USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 963 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 35 MET CE :methyl -145:sc= -2.55! (180deg=-2.84) USER MOD Set 1.2: A 86 ASN : amide:sc= 0.892 K(o=-1.7,f=-5.6) USER MOD Set 2.1: A 46 THR OG1 : rot 180:sc= -0.0641 USER MOD Set 2.2: A 72 HIS : no HE2:sc= 0.59 K(o=0.53,f=-3.9!) USER MOD Set 3.1: A 33 ASN : amide:sc= -0.402 K(o=-0.54,f=-4) USER MOD Set 3.2: A 39 THR OG1 : rot -137:sc= -0.142 USER MOD Set 4.1: A 23 TYR OH : rot 35:sc= 1.21 USER MOD Set 4.2: A 25 SER OG : rot 172:sc= 1.18 USER MOD Set 5.1: A 19 ASN : amide:sc= -0.648 K(o=-1.7,f=-5.7) USER MOD Set 5.2: A 77 MET CE :methyl 166:sc= -0.543 (180deg=-2.27) USER MOD Set 5.3: A 111 MET CE :methyl 143:sc= -0.514 (180deg=-1.35!) USER MOD Set 6.1: A 18 HIS : no HE2:sc= -1.02 K(o=0.21,f=-11!) USER MOD Set 6.2: A 81 SER OG : rot -33:sc= 1.23 USER MOD Single : A 27 GLN : amide:sc= -1.13 X(o=-1.1,f=-1.5) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= 0 K(o=0,f=0.58) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 CYS SG : rot -76:sc= 0.165 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 95 TYR OH : rot 120:sc= -0.347 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 SER OG : rot -5:sc= 1.05 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot 79:sc= 1.24 USER MOD Single : A 116 TYR OH : rot 0:sc= 0 USER MOD Single : A 117 MET CE :methyl 134:sc= -0.872 (180deg=-4.02!) USER MOD Single : A 120 ASN : amide:sc= 1.16 K(o=1.2,f=-0.6) USER MOD Single : A 121 LYS NZ :NH3+ 157:sc= 1.17 (180deg=0.677) USER MOD Single : A 126 MET CE :methyl -157:sc= -0.173 (180deg=-0.732) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 172:sc= 0.57 (180deg=0.299) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 THR OG1 : rot 79:sc= 1.21 USER MOD Single : A 148 LYS NZ :NH3+ -145:sc= 1.24 (180deg=1.14) 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+ 168:sc= -0.0163 (180deg=-0.153) USER MOD ----------------------------------------------------------------- ATOM 93 N LEU A 17 -24.843 -11.569 -11.196 1.00 53.14 N ATOM 94 CA LEU A 17 -24.056 -10.976 -10.149 1.00 41.34 C ATOM 95 C LEU A 17 -23.019 -10.053 -10.734 1.00 21.14 C ATOM 96 O LEU A 17 -22.504 -10.285 -11.837 1.00 72.25 O ATOM 97 CB LEU A 17 -23.420 -12.017 -9.244 1.00 4.45 C ATOM 98 CG LEU A 17 -24.391 -12.939 -8.490 1.00 52.14 C ATOM 99 CD1 LEU A 17 -23.631 -13.939 -7.639 1.00 60.32 C ATOM 100 CD2 LEU A 17 -25.349 -12.130 -7.626 1.00 0.32 C ATOM 0 HA LEU A 17 -24.730 -10.392 -9.522 1.00 41.34 H new ATOM 0 HB2 LEU A 17 -22.756 -12.637 -9.847 1.00 4.45 H new ATOM 0 HB3 LEU A 17 -22.798 -11.502 -8.512 1.00 4.45 H new ATOM 0 HG LEU A 17 -24.975 -13.487 -9.230 1.00 52.14 H new ATOM 0 HD11 LEU A 17 -24.338 -14.582 -7.114 1.00 60.32 H new ATOM 0 HD12 LEU A 17 -22.992 -14.549 -8.278 1.00 60.32 H new ATOM 0 HD13 LEU A 17 -23.017 -13.406 -6.913 1.00 60.32 H new ATOM 0 HD21 LEU A 17 -26.026 -12.805 -7.103 1.00 0.32 H new ATOM 0 HD22 LEU A 17 -24.781 -11.550 -6.899 1.00 0.32 H new ATOM 0 HD23 LEU A 17 -25.927 -11.455 -8.257 1.00 0.32 H new ATOM 112 N HIS A 18 -22.732 -9.013 -10.014 1.00 24.22 N ATOM 113 CA HIS A 18 -21.866 -7.948 -10.474 1.00 72.34 C ATOM 114 C HIS A 18 -20.648 -7.850 -9.611 1.00 71.40 C ATOM 115 O HIS A 18 -20.620 -8.380 -8.480 1.00 21.40 O ATOM 116 CB HIS A 18 -22.598 -6.615 -10.431 1.00 20.22 C ATOM 117 CG HIS A 18 -23.862 -6.591 -11.212 1.00 55.43 C ATOM 118 ND1 HIS A 18 -24.011 -5.917 -12.393 1.00 51.14 N ATOM 119 CD2 HIS A 18 -25.062 -7.133 -10.938 1.00 4.33 C ATOM 120 CE1 HIS A 18 -25.251 -6.039 -12.802 1.00 12.03 C ATOM 121 NE2 HIS A 18 -25.903 -6.772 -11.936 1.00 42.04 N ATOM 0 H HIS A 18 -23.095 -8.869 -9.072 1.00 24.22 H new ATOM 0 HA HIS A 18 -21.572 -8.177 -11.498 1.00 72.34 H new ATOM 0 HB2 HIS A 18 -22.820 -6.368 -9.393 1.00 20.22 H new ATOM 0 HB3 HIS A 18 -21.935 -5.836 -10.809 1.00 20.22 H new ATOM 0 HD1 HIS A 18 -23.276 -5.402 -12.878 1.00 51.14 H new ATOM 0 HD2 HIS A 18 -25.309 -7.743 -10.081 1.00 4.33 H new ATOM 0 HE1 HIS A 18 -25.664 -5.607 -13.702 1.00 12.03 H new ATOM 130 N ASN A 19 -19.640 -7.203 -10.137 1.00 72.23 N ATOM 131 CA ASN A 19 -18.402 -6.997 -9.428 1.00 21.31 C ATOM 132 C ASN A 19 -18.133 -5.498 -9.351 1.00 54.15 C ATOM 133 O ASN A 19 -18.165 -4.798 -10.379 1.00 1.25 O ATOM 134 CB ASN A 19 -17.246 -7.701 -10.145 1.00 34.50 C ATOM 135 CG ASN A 19 -17.499 -9.177 -10.386 1.00 44.13 C ATOM 136 OD1 ASN A 19 -18.230 -9.832 -9.655 1.00 65.24 O ATOM 137 ND2 ASN A 19 -16.889 -9.711 -11.395 1.00 2.22 N ATOM 0 H ASN A 19 -19.654 -6.802 -11.075 1.00 72.23 H new ATOM 0 HA ASN A 19 -18.482 -7.417 -8.425 1.00 21.31 H new ATOM 0 HB2 ASN A 19 -17.068 -7.209 -11.101 1.00 34.50 H new ATOM 0 HB3 ASN A 19 -16.338 -7.587 -9.554 1.00 34.50 H new ATOM 0 HD21 ASN A 19 -17.012 -10.703 -11.598 1.00 2.22 H new ATOM 0 HD22 ASN A 19 -16.286 -9.140 -11.987 1.00 2.22 H new ATOM 144 N VAL A 20 -17.900 -4.999 -8.164 1.00 44.35 N ATOM 145 CA VAL A 20 -17.707 -3.565 -7.956 1.00 35.51 C ATOM 146 C VAL A 20 -16.390 -3.298 -7.229 1.00 51.14 C ATOM 147 O VAL A 20 -16.043 -4.009 -6.299 1.00 15.11 O ATOM 148 CB VAL A 20 -18.893 -2.964 -7.121 1.00 63.00 C ATOM 149 CG1 VAL A 20 -18.721 -1.465 -6.885 1.00 54.42 C ATOM 150 CG2 VAL A 20 -20.223 -3.236 -7.801 1.00 53.02 C ATOM 0 H VAL A 20 -17.837 -5.559 -7.314 1.00 44.35 H new ATOM 0 HA VAL A 20 -17.678 -3.086 -8.935 1.00 35.51 H new ATOM 0 HB VAL A 20 -18.884 -3.458 -6.149 1.00 63.00 H new ATOM 0 HG11 VAL A 20 -19.563 -1.089 -6.304 1.00 54.42 H new ATOM 0 HG12 VAL A 20 -17.795 -1.287 -6.339 1.00 54.42 H new ATOM 0 HG13 VAL A 20 -18.682 -0.948 -7.844 1.00 54.42 H new ATOM 0 HG21 VAL A 20 -21.030 -2.811 -7.205 1.00 53.02 H new ATOM 0 HG22 VAL A 20 -20.225 -2.781 -8.792 1.00 53.02 H new ATOM 0 HG23 VAL A 20 -20.370 -4.312 -7.896 1.00 53.02 H new ATOM 160 N PHE A 21 -15.667 -2.284 -7.665 1.00 4.34 N ATOM 161 CA PHE A 21 -14.431 -1.890 -7.018 1.00 63.03 C ATOM 162 C PHE A 21 -14.759 -0.792 -6.040 1.00 45.55 C ATOM 163 O PHE A 21 -15.298 0.258 -6.417 1.00 52.52 O ATOM 164 CB PHE A 21 -13.417 -1.400 -8.072 1.00 73.24 C ATOM 165 CG PHE A 21 -12.086 -0.910 -7.539 1.00 30.42 C ATOM 166 CD1 PHE A 21 -11.121 -1.805 -7.107 1.00 52.25 C ATOM 167 CD2 PHE A 21 -11.797 0.449 -7.490 1.00 33.55 C ATOM 168 CE1 PHE A 21 -9.907 -1.360 -6.636 1.00 3.25 C ATOM 169 CE2 PHE A 21 -10.581 0.897 -7.020 1.00 22.05 C ATOM 170 CZ PHE A 21 -9.635 -0.010 -6.593 1.00 64.43 C ATOM 0 H PHE A 21 -15.918 -1.714 -8.472 1.00 4.34 H new ATOM 0 HA PHE A 21 -13.981 -2.734 -6.495 1.00 63.03 H new ATOM 0 HB2 PHE A 21 -13.228 -2.215 -8.771 1.00 73.24 H new ATOM 0 HB3 PHE A 21 -13.877 -0.592 -8.641 1.00 73.24 H new ATOM 0 HD1 PHE A 21 -11.324 -2.865 -7.140 1.00 52.25 H new ATOM 0 HD2 PHE A 21 -12.535 1.163 -7.825 1.00 33.55 H new ATOM 0 HE1 PHE A 21 -9.166 -2.070 -6.299 1.00 3.25 H new ATOM 0 HE2 PHE A 21 -10.370 1.956 -6.986 1.00 22.05 H new ATOM 0 HZ PHE A 21 -8.681 0.337 -6.225 1.00 64.43 H new ATOM 180 N VAL A 22 -14.435 -1.015 -4.807 1.00 50.12 N ATOM 181 CA VAL A 22 -14.768 -0.099 -3.770 1.00 43.21 C ATOM 182 C VAL A 22 -13.535 0.576 -3.205 1.00 52.13 C ATOM 183 O VAL A 22 -12.585 -0.075 -2.758 1.00 64.40 O ATOM 184 CB VAL A 22 -15.634 -0.761 -2.663 1.00 65.55 C ATOM 185 CG1 VAL A 22 -16.969 -1.191 -3.252 1.00 74.43 C ATOM 186 CG2 VAL A 22 -14.928 -1.967 -2.051 1.00 31.12 C ATOM 0 H VAL A 22 -13.929 -1.843 -4.492 1.00 50.12 H new ATOM 0 HA VAL A 22 -15.382 0.683 -4.217 1.00 43.21 H new ATOM 0 HB VAL A 22 -15.795 -0.028 -1.872 1.00 65.55 H new ATOM 0 HG11 VAL A 22 -17.577 -1.655 -2.475 1.00 74.43 H new ATOM 0 HG12 VAL A 22 -17.490 -0.319 -3.647 1.00 74.43 H new ATOM 0 HG13 VAL A 22 -16.798 -1.907 -4.056 1.00 74.43 H new ATOM 0 HG21 VAL A 22 -15.561 -2.407 -1.280 1.00 31.12 H new ATOM 0 HG22 VAL A 22 -14.734 -2.707 -2.827 1.00 31.12 H new ATOM 0 HG23 VAL A 22 -13.984 -1.650 -1.608 1.00 31.12 H new ATOM 196 N TYR A 23 -13.555 1.883 -3.248 1.00 13.04 N ATOM 197 CA TYR A 23 -12.439 2.683 -2.806 1.00 65.22 C ATOM 198 C TYR A 23 -12.345 2.808 -1.292 1.00 62.01 C ATOM 199 O TYR A 23 -11.260 2.744 -0.737 1.00 11.22 O ATOM 200 CB TYR A 23 -12.453 4.060 -3.485 1.00 3.12 C ATOM 201 CG TYR A 23 -13.718 4.898 -3.284 1.00 11.34 C ATOM 202 CD1 TYR A 23 -14.847 4.700 -4.078 1.00 41.30 C ATOM 203 CD2 TYR A 23 -13.769 5.894 -2.320 1.00 34.20 C ATOM 204 CE1 TYR A 23 -15.982 5.470 -3.911 1.00 34.54 C ATOM 205 CE2 TYR A 23 -14.903 6.664 -2.148 1.00 51.02 C ATOM 206 CZ TYR A 23 -16.004 6.448 -2.946 1.00 24.24 C ATOM 207 OH TYR A 23 -17.126 7.218 -2.775 1.00 55.42 O ATOM 0 H TYR A 23 -14.348 2.426 -3.591 1.00 13.04 H new ATOM 0 HA TYR A 23 -11.538 2.153 -3.114 1.00 65.22 H new ATOM 0 HB2 TYR A 23 -11.601 4.632 -3.118 1.00 3.12 H new ATOM 0 HB3 TYR A 23 -12.303 3.916 -4.555 1.00 3.12 H new ATOM 0 HD1 TYR A 23 -14.834 3.931 -4.837 1.00 41.30 H new ATOM 0 HD2 TYR A 23 -12.907 6.071 -1.693 1.00 34.20 H new ATOM 0 HE1 TYR A 23 -16.847 5.304 -4.536 1.00 34.54 H new ATOM 0 HE2 TYR A 23 -14.926 7.433 -1.390 1.00 51.02 H new ATOM 0 HH TYR A 23 -17.924 6.675 -2.943 1.00 55.42 H new ATOM 217 N GLY A 24 -13.471 2.972 -0.626 1.00 32.21 N ATOM 218 CA GLY A 24 -13.413 3.151 0.807 1.00 52.45 C ATOM 219 C GLY A 24 -14.749 3.014 1.484 1.00 74.43 C ATOM 220 O GLY A 24 -14.847 2.390 2.539 1.00 32.24 O ATOM 0 H GLY A 24 -14.404 2.985 -1.037 1.00 32.21 H new ATOM 0 HA2 GLY A 24 -12.724 2.419 1.229 1.00 52.45 H new ATOM 0 HA3 GLY A 24 -13.003 4.137 1.026 1.00 52.45 H new ATOM 224 N SER A 25 -15.783 3.559 0.866 1.00 73.50 N ATOM 225 CA SER A 25 -17.128 3.562 1.435 1.00 25.34 C ATOM 226 C SER A 25 -17.652 2.145 1.731 1.00 74.44 C ATOM 227 O SER A 25 -18.454 1.955 2.636 1.00 54.13 O ATOM 228 CB SER A 25 -18.071 4.250 0.458 1.00 0.43 C ATOM 229 OG SER A 25 -17.575 5.532 0.081 1.00 20.32 O ATOM 0 H SER A 25 -15.718 4.013 -0.045 1.00 73.50 H new ATOM 0 HA SER A 25 -17.084 4.095 2.385 1.00 25.34 H new ATOM 0 HB2 SER A 25 -18.196 3.630 -0.430 1.00 0.43 H new ATOM 0 HB3 SER A 25 -19.056 4.357 0.913 1.00 0.43 H new ATOM 0 HG SER A 25 -18.128 5.898 -0.641 1.00 20.32 H new ATOM 235 N PHE A 26 -17.178 1.163 0.985 1.00 44.02 N ATOM 236 CA PHE A 26 -17.668 -0.199 1.132 1.00 34.30 C ATOM 237 C PHE A 26 -16.492 -1.180 1.161 1.00 23.41 C ATOM 238 O PHE A 26 -16.637 -2.333 0.805 1.00 73.41 O ATOM 239 CB PHE A 26 -18.571 -0.550 -0.070 1.00 14.42 C ATOM 240 CG PHE A 26 -19.706 0.399 -0.327 1.00 15.31 C ATOM 241 CD1 PHE A 26 -20.688 0.621 0.624 1.00 71.03 C ATOM 242 CD2 PHE A 26 -19.782 1.074 -1.527 1.00 53.41 C ATOM 243 CE1 PHE A 26 -21.721 1.502 0.370 1.00 72.22 C ATOM 244 CE2 PHE A 26 -20.808 1.945 -1.781 1.00 74.44 C ATOM 245 CZ PHE A 26 -21.778 2.163 -0.832 1.00 24.14 C ATOM 0 H PHE A 26 -16.457 1.281 0.273 1.00 44.02 H new ATOM 0 HA PHE A 26 -18.230 -0.273 2.063 1.00 34.30 H new ATOM 0 HB2 PHE A 26 -17.951 -0.598 -0.965 1.00 14.42 H new ATOM 0 HB3 PHE A 26 -18.983 -1.547 0.087 1.00 14.42 H new ATOM 0 HD1 PHE A 26 -20.646 0.102 1.570 1.00 71.03 H new ATOM 0 HD2 PHE A 26 -19.022 0.914 -2.277 1.00 53.41 H new ATOM 0 HE1 PHE A 26 -22.483 1.671 1.116 1.00 72.22 H new ATOM 0 HE2 PHE A 26 -20.855 2.461 -2.728 1.00 74.44 H new ATOM 0 HZ PHE A 26 -22.584 2.853 -1.032 1.00 24.14 H new ATOM 255 N GLN A 27 -15.336 -0.731 1.624 1.00 44.21 N ATOM 256 CA GLN A 27 -14.140 -1.588 1.580 1.00 40.12 C ATOM 257 C GLN A 27 -14.117 -2.649 2.692 1.00 40.34 C ATOM 258 O GLN A 27 -13.408 -3.657 2.586 1.00 53.53 O ATOM 259 CB GLN A 27 -12.825 -0.737 1.539 1.00 54.43 C ATOM 260 CG GLN A 27 -12.535 0.148 2.772 1.00 42.15 C ATOM 261 CD GLN A 27 -12.061 -0.622 3.998 1.00 33.41 C ATOM 262 OE1 GLN A 27 -11.406 -1.656 3.883 1.00 73.43 O ATOM 263 NE2 GLN A 27 -12.382 -0.132 5.166 1.00 12.03 N ATOM 0 H GLN A 27 -15.191 0.195 2.026 1.00 44.21 H new ATOM 0 HA GLN A 27 -14.194 -2.147 0.646 1.00 40.12 H new ATOM 0 HB2 GLN A 27 -11.984 -1.416 1.402 1.00 54.43 H new ATOM 0 HB3 GLN A 27 -12.862 -0.094 0.659 1.00 54.43 H new ATOM 0 HG2 GLN A 27 -11.778 0.886 2.505 1.00 42.15 H new ATOM 0 HG3 GLN A 27 -13.439 0.699 3.030 1.00 42.15 H new ATOM 0 HE21 GLN A 27 -12.927 0.728 5.226 1.00 12.03 H new ATOM 0 HE22 GLN A 27 -12.088 -0.610 6.018 1.00 12.03 H new ATOM 272 N ASP A 28 -14.899 -2.432 3.729 1.00 35.01 N ATOM 273 CA ASP A 28 -14.889 -3.316 4.890 1.00 53.32 C ATOM 274 C ASP A 28 -16.139 -4.194 4.895 1.00 61.13 C ATOM 275 O ASP A 28 -17.241 -3.692 4.756 1.00 62.14 O ATOM 276 CB ASP A 28 -14.813 -2.487 6.174 1.00 30.02 C ATOM 277 CG ASP A 28 -14.618 -3.335 7.407 1.00 4.42 C ATOM 278 OD1 ASP A 28 -13.455 -3.722 7.692 1.00 52.40 O ATOM 279 OD2 ASP A 28 -15.604 -3.612 8.114 1.00 22.12 O ATOM 0 H ASP A 28 -15.552 -1.652 3.798 1.00 35.01 H new ATOM 0 HA ASP A 28 -14.013 -3.963 4.837 1.00 53.32 H new ATOM 0 HB2 ASP A 28 -13.991 -1.776 6.094 1.00 30.02 H new ATOM 0 HB3 ASP A 28 -15.728 -1.905 6.280 1.00 30.02 H new ATOM 284 N PRO A 29 -15.986 -5.517 5.067 1.00 31.11 N ATOM 285 CA PRO A 29 -17.106 -6.467 4.998 1.00 60.22 C ATOM 286 C PRO A 29 -18.199 -6.251 6.057 1.00 14.15 C ATOM 287 O PRO A 29 -19.361 -6.611 5.839 1.00 12.55 O ATOM 288 CB PRO A 29 -16.446 -7.827 5.188 1.00 43.30 C ATOM 289 CG PRO A 29 -15.139 -7.550 5.822 1.00 55.12 C ATOM 290 CD PRO A 29 -14.710 -6.201 5.330 1.00 45.23 C ATOM 0 HA PRO A 29 -17.637 -6.351 4.053 1.00 60.22 H new ATOM 0 HB2 PRO A 29 -17.057 -8.475 5.817 1.00 43.30 H new ATOM 0 HB3 PRO A 29 -16.318 -8.337 4.233 1.00 43.30 H new ATOM 0 HG2 PRO A 29 -15.224 -7.558 6.909 1.00 55.12 H new ATOM 0 HG3 PRO A 29 -14.407 -8.312 5.554 1.00 55.12 H new ATOM 0 HD2 PRO A 29 -14.115 -5.671 6.074 1.00 45.23 H new ATOM 0 HD3 PRO A 29 -14.100 -6.276 4.430 1.00 45.23 H new ATOM 298 N ASP A 30 -17.843 -5.653 7.186 1.00 24.14 N ATOM 299 CA ASP A 30 -18.818 -5.429 8.268 1.00 62.41 C ATOM 300 C ASP A 30 -19.893 -4.472 7.823 1.00 14.15 C ATOM 301 O ASP A 30 -21.080 -4.705 8.042 1.00 50.02 O ATOM 302 CB ASP A 30 -18.136 -4.897 9.526 1.00 34.43 C ATOM 303 CG ASP A 30 -19.104 -4.610 10.663 1.00 2.23 C ATOM 304 OD1 ASP A 30 -19.433 -5.540 11.428 1.00 73.31 O ATOM 305 OD2 ASP A 30 -19.514 -3.440 10.834 1.00 63.41 O ATOM 0 H ASP A 30 -16.901 -5.315 7.384 1.00 24.14 H new ATOM 0 HA ASP A 30 -19.274 -6.390 8.506 1.00 62.41 H new ATOM 0 HB2 ASP A 30 -17.396 -5.623 9.863 1.00 34.43 H new ATOM 0 HB3 ASP A 30 -17.596 -3.983 9.279 1.00 34.43 H new ATOM 310 N VAL A 31 -19.479 -3.420 7.150 1.00 24.51 N ATOM 311 CA VAL A 31 -20.409 -2.422 6.686 1.00 35.21 C ATOM 312 C VAL A 31 -21.254 -2.964 5.542 1.00 60.01 C ATOM 313 O VAL A 31 -22.384 -2.555 5.357 1.00 33.12 O ATOM 314 CB VAL A 31 -19.737 -1.057 6.306 1.00 74.40 C ATOM 315 CG1 VAL A 31 -18.971 -0.486 7.485 1.00 13.23 C ATOM 316 CG2 VAL A 31 -18.844 -1.162 5.080 1.00 24.43 C ATOM 0 H VAL A 31 -18.504 -3.237 6.914 1.00 24.51 H new ATOM 0 HA VAL A 31 -21.061 -2.198 7.530 1.00 35.21 H new ATOM 0 HB VAL A 31 -20.544 -0.372 6.047 1.00 74.40 H new ATOM 0 HG11 VAL A 31 -18.514 0.461 7.198 1.00 13.23 H new ATOM 0 HG12 VAL A 31 -19.655 -0.321 8.318 1.00 13.23 H new ATOM 0 HG13 VAL A 31 -18.194 -1.187 7.788 1.00 13.23 H new ATOM 0 HG21 VAL A 31 -18.406 -0.187 4.864 1.00 24.43 H new ATOM 0 HG22 VAL A 31 -18.049 -1.883 5.270 1.00 24.43 H new ATOM 0 HG23 VAL A 31 -19.436 -1.491 4.226 1.00 24.43 H new ATOM 326 N ILE A 32 -20.698 -3.908 4.794 1.00 41.23 N ATOM 327 CA ILE A 32 -21.361 -4.486 3.642 1.00 74.14 C ATOM 328 C ILE A 32 -22.651 -5.224 4.041 1.00 4.21 C ATOM 329 O ILE A 32 -23.729 -4.952 3.497 1.00 11.54 O ATOM 330 CB ILE A 32 -20.391 -5.423 2.898 1.00 1.13 C ATOM 331 CG1 ILE A 32 -19.172 -4.645 2.429 1.00 11.43 C ATOM 332 CG2 ILE A 32 -21.055 -6.087 1.728 1.00 44.02 C ATOM 333 CD1 ILE A 32 -19.508 -3.478 1.538 1.00 72.33 C ATOM 0 H ILE A 32 -19.771 -4.293 4.973 1.00 41.23 H new ATOM 0 HA ILE A 32 -21.653 -3.677 2.972 1.00 74.14 H new ATOM 0 HB ILE A 32 -20.080 -6.202 3.594 1.00 1.13 H new ATOM 0 HG12 ILE A 32 -18.626 -4.281 3.300 1.00 11.43 H new ATOM 0 HG13 ILE A 32 -18.504 -5.320 1.893 1.00 11.43 H new ATOM 0 HG21 ILE A 32 -20.341 -6.740 1.227 1.00 44.02 H new ATOM 0 HG22 ILE A 32 -21.903 -6.676 2.077 1.00 44.02 H new ATOM 0 HG23 ILE A 32 -21.404 -5.327 1.029 1.00 44.02 H new ATOM 0 HD11 ILE A 32 -18.590 -2.970 1.242 1.00 72.33 H new ATOM 0 HD12 ILE A 32 -20.027 -3.837 0.649 1.00 72.33 H new ATOM 0 HD13 ILE A 32 -20.151 -2.782 2.077 1.00 72.33 H new ATOM 345 N ASN A 33 -22.546 -6.112 5.007 1.00 40.11 N ATOM 346 CA ASN A 33 -23.708 -6.857 5.519 1.00 34.41 C ATOM 347 C ASN A 33 -24.784 -5.928 6.031 1.00 13.13 C ATOM 348 O ASN A 33 -25.969 -6.215 5.930 1.00 42.34 O ATOM 349 CB ASN A 33 -23.276 -7.816 6.626 1.00 24.44 C ATOM 350 CG ASN A 33 -22.521 -9.003 6.096 1.00 1.33 C ATOM 351 OD1 ASN A 33 -22.825 -9.523 5.032 1.00 60.23 O ATOM 352 ND2 ASN A 33 -21.489 -9.387 6.772 1.00 60.10 N ATOM 0 H ASN A 33 -21.666 -6.346 5.466 1.00 40.11 H new ATOM 0 HA ASN A 33 -24.125 -7.428 4.689 1.00 34.41 H new ATOM 0 HB2 ASN A 33 -22.651 -7.282 7.342 1.00 24.44 H new ATOM 0 HB3 ASN A 33 -24.157 -8.162 7.167 1.00 24.44 H new ATOM 0 HD21 ASN A 33 -20.902 -10.144 6.421 1.00 60.10 H new ATOM 0 HD22 ASN A 33 -21.261 -8.933 7.657 1.00 60.10 H new ATOM 359 N VAL A 34 -24.368 -4.811 6.563 1.00 45.52 N ATOM 360 CA VAL A 34 -25.291 -3.849 7.106 1.00 34.03 C ATOM 361 C VAL A 34 -25.895 -2.951 6.016 1.00 30.03 C ATOM 362 O VAL A 34 -27.105 -2.695 6.003 1.00 14.54 O ATOM 363 CB VAL A 34 -24.627 -2.970 8.197 1.00 21.55 C ATOM 364 CG1 VAL A 34 -25.624 -1.993 8.811 1.00 41.21 C ATOM 365 CG2 VAL A 34 -23.980 -3.833 9.271 1.00 1.10 C ATOM 0 H VAL A 34 -23.387 -4.542 6.633 1.00 45.52 H new ATOM 0 HA VAL A 34 -26.096 -4.425 7.562 1.00 34.03 H new ATOM 0 HB VAL A 34 -23.845 -2.383 7.715 1.00 21.55 H new ATOM 0 HG11 VAL A 34 -25.124 -1.393 9.572 1.00 41.21 H new ATOM 0 HG12 VAL A 34 -26.018 -1.338 8.034 1.00 41.21 H new ATOM 0 HG13 VAL A 34 -26.444 -2.548 9.267 1.00 41.21 H new ATOM 0 HG21 VAL A 34 -23.521 -3.193 10.025 1.00 1.10 H new ATOM 0 HG22 VAL A 34 -24.739 -4.460 9.740 1.00 1.10 H new ATOM 0 HG23 VAL A 34 -23.216 -4.465 8.818 1.00 1.10 H new ATOM 375 N MET A 35 -25.064 -2.488 5.105 1.00 43.42 N ATOM 376 CA MET A 35 -25.491 -1.526 4.108 1.00 45.51 C ATOM 377 C MET A 35 -26.426 -2.186 3.089 1.00 44.11 C ATOM 378 O MET A 35 -27.421 -1.593 2.681 1.00 4.10 O ATOM 379 CB MET A 35 -24.248 -0.927 3.425 1.00 10.13 C ATOM 380 CG MET A 35 -24.443 0.426 2.737 1.00 42.01 C ATOM 381 SD MET A 35 -25.599 0.445 1.350 1.00 24.24 S ATOM 382 CE MET A 35 -24.738 -0.596 0.198 1.00 1.24 C ATOM 0 H MET A 35 -24.084 -2.763 5.034 1.00 43.42 H new ATOM 0 HA MET A 35 -26.051 -0.723 4.587 1.00 45.51 H new ATOM 0 HB2 MET A 35 -23.463 -0.821 4.174 1.00 10.13 H new ATOM 0 HB3 MET A 35 -23.887 -1.640 2.684 1.00 10.13 H new ATOM 0 HG2 MET A 35 -24.787 1.144 3.481 1.00 42.01 H new ATOM 0 HG3 MET A 35 -23.473 0.774 2.382 1.00 42.01 H new ATOM 0 HE1 MET A 35 -24.911 -0.237 -0.817 1.00 1.24 H new ATOM 0 HE2 MET A 35 -23.670 -0.572 0.414 1.00 1.24 H new ATOM 0 HE3 MET A 35 -25.104 -1.619 0.288 1.00 1.24 H new ATOM 392 N LEU A 36 -26.152 -3.430 2.736 1.00 22.44 N ATOM 393 CA LEU A 36 -27.032 -4.132 1.834 1.00 23.24 C ATOM 394 C LEU A 36 -27.704 -5.317 2.491 1.00 21.12 C ATOM 395 O LEU A 36 -28.916 -5.265 2.736 1.00 42.30 O ATOM 396 CB LEU A 36 -26.419 -4.471 0.431 1.00 72.41 C ATOM 397 CG LEU A 36 -25.036 -5.146 0.359 1.00 0.03 C ATOM 398 CD1 LEU A 36 -24.821 -5.739 -1.020 1.00 43.30 C ATOM 399 CD2 LEU A 36 -23.951 -4.112 0.579 1.00 72.15 C ATOM 0 H LEU A 36 -25.342 -3.962 3.056 1.00 22.44 H new ATOM 0 HA LEU A 36 -27.815 -3.410 1.602 1.00 23.24 H new ATOM 0 HB2 LEU A 36 -27.127 -5.117 -0.089 1.00 72.41 H new ATOM 0 HB3 LEU A 36 -26.360 -3.541 -0.135 1.00 72.41 H new ATOM 0 HG LEU A 36 -24.994 -5.923 1.123 1.00 0.03 H new ATOM 0 HD11 LEU A 36 -23.841 -6.214 -1.063 1.00 43.30 H new ATOM 0 HD12 LEU A 36 -25.593 -6.481 -1.221 1.00 43.30 H new ATOM 0 HD13 LEU A 36 -24.874 -4.948 -1.768 1.00 43.30 H new ATOM 0 HD21 LEU A 36 -22.974 -4.593 0.527 1.00 72.15 H new ATOM 0 HD22 LEU A 36 -24.019 -3.344 -0.192 1.00 72.15 H new ATOM 0 HD23 LEU A 36 -24.078 -3.654 1.560 1.00 72.15 H new ATOM 411 N ASP A 37 -26.928 -6.349 2.841 1.00 60.40 N ATOM 412 CA ASP A 37 -27.479 -7.595 3.437 1.00 44.42 C ATOM 413 C ASP A 37 -26.391 -8.641 3.543 1.00 73.03 C ATOM 414 O ASP A 37 -26.177 -9.227 4.598 1.00 13.50 O ATOM 415 CB ASP A 37 -28.631 -8.179 2.585 1.00 63.21 C ATOM 416 CG ASP A 37 -29.327 -9.372 3.226 1.00 73.00 C ATOM 417 OD1 ASP A 37 -30.317 -9.156 3.968 1.00 72.24 O ATOM 418 OD2 ASP A 37 -28.930 -10.526 2.972 1.00 73.32 O ATOM 0 H ASP A 37 -25.915 -6.356 2.726 1.00 60.40 H new ATOM 0 HA ASP A 37 -27.865 -7.337 4.423 1.00 44.42 H new ATOM 0 HB2 ASP A 37 -29.367 -7.396 2.402 1.00 63.21 H new ATOM 0 HB3 ASP A 37 -28.236 -8.479 1.614 1.00 63.21 H new ATOM 423 N ARG A 38 -25.689 -8.855 2.449 1.00 12.24 N ATOM 424 CA ARG A 38 -24.649 -9.883 2.382 1.00 13.03 C ATOM 425 C ARG A 38 -23.347 -9.259 1.965 1.00 32.01 C ATOM 426 O ARG A 38 -23.343 -8.164 1.408 1.00 40.14 O ATOM 427 CB ARG A 38 -24.997 -10.950 1.341 1.00 73.13 C ATOM 428 CG ARG A 38 -26.291 -11.698 1.565 1.00 15.32 C ATOM 429 CD ARG A 38 -26.496 -12.706 0.459 1.00 72.53 C ATOM 430 NE ARG A 38 -27.736 -13.468 0.594 1.00 44.10 N ATOM 431 CZ ARG A 38 -28.029 -14.553 -0.129 1.00 14.21 C ATOM 432 NH1 ARG A 38 -27.145 -15.018 -1.022 1.00 62.34 N ATOM 433 NH2 ARG A 38 -29.188 -15.174 0.045 1.00 73.31 N ATOM 0 H ARG A 38 -25.815 -8.330 1.583 1.00 12.24 H new ATOM 0 HA ARG A 38 -24.572 -10.338 3.369 1.00 13.03 H new ATOM 0 HB2 ARG A 38 -25.041 -10.473 0.362 1.00 73.13 H new ATOM 0 HB3 ARG A 38 -24.183 -11.674 1.306 1.00 73.13 H new ATOM 0 HG2 ARG A 38 -26.267 -12.203 2.531 1.00 15.32 H new ATOM 0 HG3 ARG A 38 -27.126 -10.998 1.592 1.00 15.32 H new ATOM 0 HD2 ARG A 38 -26.499 -12.188 -0.500 1.00 72.53 H new ATOM 0 HD3 ARG A 38 -25.653 -13.397 0.445 1.00 72.53 H new ATOM 0 HE ARG A 38 -28.419 -13.152 1.282 1.00 44.10 H new ATOM 0 HH11 ARG A 38 -26.251 -14.544 -1.149 1.00 62.34 H new ATOM 0 HH12 ARG A 38 -27.366 -15.846 -1.575 1.00 62.34 H new ATOM 0 HH21 ARG A 38 -29.856 -14.823 0.731 1.00 73.31 H new ATOM 0 HH22 ARG A 38 -29.411 -16.002 -0.507 1.00 73.31 H new ATOM 447 N THR A 39 -22.247 -9.943 2.234 1.00 70.25 N ATOM 448 CA THR A 39 -20.958 -9.495 1.786 1.00 2.24 C ATOM 449 C THR A 39 -20.452 -10.380 0.637 1.00 40.25 C ATOM 450 O THR A 39 -20.091 -11.548 0.855 1.00 4.44 O ATOM 451 CB THR A 39 -19.921 -9.496 2.931 1.00 62.13 C ATOM 452 OG1 THR A 39 -20.432 -8.759 4.023 1.00 53.21 O ATOM 453 CG2 THR A 39 -18.634 -8.829 2.504 1.00 4.31 C ATOM 0 H THR A 39 -22.231 -10.814 2.764 1.00 70.25 H new ATOM 0 HA THR A 39 -21.077 -8.470 1.434 1.00 2.24 H new ATOM 0 HB THR A 39 -19.726 -10.534 3.201 1.00 62.13 H new ATOM 0 HG1 THR A 39 -19.727 -8.185 4.389 1.00 53.21 H new ATOM 0 HG21 THR A 39 -17.924 -8.845 3.331 1.00 4.31 H new ATOM 0 HG22 THR A 39 -18.212 -9.364 1.653 1.00 4.31 H new ATOM 0 HG23 THR A 39 -18.836 -7.796 2.220 1.00 4.31 H new ATOM 461 N PRO A 40 -20.479 -9.850 -0.601 1.00 34.13 N ATOM 462 CA PRO A 40 -19.915 -10.522 -1.782 1.00 4.11 C ATOM 463 C PRO A 40 -18.426 -10.777 -1.580 1.00 74.15 C ATOM 464 O PRO A 40 -17.776 -10.039 -0.828 1.00 60.14 O ATOM 465 CB PRO A 40 -20.118 -9.491 -2.896 1.00 44.50 C ATOM 466 CG PRO A 40 -21.256 -8.674 -2.433 1.00 60.44 C ATOM 467 CD PRO A 40 -21.072 -8.551 -0.959 1.00 55.11 C ATOM 0 HA PRO A 40 -20.377 -11.487 -1.990 1.00 4.11 H new ATOM 0 HB2 PRO A 40 -19.225 -8.883 -3.043 1.00 44.50 H new ATOM 0 HB3 PRO A 40 -20.336 -9.973 -3.849 1.00 44.50 H new ATOM 0 HG2 PRO A 40 -21.260 -7.695 -2.913 1.00 60.44 H new ATOM 0 HG3 PRO A 40 -22.207 -9.150 -2.673 1.00 60.44 H new ATOM 0 HD2 PRO A 40 -20.415 -7.720 -0.700 1.00 55.11 H new ATOM 0 HD3 PRO A 40 -22.018 -8.382 -0.445 1.00 55.11 H new ATOM 475 N GLU A 41 -17.893 -11.815 -2.222 1.00 73.55 N ATOM 476 CA GLU A 41 -16.481 -12.160 -2.067 1.00 64.25 C ATOM 477 C GLU A 41 -15.611 -10.975 -2.430 1.00 51.24 C ATOM 478 O GLU A 41 -15.788 -10.354 -3.477 1.00 55.35 O ATOM 479 CB GLU A 41 -16.083 -13.413 -2.877 1.00 62.23 C ATOM 480 CG GLU A 41 -14.595 -13.757 -2.753 1.00 54.04 C ATOM 481 CD GLU A 41 -14.194 -15.051 -3.420 1.00 72.23 C ATOM 482 OE1 GLU A 41 -14.245 -16.101 -2.752 1.00 41.54 O ATOM 483 OE2 GLU A 41 -13.771 -15.040 -4.599 1.00 23.11 O ATOM 0 H GLU A 41 -18.413 -12.428 -2.850 1.00 73.55 H new ATOM 0 HA GLU A 41 -16.320 -12.410 -1.018 1.00 64.25 H new ATOM 0 HB2 GLU A 41 -16.676 -14.262 -2.538 1.00 62.23 H new ATOM 0 HB3 GLU A 41 -16.327 -13.253 -3.927 1.00 62.23 H new ATOM 0 HG2 GLU A 41 -14.010 -12.944 -3.184 1.00 54.04 H new ATOM 0 HG3 GLU A 41 -14.335 -13.812 -1.696 1.00 54.04 H new ATOM 490 N ILE A 42 -14.709 -10.648 -1.556 1.00 21.51 N ATOM 491 CA ILE A 42 -13.889 -9.495 -1.737 1.00 24.10 C ATOM 492 C ILE A 42 -12.512 -9.931 -2.186 1.00 1.51 C ATOM 493 O ILE A 42 -11.953 -10.896 -1.658 1.00 2.40 O ATOM 494 CB ILE A 42 -13.765 -8.705 -0.417 1.00 41.30 C ATOM 495 CG1 ILE A 42 -15.147 -8.479 0.197 1.00 20.43 C ATOM 496 CG2 ILE A 42 -13.106 -7.372 -0.686 1.00 31.53 C ATOM 497 CD1 ILE A 42 -15.131 -7.750 1.525 1.00 42.02 C ATOM 0 H ILE A 42 -14.523 -11.172 -0.701 1.00 21.51 H new ATOM 0 HA ILE A 42 -14.346 -8.853 -2.490 1.00 24.10 H new ATOM 0 HB ILE A 42 -13.158 -9.279 0.283 1.00 41.30 H new ATOM 0 HG12 ILE A 42 -15.756 -7.912 -0.507 1.00 20.43 H new ATOM 0 HG13 ILE A 42 -15.633 -9.445 0.333 1.00 20.43 H new ATOM 0 HG21 ILE A 42 -13.019 -6.814 0.247 1.00 31.53 H new ATOM 0 HG22 ILE A 42 -12.113 -7.535 -1.106 1.00 31.53 H new ATOM 0 HG23 ILE A 42 -13.710 -6.804 -1.393 1.00 31.53 H new ATOM 0 HD11 ILE A 42 -16.152 -7.633 1.888 1.00 42.02 H new ATOM 0 HD12 ILE A 42 -14.552 -8.324 2.248 1.00 42.02 H new ATOM 0 HD13 ILE A 42 -14.677 -6.768 1.395 1.00 42.02 H new ATOM 509 N VAL A 43 -11.985 -9.245 -3.149 1.00 31.51 N ATOM 510 CA VAL A 43 -10.678 -9.547 -3.676 1.00 33.41 C ATOM 511 C VAL A 43 -9.819 -8.276 -3.732 1.00 12.41 C ATOM 512 O VAL A 43 -10.345 -7.172 -3.920 1.00 62.51 O ATOM 513 CB VAL A 43 -10.772 -10.198 -5.094 1.00 2.11 C ATOM 514 CG1 VAL A 43 -11.378 -9.253 -6.101 1.00 1.14 C ATOM 515 CG2 VAL A 43 -9.425 -10.682 -5.570 1.00 33.34 C ATOM 0 H VAL A 43 -12.445 -8.454 -3.599 1.00 31.51 H new ATOM 0 HA VAL A 43 -10.206 -10.266 -3.007 1.00 33.41 H new ATOM 0 HB VAL A 43 -11.431 -11.061 -5.003 1.00 2.11 H new ATOM 0 HG11 VAL A 43 -11.427 -9.741 -7.074 1.00 1.14 H new ATOM 0 HG12 VAL A 43 -12.383 -8.978 -5.782 1.00 1.14 H new ATOM 0 HG13 VAL A 43 -10.762 -8.356 -6.175 1.00 1.14 H new ATOM 0 HG21 VAL A 43 -9.528 -11.129 -6.559 1.00 33.34 H new ATOM 0 HG22 VAL A 43 -8.734 -9.841 -5.622 1.00 33.34 H new ATOM 0 HG23 VAL A 43 -9.039 -11.426 -4.874 1.00 33.34 H new ATOM 525 N SER A 44 -8.525 -8.430 -3.531 1.00 72.22 N ATOM 526 CA SER A 44 -7.596 -7.329 -3.626 1.00 64.32 C ATOM 527 C SER A 44 -7.377 -7.011 -5.103 1.00 31.44 C ATOM 528 O SER A 44 -7.020 -7.902 -5.890 1.00 62.30 O ATOM 529 CB SER A 44 -6.270 -7.756 -3.009 1.00 52.30 C ATOM 530 OG SER A 44 -6.459 -8.242 -1.683 1.00 42.42 O ATOM 0 H SER A 44 -8.091 -9.323 -3.297 1.00 72.22 H new ATOM 0 HA SER A 44 -7.984 -6.454 -3.105 1.00 64.32 H new ATOM 0 HB2 SER A 44 -5.812 -8.531 -3.623 1.00 52.30 H new ATOM 0 HB3 SER A 44 -5.581 -6.911 -2.996 1.00 52.30 H new ATOM 0 HG SER A 44 -5.595 -8.512 -1.307 1.00 42.42 H new ATOM 536 N ALA A 45 -7.613 -5.783 -5.489 1.00 22.30 N ATOM 537 CA ALA A 45 -7.460 -5.398 -6.866 1.00 75.22 C ATOM 538 C ALA A 45 -6.862 -4.010 -7.014 1.00 53.53 C ATOM 539 O ALA A 45 -6.909 -3.186 -6.100 1.00 44.21 O ATOM 540 CB ALA A 45 -8.791 -5.469 -7.576 1.00 31.53 C ATOM 0 H ALA A 45 -7.912 -5.032 -4.867 1.00 22.30 H new ATOM 0 HA ALA A 45 -6.764 -6.101 -7.323 1.00 75.22 H new ATOM 0 HB1 ALA A 45 -8.664 -5.175 -8.618 1.00 31.53 H new ATOM 0 HB2 ALA A 45 -9.174 -6.489 -7.530 1.00 31.53 H new ATOM 0 HB3 ALA A 45 -9.498 -4.794 -7.093 1.00 31.53 H new ATOM 546 N THR A 46 -6.304 -3.770 -8.160 1.00 14.12 N ATOM 547 CA THR A 46 -5.726 -2.506 -8.489 1.00 54.52 C ATOM 548 C THR A 46 -6.458 -1.913 -9.680 1.00 75.21 C ATOM 549 O THR A 46 -6.690 -2.597 -10.671 1.00 14.41 O ATOM 550 CB THR A 46 -4.244 -2.664 -8.860 1.00 54.00 C ATOM 551 OG1 THR A 46 -3.567 -3.323 -7.802 1.00 63.11 O ATOM 552 CG2 THR A 46 -3.599 -1.306 -9.090 1.00 71.10 C ATOM 0 H THR A 46 -6.237 -4.461 -8.907 1.00 14.12 H new ATOM 0 HA THR A 46 -5.811 -1.854 -7.620 1.00 54.52 H new ATOM 0 HB THR A 46 -4.174 -3.247 -9.778 1.00 54.00 H new ATOM 0 HG1 THR A 46 -2.621 -3.428 -8.034 1.00 63.11 H new ATOM 0 HG21 THR A 46 -2.550 -1.441 -9.352 1.00 71.10 H new ATOM 0 HG22 THR A 46 -4.112 -0.792 -9.903 1.00 71.10 H new ATOM 0 HG23 THR A 46 -3.672 -0.710 -8.181 1.00 71.10 H new ATOM 560 N LEU A 47 -6.819 -0.672 -9.563 1.00 15.14 N ATOM 561 CA LEU A 47 -7.456 0.059 -10.613 1.00 52.35 C ATOM 562 C LEU A 47 -6.446 1.018 -11.250 1.00 20.32 C ATOM 563 O LEU A 47 -6.107 2.045 -10.659 1.00 60.23 O ATOM 564 CB LEU A 47 -8.667 0.823 -10.056 1.00 22.20 C ATOM 565 CG LEU A 47 -9.401 1.735 -11.027 1.00 51.01 C ATOM 566 CD1 LEU A 47 -9.838 0.977 -12.263 1.00 61.40 C ATOM 567 CD2 LEU A 47 -10.600 2.378 -10.348 1.00 63.23 C ATOM 0 H LEU A 47 -6.675 -0.127 -8.713 1.00 15.14 H new ATOM 0 HA LEU A 47 -7.813 -0.629 -11.379 1.00 52.35 H new ATOM 0 HB2 LEU A 47 -9.379 0.096 -9.667 1.00 22.20 H new ATOM 0 HB3 LEU A 47 -8.332 1.424 -9.211 1.00 22.20 H new ATOM 0 HG LEU A 47 -8.712 2.520 -11.339 1.00 51.01 H new ATOM 0 HD11 LEU A 47 -10.360 1.654 -12.939 1.00 61.40 H new ATOM 0 HD12 LEU A 47 -8.963 0.565 -12.766 1.00 61.40 H new ATOM 0 HD13 LEU A 47 -10.506 0.165 -11.975 1.00 61.40 H new ATOM 0 HD21 LEU A 47 -11.114 3.027 -11.056 1.00 63.23 H new ATOM 0 HD22 LEU A 47 -11.284 1.601 -10.005 1.00 63.23 H new ATOM 0 HD23 LEU A 47 -10.263 2.967 -9.495 1.00 63.23 H new ATOM 579 N PRO A 48 -5.903 0.664 -12.419 1.00 73.24 N ATOM 580 CA PRO A 48 -4.945 1.498 -13.124 1.00 44.35 C ATOM 581 C PRO A 48 -5.637 2.594 -13.941 1.00 1.04 C ATOM 582 O PRO A 48 -6.664 2.354 -14.590 1.00 41.04 O ATOM 583 CB PRO A 48 -4.218 0.513 -14.064 1.00 22.43 C ATOM 584 CG PRO A 48 -4.861 -0.829 -13.839 1.00 22.22 C ATOM 585 CD PRO A 48 -6.165 -0.573 -13.150 1.00 50.11 C ATOM 0 HA PRO A 48 -4.276 2.017 -12.438 1.00 44.35 H new ATOM 0 HB2 PRO A 48 -4.316 0.823 -15.104 1.00 22.43 H new ATOM 0 HB3 PRO A 48 -3.152 0.477 -13.841 1.00 22.43 H new ATOM 0 HG2 PRO A 48 -5.019 -1.346 -14.786 1.00 22.22 H new ATOM 0 HG3 PRO A 48 -4.221 -1.467 -13.230 1.00 22.22 H new ATOM 0 HD2 PRO A 48 -6.983 -0.458 -13.861 1.00 50.11 H new ATOM 0 HD3 PRO A 48 -6.437 -1.389 -12.481 1.00 50.11 H new ATOM 593 N GLY A 49 -5.081 3.782 -13.901 1.00 12.10 N ATOM 594 CA GLY A 49 -5.635 4.885 -14.649 1.00 25.04 C ATOM 595 C GLY A 49 -6.502 5.763 -13.787 1.00 23.44 C ATOM 596 O GLY A 49 -7.188 6.654 -14.279 1.00 22.50 O ATOM 0 H GLY A 49 -4.247 4.009 -13.359 1.00 12.10 H new ATOM 0 HA2 GLY A 49 -4.826 5.478 -15.075 1.00 25.04 H new ATOM 0 HA3 GLY A 49 -6.222 4.501 -15.483 1.00 25.04 H new ATOM 600 N PHE A 50 -6.468 5.523 -12.498 1.00 2.15 N ATOM 601 CA PHE A 50 -7.268 6.262 -11.552 1.00 31.24 C ATOM 602 C PHE A 50 -6.474 6.460 -10.302 1.00 64.25 C ATOM 603 O PHE A 50 -5.611 5.666 -10.001 1.00 20.15 O ATOM 604 CB PHE A 50 -8.591 5.526 -11.234 1.00 44.25 C ATOM 605 CG PHE A 50 -9.547 5.422 -12.402 1.00 22.30 C ATOM 606 CD1 PHE A 50 -9.454 4.384 -13.316 1.00 50.53 C ATOM 607 CD2 PHE A 50 -10.521 6.377 -12.588 1.00 71.11 C ATOM 608 CE1 PHE A 50 -10.318 4.304 -14.386 1.00 51.22 C ATOM 609 CE2 PHE A 50 -11.386 6.307 -13.655 1.00 60.22 C ATOM 610 CZ PHE A 50 -11.286 5.269 -14.557 1.00 24.15 C ATOM 0 H PHE A 50 -5.881 4.805 -12.074 1.00 2.15 H new ATOM 0 HA PHE A 50 -7.528 7.227 -11.988 1.00 31.24 H new ATOM 0 HB2 PHE A 50 -8.358 4.521 -10.881 1.00 44.25 H new ATOM 0 HB3 PHE A 50 -9.092 6.043 -10.416 1.00 44.25 H new ATOM 0 HD1 PHE A 50 -8.694 3.628 -13.188 1.00 50.53 H new ATOM 0 HD2 PHE A 50 -10.607 7.193 -11.886 1.00 71.11 H new ATOM 0 HE1 PHE A 50 -10.237 3.488 -15.088 1.00 51.22 H new ATOM 0 HE2 PHE A 50 -12.144 7.065 -13.786 1.00 60.22 H new ATOM 0 HZ PHE A 50 -11.965 5.213 -15.395 1.00 24.15 H new ATOM 620 N GLN A 51 -6.755 7.497 -9.585 1.00 10.43 N ATOM 621 CA GLN A 51 -6.050 7.783 -8.365 1.00 60.32 C ATOM 622 C GLN A 51 -7.029 8.283 -7.340 1.00 42.20 C ATOM 623 O GLN A 51 -8.042 8.906 -7.691 1.00 11.31 O ATOM 624 CB GLN A 51 -4.921 8.798 -8.618 1.00 23.51 C ATOM 625 CG GLN A 51 -4.099 9.173 -7.390 1.00 41.55 C ATOM 626 CD GLN A 51 -2.922 10.057 -7.735 1.00 31.52 C ATOM 627 OE1 GLN A 51 -3.025 11.288 -7.757 1.00 50.54 O ATOM 628 NE2 GLN A 51 -1.792 9.443 -7.988 1.00 53.34 N ATOM 0 H GLN A 51 -7.479 8.175 -9.823 1.00 10.43 H new ATOM 0 HA GLN A 51 -5.582 6.874 -7.986 1.00 60.32 H new ATOM 0 HB2 GLN A 51 -4.250 8.390 -9.374 1.00 23.51 H new ATOM 0 HB3 GLN A 51 -5.357 9.706 -9.035 1.00 23.51 H new ATOM 0 HG2 GLN A 51 -4.738 9.686 -6.671 1.00 41.55 H new ATOM 0 HG3 GLN A 51 -3.739 8.265 -6.906 1.00 41.55 H new ATOM 0 HE21 GLN A 51 -1.748 8.424 -7.960 1.00 53.34 H new ATOM 0 HE22 GLN A 51 -0.957 9.984 -8.213 1.00 53.34 H new ATOM 637 N ARG A 52 -6.770 7.970 -6.096 1.00 61.14 N ATOM 638 CA ARG A 52 -7.634 8.377 -5.040 1.00 34.23 C ATOM 639 C ARG A 52 -7.051 9.581 -4.364 1.00 24.33 C ATOM 640 O ARG A 52 -5.862 9.598 -4.016 1.00 51.10 O ATOM 641 CB ARG A 52 -7.838 7.249 -4.021 1.00 11.13 C ATOM 642 CG ARG A 52 -8.888 7.573 -2.966 1.00 62.24 C ATOM 643 CD ARG A 52 -9.092 6.431 -1.994 1.00 35.31 C ATOM 644 NE ARG A 52 -10.191 6.712 -1.065 1.00 53.03 N ATOM 645 CZ ARG A 52 -10.398 6.083 0.107 1.00 45.53 C ATOM 646 NH1 ARG A 52 -9.572 5.130 0.522 1.00 60.10 N ATOM 647 NH2 ARG A 52 -11.439 6.423 0.857 1.00 30.32 N ATOM 0 H ARG A 52 -5.958 7.430 -5.797 1.00 61.14 H new ATOM 0 HA ARG A 52 -8.608 8.623 -5.462 1.00 34.23 H new ATOM 0 HB2 ARG A 52 -8.131 6.341 -4.548 1.00 11.13 H new ATOM 0 HB3 ARG A 52 -6.889 7.039 -3.527 1.00 11.13 H new ATOM 0 HG2 ARG A 52 -8.586 8.465 -2.418 1.00 62.24 H new ATOM 0 HG3 ARG A 52 -9.834 7.804 -3.456 1.00 62.24 H new ATOM 0 HD2 ARG A 52 -9.304 5.515 -2.545 1.00 35.31 H new ATOM 0 HD3 ARG A 52 -8.173 6.260 -1.433 1.00 35.31 H new ATOM 0 HE ARG A 52 -10.852 7.443 -1.328 1.00 53.03 H new ATOM 0 HH11 ARG A 52 -8.769 4.867 -0.049 1.00 60.10 H new ATOM 0 HH12 ARG A 52 -9.740 4.661 1.412 1.00 60.10 H new ATOM 0 HH21 ARG A 52 -12.075 7.156 0.544 1.00 30.32 H new ATOM 0 HH22 ARG A 52 -11.603 5.951 1.746 1.00 30.32 H new ATOM 661 N PHE A 53 -7.871 10.560 -4.168 1.00 44.23 N ATOM 662 CA PHE A 53 -7.478 11.770 -3.505 1.00 43.44 C ATOM 663 C PHE A 53 -8.107 11.761 -2.174 1.00 3.12 C ATOM 664 O PHE A 53 -9.270 11.439 -2.053 1.00 74.50 O ATOM 665 CB PHE A 53 -7.975 13.009 -4.271 1.00 41.43 C ATOM 666 CG PHE A 53 -7.243 13.335 -5.542 1.00 71.12 C ATOM 667 CD1 PHE A 53 -6.682 12.349 -6.329 1.00 11.41 C ATOM 668 CD2 PHE A 53 -7.124 14.645 -5.939 1.00 24.34 C ATOM 669 CE1 PHE A 53 -6.012 12.665 -7.488 1.00 31.41 C ATOM 670 CE2 PHE A 53 -6.456 14.974 -7.097 1.00 74.03 C ATOM 671 CZ PHE A 53 -5.897 13.981 -7.871 1.00 62.34 C ATOM 0 H PHE A 53 -8.846 10.547 -4.466 1.00 44.23 H new ATOM 0 HA PHE