0 H SER A 81 -28.516 -8.632 -9.287 1.00 11.33 H new ATOM 0 HA SER A 81 -27.591 -6.140 -10.296 1.00 55.25 H new ATOM 0 HB2 SER A 81 -29.740 -6.203 -11.555 1.00 30.30 H new ATOM 0 HB3 SER A 81 -28.743 -7.632 -11.745 1.00 30.30 H new ATOM 0 HG SER A 81 -30.961 -8.156 -11.348 1.00 71.50 H new ATOM 1124 N ASP A 82 -29.837 -6.042 -7.934 1.00 3.23 N ATOM 1125 CA ASP A 82 -30.493 -5.169 -6.967 1.00 25.24 C ATOM 1126 C ASP A 82 -29.461 -4.417 -6.166 1.00 73.52 C ATOM 1127 O ASP A 82 -29.511 -3.205 -6.069 1.00 22.23 O ATOM 1128 CB ASP A 82 -31.381 -5.973 -6.014 1.00 74.33 C ATOM 1129 CG ASP A 82 -32.080 -5.093 -4.994 1.00 11.21 C ATOM 1130 OD1 ASP A 82 -33.153 -4.549 -5.310 1.00 0.31 O ATOM 1131 OD2 ASP A 82 -31.566 -4.942 -3.860 1.00 21.10 O ATOM 0 H ASP A 82 -29.949 -7.037 -7.740 1.00 3.23 H new ATOM 0 HA ASP A 82 -31.117 -4.466 -7.519 1.00 25.24 H new ATOM 0 HB2 ASP A 82 -32.127 -6.519 -6.591 1.00 74.33 H new ATOM 0 HB3 ASP A 82 -30.774 -6.715 -5.495 1.00 74.33 H new ATOM 1136 N GLU A 83 -28.511 -5.154 -5.619 1.00 20.14 N ATOM 1137 CA GLU A 83 -27.446 -4.600 -4.797 1.00 12.02 C ATOM 1138 C GLU A 83 -26.617 -3.584 -5.613 1.00 73.31 C ATOM 1139 O GLU A 83 -26.243 -2.532 -5.104 1.00 4.30 O ATOM 1140 CB GLU A 83 -26.592 -5.758 -4.274 1.00 34.14 C ATOM 1141 CG GLU A 83 -25.481 -5.407 -3.308 1.00 33.22 C ATOM 1142 CD GLU A 83 -24.752 -6.657 -2.863 1.00 33.04 C ATOM 1143 OE1 GLU A 83 -23.963 -7.186 -3.635 1.00 61.10 O ATOM 1144 OE2 GLU A 83 -25.011 -7.158 -1.746 1.00 33.15 O ATOM 0 H GLU A 83 -28.455 -6.166 -5.733 1.00 20.14 H new ATOM 0 HA GLU A 83 -27.857 -4.057 -3.946 1.00 12.02 H new ATOM 0 HB2 GLU A 83 -27.253 -6.473 -3.785 1.00 34.14 H new ATOM 0 HB3 GLU A 83 -26.149 -6.267 -5.130 1.00 34.14 H new ATOM 0 HG2 GLU A 83 -24.781 -4.720 -3.784 1.00 33.22 H new ATOM 0 HG3 GLU A 83 -25.894 -4.891 -2.441 1.00 33.22 H new ATOM 1151 N LEU A 84 -26.367 -3.900 -6.888 1.00 40.33 N ATOM 1152 CA LEU A 84 -25.669 -2.989 -7.807 1.00 74.01 C ATOM 1153 C LEU A 84 -26.412 -1.652 -7.901 1.00 21.13 C ATOM 1154 O LEU A 84 -25.823 -0.581 -7.724 1.00 2.14 O ATOM 1155 CB LEU A 84 -25.578 -3.610 -9.213 1.00 74.42 C ATOM 1156 CG LEU A 84 -24.775 -2.812 -10.251 1.00 45.32 C ATOM 1157 CD1 LEU A 84 -23.317 -2.771 -9.879 1.00 15.13 C ATOM 1158 CD2 LEU A 84 -24.939 -3.394 -11.628 1.00 22.20 C ATOM 0 H LEU A 84 -26.640 -4.787 -7.311 1.00 40.33 H new ATOM 0 HA LEU A 84 -24.665 -2.821 -7.417 1.00 74.01 H new ATOM 0 HB2 LEU A 84 -25.133 -4.601 -9.123 1.00 74.42 H new ATOM 0 HB3 LEU A 84 -26.590 -3.748 -9.594 1.00 74.42 H new ATOM 0 HG LEU A 84 -25.165 -1.794 -10.259 1.00 45.32 H new ATOM 0 HD11 LEU A 84 -22.766 -2.201 -10.627 1.00 15.13 H new ATOM 0 HD12 LEU A 84 -23.203 -2.296 -8.905 1.00 15.13 H new ATOM 0 HD13 LEU A 84 -22.924 -3.787 -9.835 1.00 15.13 H new ATOM 0 HD21 LEU A 84 -24.359 -2.809 -12.342 1.00 22.20 H new ATOM 0 HD22 LEU A 84 -24.585 -4.425 -11.632 1.00 22.20 H new ATOM 0 HD23 LEU A 84 -25.992 -3.371 -11.910 1.00 22.20 H new ATOM 1170 N GLU A 85 -27.708 -1.726 -8.163 1.00 44.14 N ATOM 1171 CA GLU A 85 -28.549 -0.544 -8.270 1.00 40.02 C ATOM 1172 C GLU A 85 -28.716 0.141 -6.920 1.00 25.32 C ATOM 1173 O GLU A 85 -28.897 1.351 -6.843 1.00 40.35 O ATOM 1174 CB GLU A 85 -29.900 -0.890 -8.885 1.00 42.51 C ATOM 1175 CG GLU A 85 -29.804 -1.363 -10.321 1.00 75.23 C ATOM 1176 CD GLU A 85 -31.145 -1.689 -10.917 1.00 61.23 C ATOM 1177 OE1 GLU A 85 -31.867 -0.762 -11.338 1.00 71.14 O ATOM 1178 OE2 GLU A 85 -31.512 -2.881 -10.968 1.00 33.15 O ATOM 0 H GLU A 85 -28.205 -2.605 -8.307 1.00 44.14 H new ATOM 0 HA GLU A 85 -28.050 0.161 -8.935 1.00 40.02 H new ATOM 0 HB2 GLU A 85 -30.376 -1.666 -8.286 1.00 42.51 H new ATOM 0 HB3 GLU A 85 -30.546 -0.013 -8.842 1.00 42.51 H new ATOM 0 HG2 GLU A 85 -29.322 -0.591 -10.922 1.00 75.23 H new ATOM 0 HG3 GLU A 85 -29.167 -2.246 -10.366 1.00 75.23 H new ATOM 1185 N ASN A 86 -28.650 -0.645 -5.869 1.00 14.00 N ATOM 1186 CA ASN A 86 -28.739 -0.157 -4.501 1.00 22.33 C ATOM 1187 C ASN A 86 -27.526 0.717 -4.208 1.00 53.43 C ATOM 1188 O ASN A 86 -27.642 1.810 -3.680 1.00 44.50 O ATOM 1189 CB ASN A 86 -28.755 -1.356 -3.539 1.00 40.52 C ATOM 1190 CG ASN A 86 -28.945 -0.983 -2.102 1.00 1.22 C ATOM 1191 OD1 ASN A 86 -30.070 -0.903 -1.615 1.00 34.43 O ATOM 1192 ND2 ASN A 86 -27.874 -0.781 -1.408 1.00 1.33 N ATOM 0 H ASN A 86 -28.531 -1.656 -5.936 1.00 14.00 H new ATOM 0 HA ASN A 86 -29.651 0.426 -4.370 1.00 22.33 H new ATOM 0 HB2 ASN A 86 -29.554 -2.036 -3.836 1.00 40.52 H new ATOM 0 HB3 ASN A 86 -27.817 -1.902 -3.641 1.00 40.52 H new ATOM 0 HD21 ASN A 86 -27.945 -0.545 -0.418 1.00 1.33 H new ATOM 0 HD22 ASN A 86 -26.958 -0.857 -1.850 1.00 1.33 H new ATOM 1199 N LEU A 87 -26.365 0.219 -4.588 1.00 32.54 N ATOM 1200 CA LEU A 87 -25.105 0.931 -4.415 1.00 60.41 C ATOM 1201 C LEU A 87 -25.102 2.187 -5.262 1.00 40.25 C ATOM 1202 O LEU A 87 -24.655 3.241 -4.821 1.00 33.14 O ATOM 1203 CB LEU A 87 -23.921 0.036 -4.801 1.00 4.03 C ATOM 1204 CG LEU A 87 -23.721 -1.231 -3.969 1.00 31.43 C ATOM 1205 CD1 LEU A 87 -22.585 -2.065 -4.540 1.00 44.34 C ATOM 1206 CD2 LEU A 87 -23.432 -0.877 -2.519 1.00 41.13 C ATOM 0 H LEU A 87 -26.265 -0.696 -5.028 1.00 32.54 H new ATOM 0 HA LEU A 87 -25.003 1.205 -3.365 1.00 60.41 H new ATOM 0 HB2 LEU A 87 -24.041 -0.257 -5.844 1.00 4.03 H new ATOM 0 HB3 LEU A 87 -23.010 0.631 -4.740 1.00 4.03 H new ATOM 0 HG LEU A 87 -24.640 -1.816 -4.008 1.00 31.43 H new ATOM 0 HD11 LEU A 87 -22.455 -2.964 -3.937 1.00 44.34 H new ATOM 0 HD12 LEU A 87 -22.821 -2.347 -5.566 1.00 44.34 H new ATOM 0 HD13 LEU A 87 -21.664 -1.483 -4.527 1.00 44.34 H new ATOM 0 HD21 LEU A 87 -23.293 -1.791 -1.942 1.00 41.13 H new ATOM 0 HD22 LEU A 87 -22.527 -0.273 -2.466 1.00 41.13 H new ATOM 0 HD23 LEU A 87 -24.269 -0.313 -2.108 1.00 41.13 H new ATOM 1218 N ASP A 88 -25.620 2.061 -6.480 1.00 41.10 N ATOM 1219 CA ASP A 88 -25.748 3.197 -7.405 1.00 12.21 C ATOM 1220 C ASP A 88 -26.669 4.262 -6.826 1.00 21.41 C ATOM 1221 O ASP A 88 -26.475 5.441 -7.035 1.00 13.35 O ATOM 1222 CB ASP A 88 -26.257 2.718 -8.771 1.00 41.31 C ATOM 1223 CG ASP A 88 -26.477 3.840 -9.775 1.00 52.15 C ATOM 1224 OD1 ASP A 88 -25.509 4.300 -10.404 1.00 71.40 O ATOM 1225 OD2 ASP A 88 -27.645 4.267 -9.953 1.00 21.52 O ATOM 0 H ASP A 88 -25.963 1.178 -6.858 1.00 41.10 H new ATOM 0 HA ASP A 88 -24.763 3.643 -7.543 1.00 12.21 H new ATOM 0 HB2 ASP A 88 -25.542 2.008 -9.186 1.00 41.31 H new ATOM 0 HB3 ASP A 88 -27.195 2.181 -8.630 1.00 41.31 H new ATOM 1230 N ALA A 89 -27.650 3.827 -6.078 1.00 40.42 N ATOM 1231 CA ALA A 89 -28.579 4.723 -5.422 1.00 74.21 C ATOM 1232 C ALA A 89 -27.906 5.439 -4.238 1.00 53.03 C ATOM 1233 O ALA A 89 -28.084 6.644 -4.043 1.00 30.30 O ATOM 1234 CB ALA A 89 -29.791 3.936 -4.948 1.00 12.02 C ATOM 0 H ALA A 89 -27.831 2.839 -5.903 1.00 40.42 H new ATOM 0 HA ALA A 89 -28.899 5.484 -6.134 1.00 74.21 H new ATOM 0 HB1 ALA A 89 -30.491 4.609 -4.454 1.00 12.02 H new ATOM 0 HB2 ALA A 89 -30.279 3.469 -5.804 1.00 12.02 H new ATOM 0 HB3 ALA A 89 -29.473 3.165 -4.246 1.00 12.02 H new ATOM 1240 N VAL A 90 -27.145 4.685 -3.463 1.00 22.11 N ATOM 1241 CA VAL A 90 -26.461 5.195 -2.269 1.00 75.51 C ATOM 1242 C VAL A 90 -25.260 6.118 -2.625 1.00 12.04 C ATOM 1243 O VAL A 90 -25.210 7.285 -2.218 1.00 5.35 O ATOM 1244 CB VAL A 90 -25.989 3.993 -1.369 1.00 74.44 C ATOM 1245 CG1 VAL A 90 -25.199 4.451 -0.160 1.00 13.03 C ATOM 1246 CG2 VAL A 90 -27.187 3.173 -0.910 1.00 11.10 C ATOM 0 H VAL A 90 -26.978 3.694 -3.639 1.00 22.11 H new ATOM 0 HA VAL A 90 -27.174 5.805 -1.715 1.00 75.51 H new ATOM 0 HB VAL A 90 -25.331 3.379 -1.983 1.00 74.44 H new ATOM 0 HG11 VAL A 90 -24.897 3.584 0.427 1.00 13.03 H new ATOM 0 HG12 VAL A 90 -24.312 4.993 -0.489 1.00 13.03 H new ATOM 0 HG13 VAL A 90 -25.818 5.106 0.452 1.00 13.03 H new ATOM 0 HG21 VAL A 90 -26.845 2.345 -0.289 1.00 11.10 H new ATOM 0 HG22 VAL A 90 -27.861 3.806 -0.333 1.00 11.10 H new ATOM 0 HG23 VAL A 90 -27.714 2.780 -1.780 1.00 11.10 H new ATOM 1256 N GLU A 91 -24.327 5.601 -3.398 1.00 24.14 N ATOM 1257 CA GLU A 91 -23.111 6.340 -3.769 1.00 14.51 C ATOM 1258 C GLU A 91 -23.379 7.356 -4.885 1.00 24.51 C ATOM 1259 O GLU A 91 -22.659 8.345 -5.030 1.00 54.25 O ATOM 1260 CB GLU A 91 -22.015 5.359 -4.187 1.00 2.14 C ATOM 1261 CG GLU A 91 -21.603 4.389 -3.084 1.00 54.41 C ATOM 1262 CD GLU A 91 -20.913 5.066 -1.912 1.00 20.30 C ATOM 1263 OE1 GLU A 91 -21.585 5.732 -1.089 1.00 43.12 O ATOM 1264 OE2 GLU A 91 -19.682 4.947 -1.804 1.00 75.42 O ATOM 0 H GLU A 91 -24.378 4.661 -3.792 1.00 24.14 H new ATOM 0 HA GLU A 91 -22.779 6.901 -2.896 1.00 14.51 H new ATOM 0 HB2 GLU A 91 -22.361 4.789 -5.049 1.00 2.14 H new ATOM 0 HB3 GLU A 91 -21.139 5.923 -4.508 1.00 2.14 H new ATOM 0 HG2 GLU A 91 -22.488 3.865 -2.722 1.00 54.41 H new ATOM 0 HG3 GLU A 91 -20.936 3.636 -3.503 1.00 54.41 H new ATOM 1271 N GLY A 92 -24.438 7.108 -5.638 1.00 22.53 N ATOM 1272 CA GLY A 92 -24.798 7.915 -6.806 1.00 12.41 C ATOM 1273 C GLY A 92 -25.052 9.388 -6.531 1.00 32.14 C ATOM 1274 O GLY A 92 -25.060 10.189 -7.454 1.00 54.30 O ATOM 0 H GLY A 92 -25.081 6.336 -5.460 1.00 22.53 H new ATOM 0 HA2 GLY A 92 -23.999 7.833 -7.542 1.00 12.41 H new ATOM 0 HA3 GLY A 92 -25.693 7.488 -7.259 1.00 12.41 H new ATOM 1278 N ASN A 93 -25.270 9.751 -5.283 1.00 20.44 N ATOM 1279 CA ASN A 93 -25.532 11.154 -4.940 1.00 63.12 C ATOM 1280 C ASN A 93 -24.336 12.040 -5.276 1.00 61.55 C ATOM 1281 O ASN A 93 -24.490 13.112 -5.868 1.00 53.35 O ATOM 1282 CB ASN A 93 -25.872 11.319 -3.459 1.00 54.31 C ATOM 1283 CG ASN A 93 -27.127 10.592 -3.035 1.00 73.04 C ATOM 1284 OD1 ASN A 93 -28.060 10.412 -3.820 1.00 33.31 O ATOM 1285 ND2 ASN A 93 -27.163 10.177 -1.801 1.00 31.33 N ATOM 0 H ASN A 93 -25.273 9.110 -4.490 1.00 20.44 H new ATOM 0 HA ASN A 93 -26.390 11.464 -5.537 1.00 63.12 H new ATOM 0 HB2 ASN A 93 -25.035 10.958 -2.862 1.00 54.31 H new ATOM 0 HB3 ASN A 93 -25.986 12.380 -3.238 1.00 54.31 H new ATOM 0 HD21 ASN A 93 -27.985 9.683 -1.453 1.00 31.33 H new ATOM 0 HD22 ASN A 93 -26.370 10.346 -1.183 1.00 31.33 H new ATOM 1292 N GLU A 94 -23.150 11.586 -4.919 1.00 23.04 N ATOM 1293 CA GLU A 94 -21.944 12.378 -5.132 1.00 43.42 C ATOM 1294 C GLU A 94 -21.025 11.741 -6.179 1.00 22.10 C ATOM 1295 O GLU A 94 -20.050 12.355 -6.608 1.00 73.54 O ATOM 1296 CB GLU A 94 -21.170 12.532 -3.814 1.00 24.34 C ATOM 1297 CG GLU A 94 -21.930 13.221 -2.685 1.00 0.40 C ATOM 1298 CD GLU A 94 -22.325 14.644 -3.009 1.00 13.22 C ATOM 1299 OE1 GLU A 94 -21.435 15.519 -3.071 1.00 72.40 O ATOM 1300 OE2 GLU A 94 -23.534 14.914 -3.174 1.00 13.43 O ATOM 0 H GLU A 94 -22.991 10.678 -4.482 1.00 23.04 H new ATOM 0 HA GLU A 94 -22.259 13.356 -5.497 1.00 43.42 H new ATOM 0 HB2 GLU A 94 -20.866 11.542 -3.473 1.00 24.34 H new ATOM 0 HB3 GLU A 94 -20.258 13.095 -4.012 1.00 24.34 H new ATOM 0 HG2 GLU A 94 -22.827 12.646 -2.457 1.00 0.40 H new ATOM 0 HG3 GLU A 94 -21.313 13.219 -1.787 1.00 0.40 H new ATOM 1307 N TYR A 95 -21.334 10.521 -6.588 1.00 23.41 N ATOM 1308 CA TYR A 95 -20.472 9.775 -7.508 1.00 64.21 C ATOM 1309 C TYR A 95 -21.268 9.225 -8.669 1.00 44.11 C ATOM 1310 O TYR A 95 -22.492 9.228 -8.642 1.00 24.35 O ATOM 1311 CB TYR A 95 -19.807 8.598 -6.787 1.00 24.12 C ATOM 1312 CG TYR A 95 -18.955 8.977 -5.608 1.00 12.40 C ATOM 1313 CD1 TYR A 95 -19.528 9.226 -4.374 1.00 22.33 C ATOM 1314 CD2 TYR A 95 -17.583 9.080 -5.727 1.00 3.11 C ATOM 1315 CE1 TYR A 95 -18.764 9.570 -3.297 1.00 34.13 C ATOM 1316 CE2 TYR A 95 -16.808 9.422 -4.649 1.00 13.53 C ATOM 1317 CZ TYR A 95 -17.409 9.665 -3.434 1.00 53.11 C ATOM 1318 OH TYR A 95 -16.649 10.001 -2.355 1.00 62.24 O ATOM 0 H TYR A 95 -22.175 10.021 -6.300 1.00 23.41 H new ATOM 0 HA TYR A 95 -19.715 10.468 -7.875 1.00 64.21 H new ATOM 0 HB2 TYR A 95 -20.584 7.912 -6.450 1.00 24.12 H new ATOM 0 HB3 TYR A 95 -19.190 8.054 -7.503 1.00 24.12 H new ATOM 0 HD1 TYR A 95 -20.599 9.147 -4.261 1.00 22.33 H new ATOM 0 HD2 TYR A 95 -17.115 8.889 -6.681 1.00 3.11 H new ATOM 0 HE1 TYR A 95 -19.228 9.766 -2.342 1.00 34.13 H new ATOM 0 HE2 TYR A 95 -15.736 9.500 -4.752 1.00 13.53 H new ATOM 0 HH TYR A 95 -15.757 10.275 -2.655 1.00 62.24 H new ATOM 1328 N GLU A 96 -20.570 8.761 -9.682 1.00 11.22 N ATOM 1329 CA GLU A 96 -21.202 8.115 -10.804 1.00 0.00 C ATOM 1330 C GLU A 96 -20.619 6.721 -10.969 1.00 73.04 C ATOM 1331 O GLU A 96 -19.422 6.496 -10.723 1.00 62.01 O ATOM 1332 CB GLU A 96 -21.013 8.932 -12.095 1.00 23.50 C ATOM 1333 CG GLU A 96 -21.637 8.293 -13.341 1.00 72.11 C ATOM 1334 CD GLU A 96 -23.130 8.084 -13.214 1.00 42.53 C ATOM 1335 OE1 GLU A 96 -23.558 7.065 -12.623 1.00 4.31 O ATOM 1336 OE2 GLU A 96 -23.904 8.934 -13.701 1.00 65.53 O ATOM 0 H GLU A 96 -19.554 8.822 -9.749 1.00 11.22 H new ATOM 0 HA GLU A 96 -22.273 8.045 -10.613 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -21.447 9.922 -11.952 1.00 23.50 H new ATOM 0 HB3 GLU A 96 -19.946 9.074 -12.269 1.00 23.50 H new ATOM 0 HG2 GLU A 96 -21.437 8.925 -14.206 1.00 72.11 H new ATOM 0 HG3 GLU A 96 -21.156 7.333 -13.530 1.00 72.11 H new ATOM 1343 N ARG A 97 -21.463 5.800 -11.374 1.00 23.21 N ATOM 1344 CA ARG A 97 -21.082 4.422 -11.539 1.00 40.13 C ATOM 1345 C ARG A 97 -20.546 4.230 -12.937 1.00 75.53 C ATOM 1346 O ARG A 97 -21.285 4.374 -13.926 1.00 0.30 O ATOM 1347 CB ARG A 97 -22.301 3.514 -11.350 1.00 40.12 C ATOM 1348 CG ARG A 97 -21.978 2.024 -11.345 1.00 63.43 C ATOM 1349 CD ARG A 97 -23.240 1.175 -11.255 1.00 4.44 C ATOM 1350 NE ARG A 97 -24.065 1.272 -12.471 1.00 61.14 N ATOM 1351 CZ ARG A 97 -25.377 0.984 -12.548 1.00 70.41 C ATOM 1352 NH1 ARG A 97 -26.066 0.660 -11.450 1.00 44.15 N ATOM 1353 NH2 ARG A 97 -25.993 1.033 -13.720 1.00 34.22 N ATOM 0 H ARG A 97 -22.439 5.991 -11.599 1.00 23.21 H new ATOM 0 HA ARG A 97 -20.323 4.167 -10.799 1.00 40.13 H new ATOM 0 HB2 ARG A 97 -22.789 3.771 -10.410 1.00 40.12 H new ATOM 0 HB3 ARG A 97 -23.017 3.716 -12.147 1.00 40.12 H new ATOM 0 HG2 ARG A 97 -21.430 1.767 -12.252 1.00 63.43 H new ATOM 0 HG3 ARG A 97 -21.325 1.796 -10.503 1.00 63.43 H new ATOM 0 HD2 ARG A 97 -22.964 0.134 -11.088 1.00 4.44 H new ATOM 0 HD3 ARG A 97 -23.828 1.491 -10.393 1.00 4.44 H new ATOM 0 HE ARG A 97 -23.604 1.583 -13.326 1.00 61.14 H new ATOM 0 HH11 ARG A 97 -25.598 0.630 -10.544 1.00 44.15 H new ATOM 0 HH12 ARG A 97 -27.060 0.443 -11.517 1.00 44.15 H new ATOM 0 HH21 ARG A 97 -25.473 1.288 -14.559 1.00 34.22 H new ATOM 0 HH22 ARG A 97 -26.988 0.815 -13.783 1.00 34.22 H new ATOM 1367 N VAL A 98 -19.290 3.926 -13.034 1.00 4.25 N ATOM 1368 CA VAL A 98 -18.668 3.706 -14.311 1.00 1.22 C ATOM 1369 C VAL A 98 -17.949 2.386 -14.333 1.00 35.23 C ATOM 1370 O VAL A 98 -17.648 1.822 -13.279 1.00 64.41 O ATOM 1371 CB VAL A 98 -17.706 4.842 -14.709 1.00 42.14 C ATOM 1372 CG1 VAL A 98 -18.486 6.145 -14.853 1.00 45.53 C ATOM 1373 CG2 VAL A 98 -16.591 4.979 -13.671 1.00 43.12 C ATOM 0 H VAL A 98 -18.664 3.822 -12.235 1.00 4.25 H new ATOM 0 HA VAL A 98 -19.471 3.691 -15.048 1.00 1.22 H new ATOM 0 HB VAL A 98 -17.243 4.607 -15.668 1.00 42.14 H new ATOM 0 HG11 VAL A 98 -17.805 6.948 -15.135 1.00 45.53 H new ATOM 0 HG12 VAL A 98 -19.248 6.029 -15.623 1.00 45.53 H new ATOM 0 HG13 VAL A 98 -18.963 6.390 -13.904 1.00 45.53 H new ATOM 0 HG21 VAL A 98 -15.918 5.785 -13.964 1.00 43.12 H new ATOM 0 HG22 VAL A 98 -17.026 5.205 -12.697 1.00 43.12 H new ATOM 0 HG23 VAL A 98 -16.033 4.045 -13.611 1.00 43.12 H new ATOM 1383 N THR A 99 -17.687 1.892 -15.505 1.00 74.15 N ATOM 1384 CA THR A 99 -17.023 0.629 -15.656 1.00 62.10 C ATOM 1385 C THR A 99 -15.527 0.856 -15.842 1.00 52.25 C ATOM 1386 O THR A 99 -15.102 1.720 -16.628 1.00 62.35 O ATOM 1387 CB THR A 99 -17.630 -0.236 -16.810 1.00 11.04 C ATOM 1388 OG1 THR A 99 -16.925 -1.481 -16.930 1.00 12.13 O ATOM 1389 CG2 THR A 99 -17.606 0.498 -18.140 1.00 3.50 C ATOM 0 H THR A 99 -17.926 2.351 -16.384 1.00 74.15 H new ATOM 0 HA THR A 99 -17.181 0.053 -14.744 1.00 62.10 H new ATOM 0 HB THR A 99 -18.671 -0.432 -16.552 1.00 11.04 H new ATOM 0 HG1 THR A 99 -17.318 -2.011 -17.655 1.00 12.13 H new ATOM 0 HG21 THR A 99 -18.036 -0.137 -18.914 1.00 3.50 H new ATOM 0 HG22 THR A 99 -18.188 1.416 -18.059 1.00 3.50 H new ATOM 0 HG23 THR A 99 -16.577 0.743 -18.402 1.00 3.50 H new ATOM 1397 N VAL A 100 -14.744 0.122 -15.104 1.00 2.52 N ATOM 1398 CA VAL A 100 -13.316 0.283 -15.095 1.00 0.45 C ATOM 1399 C VAL A 100 -12.624 -1.064 -15.091 1.00 71.24 C ATOM 1400 O VAL A 100 -13.244 -2.098 -14.808 1.00 33.03 O ATOM 1401 CB VAL A 100 -12.845 1.088 -13.852 1.00 31.14 C ATOM 1402 CG1 VAL A 100 -13.400 2.503 -13.868 1.00 75.50 C ATOM 1403 CG2 VAL A 100 -13.253 0.377 -12.565 1.00 2.51 C ATOM 0 H VAL A 100 -15.082 -0.614 -14.484 1.00 2.52 H new ATOM 0 HA VAL A 100 -13.051 0.832 -15.999 1.00 0.45 H new ATOM 0 HB VAL A 100 -11.757 1.150 -13.890 1.00 31.14 H new ATOM 0 HG11 VAL A 100 -13.052 3.040 -12.986 1.00 75.50 H new ATOM 0 HG12 VAL A 100 -13.057 3.018 -14.765 1.00 75.50 H new ATOM 0 HG13 VAL A 100 -14.489 2.467 -13.865 1.00 75.50 H new ATOM 0 HG21 VAL A 100 -12.914 0.956 -11.706 1.00 2.51 H new ATOM 0 HG22 VAL A 100 -14.338 0.279 -12.532 1.00 2.51 H new ATOM 0 HG23 VAL A 100 -12.799 -0.613 -12.537 1.00 2.51 H new ATOM 1413 N GLY A 101 -11.357 -1.047 -15.383 1.00 20.25 N ATOM 1414 CA GLY A 101 -10.593 -2.245 -15.397 1.00 45.24 C ATOM 1415 C GLY A 101 -9.719 -2.352 -14.182 1.00 15.15 C ATOM 1416 O GLY A 101 -8.919 -1.459 -13.906 1.00 12.52 O ATOM 0 H GLY A 101 -10.832 -0.204 -15.616 1.00 20.25 H new ATOM 0 HA2 GLY A 101 -11.262 -3.104 -15.442 1.00 45.24 H new ATOM 0 HA3 GLY A 101 -9.976 -2.274 -16.295 1.00 45.24 H new ATOM 1420 N ILE A 102 -9.881 -3.420 -13.449 1.00 11.21 N ATOM 1421 CA ILE A 102 -9.089 -3.673 -12.267 1.00 45.53 C ATOM 1422 C ILE A 102 -8.298 -4.940 -12.449 1.00 4.43 C ATOM 1423 O ILE A 102 -8.696 -5.806 -13.198 1.00 43.23 O ATOM 1424 CB ILE A 102 -9.947 -3.697 -10.939 1.00 65.43 C ATOM 1425 CG1 ILE A 102 -11.114 -4.715 -10.963 1.00 41.24 C ATOM 1426 CG2 ILE A 102 -10.464 -2.323 -10.603 1.00 34.44 C ATOM 1427 CD1 ILE A 102 -10.754 -6.158 -10.682 1.00 2.04 C ATOM 0 H ILE A 102 -10.569 -4.145 -13.653 1.00 11.21 H new ATOM 0 HA ILE A 102 -8.398 -2.839 -12.146 1.00 45.53 H new ATOM 0 HB ILE A 102 -9.263 -4.031 -10.159 1.00 65.43 H new ATOM 0 HG12 ILE A 102 -11.858 -4.400 -10.231 1.00 41.24 H new ATOM 0 HG13 ILE A 102 -11.590 -4.666 -11.942 1.00 41.24 H new ATOM 0 HG21 ILE A 102 -11.050 -2.369 -9.685 1.00 34.44 H new ATOM 0 HG22 ILE A 102 -9.624 -1.642 -10.463 1.00 34.44 H new ATOM 0 HG23 ILE A 102 -11.092 -1.961 -11.417 1.00 34.44 H new ATOM 0 HD11 ILE A 102 -11.653 -6.773 -10.727 1.00 2.04 H new ATOM 0 HD12 ILE A 102 -10.039 -6.506 -11.427 1.00 2.04 H new ATOM 0 HD13 ILE A 102 -10.311 -6.236 -9.689 1.00 2.04 H new ATOM 1439 N VAL A 103 -7.194 -5.042 -11.798 1.00 2.11 N ATOM 1440 CA VAL A 103 -6.357 -6.203 -11.920 1.00 1.05 C ATOM 1441 C VAL A 103 -6.341 -6.919 -10.601 1.00 13.34 C ATOM 1442 O VAL A 103 -6.165 -6.288 -9.556 1.00 33.24 O ATOM 1443 CB VAL A 103 -4.909 -5.822 -12.341 1.00 12.10 C ATOM 1444 CG1 VAL A 103 -4.022 -7.053 -12.486 1.00 24.42 C ATOM 1445 CG2 VAL A 103 -4.908 -5.010 -13.633 1.00 35.40 C ATOM 0 H VAL A 103 -6.837 -4.328 -11.163 1.00 2.11 H new ATOM 0 HA VAL A 103 -6.760 -6.850 -12.699 1.00 1.05 H new ATOM 0 HB VAL A 103 -4.495 -5.204 -11.544 1.00 12.10 H new ATOM 0 HG11 VAL A 103 -3.019 -6.746 -12.781 1.00 24.42 H new ATOM 0 HG12 VAL A 103 -3.974 -7.581 -11.534 1.00 24.42 H new ATOM 0 HG13 VAL A 103 -4.438 -7.713 -13.247 1.00 24.42 H new ATOM 0 HG21 VAL A 103 -3.883 -4.758 -13.903 1.00 35.40 H new ATOM 0 HG22 VAL A 103 -5.360 -5.597 -14.432 1.00 35.40 H new ATOM 0 HG23 VAL A 103 -5.481 -4.094 -13.488 1.00 35.40 H new ATOM 1455 N ARG A 104 -6.557 -8.215 -10.637 1.00 13.03 N ATOM 1456 CA ARG A 104 -6.572 -9.016 -9.430 1.00 64.41 C ATOM 1457 C ARG A 104 -5.184 -9.133 -8.867 1.00 22.11 C ATOM 1458 O ARG A 104 -4.266 -9.561 -9.565 1.00 65.31 O ATOM 1459 CB ARG A 104 -7.120 -10.415 -9.694 1.00 52.11 C ATOM 1460 CG ARG A 104 -8.545 -10.446 -10.196 1.00 53.53 C ATOM 1461 CD ARG A 104 -9.048 -11.876 -10.331 1.00 4.42 C ATOM 1462 NE ARG A 104 -8.992 -12.579 -9.050 1.00 41.31 N ATOM 1463 CZ ARG A 104 -9.760 -13.593 -8.682 1.00 4.43 C ATOM 1464 NH1 ARG A 104 -10.660 -14.113 -9.516 1.00 44.45 N ATOM 1465 NH2 ARG A 104 -9.617 -14.083 -7.475 1.00 2.12 N ATOM 0 H ARG A 104 -6.726 -8.741 -11.494 1.00 13.03 H new ATOM 0 HA ARG A 104 -7.224 -8.515 -8.714 1.00 64.41 H new ATOM 0 HB2 ARG A 104 -6.480 -10.910 -10.424 1.00 52.11 H new ATOM 0 HB3 ARG A 104 -7.060 -10.995 -8.773 1.00 52.11 H new ATOM 0 HG2 ARG A 104 -9.188 -9.895 -9.510 1.00 53.53 H new ATOM 0 HG3 ARG A 104 -8.605 -9.944 -11.162 1.00 53.53 H new ATOM 0 HD2 ARG A 104 -10.073 -11.870 -10.701 1.00 4.42 H new ATOM 0 HD3 ARG A 104 -8.446 -12.408 -11.068 1.00 4.42 H new ATOM 0 HE ARG A 104 -8.296 -12.258 -8.377 1.00 41.31 H new ATOM 0 HH11 ARG A 104 -10.766 -13.730 -10.455 1.00 44.45 H new ATOM 0 HH12 ARG A 104 -11.243 -14.894 -9.215 1.00 44.45 H new ATOM 0 HH21 ARG A 104 -8.925 -13.683 -6.841 1.00 2.12 H new ATOM 0 HH22 ARG A 104 -10.198 -14.864 -7.170 1.00 2.12 H new ATOM 1479 N GLU A 105 -5.027 -8.774 -7.608 1.00 61.12 N ATOM 1480 CA GLU A 105 -3.729 -8.847 -6.968 1.00 14.10 C ATOM 1481 C GLU A 105 -3.383 -10.276 -6.564 1.00 24.35 C ATOM 1482 O GLU A 105 -2.286 -10.542 -6.063 1.00 65.11 O ATOM 1483 CB GLU A 105 -3.622 -7.885 -5.785 1.00 11.33 C ATOM 1484 CG GLU A 105 -3.759 -6.420 -6.179 1.00 32.24 C ATOM 1485 CD GLU A 105 -3.449 -5.473 -5.048 1.00 22.41 C ATOM 1486 OE1 GLU A 105 -4.322 -5.227 -4.202 1.00 53.42 O ATOM 1487 OE2 GLU A 105 -2.302 -4.953 -4.995 1.00 74.02 O ATOM 0 H GLU A 105 -5.779 -8.430 -7.010 1.00 61.12 H new ATOM 0 HA GLU A 105 -2.991 -8.530 -7.704 1.00 14.10 H new ATOM 0 HB2 GLU A 105 -4.394 -8.131 -5.056 1.00 11.33 H new ATOM 0 HB3 GLU A 105 -2.661 -8.032 -5.293 1.00 11.33 H new ATOM 0 HG2 GLU A 105 -3.091 -6.210 -7.014 1.00 32.24 H new ATOM 0 HG3 GLU A 105 -4.775 -6.238 -6.530 1.00 32.24 H new ATOM 1494 N ASP A 106 -4.332 -11.184 -6.774 1.00 55.11 N ATOM 1495 CA ASP A 106 -4.115 -12.619 -6.549 1.00 33.25 C ATOM 1496 C ASP A 106 -3.036 -13.081 -7.488 1.00 54.21 C ATOM 1497 O ASP A 106 -1.972 -13.552 -7.081 1.00 33.21 O ATOM 1498 CB ASP A 106 -5.366 -13.452 -6.912 1.00 35.14 C ATOM 1499 CG ASP A 106 -6.613 -13.081 -6.192 1.00 11.03 C ATOM 1500 OD1 ASP A 106 -6.820 -13.542 -5.046 1.00 62.34 O ATOM 1501 OD2 ASP A 106 -7.430 -12.365 -6.780 1.00 31.43 O ATOM 0 H ASP A 106 -5.269 -10.953 -7.103 1.00 55.11 H new ATOM 0 HA ASP A 106 -3.867 -12.755 -5.496 1.00 33.25 H new ATOM 0 HB2 ASP A 106 -5.544 -13.359 -7.983 1.00 35.14 H new ATOM 0 HB3 ASP A 106 -5.152 -14.502 -6.714 1.00 35.14 H new ATOM 1506 N ASN A 107 -3.324 -12.922 -8.754 1.00 53.23 N ATOM 1507 CA ASN A 107 -2.455 -13.354 -9.799 1.00 12.32 C ATOM 1508 C ASN A 107 -1.968 -12.183 -10.657 1.00 33.32 C ATOM 1509 O ASN A 107 -1.000 -11.518 -10.287 1.00 60.32 O ATOM 1510 CB ASN A 107 -3.090 -14.523 -10.617 1.00 13.25 C ATOM 1511 CG ASN A 107 -4.474 -14.204 -11.219 1.00 5.40 C ATOM 1512 OD1 ASN A 107 -5.215 -13.358 -10.714 1.00 73.32 O ATOM 1513 ND2 ASN A 107 -4.829 -14.878 -12.272 1.00 12.03 N ATOM 0 H ASN A 107 -4.183 -12.482 -9.085 1.00 53.23 H new ATOM 0 HA ASN A 107 -1.554 -13.766 -9.345 1.00 12.32 H new ATOM 0 HB2 ASN A 107 -2.411 -14.796 -11.425 1.00 13.25 H new ATOM 0 HB3 ASN A 107 -3.182 -15.395 -9.969 1.00 13.25 H new ATOM 0 HD21 ASN A 107 -5.740 -14.712 -12.700 1.00 12.03 H new ATOM 0 HD22 ASN A 107 -4.197 -15.572 -12.670 1.00 12.03 H new ATOM 1520 N SER A 108 -2.654 -11.891 -11.747 1.00 21.22 N ATOM 1521 CA SER A 108 -2.257 -10.803 -12.628 1.00 12.13 C ATOM 1522 C SER A 108 -3.282 -10.567 -13.732 1.00 74.43 C ATOM 1523 O SER A 108 -3.018 -9.830 -14.688 1.00 12.15 O ATOM 1524 CB SER A 108 -0.870 -11.094 -13.236 1.00 41.22 C ATOM 1525 OG SER A 108 -0.833 -12.368 -13.877 1.00 14.12 O ATOM 0 H SER A 108 -3.491 -12.392 -12.046 1.00 21.22 H new ATOM 0 HA SER A 108 -2.204 -9.893 -12.031 1.00 12.13 H new ATOM 0 HB2 SER A 108 -0.618 -10.316 -13.957 1.00 41.22 H new ATOM 0 HB3 SER A 108 -0.114 -11.059 -12.452 1.00 41.22 H new ATOM 0 HG SER A 108 0.059 -12.519 -14.253 1.00 14.12 H new ATOM 1531 N GLU A 109 -4.457 -11.153 -13.592 1.00 22.34 N ATOM 1532 CA GLU A 109 -5.458 -11.027 -14.618 1.00 44.00 C ATOM 1533 C GLU A 109 -6.258 -9.764 -14.446 1.00 25.30 C ATOM 1534 O GLU A 109 -6.519 -9.315 -13.308 1.00 54.03 O ATOM 1535 CB GLU A 109 -6.377 -12.240 -14.661 1.00 13.25 C ATOM 1536 CG GLU A 109 -7.115 -12.505 -13.370 1.00 33.41 C ATOM 1537 CD GLU A 109 -8.022 -13.688 -13.467 1.00 70.44 C ATOM 1538 OE1 GLU A 109 -9.182 -13.519 -13.883 1.00 51.05 O ATOM 1539 OE2 GLU A 109 -7.594 -14.806 -13.131 1.00 2.40 O ATOM 0 H GLU A 109 -4.733 -11.713 -12.786 1.00 22.34 H new ATOM 0 HA GLU A 109 -4.933 -10.973 -15.572 1.00 44.00 H new ATOM 0 HB2 GLU A 109 -7.105 -12.102 -15.461 1.00 13.25 H new ATOM 0 HB3 GLU A 109 -5.787 -13.120 -14.916 1.00 13.25 H new ATOM 0 HG2 GLU A 109 -6.394 -12.668 -12.569 1.00 33.41 H new ATOM 0 HG3 GLU A 109 -7.698 -11.624 -13.100 1.00 33.41 H new ATOM 1546 N LYS A 110 -6.640 -9.195 -15.544 1.00 31.01 N ATOM 1547 CA LYS A 110 -7.415 -7.996 -15.525 1.00 64.00 C ATOM 1548 C LYS A 110 -8.898 -8.320 -15.595 1.00 51.31 C ATOM 1549 O LYS A 110 -9.326 -9.275 -16.246 1.00 63.31 O ATOM 1550 CB LYS A 110 -6.986 -7.029 -16.634 1.00 40.35 C ATOM 1551 CG LYS A 110 -7.079 -7.590 -18.031 1.00 31.42 C ATOM 1552 CD LYS A 110 -6.542 -6.600 -19.045 1.00 1.14 C ATOM 1553 CE LYS A 110 -6.579 -7.160 -20.449 1.00 24.14 C ATOM 1554 NZ LYS A 110 -6.028 -6.202 -21.429 1.00 61.53 N ATOM 0 H LYS A 110 -6.424 -9.547 -16.477 1.00 31.01 H new ATOM 0 HA LYS A 110 -7.230 -7.486 -14.579 1.00 64.00 H new ATOM 0 HB2 LYS A 110 -7.604 -6.133 -16.575 1.00 40.35 H new ATOM 0 HB3 LYS A 110 -5.957 -6.719 -16.449 1.00 40.35 H new ATOM 0 HG2 LYS A 110 -6.516 -8.521 -18.092 1.00 31.42 H new ATOM 0 HG3 LYS A 110 -8.117 -7.829 -18.264 1.00 31.42 H new ATOM 0 HD2 LYS A 110 -7.129 -5.683 -19.004 1.00 1.14 H new ATOM 0 HD3 LYS A 110 -5.517 -6.334 -18.786 1.00 1.14 H new ATOM 0 HE2 LYS A 110 -6.009 -8.089 -20.487 1.00 24.14 H new ATOM 0 HE3 LYS A 110 -7.607 -7.405 -20.717 1.00 24.14 H new ATOM 0 HZ1 LYS A 110 -6.068 -6.618 -22.381 1.00 61.53 H new ATOM 0 HZ2 LYS A 110 -6.587 -5.325 -21.410 1.00 61.53 H new ATOM 0 HZ3 LYS A 110 -5.040 -5.987 -21.187 1.00 61.53 H new ATOM 1568 N MET A 111 -9.645 -7.537 -14.920 1.00 44.12 N ATOM 1569 CA MET A 111 -11.062 -7.690 -14.757 1.00 70.31 C ATOM 1570 C MET A 111 -11.762 -6.420 -15.019 1.00 51.14 C ATOM 1571 O MET A 111 -11.154 -5.354 -15.024 1.00 12.53 O ATOM 1572 CB MET A 111 -11.389 -8.149 -13.360 1.00 61.21 C ATOM 1573 CG MET A 111 -11.124 -9.591 -13.100 1.00 10.43 C ATOM 1574 SD MET A 111 -12.302 -10.660 -13.924 1.00 72.03 S ATOM 1575 CE MET A 111 -13.793 -10.161 -13.068 1.00 25.44 C ATOM 0 H MET A 111 -9.277 -6.720 -14.432 1.00 44.12 H new ATOM 0 HA MET A 111 -11.396 -8.439 -15.475 1.00 70.31 H new ATOM 0 HB2 MET A 111 -10.811 -7.554 -12.652 1.00 61.21 H new ATOM 0 HB3 MET A 111 -12.442 -7.946 -13.163 1.00 61.21 H new ATOM 0 HG2 MET A 111 -10.117 -9.839 -13.434 1.00 10.43 H new ATOM 0 HG3 MET A 111 -11.158 -9.776 -12.026 1.00 10.43 H new ATOM 0 HE1 MET A 111 -14.590 -10.874 -13.280 1.00 25.44 H new ATOM 0 HE2 MET A 111 -13.605 -10.135 -11.995 1.00 25.44 H new ATOM 0 HE3 MET A 111 -14.093 -9.170 -13.408 1.00 25.44 H new ATOM 1585 N ALA A 112 -13.011 -6.527 -15.247 1.00 21.33 N ATOM 1586 CA ALA A 112 -13.834 -5.364 -15.501 1.00 43.24 C ATOM 1587 C ALA A 112 -14.871 -5.253 -14.424 1.00 44.44 C ATOM 1588 O ALA A 112 -15.590 -6.216 -14.150 1.00 61.31 O ATOM 1589 CB ALA A 112 -14.482 -5.429 -16.866 1.00 44.14 C ATOM 0 H ALA A 112 -13.514 -7.414 -15.268 1.00 21.33 H new ATOM 0 HA ALA A 112 -13.201 -4.477 -15.491 1.00 43.24 H new ATOM 0 HB1 ALA A 112 -15.092 -4.539 -17.022 1.00 44.14 H new ATOM 0 HB2 ALA A 112 -13.710 -5.478 -17.633 1.00 44.14 H new ATOM 0 HB3 ALA A 112 -15.112 -6.316 -16.928 1.00 44.14 H new ATOM 1595 N VAL A 113 -14.941 -4.115 -13.807 1.00 32.23 N ATOM 1596 CA VAL A 113 -15.846 -3.902 -12.701 1.00 14.53 C ATOM 1597 C VAL A 113 -16.436 -2.521 -12.786 1.00 74.30 C ATOM 1598 O VAL A 113 -16.045 -1.727 -13.633 1.00 62.31 O ATOM 1599 CB VAL A 113 -15.115 -4.009 -11.325 1.00 32.23 C ATOM 1600 CG1 VAL A 113 -14.479 -5.360 -11.125 1.00 23.40 C ATOM 1601 CG2 VAL A 113 -14.085 -2.908 -11.162 1.00 71.55 C ATOM 0 H VAL A 113 -14.375 -3.302 -14.050 1.00 32.23 H new ATOM 0 HA VAL A 113 -16.615 -4.671 -12.766 1.00 14.53 H new ATOM 0 HB VAL A 113 -15.876 -3.886 -10.555 1.00 32.23 H new ATOM 0 HG11 VAL A 113 -13.982 -5.388 -10.155 1.00 23.40 H new ATOM 0 HG12 VAL A 113 -15.247 -6.133 -11.162 1.00 23.40 H new ATOM 0 HG13 VAL A 113 -13.747 -5.538 -11.913 1.00 23.40 H new ATOM 0 HG21 VAL A 113 -13.594 -3.010 -10.194 1.00 71.55 H new ATOM 0 HG22 VAL A 113 -13.342 -2.984 -11.956 1.00 71.55 H new ATOM 0 HG23 VAL A 113 -14.578 -1.937 -11.218 1.00 71.55 H new ATOM 1611 N LYS A 114 -17.370 -2.237 -11.932 1.00 62.13 N ATOM 1612 CA LYS A 114 -17.868 -0.897 -11.816 1.00 3.24 C ATOM 1613 C LYS A 114 -17.297 -0.255 -10.580 1.00 4.41 C ATOM 1614 O LYS A 114 -16.952 -0.942 -9.624 1.00 72.44 O ATOM 1615 CB LYS A 