A 53 -6.391 11.817 -3.446 1.00 43.44 H new ATOM 0 HB2 PHE A 53 -9.029 12.866 -4.509 1.00 41.43 H new ATOM 0 HB3 PHE A 53 -7.912 13.871 -3.607 1.00 41.43 H new ATOM 0 HD1 PHE A 53 -6.770 11.315 -6.030 1.00 11.41 H new ATOM 0 HD2 PHE A 53 -7.560 15.427 -5.335 1.00 24.34 H new ATOM 0 HE1 PHE A 53 -5.578 11.884 -8.094 1.00 31.41 H new ATOM 0 HE2 PHE A 53 -6.370 16.008 -7.398 1.00 74.03 H new ATOM 0 HZ PHE A 53 -5.369 14.236 -8.778 1.00 62.34 H new ATOM 681 N ARG A 54 -7.365 12.097 -1.173 1.00 43.30 N ATOM 682 CA ARG A 54 -7.919 12.074 0.144 1.00 41.13 C ATOM 683 C ARG A 54 -7.976 13.447 0.767 1.00 62.50 C ATOM 684 O ARG A 54 -6.976 14.175 0.826 1.00 13.33 O ATOM 685 CB ARG A 54 -7.240 11.035 1.061 1.00 61.14 C ATOM 686 CG ARG A 54 -5.772 11.278 1.375 1.00 5.45 C ATOM 687 CD ARG A 54 -5.230 10.182 2.290 1.00 52.14 C ATOM 688 NE ARG A 54 -6.000 10.067 3.540 1.00 53.31 N ATOM 689 CZ ARG A 54 -5.665 9.305 4.597 1.00 75.01 C ATOM 690 NH1 ARG A 54 -4.490 8.701 4.651 1.00 52.22 N ATOM 691 NH2 ARG A 54 -6.509 9.180 5.614 1.00 42.24 N ATOM 0 H ARG A 54 -6.389 12.387 -1.235 1.00 43.30 H new ATOM 0 HA ARG A 54 -8.952 11.744 0.032 1.00 41.13 H new ATOM 0 HB2 ARG A 54 -7.790 10.996 2.001 1.00 61.14 H new ATOM 0 HB3 ARG A 54 -7.334 10.054 0.596 1.00 61.14 H new ATOM 0 HG2 ARG A 54 -5.196 11.305 0.450 1.00 5.45 H new ATOM 0 HG3 ARG A 54 -5.653 12.250 1.853 1.00 5.45 H new ATOM 0 HD2 ARG A 54 -5.252 9.228 1.763 1.00 52.14 H new ATOM 0 HD3 ARG A 54 -4.187 10.392 2.526 1.00 52.14 H new ATOM 0 HE ARG A 54 -6.860 10.611 3.610 1.00 53.31 H new ATOM 0 HH11 ARG A 54 -3.825 8.810 3.885 1.00 52.22 H new ATOM 0 HH12 ARG A 54 -4.249 8.126 5.458 1.00 52.22 H new ATOM 0 HH21 ARG A 54 -7.408 9.661 5.592 1.00 42.24 H new ATOM 0 HH22 ARG A 54 -6.258 8.603 6.417 1.00 42.24 H new ATOM 796 N TYR A 60 -15.257 13.589 0.275 1.00 40.42 N ATOM 797 CA TYR A 60 -14.626 12.448 0.859 1.00 10.31 C ATOM 798 C TYR A 60 -13.465 12.061 -0.044 1.00 2.02 C ATOM 799 O TYR A 60 -13.348 12.610 -1.148 1.00 51.43 O ATOM 800 CB TYR A 60 -15.646 11.295 0.872 1.00 73.44 C ATOM 801 CG TYR A 60 -16.976 11.633 1.511 1.00 70.42 C ATOM 802 CD1 TYR A 60 -18.002 12.208 0.756 1.00 34.32 C ATOM 803 CD2 TYR A 60 -17.216 11.370 2.849 1.00 31.03 C ATOM 804 CE1 TYR A 60 -19.223 12.508 1.330 1.00 24.43 C ATOM 805 CE2 TYR A 60 -18.433 11.669 3.430 1.00 73.35 C ATOM 806 CZ TYR A 60 -19.434 12.236 2.669 1.00 14.32 C ATOM 807 OH TYR A 60 -20.651 12.532 3.252 1.00 62.33 O ATOM 0 HA TYR A 60 -14.279 12.656 1.871 1.00 10.31 H new ATOM 0 HB2 TYR A 60 -15.823 10.973 -0.154 1.00 73.44 H new ATOM 0 HB3 TYR A 60 -15.209 10.448 1.401 1.00 73.44 H new ATOM 0 HD1 TYR A 60 -17.839 12.421 -0.290 1.00 34.32 H new ATOM 0 HD2 TYR A 60 -16.437 10.923 3.449 1.00 31.03 H new ATOM 0 HE1 TYR A 60 -20.008 12.952 0.736 1.00 24.43 H new ATOM 0 HE2 TYR A 60 -18.600 11.460 4.476 1.00 73.35 H new ATOM 0 HH TYR A 60 -20.631 12.277 4.198 1.00 62.33 H new ATOM 817 N PRO A 61 -12.573 11.141 0.391 1.00 50.43 N ATOM 818 CA PRO A 61 -11.505 10.641 -0.461 1.00 62.40 C ATOM 819 C PRO A 61 -12.060 9.880 -1.673 1.00 73.10 C ATOM 820 O PRO A 61 -12.362 8.677 -1.595 1.00 61.35 O ATOM 821 CB PRO A 61 -10.698 9.715 0.450 1.00 63.21 C ATOM 822 CG PRO A 61 -11.079 10.126 1.825 1.00 44.32 C ATOM 823 CD PRO A 61 -12.506 10.561 1.738 1.00 60.01 C ATOM 0 HA PRO A 61 -10.901 11.447 -0.878 1.00 62.40 H new ATOM 0 HB2 PRO A 61 -10.940 8.668 0.267 1.00 63.21 H new ATOM 0 HB3 PRO A 61 -9.627 9.829 0.284 1.00 63.21 H new ATOM 0 HG2 PRO A 61 -10.964 9.300 2.526 1.00 44.32 H new ATOM 0 HG3 PRO A 61 -10.444 10.937 2.181 1.00 44.32 H new ATOM 0 HD2 PRO A 61 -13.194 9.724 1.855 1.00 60.01 H new ATOM 0 HD3 PRO A 61 -12.757 11.290 2.508 1.00 60.01 H new ATOM 831 N CYS A 62 -12.204 10.598 -2.757 1.00 71.20 N ATOM 832 CA CYS A 62 -12.835 10.136 -3.966 1.00 51.10 C ATOM 833 C CYS A 62 -11.812 9.637 -5.006 1.00 63.25 C ATOM 834 O CYS A 62 -10.598 9.842 -4.860 1.00 2.23 O ATOM 835 CB CYS A 62 -13.685 11.300 -4.510 1.00 21.32 C ATOM 836 SG CYS A 62 -12.765 12.847 -4.711 1.00 3.22 S ATOM 0 H CYS A 62 -11.871 11.560 -2.824 1.00 71.20 H new ATOM 0 HA CYS A 62 -13.465 9.273 -3.751 1.00 51.10 H new ATOM 0 HB2 CYS A 62 -14.106 11.011 -5.473 1.00 21.32 H new ATOM 0 HB3 CYS A 62 -14.523 11.472 -3.835 1.00 21.32 H new ATOM 0 HG CYS A 62 -12.591 13.403 -3.549 1.00 3.22 H new ATOM 842 N ILE A 63 -12.314 8.963 -6.029 1.00 42.32 N ATOM 843 CA ILE A 63 -11.495 8.414 -7.113 1.00 3.25 C ATOM 844 C ILE A 63 -11.664 9.285 -8.334 1.00 73.42 C ATOM 845 O ILE A 63 -12.753 9.745 -8.598 1.00 24.44 O ATOM 846 CB ILE A 63 -11.980 6.968 -7.493 1.00 71.43 C ATOM 847 CG1 ILE A 63 -11.912 6.030 -6.296 1.00 61.32 C ATOM 848 CG2 ILE A 63 -11.190 6.386 -8.665 1.00 74.12 C ATOM 849 CD1 ILE A 63 -10.519 5.828 -5.757 1.00 14.43 C ATOM 0 H ILE A 63 -13.311 8.777 -6.137 1.00 42.32 H new ATOM 0 HA ILE A 63 -10.457 8.380 -6.783 1.00 3.25 H new ATOM 0 HB ILE A 63 -13.020 7.060 -7.805 1.00 71.43 H new ATOM 0 HG12 ILE A 63 -12.545 6.425 -5.501 1.00 61.32 H new ATOM 0 HG13 ILE A 63 -12.325 5.062 -6.581 1.00 61.32 H new ATOM 0 HG21 ILE A 63 -11.560 5.386 -8.892 1.00 74.12 H new ATOM 0 HG22 ILE A 63 -11.312 7.025 -9.539 1.00 74.12 H new ATOM 0 HG23 ILE A 63 -10.134 6.331 -8.400 1.00 74.12 H new ATOM 0 HD11 ILE A 63 -10.553 5.148 -4.906 1.00 14.43 H new ATOM 0 HD12 ILE A 63 -9.886 5.403 -6.536 1.00 14.43 H new ATOM 0 HD13 ILE A 63 -10.109 6.787 -5.439 1.00 14.43 H new ATOM 861 N VAL A 64 -10.604 9.535 -9.047 1.00 71.31 N ATOM 862 CA VAL A 64 -10.677 10.260 -10.313 1.00 15.41 C ATOM 863 C VAL A 64 -9.671 9.647 -11.280 1.00 44.02 C ATOM 864 O VAL A 64 -8.679 9.052 -10.837 1.00 51.24 O ATOM 865 CB VAL A 64 -10.365 11.800 -10.169 1.00 33.12 C ATOM 866 CG1 VAL A 64 -11.387 12.513 -9.315 1.00 33.24 C ATOM 867 CG2 VAL A 64 -8.960 12.032 -9.617 1.00 72.41 C ATOM 0 H VAL A 64 -9.661 9.250 -8.781 1.00 71.31 H new ATOM 0 HA VAL A 64 -11.700 10.173 -10.678 1.00 15.41 H new ATOM 0 HB VAL A 64 -10.420 12.223 -11.172 1.00 33.12 H new ATOM 0 HG11 VAL A 64 -11.129 13.570 -9.245 1.00 33.24 H new ATOM 0 HG12 VAL A 64 -12.374 12.409 -9.766 1.00 33.24 H new ATOM 0 HG13 VAL A 64 -11.396 12.075 -8.317 1.00 33.24 H new ATOM 0 HG21 VAL A 64 -8.776 13.103 -9.530 1.00 72.41 H new ATOM 0 HG22 VAL A 64 -8.874 11.568 -8.635 1.00 72.41 H new ATOM 0 HG23 VAL A 64 -8.226 11.591 -10.292 1.00 72.41 H new ATOM 877 N PRO A 65 -9.917 9.736 -12.591 1.00 44.21 N ATOM 878 CA PRO A 65 -8.983 9.240 -13.601 1.00 72.51 C ATOM 879 C PRO A 65 -7.666 10.027 -13.604 1.00 55.44 C ATOM 880 O PRO A 65 -7.649 11.266 -13.758 1.00 34.54 O ATOM 881 CB PRO A 65 -9.730 9.423 -14.922 1.00 13.30 C ATOM 882 CG PRO A 65 -10.771 10.441 -14.637 1.00 51.30 C ATOM 883 CD PRO A 65 -11.141 10.283 -13.198 1.00 2.21 C ATOM 0 HA PRO A 65 -8.697 8.205 -13.414 1.00 72.51 H new ATOM 0 HB2 PRO A 65 -9.058 9.757 -15.713 1.00 13.30 H new ATOM 0 HB3 PRO A 65 -10.175 8.486 -15.257 1.00 13.30 H new ATOM 0 HG2 PRO A 65 -10.394 11.445 -14.832 1.00 51.30 H new ATOM 0 HG3 PRO A 65 -11.640 10.296 -15.279 1.00 51.30 H new ATOM 0 HD2 PRO A 65 -11.422 11.235 -12.748 1.00 2.21 H new ATOM 0 HD3 PRO A 65 -11.988 9.609 -13.072 1.00 2.21 H new ATOM 891 N SER A 66 -6.587 9.310 -13.433 1.00 70.44 N ATOM 892 CA SER A 66 -5.267 9.866 -13.382 1.00 41.41 C ATOM 893 C SER A 66 -4.412 9.164 -14.421 1.00 10.42 C ATOM 894 O SER A 66 -4.542 7.961 -14.608 1.00 70.10 O ATOM 895 CB SER A 66 -4.690 9.661 -11.981 1.00 15.43 C ATOM 896 OG SER A 66 -3.394 10.213 -11.861 1.00 71.13 O ATOM 0 H SER A 66 -6.606 8.296 -13.323 1.00 70.44 H new ATOM 0 HA SER A 66 -5.288 10.935 -13.595 1.00 41.41 H new ATOM 0 HB2 SER A 66 -5.350 10.120 -11.245 1.00 15.43 H new ATOM 0 HB3 SER A 66 -4.653 8.595 -11.755 1.00 15.43 H new ATOM 0 HG SER A 66 -3.058 10.065 -10.952 1.00 71.13 H new ATOM 902 N GLU A 67 -3.536 9.886 -15.083 1.00 64.51 N ATOM 903 CA GLU A 67 -2.736 9.283 -16.135 1.00 13.21 C ATOM 904 C GLU A 67 -1.662 8.366 -15.568 1.00 14.34 C ATOM 905 O GLU A 67 -1.356 7.319 -16.142 1.00 44.12 O ATOM 906 CB GLU A 67 -2.082 10.333 -17.016 1.00 22.40 C ATOM 907 CG GLU A 67 -3.040 11.267 -17.717 1.00 54.52 C ATOM 908 CD GLU A 67 -2.332 12.135 -18.723 1.00 33.41 C ATOM 909 OE1 GLU A 67 -1.766 13.175 -18.345 1.00 31.41 O ATOM 910 OE2 GLU A 67 -2.319 11.777 -19.927 1.00 4.23 O ATOM 0 H GLU A 67 -3.358 10.877 -14.918 1.00 64.51 H new ATOM 0 HA GLU A 67 -3.423 8.692 -16.741 1.00 13.21 H new ATOM 0 HB2 GLU A 67 -1.402 10.926 -16.404 1.00 22.40 H new ATOM 0 HB3 GLU A 67 -1.476 9.828 -17.768 1.00 22.40 H new ATOM 0 HG2 GLU A 67 -3.814 10.686 -18.218 1.00 54.52 H new ATOM 0 HG3 GLU A 67 -3.540 11.896 -16.981 1.00 54.52 H new ATOM 917 N LYS A 68 -1.104 8.747 -14.447 1.00 0.13 N ATOM 918 CA LYS A 68 -0.012 7.991 -13.854 1.00 54.21 C ATOM 919 C LYS A 68 -0.443 7.281 -12.592 1.00 52.11 C ATOM 920 O LYS A 68 0.365 6.623 -11.933 1.00 32.22 O ATOM 921 CB LYS A 68 1.117 8.930 -13.505 1.00 54.31 C ATOM 922 CG LYS A 68 1.664 9.692 -14.688 1.00 53.14 C ATOM 923 CD LYS A 68 2.792 10.600 -14.271 1.00 73.32 C ATOM 924 CE LYS A 68 2.334 11.632 -13.246 1.00 62.32 C ATOM 925 NZ LYS A 68 3.418 12.554 -12.858 1.00 23.22 N ATOM 0 H LYS A 68 -1.382 9.575 -13.921 1.00 0.13 H new ATOM 0 HA LYS A 68 0.307 7.247 -14.584 1.00 54.21 H new ATOM 0 HB2 LYS A 68 0.767 9.641 -12.757 1.00 54.31 H new ATOM 0 HB3 LYS A 68 1.925 8.358 -13.048 1.00 54.31 H new ATOM 0 HG2 LYS A 68 2.017 8.991 -15.445 1.00 53.14 H new ATOM 0 HG3 LYS A 68 0.869 10.281 -15.145 1.00 53.14 H new ATOM 0 HD2 LYS A 68 3.603 10.004 -13.851 1.00 73.32 H new ATOM 0 HD3 LYS A 68 3.192 11.110 -15.147 1.00 73.32 H new ATOM 0 HE2 LYS A 68 1.502 12.205 -13.657 1.00 62.32 H new ATOM 0 HE3 LYS A 68 1.961 11.120 -12.359 1.00 62.32 H new ATOM 0 HZ1 LYS A 68 3.060 13.237 -12.160 1.00 23.22 H new ATOM 0 HZ2 LYS A 68 4.202 12.012 -12.441 1.00 23.22 H new ATOM 0 HZ3 LYS A 68 3.758 13.064 -13.698 1.00 23.22 H new ATOM 939 N GLY A 69 -1.697 7.397 -12.263 1.00 23.01 N ATOM 940 CA GLY A 69 -2.165 6.864 -11.017 1.00 52.42 C ATOM 941 C GLY A 69 -2.773 5.490 -11.118 1.00 2.21 C ATOM 942 O GLY A 69 -3.220 5.056 -12.193 1.00 1.33 O ATOM 0 H GLY A 69 -2.409 7.852 -12.835 1.00 23.01 H new ATOM 0 HA2 GLY A 69 -1.332 6.829 -10.315 1.00 52.42 H new ATOM 0 HA3 GLY A 69 -2.905 7.546 -10.599 1.00 52.42 H new ATOM 946 N GLU A 70 -2.765 4.812 -10.008 1.00 52.25 N ATOM 947 CA GLU A 70 -3.374 3.528 -9.836 1.00 13.55 C ATOM 948 C GLU A 70 -3.927 3.451 -8.404 1.00 43.33 C ATOM 949 O GLU A 70 -3.324 3.992 -7.464 1.00 33.43 O ATOM 950 CB GLU A 70 -2.384 2.362 -10.113 1.00 55.25 C ATOM 951 CG GLU A 70 -1.163 2.254 -9.171 1.00 11.01 C ATOM 952 CD GLU A 70 -0.189 3.418 -9.264 1.00 2.32 C ATOM 953 OE1 GLU A 70 0.736 3.363 -10.089 1.00 3.11 O ATOM 954 OE2 GLU A 70 -0.327 4.392 -8.498 1.00 21.12 O ATOM 0 H GLU A 70 -2.313 5.156 -9.161 1.00 52.25 H new ATOM 0 HA GLU A 70 -4.179 3.417 -10.562 1.00 13.55 H new ATOM 0 HB2 GLU A 70 -2.938 1.425 -10.062 1.00 55.25 H new ATOM 0 HB3 GLU A 70 -2.018 2.461 -11.135 1.00 55.25 H new ATOM 0 HG2 GLU A 70 -1.519 2.176 -8.144 1.00 11.01 H new ATOM 0 HG3 GLU A 70 -0.628 1.331 -9.394 1.00 11.01 H new ATOM 961 N VAL A 71 -5.062 2.826 -8.237 1.00 0.32 N ATOM 962 CA VAL A 71 -5.682 2.707 -6.934 1.00 11.54 C ATOM 963 C VAL A 71 -5.686 1.266 -6.510 1.00 60.32 C ATOM 964 O VAL A 71 -6.015 0.396 -7.285 1.00 35.44 O ATOM 965 CB VAL A 71 -7.161 3.219 -6.934 1.00 15.22 C ATOM 966 CG1 VAL A 71 -7.773 3.130 -5.539 1.00 25.11 C ATOM 967 CG2 VAL A 71 -7.239 4.634 -7.437 1.00 52.43 C ATOM 0 H VAL A 71 -5.585 2.385 -8.994 1.00 0.32 H new ATOM 0 HA VAL A 71 -5.102 3.321 -6.245 1.00 11.54 H new ATOM 0 HB VAL A 71 -7.731 2.576 -7.605 1.00 15.22 H new ATOM 0 HG11 VAL A 71 -8.801 3.492 -5.569 1.00 25.11 H new ATOM 0 HG12 VAL A 71 -7.763 2.093 -5.203 1.00 25.11 H new ATOM 0 HG13 VAL A 71 -7.193 3.741 -4.848 1.00 25.11 H new ATOM 0 HG21 VAL A 71 -8.277 4.967 -7.427 1.00 52.43 H new ATOM 0 HG22 VAL A 71 -6.644 5.282 -6.794 1.00 52.43 H new ATOM 0 HG23 VAL A 71 -6.853 4.680 -8.455 1.00 52.43 H new ATOM 977 N HIS A 72 -5.305 1.013 -5.301 1.00 54.42 N ATOM 978 CA HIS A 72 -5.351 -0.328 -4.785 1.00 70.14 C ATOM 979 C HIS A 72 -6.476 -0.415 -3.806 1.00 14.44 C ATOM 980 O HIS A 72 -6.466 0.273 -2.782 1.00 54.22 O ATOM 981 CB HIS A 72 -4.036 -0.730 -4.126 1.00 72.40 C ATOM 982 CG HIS A 72 -2.870 -0.827 -5.062 1.00 73.52 C ATOM 983 ND1 HIS A 72 -2.251 -2.016 -5.375 1.00 52.45 N ATOM 984 CD2 HIS A 72 -2.184 0.132 -5.725 1.00 23.32 C ATOM 985 CE1 HIS A 72 -1.238 -1.781 -6.177 1.00 33.51 C ATOM 986 NE2 HIS A 72 -1.178 -0.483 -6.407 1.00 74.14 N ATOM 0 H HIS A 72 -4.957 1.714 -4.646 1.00 54.42 H new ATOM 0 HA HIS A 72 -5.511 -1.021 -5.611 1.00 70.14 H new ATOM 0 HB2 HIS A 72 -3.800 -0.005 -3.347 1.00 72.40 H new ATOM 0 HB3 HIS A 72 -4.171 -1.694 -3.635 1.00 72.40 H new ATOM 0 HD1 HIS A 72 -2.535 -2.936 -5.037 1.00 52.45 H new ATOM 0 HD2 HIS A 72 -2.395 1.191 -5.715 1.00 23.32 H new ATOM 0 HE1 HIS A 72 -0.567 -2.525 -6.580 1.00 33.51 H new ATOM 995 N GLY A 73 -7.440 -1.225 -4.112 1.00 45.21 N ATOM 996 CA GLY A 73 -8.590 -1.336 -3.285 1.00 3.34 C ATOM 997 C GLY A 73 -9.157 -2.709 -3.343 1.00 42.32 C ATOM 998 O GLY A 73 -8.444 -3.675 -3.646 1.00 65.21 O ATOM 0 H GLY A 73 -7.449 -1.823 -4.938 1.00 45.21 H new ATOM 0 HA2 GLY A 73 -8.328 -1.090 -2.256 1.00 3.34 H new ATOM 0 HA3 GLY A 73 -9.342 -0.614 -3.603 1.00 3.34 H new ATOM 1002 N LYS A 74 -10.420 -2.825 -3.074 1.00 42.35 N ATOM 1003 CA LYS A 74 -11.057 -4.106 -3.075 1.00 11.12 C ATOM 1004 C LYS A 74 -12.204 -4.186 -4.005 1.00 21.23 C ATOM 1005 O LYS A 74 -12.868 -3.195 -4.289 1.00 3.41 O ATOM 1006 CB LYS A 74 -11.478 -4.581 -1.683 1.00 22.24 C ATOM 1007 CG LYS A 74 -10.388 -5.290 -0.891 1.00 64.34 C ATOM 1008 CD LYS A 74 -9.257 -4.405 -0.476 1.00 30.23 C ATOM 1009 CE LYS A 74 -9.682 -3.424 0.618 1.00 4.53 C ATOM 1010 NZ LYS A 74 -8.548 -2.624 1.113 1.00 45.22 N ATOM 0 H LYS A 74 -11.034 -2.042 -2.849 1.00 42.35 H new ATOM 0 HA LYS A 74 -10.283 -4.784 -3.435 1.00 11.12 H new ATOM 0 HB2 LYS A 74 -11.822 -3.720 -1.110 1.00 22.24 H new ATOM 0 HB3 LYS A 74 -12.328 -5.255 -1.787 1.00 22.24 H new ATOM 0 HG2 LYS A 74 -10.832 -5.734 -0.000 1.00 64.34 H new ATOM 0 HG3 LYS A 74 -9.992 -6.109 -1.492 1.00 64.34 H new ATOM 0 HD2 LYS A 74 -8.429 -5.016 -0.116 1.00 30.23 H new ATOM 0 HD3 LYS A 74 -8.892 -3.851 -1.341 1.00 30.23 H new ATOM 0 HE2 LYS A 74 -10.453 -2.759 0.229 1.00 4.53 H new ATOM 0 HE3 LYS A 74 -10.126 -3.975 1.447 1.00 4.53 H new ATOM 0 HZ1 LYS A 74 -8.879 -1.972 1.853 1.00 45.22 H new ATOM 0 HZ2 LYS A 74 -7.823 -3.257 1.508 1.00 45.22 H new ATOM 0 HZ3 LYS A 74 -8.140 -2.077 0.328 1.00 45.22 H new ATOM 1024 N VAL A 75 -12.412 -5.365 -4.484 1.00 52.14 N ATOM 1025 CA VAL A 75 -13.532 -5.670 -5.337 1.00 4.44 C ATOM 1026 C VAL A 75 -14.527 -6.567 -4.634 1.00 3.41 C ATOM 1027 O VAL A 75 -14.157 -7.596 -4.072 1.00 21.33 O ATOM 1028 CB VAL A 75 -13.081 -6.335 -6.663 1.00 15.25 C ATOM 1029 CG1 VAL A 75 -14.266 -6.927 -7.422 1.00 73.13 C ATOM 1030 CG2 VAL A 75 -12.352 -5.333 -7.536 1.00 55.41 C ATOM 0 H VAL A 75 -11.805 -6.163 -4.297 1.00 52.14 H new ATOM 0 HA VAL A 75 -14.013 -4.721 -5.573 1.00 4.44 H new ATOM 0 HB VAL A 75 -12.402 -7.149 -6.410 1.00 15.25 H new ATOM 0 HG11 VAL A 75 -13.914 -7.385 -8.346 1.00 73.13 H new ATOM 0 HG12 VAL A 75 -14.752 -7.682 -6.805 1.00 73.13 H new ATOM 0 HG13 VAL A 75 -14.979 -6.137 -7.657 1.00 73.13 H new ATOM 0 HG21 VAL A 75 -12.042 -5.816 -8.463 1.00 55.41 H new ATOM 0 HG22 VAL A 75 -13.016 -4.499 -7.765 1.00 55.41 H new ATOM 0 HG23 VAL A 75 -11.473 -4.962 -7.008 1.00 55.41 H new ATOM 1040 N LEU A 76 -15.772 -6.155 -4.668 1.00 72.34 N ATOM 1041 CA LEU A 76 -16.868 -6.920 -4.147 1.00 2.34 C ATOM 1042 C LEU A 76 -17.471 -7.680 -5.308 1.00 23.04 C ATOM 1043 O LEU A 76 -18.068 -7.073 -6.208 1.00 13.23 O ATOM 1044 CB LEU A 76 -17.947 -5.997 -3.562 1.00 40.24 C ATOM 1045 CG LEU A 76 -17.518 -5.025 -2.465 1.00 1.51 C ATOM 1046 CD1 LEU A 76 -18.706 -4.203 -2.000 1.00 71.00 C ATOM 1047 CD2 LEU A 76 -16.899 -5.764 -1.302 1.00 72.14 C ATOM 0 H LEU A 76 -16.052 -5.259 -5.068 1.00 72.34 H new ATOM 0 HA LEU A 76 -16.514 -7.584 -3.359 1.00 2.34 H new ATOM 0 HB2 LEU A 76 -18.373 -5.416 -4.380 1.00 40.24 H new ATOM 0 HB3 LEU A 76 -18.747 -6.622 -3.165 1.00 40.24 H new ATOM 0 HG LEU A 76 -16.765 -4.353 -2.877 1.00 1.51 H new ATOM 0 HD11 LEU A 76 -18.388 -3.514 -1.218 1.00 71.00 H new ATOM 0 HD12 LEU A 76 -19.108 -3.637 -2.840 1.00 71.00 H new ATOM 0 HD13 LEU A 76 -19.476 -4.867 -1.607 1.00 71.00 H new ATOM 0 HD21 LEU A 76 -16.602 -5.050 -0.534 1.00 72.14 H new ATOM 0 HD22 LEU A 76 -17.625 -6.462 -0.887 1.00 72.14 H new ATOM 0 HD23 LEU A 76 -16.023 -6.314 -1.645 1.00 72.14 H new ATOM 1059 N MET A 77 -17.291 -8.963 -5.333 1.00 1.32 N ATOM 1060 CA MET A 77 -17.826 -9.763 -6.408 1.00 72.22 C ATOM 1061 C MET A 77 -18.904 -10.693 -5.944 1.00 13.51 C ATOM 1062 O MET A 77 -18.734 -11.457 -4.988 1.00 23.33 O ATOM 1063 CB MET A 77 -16.746 -10.496 -7.196 1.00 75.33 C ATOM 1064 CG MET A 77 -15.838 -11.356 -6.383 1.00 61.53 C ATOM 1065 SD MET A 77 -14.618 -12.217 -7.401 1.00 51.43 S ATOM 1066 CE MET A 77 -13.881 -10.839 -8.269 1.00 63.31 C ATOM 0 H MET A 77 -16.778 -9.487 -4.624 1.00 1.32 H new ATOM 0 HA MET A 77 -18.288 -9.059 -7.100 1.00 72.22 H new ATOM 0 HB2 MET A 77 -17.228 -11.117 -7.951 1.00 75.33 H new ATOM 0 HB3 MET A 77 -16.143 -9.759 -7.727 1.00 75.33 H new ATOM 0 HG2 MET A 77 -15.323 -10.741 -5.645 1.00 61.53 H new ATOM 0 HG3 MET A 77 -16.430 -12.087 -5.832 1.00 61.53 H new ATOM 0 HE1 MET A 77 -12.955 -11.162 -8.745 1.00 63.31 H new ATOM 0 HE2 MET A 77 -14.572 -10.476 -9.029 1.00 63.31 H new ATOM 0 HE3 MET A 77 -13.665 -10.037 -7.563 1.00 63.31 H new ATOM 1076 N GLY A 78 -20.007 -10.617 -6.613 1.00 55.14 N ATOM 1077 CA GLY A 78 -21.148 -11.410 -6.258 1.00 40.23 C ATOM 1078 C GLY A 78 -22.271 -10.559 -5.713 1.00 42.05 C ATOM 1079 O GLY A 78 -23.066 -11.012 -4.890 1.00 41.21 O ATOM 0 H GLY A 78 -20.147 -10.007 -7.419 1.00 55.14 H new ATOM 0 HA2 GLY A 78 -21.498 -11.957 -7.133 1.00 40.23 H new ATOM 0 HA3 GLY A 78 -20.859 -12.151 -5.513 1.00 40.23 H new ATOM 1083 N VAL A 79 -22.333 -9.315 -6.159 1.00 53.11 N ATOM 1084 CA VAL A 79 -23.371 -8.413 -5.710 1.00 42.13 C ATOM 1085 C VAL A 79 -24.566 -8.489 -6.677 1.00 2.23 C ATOM 1086 O VAL A 79 -24.390 -8.467 -7.903 1.00 23.21 O ATOM 1087 CB VAL A 79 -22.840 -6.934 -5.557 1.00 51.23 C ATOM 1088 CG1 VAL A 79 -22.429 -6.319 -6.874 1.00 64.25 C ATOM 1089 CG2 VAL A 79 -23.834 -6.055 -4.844 1.00 13.31 C ATOM 0 H VAL A 79 -21.678 -8.912 -6.829 1.00 53.11 H new ATOM 0 HA VAL A 79 -23.698 -8.724 -4.718 1.00 42.13 H new ATOM 0 HB VAL A 79 -21.942 -7.001 -4.943 1.00 51.23 H new ATOM 0 HG11 VAL A 79 -22.073 -5.303 -6.706 1.00 64.25 H new ATOM 0 HG12 VAL A 79 -21.632 -6.914 -7.320 1.00 64.25 H new ATOM 0 HG13 VAL A 79 -23.285 -6.296 -7.548 1.00 64.25 H new ATOM 0 HG21 VAL A 79 -23.432 -5.046 -4.759 1.00 13.31 H new ATOM 0 HG22 VAL A 79 -24.766 -6.027 -5.409 1.00 13.31 H new ATOM 0 HG23 VAL A 79 -24.025 -6.455 -3.848 1.00 13.31 H new ATOM 1099 N THR A 80 -25.754 -8.612 -6.138 1.00 31.34 N ATOM 1100 CA THR A 80 -26.942 -8.734 -6.919 1.00 4.34 C ATOM 1101 C THR A 80 -27.304 -7.359 -7.557 1.00 52.53 C ATOM 1102 O THR A 80 -26.871 -6.316 -7.060 1.00 21.43 O ATOM 1103 CB THR A 80 -28.046 -9.224 -5.968 1.00 32.12 C ATOM 1104 OG1 THR A 80 -27.571 -10.403 -5.291 1.00 34.33 O ATOM 1105 CG2 THR A 80 -29.282 -9.584 -6.715 1.00 42.05 C ATOM 0 H THR A 80 -25.916 -8.629 -5.131 1.00 31.34 H new ATOM 0 HA THR A 80 -26.814 -9.439 -7.741 1.00 4.34 H new ATOM 0 HB THR A 80 -28.281 -8.424 -5.266 1.00 32.12 H new ATOM 0 HG1 THR A 80 -28.262 -10.729 -4.678 1.00 34.33 H new ATOM 0 HG21 THR A 80 -30.044 -9.927 -6.015 1.00 42.05 H new ATOM 0 HG22 THR A 80 -29.650 -8.710 -7.252 1.00 42.05 H new ATOM 0 HG23 THR A 80 -29.059 -10.379 -7.426 1.00 42.05 H new ATOM 1113 N SER A 81 -28.094 -7.360 -8.638 1.00 55.33 N ATOM 1114 CA SER A 81 -28.427 -6.125 -9.358 1.00 22.03 C ATOM 1115 C SER A 81 -29.197 -5.131 -8.481 1.00 23.31 C ATOM 1116 O SER A 81 -28.986 -3.927 -8.578 1.00 31.34 O ATOM 1117 CB SER A 81 -29.201 -6.444 -10.637 1.00 51.42 C ATOM 1118 OG SER A 81 -28.468 -7.368 -11.441 1.00 3.14 O ATOM 0 H SER A 81 -28.514 -8.202 -9.033 1.00 55.33 H new ATOM 0 HA SER A 81 -27.488 -5.643 -9.629 1.00 22.03 H new ATOM 0 HB2 SER A 81 -30.175 -6.863 -10.386 1.00 51.42 H new ATOM 0 HB3 SER A 81 -29.383 -5.528 -11.198 1.00 51.42 H new ATOM 0 HG SER A 81 -27.508 -7.204 -11.335 1.00 3.14 H new ATOM 1124 N ASP A 82 -30.051 -5.641 -7.605 1.00 20.22 N ATOM 1125 CA ASP A 82 -30.828 -4.781 -6.699 1.00 14.51 C ATOM 1126 C ASP A 82 -29.910 -4.051 -5.734 1.00 51.12 C ATOM 1127 O ASP A 82 -30.121 -2.884 -5.414 1.00 33.14 O ATOM 1128 CB ASP A 82 -31.868 -5.593 -5.923 1.00 24.54 C ATOM 1129 CG ASP A 82 -32.901 -6.235 -6.816 1.00 61.02 C ATOM 1130 OD1 ASP A 82 -33.850 -5.539 -7.247 1.00 45.52 O ATOM 1131 OD2 ASP A 82 -32.776 -7.439 -7.125 1.00 63.44 O ATOM 0 H ASP A 82 -30.229 -6.639 -7.496 1.00 20.22 H new ATOM 0 HA ASP A 82 -31.353 -4.046 -7.309 1.00 14.51 H new ATOM 0 HB2 ASP A 82 -31.361 -6.368 -5.348 1.00 24.54 H new ATOM 0 HB3 ASP A 82 -32.369 -4.942 -5.207 1.00 24.54 H new ATOM 1136 N GLU A 83 -28.874 -4.735 -5.320 1.00 12.14 N ATOM 1137 CA GLU A 83 -27.887 -4.198 -4.400 1.00 11.35 C ATOM 1138 C GLU A 83 -26.962 -3.263 -5.188 1.00 14.54 C ATOM 1139 O GLU A 83 -26.459 -2.298 -4.671 1.00 33.44 O ATOM 1140 CB GLU A 83 -27.084 -5.362 -3.828 1.00 32.02 C ATOM 1141 CG GLU A 83 -27.932 -6.516 -3.285 1.00 74.32 C ATOM 1142 CD GLU A 83 -28.820 -6.142 -2.130 1.00 51.53 C ATOM 1143 OE1 GLU A 83 -29.820 -5.459 -2.340 1.00 53.43 O ATOM 1144 OE2 GLU A 83 -28.553 -6.578 -0.995 1.00 70.34 O ATOM 0 H GLU A 83 -28.684 -5.694 -5.612 1.00 12.14 H new ATOM 0 HA GLU A 83 -28.361 -3.648 -3.587 1.00 11.35 H new ATOM 0 HB2 GLU A 83 -26.424 -5.748 -4.605 1.00 32.02 H new ATOM 0 HB3 GLU A 83 -26.447 -4.988 -3.026 1.00 32.02 H new ATOM 0 HG2 GLU A 83 -28.551 -6.907 -4.092 1.00 74.32 H new ATOM 0 HG3 GLU A 83 -27.269 -7.323 -2.972 1.00 74.32 H new ATOM 1151 N LEU A 84 -26.769 -3.563 -6.472 1.00 11.44 N ATOM 1152 CA LEU A 84 -25.984 -2.702 -7.352 1.00 61.14 C ATOM 1153 C LEU A 84 -26.699 -1.367 -7.498 1.00 30.32 C ATOM 1154 O LEU A 84 -26.077 -0.310 -7.478 1.00 5.40 O ATOM 1155 CB LEU A 84 -25.807 -3.335 -8.738 1.00 4.55 C ATOM 1156 CG LEU A 84 -24.937 -2.543 -9.727 1.00 71.12 C ATOM 1157 CD1 LEU A 84 -23.488 -2.551 -9.314 1.00 2.12 C ATOM 1158 CD2 LEU A 84 -25.084 -3.069 -11.119 1.00 54.10 C ATOM 0 H LEU A 84 -27.146 -4.396 -6.925 1.00 11.44 H new ATOM 0 HA LEU A 84 -24.996 -2.564 -6.913 1.00 61.14 H new ATOM 0 HB2 LEU A 84 -25.370 -4.326 -8.611 1.00 4.55 H new ATOM 0 HB3 LEU A 84 -26.793 -3.475 -9.182 1.00 4.55 H new ATOM 0 HG LEU A 84 -25.289 -1.511 -9.711 1.00 71.12 H new ATOM 0 HD11 LEU A 84 -22.901 -1.982 -10.035 1.00 2.12 H new ATOM 0 HD12 LEU A 84 -23.388 -2.099 -8.327 1.00 2.12 H new ATOM 0 HD13 LEU A 84 -23.125 -3.578 -9.280 1.00 2.12 H new ATOM 0 HD21 LEU A 84 -24.457 -2.489 -11.795 1.00 54.10 H new ATOM 0 HD22 LEU A 84 -24.777 -4.115 -11.147 1.00 54.10 H new ATOM 0 HD23 LEU A 84 -26.125 -2.988 -11.431 1.00 54.10 H new ATOM 1170 N GLU A 85 -28.024 -1.435 -7.644 1.00 35.22 N ATOM 1171 CA GLU A 85 -28.859 -0.245 -7.704 1.00 3.32 C ATOM 1172 C GLU A 85 -28.832 0.476 -6.372 1.00 24.22 C ATOM 1173 O GLU A 85 -28.975 1.679 -6.313 1.00 64.34 O ATOM 1174 CB GLU A 85 -30.296 -0.591 -8.075 1.00 14.23 C ATOM 1175 CG GLU A 85 -30.464 -1.169 -9.465 1.00 4.12 C ATOM 1176 CD GLU A 85 -31.902 -1.485 -9.778 1.00 30.43 C ATOM 1177 OE1 GLU A 85 -32.672 -0.550 -10.088 1.00 0.20 O ATOM 1178 OE2 GLU A 85 -32.287 -2.671 -9.735 1.00 74.42 O ATOM 0 H GLU A 85 -28.540 -2.311 -7.723 1.00 35.22 H new ATOM 0 HA GLU A 85 -28.457 0.407 -8.480 1.00 3.32 H new ATOM 0 HB2 GLU A 85 -30.683 -1.306 -7.349 1.00 14.23 H new ATOM 0 HB3 GLU A 85 -30.906 0.309 -7.993 1.00 14.23 H new ATOM 0 HG2 GLU A 85 -30.081 -0.461 -10.200 1.00 4.12 H new ATOM 0 HG3 GLU A 85 -29.866 -2.076 -9.554 1.00 4.12 H new ATOM 1185 N ASN A 86 -28.650 -0.281 -5.318 1.00 20.43 N ATOM 1186 CA ASN A 86 -28.538 0.255 -3.974 1.00 23.55 C ATOM 1187 C ASN A 86 -27.199 0.976 -3.761 1.00 32.10 C ATOM 1188 O ASN A 86 -27.163 2.056 -3.189 1.00 60.33 O ATOM 1189 CB ASN A 86 -28.834 -0.838 -2.927 1.00 3.41 C ATOM 1190 CG ASN A 86 -27.821 -0.963 -1.807 1.00 43.41 C ATOM 1191 OD1 ASN A 86 -26.889 -1.746 -1.884 1.00 0.33 O ATOM 1192 ND2 ASN A 86 -27.981 -0.201 -0.797 1.00 21.02 N ATOM 0 H ASN A 86 -28.574 -1.297 -5.364 1.00 20.43 H new ATOM 0 HA ASN A 86 -29.299 1.023 -3.837 1.00 23.55 H new ATOM 0 HB2 ASN A 86 -29.812 -0.640 -2.488 1.00 3.41 H new ATOM 0 HB3 ASN A 86 -28.903 -1.798 -3.439 1.00 3.41 H new ATOM 0 HD21 ASN A 86 -27.318 -0.235 -0.022 1.00 21.02 H new ATOM 0 HD22 ASN A 86 -28.771 0.443 -0.764 1.00 21.02 H new ATOM 1199 N LEU A 87 -26.120 0.395 -4.257 1.00 15.14 N ATOM 1200 CA LEU A 87 -24.801 1.042 -4.230 1.00 23.32 C ATOM 1201 C LEU A 87 -24.885 2.327 -5.043 1.00 30.11 C ATOM 1202 O LEU A 87 -24.384 3.390 -4.646 1.00 61.02 O ATOM 1203 CB LEU A 87 -23.743 0.119 -4.860 1.00 34.33 C ATOM 1204 CG LEU A 87 -23.515 -1.238 -4.184 1.00 71.20 C ATOM 1205 CD1 LEU A 87 -22.541 -2.071 -4.996 1.00 21.02 C ATOM 1206 CD2 LEU A 87 -22.977 -1.049 -2.779 1.00 22.52 C ATOM 0 H LEU A 87 -26.123 -0.530 -4.688 1.00 15.14 H new ATOM 0 HA LEU A 87 -24.517 1.252 -3.199 1.00 23.32 H new ATOM 0 HB2 LEU A 87 -24.025 -0.062 -5.897 1.00 34.33 H new ATOM 0 HB3 LEU A 87 -22.793 0.654 -4.877 1.00 34.33 H new ATOM 0 HG LEU A 87 -24.472 -1.758 -4.128 1.00 71.20 H new ATOM 0 HD11 LEU A 87 -22.387 -3.032 -4.506 1.00 21.02 H new ATOM 0 HD12 LEU A 87 -22.946 -2.234 -5.995 1.00 21.02 H new ATOM 0 HD13 LEU A 87 -21.589 -1.546 -5.072 1.00 21.02 H new ATOM 0 HD21 LEU A 87 -22.821 -2.023 -2.315 1.00 22.52 H new ATOM 0 HD22 LEU A 87 -22.030 -0.512 -2.821 1.00 22.52 H new ATOM 0 HD23 LEU A 87 -23.693 -0.476 -2.189 1.00 22.52 H new ATOM 1218 N ASP A 88 -25.566 2.205 -6.167 1.00 31.13 N ATOM 1219 CA ASP A 88 -25.813 3.292 -7.103 1.00 54.51 C ATOM 1220 C ASP A 88 -26.699 4.359 -6.472 1.00 54.23 C ATOM 1221 O ASP A 88 -26.588 5.533 -6.773 1.00 42.41 O ATOM 1222 CB ASP A 88 -26.458 2.711 -8.370 1.00 3.41 C ATOM 1223 CG ASP A 88 -26.794 3.727 -9.421 1.00 53.25 C ATOM 1224 OD1 ASP A 88 -25.880 4.206 -10.095 1.00 64.42 O ATOM 1225 OD2 ASP A 88 -27.992 4.036 -9.594 1.00 45.40 O ATOM 0 H ASP A 88 -25.976 1.320 -6.465 1.00 31.13 H new ATOM 0 HA ASP A 88 -24.871 3.773 -7.366 1.00 54.51 H new ATOM 0 HB2 ASP A 88 -25.782 1.972 -8.800 1.00 3.41 H new ATOM 0 HB3 ASP A 88 -27.369 2.183 -8.089 1.00 3.41 H new ATOM 1230 N ALA A 89 -27.562 3.935 -5.586 1.00 13.11 N ATOM 1231 CA ALA A 89 -28.441 4.828 -4.865 1.00 11.40 C ATOM 1232 C ALA A 89 -27.675 5.569 -3.779 1.00 61.32 C ATOM 1233 O ALA A 89 -27.878 6.755 -3.562 1.00 52.42 O ATOM 1234 CB ALA A 89 -29.597 4.048 -4.255 1.00 3.30 C ATOM 0 H ALA A 89 -27.678 2.952 -5.340 1.00 13.11 H new ATOM 0 HA ALA A 89 -28.842 5.560 -5.566 1.00 11.40 H new ATOM 0 HB1 ALA A 89 -30.252 4.731 -3.715 1.00 3.30 H new ATOM 0 HB2 ALA A 89 -30.161 3.555 -5.047 1.00 3.30 H new ATOM 0 HB3 ALA A 89 -29.207 3.299 -3.566 1.00 3.30 H new ATOM 1240 N VAL A 90 -26.811 4.852 -3.092 1.00 11.14 N ATOM 1241 CA VAL A 90 -26.040 5.413 -2.005 1.00 0.04 C ATOM 1242 C VAL A 90 -24.912 6.367 -2.489 1.00 41.35 C ATOM 1243 O VAL A 90 -24.906 7.547 -2.136 1.00 3.04 O ATOM 1244 CB VAL A 90 -25.483 4.280 -1.080 1.00 25.33 C ATOM 1245 CG1 VAL A 90 -24.540 4.822 -0.021 1.00 55.22 C ATOM 1246 CG2 VAL A 90 -26.639 3.559 -0.397 1.00 72.41 C ATOM 0 H VAL A 90 -26.624 3.865 -3.272 1.00 11.14 H new ATOM 0 HA VAL A 90 -26.720 6.031 -1.419 1.00 0.04 H new ATOM 0 HB VAL A 90 -24.923 3.589 -1.710 1.00 25.33 H new ATOM 0 HG11 VAL A 90 -24.178 4.001 0.598 1.00 55.22 H new ATOM 0 HG12 VAL A 90 -23.695 5.313 -0.503 1.00 55.22 H new ATOM 0 HG13 VAL A 90 -25.069 5.541 0.604 1.00 55.22 H new ATOM 0 HG21 VAL A 90 -26.247 2.771 0.246 1.00 72.41 H new ATOM 0 HG22 VAL A 90 -27.207 4.269 0.204 1.00 72.41 H new ATOM 0 HG23 VAL A 90 -27.291 3.120 -1.152 1.00 72.41 H new ATOM 1256 N GLU A 91 -23.997 5.877 -3.317 1.00 61.22 N ATOM 1257 CA GLU A 91 -22.862 6.704 -3.794 1.00 63.51 C ATOM 1258 C GLU A 91 -23.280 7.649 -4.910 1.00 54.40 C ATOM 1259 O GLU A 91 -22.661 8.705 -5.122 1.00 12.12 O ATOM 1260 CB GLU A 91 -21.702 5.826 -4.249 1.00 51.25 C ATOM 1261 CG GLU A 91 -21.103 4.966 -3.151 1.00 50.34 C ATOM 1262 CD GLU A 91 -20.435 5.768 -2.044 1.00 73.54 C ATOM 1263 OE1 GLU A 91 -21.138 6.289 -1.150 1.00 42.10 O ATOM 1264 OE2 GLU A 91 -19.199 5.885 -2.056 1.00 54.34 O ATOM 0 H GLU A 91 -24.005 4.923 -3.677 1.00 61.22 H new ATOM 0 HA GLU A 91 -22.531 7.311 -2.952 1.00 63.51 H new ATOM 0 HB2 GLU A 91 -22.046 5.178 -5.055 1.00 51.25 H new ATOM 0 HB3 GLU A 91 -20.920 6.463 -4.663 1.00 51.25 H new ATOM 0 HG2 GLU A 91 -21.888 4.347 -2.717 1.00 50.34 H new ATOM 0 HG3 GLU A 91 -20.370 4.289 -3.590 1.00 50.34 H new ATOM 1271 N GLY A 92 -24.349 7.274 -5.585 1.00 64.43 N ATOM 1272 CA GLY A 92 -24.877 7.994 -6.741 1.00 13.23 C ATOM 1273 C GLY A 92 -25.233 9.445 -6.491 1.00 3.12 C ATOM 1274 O GLY A 92 -25.408 10.200 -7.435 1.00 44.11 O ATOM 0 H GLY A 92 -24.890 6.444 -5.345 1.00 64.43 H new ATOM 0 HA2 GLY A 92 -24.140 7.951 -7.543 1.00 13.23 H new ATOM 0 HA3 GLY A 92 -25.767 7.475 -7.097 1.00 13.23 H new ATOM 1278 N ASN A 93 -25.347 9.836 -5.230 1.00 21.40 N ATOM 1279 CA ASN A 93 -25.702 11.213 -4.879 1.00 62.25 C ATOM 1280 C ASN A 93 -24.727 12.213 -5.479 1.00 20.03 C ATOM 1281 O ASN A 93 -25.143 13.255 -5.982 1.00 22.04 O ATOM 1282 CB ASN A 93 -25.759 11.420 -3.354 1.00 34.42 C ATOM 1283 CG ASN A 93 -26.915 10.715 -2.663 1.00 53.51 C ATOM 1284 OD1 ASN A 93 -27.387 9.666 -3.098 1.00 73.30 O ATOM 1285 ND2 ASN A 93 -27.379 11.288 -1.573 1.00 72.34 N ATOM 0 H ASN A 93 -25.200 9.222 -4.429 1.00 21.40 H new ATOM 0 HA ASN A 93 -26.694 11.386 -5.296 1.00 62.25 H new ATOM 0 HB2 ASN A 93 -24.824 11.069 -2.918 1.00 34.42 H new ATOM 0 HB3 ASN A 93 -25.826 12.488 -3.148 1.00 34.42 H new ATOM 0 HD21 ASN A 93 -28.153 10.862 -1.063 1.00 72.34 H new ATOM 0 HD22 ASN A 93 -26.965 12.158 -1.239 1.00 72.34 H new ATOM 1292 N GLU A 94 -23.434 11.905 -5.441 1.00 40.35 N ATOM 1293 CA GLU A 94 -22.434 12.821 -5.999 1.00 12.24 C ATOM 1294 C GLU A 94 -21.420 12.114 -6.907 1.00 30.43 C ATOM 1295 O GLU A 94 -20.529 12.748 -7.476 1.00 11.14 O ATOM 1296 CB GLU A 94 -21.726 13.596 -4.893 1.00 61.12 C ATOM 1297 CG GLU A 94 -22.661 14.464 -4.071 1.00 61.20 C ATOM 1298 CD GLU A 94 -21.952 15.270 -3.040 1.00 22.22 C ATOM 1299 OE1 GLU A 94 -21.517 16.394 -3.353 1.00 1.24 O ATOM 1300 OE2 GLU A 94 -21.818 14.799 -1.885 1.00 43.13 O ATOM 0 H GLU A 94 -23.055 11.047 -5.039 1.00 40.35 H new ATOM 0 HA GLU A 94 -22.976 13.527 -6.628 1.00 12.24 H new ATOM 0 HB2 GLU A 94 -21.221 12.892 -4.232 1.00 61.12 H new ATOM 0 HB3 GLU A 94 -20.955 14.225 -5.337 1.00 61.12 H new ATOM 0 HG2 GLU A 94 -23.205 15.134 -4.737 1.00 61.20 H new ATOM 0 HG3 GLU A 94 -23.401 13.830 -3.583 1.00 61.20 H new ATOM 1307 N TYR A 95 -21.566 10.818 -7.047 1.00 20.41 N ATOM 1308 CA TYR A 95 -20.682 10.025 -7.887 1.00 44.13 C ATOM 1309 C TYR A 95 -21.516 9.338 -8.933 1.00 13.04 C ATOM 1310 O TYR A 95 -22.738 9.328 -8.829 1.00 73.52 O ATOM 1311 CB TYR A 95 -19.946 8.949 -7.067 1.00 51.32 C ATOM 1312 CG TYR A 95 -19.053 9.463 -5.961 1.00 70.22 C ATOM 1313 CD1 TYR A 95 -19.580 9.840 -4.739 1.00 73.24 C ATOM 1314 CD2 TYR A 95 -17.682 9.552 -6.135 1.00 32.44 C ATOM 1315 CE1 TYR A 95 -18.774 10.294 -3.722 1.00 4.52 C ATOM 1316 CE2 TYR A 95 -16.871 10.006 -5.122 1.00 22.35 C ATOM 1317 CZ TYR A 95 -17.422 10.374 -3.917 1.00 13.11 C ATOM 1318 OH TYR A 95 -16.610 10.824 -2.899 1.00 24.43 O ATOM 0 H TYR A 95 -22.298 10.278 -6.585 1.00 20.41 H new ATOM 0 HA TYR A 95 -19.941 10.686 -8.336 1.00 44.13 H new ATOM 0 HB2 TYR A 95 -20.688 8.282 -6.629 1.00 51.32 H new ATOM 0 HB3 TYR A 95 -19.341 8.350 -7.748 1.00 51.32 H new ATOM 0 HD1 TYR A 95 -20.646 9.776 -4.581 1.00 73.24 H new ATOM 0 HD2 TYR A 95 -17.244 9.261 -7.079 1.00 32.44 H new ATOM 0 HE1 TYR A 95 -19.205 10.586 -2.776 1.00 4.52 H new ATOM 0 HE2 TYR A 95 -15.804 10.073 -5.272 1.00 22.35 H new ATOM 0 HH TYR A 95 -15.965 10.125 -2.662 1.00 24.43 H new ATOM 1328 N GLU A 96 -20.884 8.785 -9.928 1.00 43.42 N ATOM 1329 CA GLU A 96 -21.594 8.034 -10.925 1.00 44.13 C ATOM 1330 C GLU A 96 -20.933 6.682 -11.061 1.00 24.51 C ATOM 1331 O GLU A 96 -19.729 6.541 -10.785 1.00 41.34 O ATOM 1332 CB GLU A 96 -21.631 8.785 -12.270 1.00 25.03 C ATOM 1333 CG GLU A 96 -22.401 8.079 -13.368 1.00 55.34 C ATOM 1334 CD GLU A 96 -23.825 7.830 -12.981 1.00 30.02 C ATOM 1335 OE1 GLU A 96 -24.105 6.776 -12.381 1.00 74.31 O ATOM 1336 OE2 GLU A 96 -24.686 8.695 -13.261 1.00 65.40 O ATOM 0 H GLU A 96 -19.876 8.840 -10.071 1.00 43.42 H new ATOM 0 HA GLU A 96 -22.632 7.902 -10.618 1.00 44.13 H new ATOM 0 HB2 GLU A 96 -22.073 9.768 -12.110 1.00 25.03 H new ATOM 0 HB3 GLU A 96 -20.608 8.947 -12.609 1.00 25.03 H new ATOM 0 HG2 GLU A 96 -22.372 8.681 -14.276 1.00 55.34 H new ATOM 0 HG3 GLU A 96 -21.916 7.130 -13.599 1.00 55.34 H new ATOM 1343 N ARG A 97 -21.696 5.700 -11.456 1.00 42.12 N ATOM 1344 CA ARG A 97 -21.189 4.375 -11.596 1.00 20.25 C ATOM 1345 C ARG A 97 -20.618 4.216 -12.991 1.00 53.45 C ATOM 1346 O ARG A 97 -21.351 4.226 -13.991 1.00 4.54 O ATOM 1347 CB ARG A 97 -22.323 3.373 -11.383 1.00 51.31 C ATOM 1348 CG ARG A 97 -21.901 1.914 -11.399 1.00 11.33 C ATOM 1349 CD ARG A 97 -23.120 1.010 -11.307 1.00 22.30 C ATOM 1350 NE ARG A 97 -23.988 1.181 -12.477 1.00 52.05 N ATOM 1351 CZ ARG A 97 -25.297 0.886 -12.546 1.00 14.42 C ATOM 1352 NH1 ARG A 97 -25.955 0.430 -11.476 1.00 21.51 N ATOM 1353 NH2 ARG A 97 -25.946 1.074 -13.684 1.00 43.30 N ATOM 0 H ARG A 97 -22.684 5.802 -11.688 1.00 42.12 H new ATOM 0 HA ARG A 97 -20.409 4.192 -10.857 1.00 20.25 H new ATOM 0 HB2 ARG A 97 -22.802 3.587 -10.427 1.00 51.31 H new ATOM 0 HB3 ARG A 97 -23.074 3.527 -12.158 1.00 51.31 H new ATOM 0 HG2 ARG A 97 -21.348 1.698 -12.313 1.00 11.33 H new ATOM 0 HG3 ARG A 97 -21.228 1.714 -10.565 1.00 11.33 H new ATOM 0 HD2 ARG A 97 -22.802 -0.030 -11.234 1.00 22.30 H new ATOM 0 HD3 ARG A 97 -23.678 1.237 -10.399 1.00 22.30 H new ATOM 0 HE ARG A 97 -23.556 1.560 -13.320 1.00 52.05 H new ATOM 0 HH11 ARG A 97 -25.463 0.302 -10.592 1.00 21.51 H new ATOM 0 HH12 ARG A 97 -26.949 0.210 -11.544 1.00 21.51 H new ATOM 0 HH21 ARG A 97 -25.452 1.440 -14.498 1.00 43.30 H new ATOM 0 HH22 ARG A 97 -26.940 0.853 -13.747 1.00 43.30 H new ATOM 1367 N VAL A 98 -19.332 4.063 -13.061 1.00 32.41 N ATOM 1368 CA VAL A 98 -18.654 3.897 -14.309 1.00 42.40 C ATOM 1369 C VAL A 98 -18.023 2.527 -14.378 1.00 52.21 C ATOM 1370 O VAL A 98 -17.789 1.895 -13.340 1.00 34.55 O ATOM 1371 CB VAL A 98 -17.596 5.002 -14.523 1.00 11.41 C ATOM 1372 CG1 VAL A 98 -18.295 6.359 -14.606 1.00 4.03 C ATOM 1373 CG2 VAL A 98 -16.569 4.990 -13.388 1.00 73.11 C ATOM 0 H VAL A 98 -18.718 4.050 -12.247 1.00 32.41 H new ATOM 0 HA VAL A 98 -19.387 3.985 -15.111 1.00 42.40 H new ATOM 