114 -19.412 -0.788 -11.812 1.00 51.12 C ATOM 1616 CG LYS A 114 -20.102 -1.106 -13.138 1.00 34.00 C ATOM 1617 CD LYS A 114 -20.120 -2.584 -13.473 1.00 64.25 C ATOM 1618 CE LYS A 114 -20.686 -2.811 -14.867 1.00 31.24 C ATOM 1619 NZ LYS A 114 -22.005 -2.156 -15.063 1.00 0.10 N ATOM 0 H LYS A 114 -17.804 -2.913 -11.304 1.00 62.13 H new ATOM 0 HA LYS A 114 -17.541 -0.369 -12.712 1.00 3.24 H new ATOM 0 HB2 LYS A 114 -19.803 -1.461 -11.049 1.00 51.12 H new ATOM 0 HB3 LYS A 114 -19.686 0.224 -11.515 1.00 51.12 H new ATOM 0 HG2 LYS A 114 -21.127 -0.738 -13.102 1.00 34.00 H new ATOM 0 HG3 LYS A 114 -19.597 -0.566 -13.939 1.00 34.00 H new ATOM 0 HD2 LYS A 114 -19.109 -2.988 -13.415 1.00 64.25 H new ATOM 0 HD3 LYS A 114 -20.720 -3.121 -12.739 1.00 64.25 H new ATOM 0 HE2 LYS A 114 -19.982 -2.430 -15.607 1.00 31.24 H new ATOM 0 HE3 LYS A 114 -20.787 -3.882 -15.044 1.00 31.24 H new ATOM 0 HZ1 LYS A 114 -22.438 -2.503 -15.943 1.00 0.10 H new ATOM 0 HZ2 LYS A 114 -22.626 -2.379 -14.260 1.00 0.10 H new ATOM 0 HZ3 LYS A 114 -21.875 -1.126 -15.124 1.00 0.10 H new ATOM 1633 N THR A 115 -17.165 1.027 -10.607 1.00 52.11 N ATOM 1634 CA THR A 115 -16.705 1.753 -9.471 1.00 63.33 C ATOM 1635 C THR A 115 -17.388 3.108 -9.482 1.00 72.41 C ATOM 1636 O THR A 115 -18.086 3.453 -10.455 1.00 21.21 O ATOM 1637 CB THR A 115 -15.152 1.924 -9.451 1.00 42.41 C ATOM 1638 OG1 THR A 115 -14.733 2.410 -8.162 1.00 72.41 O ATOM 1639 CG2 THR A 115 -14.705 2.928 -10.506 1.00 73.31 C ATOM 0 H THR A 115 -17.374 1.605 -11.421 1.00 52.11 H new ATOM 0 HA THR A 115 -16.956 1.193 -8.570 1.00 63.33 H new ATOM 0 HB THR A 115 -14.704 0.953 -9.659 1.00 42.41 H new ATOM 0 HG1 THR A 115 -14.911 1.728 -7.481 1.00 72.41 H new ATOM 0 HG21 THR A 115 -13.620 3.031 -10.474 1.00 73.31 H new ATOM 0 HG22 THR A 115 -15.007 2.578 -11.493 1.00 73.31 H new ATOM 0 HG23 THR A 115 -15.167 3.895 -10.307 1.00 73.31 H new ATOM 1647 N TYR A 116 -17.213 3.850 -8.433 1.00 73.03 N ATOM 1648 CA TYR A 116 -17.831 5.128 -8.299 1.00 65.25 C ATOM 1649 C TYR A 116 -16.772 6.195 -8.216 1.00 60.15 C ATOM 1650 O TYR A 116 -16.050 6.297 -7.224 1.00 74.03 O ATOM 1651 CB TYR A 116 -18.752 5.139 -7.075 1.00 32.25 C ATOM 1652 CG TYR A 116 -19.861 4.122 -7.186 1.00 54.05 C ATOM 1653 CD1 TYR A 116 -19.683 2.823 -6.729 1.00 1.50 C ATOM 1654 CD2 TYR A 116 -21.064 4.448 -7.776 1.00 31.54 C ATOM 1655 CE1 TYR A 116 -20.677 1.880 -6.864 1.00 52.15 C ATOM 1656 CE2 TYR A 116 -22.067 3.515 -7.908 1.00 22.44 C ATOM 1657 CZ TYR A 116 -21.867 2.230 -7.453 1.00 44.04 C ATOM 1658 OH TYR A 116 -22.853 1.284 -7.608 1.00 1.31 O ATOM 0 H TYR A 116 -16.631 3.581 -7.639 1.00 73.03 H new ATOM 0 HA TYR A 116 -18.447 5.336 -9.174 1.00 65.25 H new ATOM 0 HB2 TYR A 116 -18.165 4.937 -6.179 1.00 32.25 H new ATOM 0 HB3 TYR A 116 -19.184 6.133 -6.956 1.00 32.25 H new ATOM 0 HD1 TYR A 116 -18.750 2.548 -6.260 1.00 1.50 H new ATOM 0 HD2 TYR A 116 -21.222 5.452 -8.141 1.00 31.54 H new ATOM 0 HE1 TYR A 116 -20.522 0.872 -6.509 1.00 52.15 H new ATOM 0 HE2 TYR A 116 -23.006 3.789 -8.366 1.00 22.44 H new ATOM 0 HH TYR A 116 -22.543 0.426 -7.249 1.00 1.31 H new ATOM 1668 N MET A 117 -16.660 6.961 -9.269 1.00 23.40 N ATOM 1669 CA MET A 117 -15.676 8.010 -9.342 1.00 71.25 C ATOM 1670 C MET A 117 -16.336 9.352 -9.215 1.00 15.53 C ATOM 1671 O MET A 117 -17.550 9.491 -9.466 1.00 2.43 O ATOM 1672 CB MET A 117 -14.803 7.955 -10.623 1.00 11.33 C ATOM 1673 CG MET A 117 -15.551 8.166 -11.910 1.00 53.53 C ATOM 1674 SD MET A 117 -14.481 8.249 -13.365 1.00 74.52 S ATOM 1675 CE MET A 117 -15.731 8.408 -14.636 1.00 22.35 C ATOM 0 H MET A 117 -17.247 6.876 -10.099 1.00 23.40 H new ATOM 0 HA MET A 117 -14.997 7.852 -8.504 1.00 71.25 H new ATOM 0 HB2 MET A 117 -14.022 8.712 -10.546 1.00 11.33 H new ATOM 0 HB3 MET A 117 -14.305 6.986 -10.664 1.00 11.33 H new ATOM 0 HG2 MET A 117 -16.267 7.354 -12.042 1.00 53.53 H new ATOM 0 HG3 MET A 117 -16.126 9.089 -11.839 1.00 53.53 H new ATOM 0 HE1 MET A 117 -15.653 7.571 -15.330 1.00 22.35 H new ATOM 0 HE2 MET A 117 -16.719 8.408 -14.176 1.00 22.35 H new ATOM 0 HE3 MET A 117 -15.583 9.343 -15.177 1.00 22.35 H new ATOM 1685 N TRP A 118 -15.561 10.314 -8.799 1.00 61.12 N ATOM 1686 CA TRP A 118 -16.000 11.663 -8.623 1.00 33.52 C ATOM 1687 C TRP A 118 -16.284 12.195 -10.002 1.00 44.14 C ATOM 1688 O TRP A 118 -15.495 11.962 -10.930 1.00 23.14 O ATOM 1689 CB TRP A 118 -14.858 12.448 -7.977 1.00 55.03 C ATOM 1690 CG TRP A 118 -15.233 13.748 -7.347 1.00 63.05 C ATOM 1691 CD1 TRP A 118 -14.799 14.994 -7.665 1.00 21.24 C ATOM 1692 CD2 TRP A 118 -16.115 13.900 -6.276 1.00 64.45 C ATOM 1693 NE1 TRP A 118 -15.344 15.915 -6.812 1.00 61.42 N ATOM 1694 CE2 TRP A 118 -16.165 15.261 -5.949 1.00 25.42 C ATOM 1695 CE3 TRP A 118 -16.861 13.009 -5.556 1.00 23.02 C ATOM 1696 CZ2 TRP A 118 -16.945 15.742 -4.914 1.00 4.52 C ATOM 1697 CZ3 TRP A 118 -17.626 13.462 -4.553 1.00 61.53 C ATOM 1698 CH2 TRP A 118 -17.675 14.821 -4.219 1.00 60.10 C ATOM 0 H TRP A 118 -14.578 10.173 -8.567 1.00 61.12 H new ATOM 0 HA TRP A 118 -16.885 11.742 -7.992 1.00 33.52 H new ATOM 0 HB2 TRP A 118 -14.395 11.819 -7.217 1.00 55.03 H new ATOM 0 HB3 TRP A 118 -14.100 12.640 -8.737 1.00 55.03 H new ATOM 0 HD1 TRP A 118 -14.122 15.225 -8.474 1.00 21.24 H new ATOM 0 HE1 TRP A 118 -15.165 16.919 -6.822 1.00 61.42 H new ATOM 0 HE3 TRP A 118 -16.834 11.955 -5.792 1.00 23.02 H new ATOM 0 HZ2 TRP A 118 -16.975 16.793 -4.668 1.00 4.52 H new ATOM 0 HZ3 TRP A 118 -18.221 12.760 -3.987 1.00 61.53 H new ATOM 0 HH2 TRP A 118 -18.299 15.145 -3.400 1.00 60.10 H new ATOM 1709 N ILE A 119 -17.398 12.868 -10.167 1.00 2.24 N ATOM 1710 CA ILE A 119 -17.768 13.307 -11.518 1.00 71.43 C ATOM 1711 C ILE A 119 -16.794 14.377 -12.020 1.00 11.52 C ATOM 1712 O ILE A 119 -16.334 14.340 -13.192 1.00 32.45 O ATOM 1713 CB ILE A 119 -19.264 13.802 -11.674 1.00 43.05 C ATOM 1714 CG1 ILE A 119 -20.297 12.704 -11.334 1.00 65.23 C ATOM 1715 CG2 ILE A 119 -19.510 14.251 -13.099 1.00 44.21 C ATOM 1716 CD1 ILE A 119 -20.365 12.292 -9.892 1.00 42.42 C ATOM 0 H ILE A 119 -18.050 13.122 -9.425 1.00 2.24 H new ATOM 0 HA ILE A 119 -17.697 12.413 -12.138 1.00 71.43 H new ATOM 0 HB ILE A 119 -19.393 14.624 -10.970 1.00 43.05 H new ATOM 0 HG12 ILE A 119 -21.283 13.053 -11.639 1.00 65.23 H new ATOM 0 HG13 ILE A 119 -20.072 11.822 -11.934 1.00 65.23 H new ATOM 0 HG21 ILE A 119 -20.541 14.591 -13.201 1.00 44.21 H new ATOM 0 HG22 ILE A 119 -18.833 15.069 -13.345 1.00 44.21 H new ATOM 0 HG23 ILE A 119 -19.334 13.417 -13.779 1.00 44.21 H new ATOM 0 HD11 ILE A 119 -21.122 11.518 -9.770 1.00 42.42 H new ATOM 0 HD12 ILE A 119 -19.396 11.904 -9.578 1.00 42.42 H new ATOM 0 HD13 ILE A 119 -20.626 13.155 -9.279 1.00 42.42 H new ATOM 1728 N ASN A 120 -16.442 15.288 -11.135 1.00 0.44 N ATOM 1729 CA ASN A 120 -15.496 16.327 -11.457 1.00 34.13 C ATOM 1730 C ASN A 120 -14.082 15.785 -11.309 1.00 72.31 C ATOM 1731 O ASN A 120 -13.578 15.599 -10.217 1.00 10.44 O ATOM 1732 CB ASN A 120 -15.729 17.576 -10.599 1.00 51.41 C ATOM 1733 CG ASN A 120 -14.754 18.696 -10.908 1.00 35.23 C ATOM 1734 OD1 ASN A 120 -14.232 18.803 -12.019 1.00 55.24 O ATOM 1735 ND2 ASN A 120 -14.531 19.560 -9.951 1.00 53.03 N ATOM 0 H ASN A 120 -16.802 15.326 -10.182 1.00 0.44 H new ATOM 0 HA ASN A 120 -15.638 16.636 -12.493 1.00 34.13 H new ATOM 0 HB2 ASN A 120 -16.747 17.934 -10.756 1.00 51.41 H new ATOM 0 HB3 ASN A 120 -15.644 17.308 -9.546 1.00 51.41 H new ATOM 0 HD21 ASN A 120 -13.909 20.352 -10.113 1.00 53.03 H new ATOM 0 HD22 ASN A 120 -14.979 19.442 -9.043 1.00 53.03 H new ATOM 1742 N LYS A 121 -13.465 15.540 -12.420 1.00 54.45 N ATOM 1743 CA LYS A 121 -12.181 14.868 -12.487 1.00 61.14 C ATOM 1744 C LYS A 121 -11.043 15.801 -12.114 1.00 51.11 C ATOM 1745 O LYS A 121 -9.907 15.364 -11.880 1.00 71.30 O ATOM 1746 CB LYS A 121 -12.017 14.285 -13.878 1.00 23.55 C ATOM 1747 CG LYS A 121 -13.202 13.402 -14.237 1.00 71.04 C ATOM 1748 CD LYS A 121 -13.167 12.907 -15.656 1.00 53.14 C ATOM 1749 CE LYS A 121 -14.454 12.160 -15.982 1.00 14.25 C ATOM 1750 NZ LYS A 121 -15.659 13.020 -15.792 1.00 15.22 N ATOM 0 H LYS A 121 -13.837 15.802 -13.333 1.00 54.45 H new ATOM 0 HA LYS A 121 -12.149 14.059 -11.758 1.00 61.14 H new ATOM 0 HB2 LYS A 121 -11.924 15.091 -14.606 1.00 23.55 H new ATOM 0 HB3 LYS A 121 -11.096 13.703 -13.927 1.00 23.55 H new ATOM 0 HG2 LYS A 121 -13.226 12.547 -13.562 1.00 71.04 H new ATOM 0 HG3 LYS A 121 -14.124 13.961 -14.077 1.00 71.04 H new ATOM 0 HD2 LYS A 121 -13.042 13.747 -16.339 1.00 53.14 H new ATOM 0 HD3 LYS A 121 -12.310 12.249 -15.799 1.00 53.14 H new ATOM 0 HE2 LYS A 121 -14.418 11.808 -17.013 1.00 14.25 H new ATOM 0 HE3 LYS A 121 -14.533 11.278 -15.346 1.00 14.25 H new ATOM 0 HZ1 LYS A 121 -16.474 12.586 -16.270 1.00 15.22 H new ATOM 0 HZ2 LYS A 121 -15.863 13.113 -14.776 1.00 15.22 H new ATOM 0 HZ3 LYS A 121 -15.481 13.961 -16.197 1.00 15.22 H new ATOM 1764 N ALA A 122 -11.350 17.071 -12.045 1.00 72.33 N ATOM 1765 CA ALA A 122 -10.417 18.057 -11.600 1.00 1.43 C ATOM 1766 C ALA A 122 -11.089 18.931 -10.569 1.00 11.41 C ATOM 1767 O ALA A 122 -11.554 20.039 -10.862 1.00 22.45 O ATOM 1768 CB ALA A 122 -9.844 18.873 -12.753 1.00 23.05 C ATOM 0 H ALA A 122 -12.264 17.446 -12.300 1.00 72.33 H new ATOM 0 HA ALA A 122 -9.563 17.556 -11.145 1.00 1.43 H new ATOM 0 HB1 ALA A 122 -9.140 19.609 -12.364 1.00 23.05 H new ATOM 0 HB2 ALA A 122 -9.328 18.210 -13.447 1.00 23.05 H new ATOM 0 HB3 ALA A 122 -10.653 19.385 -13.274 1.00 23.05 H new ATOM 1774 N ASP A 123 -11.217 18.394 -9.386 1.00 35.44 N ATOM 1775 CA ASP A 123 -11.869 19.082 -8.294 1.00 14.34 C ATOM 1776 C ASP A 123 -10.824 19.816 -7.480 1.00 41.02 C ATOM 1777 O ASP A 123 -9.798 19.226 -7.115 1.00 2.20 O ATOM 1778 CB ASP A 123 -12.619 18.080 -7.412 1.00 24.52 C ATOM 1779 CG ASP A 123 -13.429 18.730 -6.331 1.00 4.25 C ATOM 1780 OD1 ASP A 123 -12.863 19.080 -5.289 1.00 3.21 O ATOM 1781 OD2 ASP A 123 -14.667 18.902 -6.521 1.00 33.51 O ATOM 0 H ASP A 123 -10.872 17.464 -9.147 1.00 35.44 H new ATOM 0 HA ASP A 123 -12.590 19.797 -8.691 1.00 14.34 H new ATOM 0 HB2 ASP A 123 -13.278 17.478 -8.038 1.00 24.52 H new ATOM 0 HB3 ASP A 123 -11.900 17.398 -6.957 1.00 24.52 H new ATOM 1786 N PRO A 124 -11.043 21.103 -7.193 1.00 4.22 N ATOM 1787 CA PRO A 124 -10.082 21.926 -6.477 1.00 33.32 C ATOM 1788 C PRO A 124 -10.111 21.744 -4.950 1.00 73.34 C ATOM 1789 O PRO A 124 -9.345 22.396 -4.233 1.00 12.42 O ATOM 1790 CB PRO A 124 -10.486 23.344 -6.859 1.00 44.15 C ATOM 1791 CG PRO A 124 -11.952 23.267 -7.095 1.00 3.31 C ATOM 1792 CD PRO A 124 -12.247 21.870 -7.564 1.00 73.54 C ATOM 0 HA PRO A 124 -9.060 21.659 -6.747 1.00 33.32 H new ATOM 0 HB2 PRO A 124 -10.249 24.051 -6.064 1.00 44.15 H new ATOM 0 HB3 PRO A 124 -9.958 23.680 -7.752 1.00 44.15 H new ATOM 0 HG2 PRO A 124 -12.502 23.492 -6.181 1.00 3.31 H new ATOM 0 HG3 PRO A 124 -12.262 23.998 -7.842 1.00 3.31 H new ATOM 0 HD2 PRO A 124 -13.139 21.468 -7.083 1.00 73.54 H new ATOM 0 HD3 PRO A 124 -12.423 21.840 -8.639 1.00 73.54 H new ATOM 1800 N ASP A 125 -10.984 20.893 -4.449 1.00 61.43 N ATOM 1801 CA ASP A 125 -11.014 20.631 -3.018 1.00 74.12 C ATOM 1802 C ASP A 125 -10.192 19.435 -2.678 1.00 31.04 C ATOM 1803 O ASP A 125 -9.333 19.499 -1.789 1.00 2.32 O ATOM 1804 CB ASP A 125 -12.429 20.477 -2.446 1.00 70.22 C ATOM 1805 CG ASP A 125 -13.209 21.766 -2.404 1.00 60.35 C ATOM 1806 OD1 ASP A 125 -13.076 22.518 -1.410 1.00 61.10 O ATOM 1807 OD2 ASP A 125 -13.979 22.044 -3.342 1.00 24.34 O ATOM 0 H ASP A 125 -11.672 20.377 -4.997 1.00 61.43 H new ATOM 0 HA ASP A 125 -10.585 21.517 -2.549 1.00 74.12 H new ATOM 0 HB2 ASP A 125 -12.977 19.750 -3.046 1.00 70.22 H new ATOM 0 HB3 ASP A 125 -12.361 20.071 -1.437 1.00 70.22 H new ATOM 1812 N MET A 126 -10.420 18.328 -3.370 1.00 22.05 N ATOM 1813 CA MET A 126 -9.653 17.147 -3.082 1.00 64.11 C ATOM 1814 C MET A 126 -8.252 17.264 -3.674 1.00 31.30 C ATOM 1815 O MET A 126 -8.044 17.174 -4.895 1.00 21.35 O ATOM 1816 CB MET A 126 -10.351 15.855 -3.548 1.00 53.00 C ATOM 1817 CG MET A 126 -10.651 15.841 -5.018 1.00 14.04 C ATOM 1818 SD MET A 126 -11.332 14.307 -5.607 1.00 11.31 S ATOM 1819 CE MET A 126 -11.458 14.737 -7.323 1.00 71.00 C ATOM 0 H MET A 126 -11.112 18.232 -4.113 1.00 22.05 H new ATOM 0 HA MET A 126 -9.570 17.074 -1.998 1.00 64.11 H new ATOM 0 HB2 MET A 126 -9.719 15.001 -3.305 1.00 53.00 H new ATOM 0 HB3 MET A 126 -11.281 15.732 -2.993 1.00 53.00 H new ATOM 0 HG2 MET A 126 -11.350 16.646 -5.243 1.00 14.04 H new ATOM 0 HG3 MET A 126 -9.734 16.053 -5.567 1.00 14.04 H new ATOM 0 HE1 MET A 126 -11.770 13.863 -7.895 1.00 71.00 H new ATOM 0 HE2 MET A 126 -12.193 15.532 -7.446 1.00 71.00 H new ATOM 0 HE3 MET A 126 -10.489 15.080 -7.684 1.00 71.00 H new ATOM 2066 N LYS A 140 9.369 5.497 -9.498 1.00 24.14 N ATOM 2067 CA LYS A 140 9.348 5.779 -10.929 1.00 25.41 C ATOM 2068 C LYS A 140 10.349 6.879 -11.275 1.00 71.32 C ATOM 2069 O LYS A 140 10.988 6.843 -12.320 1.00 51.01 O ATOM 2070 CB LYS A 140 7.928 6.185 -11.384 1.00 20.32 C ATOM 2071 CG LYS A 140 7.864 6.680 -12.827 1.00 22.44 C ATOM 2072 CD LYS A 140 6.461 7.078 -13.265 1.00 20.20 C ATOM 2073 CE LYS A 140 5.561 5.884 -13.446 1.00 22.45 C ATOM 2074 NZ LYS A 140 4.200 6.275 -13.885 1.00 52.32 N ATOM 0 HA LYS A 140 9.634 4.870 -11.458 1.00 25.41 H new ATOM 0 HB2 LYS A 140 7.262 5.329 -11.273 1.00 20.32 H new ATOM 0 HB3 LYS A 140 7.554 6.968 -10.724 1.00 20.32 H new ATOM 0 HG2 LYS A 140 8.529 7.536 -12.940 1.00 22.44 H new ATOM 0 HG3 LYS A 140 8.236 5.898 -13.489 1.00 22.44 H new ATOM 0 HD2 LYS A 140 6.027 7.749 -12.523 1.00 20.20 H new ATOM 0 HD3 LYS A 140 6.518 7.633 -14.201 1.00 20.20 H new ATOM 0 HE2 LYS A 140 5.999 5.208 -14.181 1.00 22.45 H new ATOM 0 HE3 LYS A 140 5.495 5.334 -12.507 1.00 22.45 H new ATOM 0 HZ1 LYS A 140 3.613 5.424 -13.997 1.00 52.32 H new ATOM 0 HZ2 LYS A 140 3.771 6.899 -13.172 1.00 52.32 H new ATOM 0 HZ3 LYS A 140 4.259 6.777 -14.794 1.00 52.32 H new ATOM 2088 N LYS A 141 10.489 7.840 -10.370 1.00 41.31 N ATOM 2089 CA LYS A 141 11.375 8.991 -10.536 1.00 32.21 C ATOM 2090 C LYS A 141 12.805 8.575 -10.887 1.00 74.43 C ATOM 2091 O LYS A 141 13.458 9.239 -11.678 1.00 11.20 O ATOM 2092 CB LYS A 141 11.350 9.872 -9.269 1.00 72.04 C ATOM 2093 CG LYS A 141 12.241 11.113 -9.326 1.00 70.22 C ATOM 2094 CD LYS A 141 12.117 11.969 -8.059 1.00 31.11 C ATOM 2095 CE LYS A 141 12.508 11.201 -6.800 1.00 72.02 C ATOM 2096 NZ LYS A 141 12.417 12.046 -5.584 1.00 20.13 N ATOM 0 H LYS A 141 9.983 7.844 -9.485 1.00 41.31 H new ATOM 0 HA LYS A 141 11.002 9.574 -11.378 1.00 32.21 H new ATOM 0 HB2 LYS A 141 10.323 10.189 -9.085 1.00 72.04 H new ATOM 0 HB3 LYS A 141 11.653 9.264 -8.416 1.00 72.04 H new ATOM 0 HG2 LYS A 141 13.279 10.808 -9.457 1.00 70.22 H new ATOM 0 HG3 LYS A 141 11.973 11.712 -10.196 1.00 70.22 H new ATOM 0 HD2 LYS A 141 12.751 12.851 -8.156 1.00 31.11 H new ATOM 0 HD3 LYS A 141 11.091 12.323 -7.962 1.00 31.11 H new ATOM 0 HE2 LYS A 141 11.858 10.333 -6.688 1.00 72.02 H new ATOM 0 HE3 LYS A 141 13.526 10.826 -6.906 1.00 72.02 H new ATOM 0 HZ1 LYS A 141 12.691 11.487 -4.751 1.00 20.13 H new ATOM 0 HZ2 LYS A 141 13.056 12.861 -5.679 1.00 20.13 H new ATOM 0 HZ3 LYS A 141 11.440 12.384 -5.468 1.00 20.13 H new ATOM 2110 N LYS A 142 13.260 7.457 -10.331 1.00 63.35 N ATOM 2111 CA LYS A 142 14.607 6.949 -10.601 1.00 24.41 C ATOM 2112 C LYS A 142 14.767 6.627 -12.101 1.00 23.33 C ATOM 2113 O LYS A 142 15.831 6.845 -12.693 1.00 64.15 O ATOM 2114 CB LYS A 142 14.876 5.709 -9.740 1.00 1.45 C ATOM 2115 CG LYS A 142 16.272 5.120 -9.885 1.00 45.45 C ATOM 2116 CD LYS A 142 16.451 3.925 -8.965 1.00 22.31 C ATOM 2117 CE LYS A 142 17.826 3.309 -9.107 1.00 32.24 C ATOM 2118 NZ LYS A 142 17.988 2.149 -8.210 1.00 43.22 N ATOM 0 H LYS A 142 12.716 6.881 -9.688 1.00 63.35 H new ATOM 0 HA LYS A 142 15.338 7.715 -10.342 1.00 24.41 H new ATOM 0 HB2 LYS A 142 14.714 5.969 -8.694 1.00 1.45 H new ATOM 0 HB3 LYS A 142 14.145 4.942 -9.995 1.00 1.45 H new ATOM 0 HG2 LYS A 142 16.438 4.817 -10.919 1.00 45.45 H new ATOM 0 HG3 LYS A 142 17.018 5.879 -9.652 1.00 45.45 H new ATOM 0 HD2 LYS A 142 16.296 4.235 -7.932 1.00 22.31 H new ATOM 0 HD3 LYS A 142 15.692 3.176 -9.190 1.00 22.31 H new ATOM 0 HE2 LYS A 142 17.983 2.998 -10.140 1.00 32.24 H new ATOM 0 HE3 LYS A 142 18.587 4.056 -8.880 1.00 32.24 H new ATOM 0 HZ1 LYS A 142 18.940 1.748 -8.330 1.00 43.22 H new ATOM 0 HZ2 LYS A 142 17.862 2.453 -7.223 1.00 43.22 H new ATOM 0 HZ3 LYS A 142 17.276 1.427 -8.444 1.00 43.22 H new ATOM 2132 N PHE A 143 13.694 6.138 -12.708 1.00 73.12 N ATOM 2133 CA PHE A 143 13.670 5.839 -14.136 1.00 44.52 C ATOM 2134 C PHE A 143 13.538 7.147 -14.904 1.00 41.24 C ATOM 2135 O PHE A 143 14.219 7.380 -15.913 1.00 61.52 O ATOM 2136 CB PHE A 143 12.449 4.980 -14.500 1.00 15.31 C ATOM 2137 CG PHE A 143 12.326 3.643 -13.828 1.00 10.04 C ATOM 2138 CD1 PHE A 143 11.750 3.535 -12.579 1.00 23.32 C ATOM 2139 CD2 PHE A 143 12.752 2.494 -14.465 1.00 50.30 C ATOM 2140 CE1 PHE A 143 11.605 2.310 -11.971 1.00 4.34 C ATOM 2141 CE2 PHE A 143 12.605 1.262 -13.867 1.00 53.41 C ATOM 2142 CZ PHE A 143 12.031 1.170 -12.616 1.00 63.23 C ATOM 0 H PHE A 143 12.817 5.937 -12.227 1.00 73.12 H new ATOM 0 HA PHE A 143 14.586 5.304 -14.387 1.00 44.52 H new ATOM 0 HB2 PHE A 143 11.551 5.556 -14.274 1.00 15.31 H new ATOM 0 HB3 PHE A 143 12.460 4.817 -15.578 1.00 15.31 H new ATOM 0 HD1 PHE A 143 11.408 4.425 -12.072 1.00 23.32 H new ATOM 0 HD2 PHE A 143 13.205 2.562 -15.443 1.00 50.30 H new ATOM 0 HE1 PHE A 143 11.158 2.242 -10.990 1.00 4.34 H new ATOM 0 HE2 PHE A 143 12.938 0.370 -14.376 1.00 53.41 H new ATOM 0 HZ PHE A 143 11.916 0.206 -12.143 1.00 63.23 H new ATOM 2152 N ILE A 144 12.655 8.004 -14.399 1.00 44.44 N ATOM 2153 CA ILE A 144 12.323 9.279 -15.025 1.00 52.54 C ATOM 2154 C ILE A 144 13.552 10.173 -15.161 1.00 24.03 C ATOM 2155 O ILE A 144 13.670 10.898 -16.127 1.00 20.53 O ATOM 2156 CB ILE A 144 11.184 10.027 -14.263 1.00 44.10 C ATOM 2157 CG1 ILE A 144 9.940 9.136 -14.129 1.00 24.51 C ATOM 2158 CG2 ILE A 144 10.811 11.332 -14.958 1.00 54.30 C ATOM 2159 CD1 ILE A 144 9.339 8.660 -15.446 1.00 53.11 C ATOM 0 H ILE A 144 12.144 7.830 -13.533 1.00 44.44 H new ATOM 0 HA ILE A 144 11.956 9.048 -16.025 1.00 52.54 H new ATOM 0 HB ILE A 144 11.561 10.263 -13.268 1.00 44.10 H new ATOM 0 HG12 ILE A 144 10.200 8.263 -13.530 1.00 24.51 H new ATOM 0 HG13 ILE A 144 9.177 9.685 -13.577 1.00 24.51 H new ATOM 0 HG21 ILE A 144 10.015 11.826 -14.401 1.00 54.30 H new ATOM 0 HG22 ILE A 144 11.684 11.984 -15.000 1.00 54.30 H new ATOM 0 HG23 ILE A 144 10.467 11.120 -15.970 1.00 54.30 H new ATOM 0 HD11 ILE A 144 8.466 8.039 -15.244 1.00 53.11 H new ATOM 0 HD12 ILE A 144 9.040 9.522 -16.042 1.00 53.11 H new ATOM 0 HD13 ILE A 144 10.080 8.078 -15.995 1.00 53.11 H new ATOM 2171 N GLU A 145 14.474 10.097 -14.204 1.00 15.21 N ATOM 2172 CA GLU A 145 15.726 10.866 -14.266 1.00 71.15 C ATOM 2173 C GLU A 145 16.478 10.608 -15.587 1.00 52.31 C ATOM 2174 O GLU A 145 17.175 11.483 -16.106 1.00 54.41 O ATOM 2175 CB GLU A 145 16.622 10.555 -13.066 1.00 3.21 C ATOM 2176 CG GLU A 145 16.025 10.959 -11.726 1.00 11.55 C ATOM 2177 CD GLU A 145 16.949 10.672 -10.572 1.00 52.43 C ATOM 2178 OE1 GLU A 145 18.037 11.275 -10.527 1.00 21.25 O ATOM 2179 OE2 GLU A 145 16.623 9.838 -9.701 1.00 75.23 O ATOM 0 H GLU A 145 14.382 9.512 -13.374 1.00 15.21 H new ATOM 0 HA GLU A 145 15.463 11.923 -14.230 1.00 71.15 H new ATOM 0 HB2 GLU A 145 16.833 9.486 -13.051 1.00 3.21 H new ATOM 0 HB3 GLU A 145 17.576 11.066 -13.196 1.00 3.21 H new ATOM 0 HG2 GLU A 145 15.790 12.023 -11.743 1.00 11.55 H new ATOM 0 HG3 GLU A 145 15.085 10.427 -11.576 1.00 11.55 H new ATOM 2186 N THR A 146 16.336 9.413 -16.108 1.00 15.15 N ATOM 2187 CA THR A 146 16.895 9.063 -17.384 1.00 14.41 C ATOM 2188 C THR A 146 15.997 9.555 -18.528 1.00 20.31 C ATOM 2189 O THR A 146 16.461 10.212 -19.479 1.00 1.22 O ATOM 2190 CB THR A 146 17.046 7.524 -17.488 1.00 23.13 C ATOM 2191 OG1 THR A 146 17.993 7.059 -16.511 1.00 5.25 O ATOM 2192 CG2 THR A 146 17.451 7.073 -18.903 1.00 2.33 C ATOM 0 H THR A 146 15.826 8.655 -15.654 1.00 15.15 H new ATOM 0 HA THR A 146 17.871 9.541 -17.469 1.00 14.41 H new ATOM 0 HB THR A 146 16.072 7.079 -17.284 1.00 23.13 H new ATOM 0 HG1 THR A 146 18.083 6.086 -16.580 1.00 5.25 H new ATOM 0 HG21 THR A 146 17.544 5.987 -18.926 1.00 2.33 H new ATOM 0 HG22 THR A 146 16.689 7.387 -19.617 1.00 2.33 H new ATOM 0 HG23 THR A 146 18.406 7.525 -19.169 1.00 2.33 H new ATOM 2200 N PHE A 147 14.717 9.276 -18.403 1.00 34.24 N ATOM 2201 CA PHE A 147 13.799 9.480 -19.493 1.00 65.23 C ATOM 2202 C PHE A 147 13.415 10.944 -19.707 1.00 0.32 C ATOM 2203 O PHE A 147 13.147 11.355 -20.826 1.00 43.44 O ATOM 2204 CB PHE A 147 12.570 8.601 -19.349 1.00 23.22 C ATOM 2205 CG PHE A 147 11.956 8.334 -20.673 1.00 20.11 C ATOM 2206 CD1 PHE A 147 12.569 7.435 -21.511 1.00 4.42 C ATOM 2207 CD2 PHE A 147 10.808 8.971 -21.098 1.00 72.34 C ATOM 2208 CE1 PHE A 147 12.074 7.160 -22.744 1.00 23.22 C ATOM 2209 CE2 PHE A 147 10.288 8.701 -22.347 1.00 2.24 C ATOM 2210 CZ PHE A 147 10.924 7.791 -23.177 1.00 53.31 C ATOM 0 H PHE A 147 14.292 8.906 -17.553 1.00 34.24 H new ATOM 0 HA PHE A 147 14.334 9.180 -20.394 1.00 65.23 H new ATOM 0 HB2 PHE A 147 12.844 7.659 -18.874 1.00 23.22 H new ATOM 0 HB3 PHE A 147 11.844 9.087 -18.698 1.00 23.22 H new ATOM 0 HD1 PHE A 147 13.467 6.935 -21.180 1.00 4.42 H new ATOM 0 HD2 PHE A 147 10.316 9.682 -20.452 1.00 72.34 H new ATOM 0 HE1 PHE A 147 12.577 6.451 -23.384 1.00 23.22 H new ATOM 0 HE2 PHE A 147 9.388 9.197 -22.677 1.00 2.24 H new ATOM 0 HZ PHE A 147 10.523 7.577 -24.157 1.00 53.31 H new ATOM 2220 N LYS A 148 13.397 11.713 -18.639 1.00 2.50 N ATOM 2221 CA LYS A 148 13.040 13.132 -18.689 1.00 53.13 C ATOM 2222 C LYS A 148 13.931 13.879 -19.673 1.00 53.41 C ATOM 2223 O LYS A 148 13.466 14.718 -20.438 1.00 65.42 O ATOM 2224 CB LYS A 148 13.158 13.744 -17.284 1.00 2.34 C ATOM 2225 CG LYS A 148 12.846 15.225 -17.196 1.00 24.43 C ATOM 2226 CD LYS A 148 12.956 15.721 -15.760 1.00 12.20 C ATOM 2227 CE LYS A 148 12.720 17.216 -15.669 1.00 74.03 C ATOM 2228 NZ LYS A 148 13.747 17.982 -16.407 1.00 44.23 N ATOM 0 H LYS A 148 13.629 11.379 -17.704 1.00 2.50 H new ATOM 0 HA LYS A 148 12.010 13.224 -19.033 1.00 53.13 H new ATOM 0 HB2 LYS A 148 12.486 13.207 -16.614 1.00 2.34 H new ATOM 0 HB3 LYS A 148 14.172 13.580 -16.918 1.00 2.34 H new ATOM 0 HG2 LYS A 148 13.533 15.784 -17.831 1.00 24.43 H new ATOM 0 HG3 LYS A 148 11.840 15.412 -17.573 1.00 24.43 H new ATOM 0 HD2 LYS A 148 12.230 15.198 -15.137 1.00 12.20 H new ATOM 0 HD3 LYS A 148 13.944 15.483 -15.366 1.00 12.20 H new ATOM 0 HE2 LYS A 148 11.734 17.453 -16.068 1.00 74.03 H new ATOM 0 HE3 LYS A 148 12.722 17.521 -14.622 1.00 74.03 H new ATOM 0 HZ1 LYS A 148 13.708 18.981 -16.120 1.00 44.23 H new ATOM 0 HZ2 LYS A 148 14.689 17.596 -16.192 1.00 44.23 H new ATOM 0 HZ3 LYS A 148 13.567 17.908 -17.429 1.00 44.23 H new ATOM 2242 N LYS A 149 15.204 13.525 -19.684 1.00 52.41 N ATOM 2243 CA LYS A 149 16.158 14.165 -20.562 1.00 12.42 C ATOM 2244 C LYS A 149 15.908 13.731 -22.003 1.00 40.25 C ATOM 2245 O LYS A 149 16.060 14.510 -22.936 1.00 42.55 O ATOM 2246 CB LYS A 149 17.582 13.832 -20.127 1.00 13.44 C ATOM 2247 CG LYS A 149 17.904 14.252 -18.703 1.00 61.11 C ATOM 2248 CD LYS A 149 19.327 13.898 -18.322 1.00 74.13 C ATOM 2249 CE LYS A 149 19.624 14.309 -16.886 1.00 43.32 C ATOM 2250 NZ LYS A 149 21.009 13.988 -16.494 1.00 63.50 N ATOM 0 H LYS A 149 15.599 12.795 -19.091 1.00 52.41 H new ATOM 0 HA LYS A 149 16.033 15.246 -20.502 1.00 12.42 H new ATOM 0 HB2 LYS A 149 17.739 12.758 -20.223 1.00 13.44 H new ATOM 0 HB3 LYS A 149 18.282 14.318 -20.806 1.00 13.44 H new ATOM 0 HG2 LYS A 149 17.756 15.327 -18.598 1.00 61.11 H new ATOM 0 HG3 LYS A 149 17.212 13.767 -18.015 1.00 61.11 H new ATOM 0 HD2 LYS A 149 19.482 12.825 -18.437 1.00 74.13 H new ATOM 0 HD3 LYS A 149 20.023 14.395 -18.998 1.00 74.13 H new ATOM 0 HE2 LYS A 149 19.454 15.380 -16.773 1.00 43.32 H new ATOM 0 HE3 LYS A 149 18.931 13.804 -16.214 1.00 43.32 H new ATOM 0 HZ1 LYS A 149 21.169 14.284 -15.510 1.00 63.50 H new ATOM 0 HZ2 LYS A 149 21.164 12.963 -16.577 1.00 63.50 H new ATOM 0 HZ3 LYS A 149 21.672 14.490 -17.119 1.00 63.50 H new ATOM 2264 N ILE A 150 15.480 12.492 -22.157 1.00 13.44 N ATOM 2265 CA ILE A 150 15.155 11.928 -23.458 1.00 5.42 C ATOM 2266 C ILE A 150 13.896 12.604 -24.008 1.00 43.30 C ATOM 2267 O ILE A 150 13.803 12.903 -25.201 1.00 72.45 O ATOM 2268 CB ILE A 150 14.928 10.394 -23.352 1.00 3.11 C ATOM 2269 CG1 ILE A 150 16.209 9.703 -22.856 1.00 5.51 C ATOM 2270 CG2 ILE A 150 14.470 9.814 -24.689 1.00 35.04 C ATOM 2271 CD1 ILE A 150 16.076 8.210 -22.647 1.00 1.21 C ATOM 0 H ILE A 150 15.347 11.844 -21.381 1.00 13.44 H new ATOM 0 HA ILE A 150 15.991 12.105 -24.135 1.00 5.42 H new ATOM 0 HB ILE A 150 14.135 10.210 -22.627 1.00 3.11 H new ATOM 0 HG12 ILE A 150 17.007 9.887 -23.575 1.00 5.51 H new ATOM 0 HG13 ILE A 150 16.514 10.163 -21.916 1.00 5.51 H new ATOM 0 HG21 ILE A 150 14.319 8.739 -24.587 1.00 35.04 H new ATOM 0 HG22 ILE A 150 13.534 10.285 -24.989 1.00 35.04 H new ATOM 0 HG23 ILE A 150 15.230 10.003 -25.447 1.00 35.04 H new ATOM 0 HD11 ILE A 150 17.026 7.806 -22.297 1.00 1.21 H new ATOM 0 HD12 ILE A 150 15.303 8.014 -21.904 1.00 1.21 H new ATOM 0 HD13 ILE A 150 15.804 7.734 -23.589 1.00 1.21 H new ATOM 2283 N MET A 151 12.951 12.867 -23.124 1.00 62.42 N ATOM 2284 CA MET A 151 11.720 13.519 -23.467 1.00 0.23 C ATOM 2285 C MET A 151 11.996 14.952 -23.941 1.00 50.14 C ATOM 2286 O MET A 151 11.361 15.448 -24.877 1.00 41.41 O ATOM 2287 CB MET A 151 10.782 13.507 -22.256 1.00 42.41 C ATOM 2288 CG MET A 151 9.452 14.136 -22.531 1.00 43.30 C ATOM 2289 SD MET A 151 8.322 14.092 -21.124 1.00 13.41 S ATOM 2290 CE MET A 151 6.892 14.899 -21.851 1.00 1.12 C ATOM 0 H MET A 151 13.027 12.626 -22.136 1.00 62.42 H new ATOM 0 HA MET A 151 11.237 12.984 -24.285 1.00 0.23 H new ATOM 0 HB2 MET A 151 10.629 12.477 -21.934 1.00 42.41 H new ATOM 0 HB3 MET A 151 11.261 14.032 -21.429 1.00 42.41 H new ATOM 0 HG2 MET A 151 9.606 15.173 -22.830 1.00 43.30 H new ATOM 0 HG3 MET A 151 8.987 13.627 -23.375 1.00 43.30 H new ATOM 0 HE1 MET A 151 6.092 14.956 -21.113 1.00 1.12 H new ATOM 0 HE2 MET A 151 7.165 15.905 -22.170 1.00 1.12 H new ATOM 0 HE3 MET A 151 6.550 14.326 -22.713 1.00 1.12 H new ATOM 2300 N GLU A 152 12.954 15.600 -23.304 1.00 53.04 N ATOM 2301 CA GLU A 152 13.370 16.942 -23.692 1.00 4.54 C ATOM 2302 C GLU A 152 14.145 16.903 -25.014 1.00 4.34 C ATOM 2303 O GLU A 152 14.087 17.837 -25.808 1.00 5.12 O ATOM 2304 CB GLU A 152 14.215 17.576 -22.588 1.00 64.02 C ATOM 2305 CG GLU A 152 13.468 17.773 -21.273 1.00 21.31 C ATOM 2306 CD GLU A 152 12.346 18.783 -21.372 1.00 21.02 C ATOM 2307 OE1 GLU A 152 11.324 18.512 -22.016 1.00 30.54 O ATOM 2308 OE2 GLU A 152 12.479 19.890 -20.815 1.00 14.41 O ATOM 0 H GLU A 152 13.465 15.217 -22.508 1.00 53.04 H new ATOM 0 HA GLU A 152 12.480 17.554 -23.837 1.00 4.54 H new ATOM 0 HB2 GLU A 152 15.089 16.950 -22.408 1.00 64.02 H new ATOM 0 HB3 GLU A 152 14.582 18.542 -22.934 1.00 64.02 H new ATOM 0 HG2 GLU A 152 13.060 16.816 -20.947 1.00 21.31 H new ATOM 0 HG3 GLU A 152 14.173 18.096 -20.507 1.00 21.31 H new ATOM 2315 N CYS A 153 14.842 15.803 -25.245 1.00 64.33 N ATOM 2316 CA CYS A 153 15.599 15.596 -26.473 1.00 15.13 C ATOM 2317 C CYS A 153 14.649 15.438 -27.672 1.00 63.55 C ATOM 2318 O CYS A 153 14.952 15.877 -28.779 1.00 62.11 O ATOM 2319 CB CYS A 153 16.504 14.363 -26.326 1.00 42.31 C ATOM 2320 SG CYS A 153 17.528 13.988 -27.765 1.00 52.23 S ATOM 0 H CYS A 153 14.900 15.026 -24.587 1.00 64.33 H new ATOM 0 HA CYS A 153 16.226 16.469 -26.654 1.00 15.13 H new ATOM 0 HB2 CYS A 153 17.155 14.510 -25.465 1.00 42.31 H new ATOM 0 HB3 CYS A 153 15.879 13.497 -26.109 1.00 42.31 H new ATOM 0 HG CYS A 153 18.247 12.932 -27.523 1.00 52.23 H new ATOM 2326 N LYS A 154 13.496 14.818 -27.431 1.00 5.32 N ATOM 2327 CA LYS A 154 12.471 14.621 -28.463 1.00 2.12 C ATOM 2328 C LYS A 154 11.720 15.899 -28.737 1.00 24.41 C ATOM 2329 O LYS A 154 11.032 16.037 -29.756 1.00 40.33 O ATOM 2330 CB LYS A 154 11.506 13.521 -28.079 1.00 34.34 C ATOM 2331 CG LYS A 154 12.186 12.196 -27.901 1.00 61.52 C ATOM 2332 CD LYS A 154 11.187 11.093 -27.693 1.00 42.30 C ATOM 2333 CE LYS A 154 11.871 9.743 -27.544 1.00 20.21 C ATOM 2334 NZ LYS A 154 10.904 8.636 -27.392 1.00 43.41 N ATOM 0 H LYS A 154 13.243 14.438 -26.519 1.00 5.32 H new ATOM 0 HA LYS A 154 12.986 14.321 -29.375 1.00 2.12 H new ATOM 0 HB2 LYS A 154 11.000 13.793 -27.153 1.00 34.34 H new ATOM 0 HB3 LYS A 154 10.738 13.431 -28.847 1.00 34.34 H new ATOM 0 HG2 LYS A 154 12.795 11.977 -28.778 1.00 61.52 H new ATOM 0 HG3 LYS A 154 12.862 12.243 -27.047 1.00 61.52 H new ATOM 0 HD2 LYS A 154 10.593 11.301 -26.803 1.00 42.30 H new ATOM 0 HD3 LYS A 154 10.497 11.062 -28.536 1.00 42.30 H new ATOM 0 HE2 LYS A 154 12.497 9.558 -28.417 1.00 20.21 H new ATOM 0 HE3 LYS A 154 12.531 9.767 -26.677 1.00 20.21 H new ATOM 0 HZ1 LYS A 154 11.418 7.737 -27.294 1.00 43.41 H new ATOM 0 HZ2 LYS A 154 10.323 8.797 -26.545 1.00 43.41 H new ATOM 0 HZ3 LYS A 154 10.290 8.594 -28.230 1.00 43.41 H new