0 HB VAL A 98 -17.064 4.816 -15.456 1.00 11.41 H new ATOM 0 HG11 VAL A 98 -17.552 7.142 -14.757 1.00 4.03 H new ATOM 0 HG12 VAL A 98 -18.995 6.357 -15.441 1.00 4.03 H new ATOM 0 HG13 VAL A 98 -18.837 6.547 -13.679 1.00 4.03 H new ATOM 0 HG21 VAL A 98 -15.832 5.775 -13.556 1.00 73.11 H new ATOM 0 HG22 VAL A 98 -17.074 5.164 -12.438 1.00 73.11 H new ATOM 0 HG23 VAL A 98 -16.068 4.022 -13.361 1.00 73.11 H new ATOM 1383 N THR A 99 -17.760 2.062 -15.562 1.00 25.30 N ATOM 1384 CA THR A 99 -17.185 0.753 -15.727 1.00 40.45 C ATOM 1385 C THR A 99 -15.674 0.879 -15.878 1.00 24.22 C ATOM 1386 O THR A 99 -15.174 1.736 -16.631 1.00 51.21 O ATOM 1387 CB THR A 99 -17.830 -0.037 -16.917 1.00 22.41 C ATOM 1388 OG1 THR A 99 -17.261 -1.347 -17.025 1.00 2.00 O ATOM 1389 CG2 THR A 99 -17.674 0.697 -18.241 1.00 50.24 C ATOM 0 H THR A 99 -17.933 2.567 -16.431 1.00 25.30 H new ATOM 0 HA THR A 99 -17.402 0.167 -14.834 1.00 40.45 H new ATOM 0 HB THR A 99 -18.895 -0.121 -16.700 1.00 22.41 H new ATOM 0 HG1 THR A 99 -17.678 -1.824 -17.772 1.00 2.00 H new ATOM 0 HG21 THR A 99 -18.136 0.113 -19.037 1.00 50.24 H new ATOM 0 HG22 THR A 99 -18.160 1.671 -18.177 1.00 50.24 H new ATOM 0 HG23 THR A 99 -16.615 0.834 -18.459 1.00 50.24 H new ATOM 1397 N VAL A 100 -14.952 0.070 -15.146 1.00 72.12 N ATOM 1398 CA VAL A 100 -13.499 0.134 -15.123 1.00 35.51 C ATOM 1399 C VAL A 100 -12.860 -1.259 -15.181 1.00 71.31 C ATOM 1400 O VAL A 100 -13.532 -2.274 -15.004 1.00 11.32 O ATOM 1401 CB VAL A 100 -12.970 0.882 -13.859 1.00 41.44 C ATOM 1402 CG1 VAL A 100 -13.409 2.343 -13.848 1.00 42.43 C ATOM 1403 CG2 VAL A 100 -13.424 0.181 -12.583 1.00 21.31 C ATOM 0 H VAL A 100 -15.347 -0.654 -14.546 1.00 72.12 H new ATOM 0 HA VAL A 100 -13.212 0.692 -16.014 1.00 35.51 H new ATOM 0 HB VAL A 100 -11.881 0.860 -13.899 1.00 41.44 H new ATOM 0 HG11 VAL A 100 -13.023 2.832 -12.954 1.00 42.43 H new ATOM 0 HG12 VAL A 100 -13.021 2.846 -14.734 1.00 42.43 H new ATOM 0 HG13 VAL A 100 -14.498 2.396 -13.849 1.00 42.43 H new ATOM 0 HG21 VAL A 100 -13.043 0.721 -11.716 1.00 21.31 H new ATOM 0 HG22 VAL A 100 -14.513 0.160 -12.547 1.00 21.31 H new ATOM 0 HG23 VAL A 100 -13.041 -0.839 -12.572 1.00 21.31 H new ATOM 1413 N GLY A 101 -11.577 -1.289 -15.427 1.00 52.50 N ATOM 1414 CA GLY A 101 -10.847 -2.522 -15.459 1.00 61.53 C ATOM 1415 C GLY A 101 -9.840 -2.573 -14.339 1.00 71.43 C ATOM 1416 O GLY A 101 -9.034 -1.652 -14.186 1.00 51.43 O ATOM 0 H GLY A 101 -11.012 -0.460 -15.610 1.00 52.50 H new ATOM 0 HA2 GLY A 101 -11.537 -3.361 -15.373 1.00 61.53 H new ATOM 0 HA3 GLY A 101 -10.338 -2.625 -16.417 1.00 61.53 H new ATOM 1420 N ILE A 102 -9.883 -3.624 -13.567 1.00 52.43 N ATOM 1421 CA ILE A 102 -9.009 -3.788 -12.428 1.00 21.15 C ATOM 1422 C ILE A 102 -8.159 -5.025 -12.570 1.00 35.42 C ATOM 1423 O ILE A 102 -8.440 -5.882 -13.393 1.00 70.24 O ATOM 1424 CB ILE A 102 -9.795 -3.789 -11.058 1.00 63.10 C ATOM 1425 CG1 ILE A 102 -10.926 -4.852 -10.978 1.00 55.20 C ATOM 1426 CG2 ILE A 102 -10.360 -2.427 -10.759 1.00 33.32 C ATOM 1427 CD1 ILE A 102 -10.498 -6.280 -10.738 1.00 43.51 C ATOM 0 H ILE A 102 -10.530 -4.400 -13.708 1.00 52.43 H new ATOM 0 HA ILE A 102 -8.349 -2.921 -12.410 1.00 21.15 H new ATOM 0 HB ILE A 102 -9.056 -4.060 -10.304 1.00 63.10 H new ATOM 0 HG12 ILE A 102 -11.609 -4.563 -10.179 1.00 55.20 H new ATOM 0 HG13 ILE A 102 -11.492 -4.818 -11.909 1.00 55.20 H new ATOM 0 HG21 ILE A 102 -10.896 -2.456 -9.810 1.00 33.32 H new ATOM 0 HG22 ILE A 102 -9.548 -1.702 -10.695 1.00 33.32 H new ATOM 0 HG23 ILE A 102 -11.046 -2.135 -11.554 1.00 33.32 H new ATOM 0 HD11 ILE A 102 -11.378 -6.923 -10.703 1.00 43.51 H new ATOM 0 HD12 ILE A 102 -9.844 -6.605 -11.547 1.00 43.51 H new ATOM 0 HD13 ILE A 102 -9.963 -6.345 -9.790 1.00 43.51 H new ATOM 1439 N VAL A 103 -7.122 -5.112 -11.793 1.00 52.54 N ATOM 1440 CA VAL A 103 -6.273 -6.271 -11.805 1.00 73.22 C ATOM 1441 C VAL A 103 -6.265 -6.889 -10.430 1.00 64.44 C ATOM 1442 O VAL A 103 -6.012 -6.208 -9.443 1.00 24.22 O ATOM 1443 CB VAL A 103 -4.819 -5.944 -12.246 1.00 52.11 C ATOM 1444 CG1 VAL A 103 -3.956 -7.207 -12.266 1.00 64.40 C ATOM 1445 CG2 VAL A 103 -4.804 -5.269 -13.615 1.00 1.34 C ATOM 0 H VAL A 103 -6.839 -4.386 -11.134 1.00 52.54 H new ATOM 0 HA VAL A 103 -6.676 -6.970 -12.538 1.00 73.22 H new ATOM 0 HB VAL A 103 -4.398 -5.252 -11.517 1.00 52.11 H new ATOM 0 HG11 VAL A 103 -2.943 -6.951 -12.578 1.00 64.40 H new ATOM 0 HG12 VAL A 103 -3.929 -7.645 -11.268 1.00 64.40 H new ATOM 0 HG13 VAL A 103 -4.380 -7.927 -12.966 1.00 64.40 H new ATOM 0 HG21 VAL A 103 -3.775 -5.050 -13.902 1.00 1.34 H new ATOM 0 HG22 VAL A 103 -5.253 -5.934 -14.353 1.00 1.34 H new ATOM 0 HG23 VAL A 103 -5.373 -4.341 -13.569 1.00 1.34 H new ATOM 1455 N ARG A 104 -6.567 -8.156 -10.373 1.00 21.13 N ATOM 1456 CA ARG A 104 -6.608 -8.891 -9.139 1.00 22.12 C ATOM 1457 C ARG A 104 -5.212 -9.137 -8.633 1.00 52.41 C ATOM 1458 O ARG A 104 -4.440 -9.878 -9.262 1.00 24.43 O ATOM 1459 CB ARG A 104 -7.286 -10.253 -9.339 1.00 44.30 C ATOM 1460 CG ARG A 104 -8.740 -10.196 -9.738 1.00 61.01 C ATOM 1461 CD ARG A 104 -9.293 -11.594 -10.017 1.00 11.22 C ATOM 1462 NE ARG A 104 -9.182 -12.515 -8.867 1.00 34.22 N ATOM 1463 CZ ARG A 104 -10.089 -13.474 -8.570 1.00 22.43 C ATOM 1464 NH1 ARG A 104 -11.208 -13.580 -9.275 1.00 11.24 N ATOM 1465 NH2 ARG A 104 -9.860 -14.323 -7.570 1.00 63.05 N ATOM 0 H ARG A 104 -6.795 -8.716 -11.195 1.00 21.13 H new ATOM 0 HA ARG A 104 -7.174 -8.298 -8.421 1.00 22.12 H new ATOM 0 HB2 ARG A 104 -6.738 -10.805 -10.103 1.00 44.30 H new ATOM 0 HB3 ARG A 104 -7.202 -10.822 -8.413 1.00 44.30 H new ATOM 0 HG2 ARG A 104 -9.319 -9.725 -8.944 1.00 61.01 H new ATOM 0 HG3 ARG A 104 -8.852 -9.574 -10.626 1.00 61.01 H new ATOM 0 HD2 ARG A 104 -10.341 -11.510 -10.305 1.00 11.22 H new ATOM 0 HD3 ARG A 104 -8.762 -12.022 -10.867 1.00 11.22 H new ATOM 0 HE ARG A 104 -8.369 -12.422 -8.258 1.00 34.22 H new ATOM 0 HH11 ARG A 104 -11.388 -12.936 -10.046 1.00 11.24 H new ATOM 0 HH12 ARG A 104 -11.888 -14.305 -9.046 1.00 11.24 H new ATOM 0 HH21 ARG A 104 -9.000 -14.251 -7.027 1.00 63.05 H new ATOM 0 HH22 ARG A 104 -10.545 -15.045 -7.347 1.00 63.05 H new ATOM 1479 N GLU A 105 -4.901 -8.570 -7.479 1.00 51.04 N ATOM 1480 CA GLU A 105 -3.610 -8.787 -6.837 1.00 62.14 C ATOM 1481 C GLU A 105 -3.633 -10.137 -6.137 1.00 54.35 C ATOM 1482 O GLU A 105 -2.678 -10.565 -5.507 1.00 23.12 O ATOM 1483 CB GLU A 105 -3.277 -7.663 -5.858 1.00 42.20 C ATOM 1484 CG GLU A 105 -3.256 -6.299 -6.514 1.00 75.32 C ATOM 1485 CD GLU A 105 -2.593 -5.240 -5.672 1.00 63.53 C ATOM 1486 OE1 GLU A 105 -3.250 -4.589 -4.850 1.00 43.33 O ATOM 1487 OE2 GLU A 105 -1.383 -5.029 -5.855 1.00 72.22 O ATOM 0 H GLU A 105 -5.527 -7.952 -6.963 1.00 51.04 H new ATOM 0 HA GLU A 105 -2.827 -8.784 -7.595 1.00 62.14 H new ATOM 0 HB2 GLU A 105 -4.010 -7.662 -5.051 1.00 42.20 H new ATOM 0 HB3 GLU A 105 -2.305 -7.858 -5.405 1.00 42.20 H new ATOM 0 HG2 GLU A 105 -2.736 -6.371 -7.469 1.00 75.32 H new ATOM 0 HG3 GLU A 105 -4.279 -5.992 -6.731 1.00 75.32 H new ATOM 1494 N ASP A 106 -4.778 -10.763 -6.255 1.00 71.44 N ATOM 1495 CA ASP A 106 -5.039 -12.117 -5.816 1.00 33.32 C ATOM 1496 C ASP A 106 -4.233 -13.085 -6.672 1.00 62.45 C ATOM 1497 O ASP A 106 -3.819 -14.152 -6.213 1.00 52.34 O ATOM 1498 CB ASP A 106 -6.529 -12.381 -5.984 1.00 52.23 C ATOM 1499 CG ASP A 106 -6.971 -13.763 -5.586 1.00 54.34 C ATOM 1500 OD1 ASP A 106 -6.965 -14.078 -4.388 1.00 22.14 O ATOM 1501 OD2 ASP A 106 -7.398 -14.524 -6.470 1.00 41.41 O ATOM 0 H ASP A 106 -5.594 -10.323 -6.680 1.00 71.44 H new ATOM 0 HA ASP A 106 -4.751 -12.252 -4.773 1.00 33.32 H new ATOM 0 HB2 ASP A 106 -7.082 -11.652 -5.391 1.00 52.23 H new ATOM 0 HB3 ASP A 106 -6.798 -12.214 -7.027 1.00 52.23 H new ATOM 1506 N ASN A 107 -4.000 -12.695 -7.929 1.00 73.14 N ATOM 1507 CA ASN A 107 -3.181 -13.493 -8.822 1.00 45.35 C ATOM 1508 C ASN A 107 -2.256 -12.549 -9.596 1.00 41.44 C ATOM 1509 O ASN A 107 -1.232 -12.123 -9.094 1.00 22.41 O ATOM 1510 CB ASN A 107 -3.999 -14.355 -9.848 1.00 42.30 C ATOM 1511 CG ASN A 107 -5.158 -15.140 -9.276 1.00 74.41 C ATOM 1512 OD1 ASN A 107 -4.993 -16.228 -8.743 1.00 45.20 O ATOM 1513 ND2 ASN A 107 -6.357 -14.619 -9.474 1.00 21.42 N ATOM 0 H ASN A 107 -4.367 -11.837 -8.341 1.00 73.14 H new ATOM 0 HA ASN A 107 -2.630 -14.199 -8.201 1.00 45.35 H new ATOM 0 HB2 ASN A 107 -4.382 -13.693 -10.625 1.00 42.30 H new ATOM 0 HB3 ASN A 107 -3.316 -15.053 -10.332 1.00 42.30 H new ATOM 0 HD21 ASN A 107 -7.190 -15.128 -9.178 1.00 21.42 H new ATOM 0 HD22 ASN A 107 -6.449 -13.708 -9.923 1.00 21.42 H new ATOM 1520 N SER A 108 -2.689 -12.186 -10.802 1.00 42.45 N ATOM 1521 CA SER A 108 -2.017 -11.273 -11.737 1.00 5.45 C ATOM 1522 C SER A 108 -2.982 -11.119 -12.916 1.00 22.24 C ATOM 1523 O SER A 108 -2.587 -10.832 -14.041 1.00 62.51 O ATOM 1524 CB SER A 108 -0.685 -11.888 -12.266 1.00 52.55 C ATOM 1525 OG SER A 108 0.257 -12.130 -11.226 1.00 10.32 O ATOM 0 H SER A 108 -3.569 -12.539 -11.178 1.00 42.45 H new ATOM 0 HA SER A 108 -1.776 -10.329 -11.249 1.00 5.45 H new ATOM 0 HB2 SER A 108 -0.901 -12.824 -12.781 1.00 52.55 H new ATOM 0 HB3 SER A 108 -0.244 -11.214 -13.001 1.00 52.55 H new ATOM 0 HG SER A 108 -0.092 -11.780 -10.380 1.00 10.32 H new ATOM 1531 N GLU A 109 -4.265 -11.280 -12.619 1.00 41.04 N ATOM 1532 CA GLU A 109 -5.286 -11.364 -13.639 1.00 61.22 C ATOM 1533 C GLU A 109 -6.190 -10.148 -13.626 1.00 63.50 C ATOM 1534 O GLU A 109 -6.510 -9.623 -12.574 1.00 52.12 O ATOM 1535 CB GLU A 109 -6.084 -12.636 -13.432 1.00 42.55 C ATOM 1536 CG GLU A 109 -5.240 -13.890 -13.530 1.00 51.14 C ATOM 1537 CD GLU A 109 -6.060 -15.137 -13.484 1.00 14.31 C ATOM 1538 OE1 GLU A 109 -6.497 -15.529 -12.401 1.00 23.13 O ATOM 1539 OE2 GLU A 109 -6.264 -15.753 -14.547 1.00 72.12 O ATOM 0 H GLU A 109 -4.620 -11.355 -11.666 1.00 41.04 H new ATOM 0 HA GLU A 109 -4.807 -11.389 -14.618 1.00 61.22 H new ATOM 0 HB2 GLU A 109 -6.562 -12.603 -12.453 1.00 42.55 H new ATOM 0 HB3 GLU A 109 -6.881 -12.683 -14.174 1.00 42.55 H new ATOM 0 HG2 GLU A 109 -4.670 -13.868 -14.459 1.00 51.14 H new ATOM 0 HG3 GLU A 109 -4.519 -13.903 -12.713 1.00 51.14 H new ATOM 1546 N LYS A 110 -6.604 -9.736 -14.788 1.00 42.13 N ATOM 1547 CA LYS A 110 -7.412 -8.530 -14.962 1.00 24.03 C ATOM 1548 C LYS A 110 -8.904 -8.857 -15.033 1.00 33.51 C ATOM 1549 O LYS A 110 -9.298 -9.949 -15.474 1.00 3.40 O ATOM 1550 CB LYS A 110 -6.991 -7.757 -16.214 1.00 74.15 C ATOM 1551 CG LYS A 110 -7.185 -8.529 -17.504 1.00 3.53 C ATOM 1552 CD LYS A 110 -6.740 -7.742 -18.721 1.00 51.54 C ATOM 1553 CE LYS A 110 -7.550 -6.470 -18.908 1.00 2.50 C ATOM 1554 NZ LYS A 110 -7.098 -5.716 -20.088 1.00 41.51 N ATOM 0 H LYS A 110 -6.397 -10.222 -15.661 1.00 42.13 H new ATOM 0 HA LYS A 110 -7.238 -7.904 -14.087 1.00 24.03 H new ATOM 0 HB2 LYS A 110 -7.562 -6.830 -16.267 1.00 74.15 H new ATOM 0 HB3 LYS A 110 -5.941 -7.479 -16.122 1.00 74.15 H new ATOM 0 HG2 LYS A 110 -6.624 -9.462 -17.453 1.00 3.53 H new ATOM 0 HG3 LYS A 110 -8.237 -8.794 -17.611 1.00 3.53 H new ATOM 0 HD2 LYS A 110 -5.685 -7.488 -18.622 1.00 51.54 H new ATOM 0 HD3 LYS A 110 -6.835 -8.366 -19.610 1.00 51.54 H new ATOM 0 HE2 LYS A 110 -8.605 -6.721 -19.017 1.00 2.50 H new ATOM 0 HE3 LYS A 110 -7.461 -5.846 -18.019 1.00 2.50 H new ATOM 0 HZ1 LYS A 110 -7.670 -4.853 -20.189 1.00 41.51 H new ATOM 0 HZ2 LYS A 110 -6.098 -5.456 -19.972 1.00 41.51 H new ATOM 0 HZ3 LYS A 110 -7.206 -6.305 -20.939 1.00 41.51 H new ATOM 1568 N MET A 111 -9.708 -7.938 -14.565 1.00 40.11 N ATOM 1569 CA MET A 111 -11.162 -8.055 -14.564 1.00 65.11 C ATOM 1570 C MET A 111 -11.809 -6.745 -14.824 1.00 71.23 C ATOM 1571 O MET A 111 -11.210 -5.692 -14.652 1.00 73.12 O ATOM 1572 CB MET A 111 -11.710 -8.561 -13.254 1.00 2.25 C ATOM 1573 CG MET A 111 -11.374 -9.965 -12.944 1.00 43.03 C ATOM 1574 SD MET A 111 -12.057 -10.500 -11.379 1.00 1.01 S ATOM 1575 CE MET A 111 -13.786 -10.261 -11.720 1.00 34.54 C ATOM 0 H MET A 111 -9.372 -7.063 -14.162 1.00 40.11 H new ATOM 0 HA MET A 111 -11.387 -8.771 -15.355 1.00 65.11 H new ATOM 0 HB2 MET A 111 -11.336 -7.927 -12.450 1.00 2.25 H new ATOM 0 HB3 MET A 111 -12.795 -8.455 -13.265 1.00 2.25 H new ATOM 0 HG2 MET A 111 -11.748 -10.609 -13.740 1.00 43.03 H new ATOM 0 HG3 MET A 111 -10.290 -10.080 -12.923 1.00 43.03 H new ATOM 0 HE1 MET A 111 -14.363 -11.058 -11.251 1.00 34.54 H new ATOM 0 HE2 MET A 111 -14.106 -9.298 -11.321 1.00 34.54 H new ATOM 0 HE3 MET A 111 -13.950 -10.280 -12.797 1.00 34.54 H new ATOM 1585 N ALA A 112 -13.028 -6.819 -15.213 1.00 44.30 N ATOM 1586 CA ALA A 112 -13.828 -5.649 -15.441 1.00 22.33 C ATOM 1587 C ALA A 112 -14.834 -5.518 -14.323 1.00 72.54 C ATOM 1588 O ALA A 112 -15.537 -6.481 -13.989 1.00 41.30 O ATOM 1589 CB ALA A 112 -14.529 -5.715 -16.776 1.00 1.35 C ATOM 0 H ALA A 112 -13.514 -7.698 -15.387 1.00 44.30 H new ATOM 0 HA ALA A 112 -13.178 -4.774 -15.458 1.00 22.33 H new ATOM 0 HB1 ALA A 112 -15.126 -4.814 -16.918 1.00 1.35 H new ATOM 0 HB2 ALA A 112 -13.789 -5.789 -17.572 1.00 1.35 H new ATOM 0 HB3 ALA A 112 -15.179 -6.590 -16.803 1.00 1.35 H new ATOM 1595 N VAL A 113 -14.900 -4.354 -13.744 1.00 24.25 N ATOM 1596 CA VAL A 113 -15.771 -4.078 -12.617 1.00 14.11 C ATOM 1597 C VAL A 113 -16.296 -2.663 -12.739 1.00 5.04 C ATOM 1598 O VAL A 113 -15.909 -1.938 -13.634 1.00 51.10 O ATOM 1599 CB VAL A 113 -15.032 -4.215 -11.249 1.00 23.32 C ATOM 1600 CG1 VAL A 113 -14.495 -5.619 -11.026 1.00 33.21 C ATOM 1601 CG2 VAL A 113 -13.917 -3.202 -11.144 1.00 43.33 C ATOM 0 H VAL A 113 -14.345 -3.551 -14.040 1.00 24.25 H new ATOM 0 HA VAL A 113 -16.580 -4.808 -12.638 1.00 14.11 H new ATOM 0 HB VAL A 113 -15.765 -4.019 -10.466 1.00 23.32 H new ATOM 0 HG11 VAL A 113 -13.989 -5.666 -10.062 1.00 33.21 H new ATOM 0 HG12 VAL A 113 -15.321 -6.330 -11.038 1.00 33.21 H new ATOM 0 HG13 VAL A 113 -13.790 -5.869 -11.818 1.00 33.21 H new ATOM 0 HG21 VAL A 113 -13.414 -3.313 -10.184 1.00 43.33 H new ATOM 0 HG22 VAL A 113 -13.201 -3.364 -11.950 1.00 43.33 H new ATOM 0 HG23 VAL A 113 -14.330 -2.196 -11.223 1.00 43.33 H new ATOM 1611 N LYS A 114 -17.178 -2.276 -11.876 1.00 61.30 N ATOM 1612 CA LYS A 114 -17.651 -0.917 -11.893 1.00 30.53 C ATOM 1613 C LYS A 114 -17.242 -0.222 -10.618 1.00 62.32 C ATOM 1614 O LYS A 114 -17.041 -0.872 -9.599 1.00 73.12 O ATOM 1615 CB LYS A 114 -19.158 -0.858 -12.113 1.00 41.41 C ATOM 1616 CG LYS A 114 -19.581 -1.535 -13.400 1.00 1.13 C ATOM 1617 CD LYS A 114 -21.040 -1.335 -13.692 1.00 5.52 C ATOM 1618 CE LYS A 114 -21.432 -2.090 -14.944 1.00 20.32 C ATOM 1619 NZ LYS A 114 -22.844 -1.869 -15.334 1.00 52.11 N ATOM 0 H LYS A 114 -17.587 -2.870 -11.154 1.00 61.30 H new ATOM 0 HA LYS A 114 -17.193 -0.393 -12.732 1.00 30.53 H new ATOM 0 HB2 LYS A 114 -19.664 -1.333 -11.273 1.00 41.41 H new ATOM 0 HB3 LYS A 114 -19.479 0.183 -12.131 1.00 41.41 H new ATOM 0 HG2 LYS A 114 -18.989 -1.142 -14.227 1.00 1.13 H new ATOM 0 HG3 LYS A 114 -19.368 -2.602 -13.334 1.00 1.13 H new ATOM 0 HD2 LYS A 114 -21.638 -1.680 -12.848 1.00 5.52 H new ATOM 0 HD3 LYS A 114 -21.251 -0.273 -13.818 1.00 5.52 H new ATOM 0 HE2 LYS A 114 -20.782 -1.785 -15.764 1.00 20.32 H new ATOM 0 HE3 LYS A 114 -21.267 -3.156 -14.786 1.00 20.32 H new ATOM 0 HZ1 LYS A 114 -23.055 -2.410 -16.197 1.00 52.11 H new ATOM 0 HZ2 LYS A 114 -23.470 -2.185 -14.566 1.00 52.11 H new ATOM 0 HZ3 LYS A 114 -23.000 -0.857 -15.514 1.00 52.11 H new ATOM 1633 N THR A 115 -17.087 1.075 -10.673 1.00 13.41 N ATOM 1634 CA THR A 115 -16.683 1.822 -9.513 1.00 30.21 C ATOM 1635 C THR A 115 -17.304 3.221 -9.563 1.00 10.32 C ATOM 1636 O THR A 115 -17.944 3.594 -10.565 1.00 40.00 O ATOM 1637 CB THR A 115 -15.128 1.915 -9.381 1.00 32.31 C ATOM 1638 OG1 THR A 115 -14.782 2.388 -8.071 1.00 24.32 O ATOM 1639 CG2 THR A 115 -14.543 2.875 -10.413 1.00 12.00 C ATOM 0 H THR A 115 -17.235 1.636 -11.512 1.00 13.41 H new ATOM 0 HA THR A 115 -17.043 1.292 -8.631 1.00 30.21 H new ATOM 0 HB THR A 115 -14.718 0.919 -9.549 1.00 32.31 H new ATOM 0 HG1 THR A 115 -14.850 1.651 -7.429 1.00 24.32 H new ATOM 0 HG21 THR A 115 -13.460 2.919 -10.296 1.00 12.00 H new ATOM 0 HG22 THR A 115 -14.786 2.524 -11.416 1.00 12.00 H new ATOM 0 HG23 THR A 115 -14.964 3.869 -10.265 1.00 12.00 H new ATOM 1647 N TYR A 116 -17.138 3.962 -8.498 1.00 40.51 N ATOM 1648 CA TYR A 116 -17.702 5.278 -8.365 1.00 74.13 C ATOM 1649 C TYR A 116 -16.593 6.301 -8.230 1.00 5.54 C ATOM 1650 O TYR A 116 -15.893 6.350 -7.217 1.00 62.14 O ATOM 1651 CB TYR A 116 -18.661 5.331 -7.160 1.00 73.40 C ATOM 1652 CG TYR A 116 -19.853 4.410 -7.306 1.00 45.33 C ATOM 1653 CD1 TYR A 116 -19.753 3.056 -7.008 1.00 4.53 C ATOM 1654 CD2 TYR A 116 -21.071 4.890 -7.761 1.00 21.11 C ATOM 1655 CE1 TYR A 116 -20.829 2.211 -7.164 1.00 14.13 C ATOM 1656 CE2 TYR A 116 -22.151 4.054 -7.913 1.00 53.45 C ATOM 1657 CZ TYR A 116 -22.022 2.713 -7.616 1.00 24.13 C ATOM 1658 OH TYR A 116 -23.092 1.875 -7.784 1.00 22.43 O ATOM 0 H TYR A 116 -16.598 3.662 -7.686 1.00 40.51 H new ATOM 0 HA TYR A 116 -18.279 5.514 -9.259 1.00 74.13 H new ATOM 0 HB2 TYR A 116 -18.113 5.065 -6.256 1.00 73.40 H new ATOM 0 HB3 TYR A 116 -19.014 6.354 -7.030 1.00 73.40 H new ATOM 0 HD1 TYR A 116 -18.815 2.660 -6.648 1.00 4.53 H new ATOM 0 HD2 TYR A 116 -21.173 5.938 -8.000 1.00 21.11 H new ATOM 0 HE1 TYR A 116 -20.734 1.161 -6.932 1.00 14.13 H new ATOM 0 HE2 TYR A 116 -23.095 4.444 -8.263 1.00 53.45 H new ATOM 0 HH TYR A 116 -22.834 0.962 -7.539 1.00 22.43 H new ATOM 1668 N MET A 117 -16.420 7.086 -9.260 1.00 74.41 N ATOM 1669 CA MET A 117 -15.394 8.116 -9.286 1.00 3.04 C ATOM 1670 C MET A 117 -16.041 9.478 -9.260 1.00 14.41 C ATOM 1671 O MET A 117 -17.227 9.615 -9.607 1.00 3.25 O ATOM 1672 CB MET A 117 -14.458 8.010 -10.510 1.00 72.44 C ATOM 1673 CG MET A 117 -15.147 8.224 -11.827 1.00 33.35 C ATOM 1674 SD MET A 117 -14.036 8.231 -13.232 1.00 73.21 S ATOM 1675 CE MET A 117 -15.218 8.340 -14.571 1.00 23.42 C ATOM 0 H MET A 117 -16.982 7.036 -10.109 1.00 74.41 H new ATOM 0 HA MET A 117 -14.776 7.969 -8.400 1.00 3.04 H new ATOM 0 HB2 MET A 117 -13.658 8.743 -10.407 1.00 72.44 H new ATOM 0 HB3 MET A 117 -13.990 7.026 -10.512 1.00 72.44 H new ATOM 0 HG2 MET A 117 -15.891 7.441 -11.968 1.00 33.35 H new ATOM 0 HG3 MET A 117 -15.684 9.172 -11.796 1.00 33.35 H new ATOM 0 HE1 MET A 117 -14.890 9.095 -15.286 1.00 23.42 H new ATOM 0 HE2 MET A 117 -15.291 7.374 -15.071 1.00 23.42 H new ATOM 0 HE3 MET A 117 -16.194 8.617 -14.173 1.00 23.42 H new ATOM 1685 N TRP A 118 -15.296 10.460 -8.809 1.00 75.20 N ATOM 1686 CA TRP A 118 -15.760 11.814 -8.764 1.00 61.40 C ATOM 1687 C TRP A 118 -15.869 12.300 -10.194 1.00 71.32 C ATOM 1688 O TRP A 118 -14.868 12.381 -10.916 1.00 34.30 O ATOM 1689 CB TRP A 118 -14.770 12.672 -7.965 1.00 61.13 C ATOM 1690 CG TRP A 118 -15.275 14.030 -7.651 1.00 75.34 C ATOM 1691 CD1 TRP A 118 -14.786 15.225 -8.071 1.00 62.21 C ATOM 1692 CD2 TRP A 118 -16.391 14.314 -6.841 1.00 34.32 C ATOM 1693 NE1 TRP A 118 -15.538 16.243 -7.552 1.00 14.22 N ATOM 1694 CE2 TRP A 118 -16.537 15.706 -6.792 1.00 52.31 C ATOM 1695 CE3 TRP A 118 -17.280 13.513 -6.151 1.00 61.22 C ATOM 1696 CZ2 TRP A 118 -17.554 16.317 -6.068 1.00 34.20 C ATOM 1697 CZ3 TRP A 118 -18.273 14.095 -5.441 1.00 14.24 C ATOM 1698 CH2 TRP A 118 -18.418 15.493 -5.395 1.00 62.43 C ATOM 0 H TRP A 118 -14.345 10.334 -8.462 1.00 75.20 H new ATOM 0 HA TRP A 118 -16.730 11.885 -8.272 1.00 61.40 H new ATOM 0 HB2 TRP A 118 -14.528 12.160 -7.034 1.00 61.13 H new ATOM 0 HB3 TRP A 118 -13.842 12.761 -8.530 1.00 61.13 H new ATOM 0 HD1 TRP A 118 -13.931 15.353 -8.718 1.00 62.21 H new ATOM 0 HE1 TRP A 118 -15.379 17.238 -7.707 1.00 14.22 H new ATOM 0 HE3 TRP A 118 -17.183 12.438 -6.178 1.00 61.22 H new ATOM 0 HZ2 TRP A 118 -17.659 17.391 -6.037 1.00 34.20 H new ATOM 0 HZ3 TRP A 118 -18.969 13.473 -4.898 1.00 14.24 H new ATOM 0 HH2 TRP A 118 -19.224 15.925 -4.820 1.00 62.43 H new ATOM 1709 N ILE A 119 -17.064 12.609 -10.592 1.00 32.32 N ATOM 1710 CA ILE A 119 -17.345 12.914 -11.975 1.00 54.01 C ATOM 1711 C ILE A 119 -16.828 14.271 -12.398 1.00 33.11 C ATOM 1712 O ILE A 119 -16.246 14.407 -13.482 1.00 20.25 O ATOM 1713 CB ILE A 119 -18.844 12.737 -12.295 1.00 54.32 C ATOM 1714 CG1 ILE A 119 -19.267 11.299 -11.966 1.00 51.01 C ATOM 1715 CG2 ILE A 119 -19.152 13.077 -13.741 1.00 63.33 C ATOM 1716 CD1 ILE A 119 -18.447 10.226 -12.675 1.00 14.20 C ATOM 0 H ILE A 119 -17.875 12.659 -9.976 1.00 32.32 H new ATOM 0 HA ILE A 119 -16.793 12.189 -12.573 1.00 54.01 H new ATOM 0 HB ILE A 119 -19.416 13.431 -11.679 1.00 54.32 H new ATOM 0 HG12 ILE A 119 -19.189 11.147 -10.889 1.00 51.01 H new ATOM 0 HG13 ILE A 119 -20.317 11.172 -12.231 1.00 51.01 H new ATOM 0 HG21 ILE A 119 -20.217 12.940 -13.928 1.00 63.33 H new ATOM 0 HG22 ILE A 119 -18.879 14.114 -13.937 1.00 63.33 H new ATOM 0 HG23 ILE A 119 -18.581 12.421 -14.398 1.00 63.33 H new ATOM 0 HD11 ILE A 119 -18.811 9.240 -12.387 1.00 14.20 H new ATOM 0 HD12 ILE A 119 -18.544 10.348 -13.754 1.00 14.20 H new ATOM 0 HD13 ILE A 119 -17.399 10.323 -12.392 1.00 14.20 H new ATOM 1728 N ASN A 120 -16.993 15.264 -11.533 1.00 55.32 N ATOM 1729 CA ASN A 120 -16.523 16.621 -11.837 1.00 23.00 C ATOM 1730 C ASN A 120 -15.011 16.598 -12.019 1.00 31.22 C ATOM 1731 O ASN A 120 -14.463 17.315 -12.854 1.00 3.04 O ATOM 1732 CB ASN A 120 -16.879 17.593 -10.714 1.00 74.41 C ATOM 1733 CG ASN A 120 -16.517 19.038 -11.055 1.00 72.53 C ATOM 1734 OD1 ASN A 120 -16.597 19.455 -12.219 1.00 15.11 O ATOM 1735 ND2 ASN A 120 -16.071 19.786 -10.082 1.00 35.33 N ATOM 0 H ASN A 120 -17.443 15.163 -10.623 1.00 55.32 H new ATOM 0 HA ASN A 120 -17.011 16.958 -12.751 1.00 23.00 H new ATOM 0 HB2 ASN A 120 -17.947 17.529 -10.507 1.00 74.41 H new ATOM 0 HB3 ASN A 120 -16.359 17.297 -9.803 1.00 74.41 H new ATOM 0 HD21 ASN A 120 -15.776 20.744 -10.269 1.00 35.33 H new ATOM 0 HD22 ASN A 120 -16.018 19.412 -9.134 1.00 35.33 H new ATOM 1742 N LYS A 121 -14.365 15.733 -11.216 1.00 2.22 N ATOM 1743 CA LYS A 121 -12.902 15.435 -11.183 1.00 75.33 C ATOM 1744 C LYS A 121 -11.975 16.638 -10.912 1.00 13.32 C ATOM 1745 O LYS A 121 -10.967 16.502 -10.217 1.00 1.12 O ATOM 1746 CB LYS A 121 -12.423 14.562 -12.378 1.00 2.14 C ATOM 1747 CG LYS A 121 -12.524 15.192 -13.762 1.00 75.25 C ATOM 1748 CD LYS A 121 -12.104 14.216 -14.856 1.00 4.32 C ATOM 1749 CE LYS A 121 -13.061 13.030 -14.967 1.00 0.44 C ATOM 1750 NZ LYS A 121 -14.416 13.441 -15.370 1.00 24.21 N ATOM 0 H LYS A 121 -14.874 15.183 -10.524 1.00 2.22 H new ATOM 0 HA LYS A 121 -12.799 14.825 -10.286 1.00 75.33 H new ATOM 0 HB2 LYS A 121 -11.383 14.286 -12.204 1.00 2.14 H new ATOM 0 HB3 LYS A 121 -13.002 13.639 -12.380 1.00 2.14 H new ATOM 0 HG2 LYS A 121 -13.548 15.519 -13.939 1.00 75.25 H new ATOM 0 HG3 LYS A 121 -11.894 16.080 -13.805 1.00 75.25 H new ATOM 0 HD2 LYS A 121 -12.063 14.739 -15.812 1.00 4.32 H new ATOM 0 HD3 LYS A 121 -11.098 13.851 -14.649 1.00 4.32 H new ATOM 0 HE2 LYS A 121 -12.669 12.317 -15.692 1.00 0.44 H new ATOM 0 HE3 LYS A 121 -13.110 12.515 -14.008 1.00 0.44 H new ATOM 0 HZ1 LYS A 121 -14.909 12.634 -15.803 1.00 24.21 H new ATOM 0 HZ2 LYS A 121 -14.945 13.762 -14.534 1.00 24.21 H new ATOM 0 HZ3 LYS A 121 -14.353 14.218 -16.059 1.00 24.21 H new ATOM 1764 N ALA A 122 -12.308 17.780 -11.433 1.00 22.35 N ATOM 1765 CA ALA A 122 -11.522 18.959 -11.240 1.00 63.34 C ATOM 1766 C ALA A 122 -12.037 19.768 -10.064 1.00 62.12 C ATOM 1767 O ALA A 122 -12.890 20.650 -10.210 1.00 25.51 O ATOM 1768 CB ALA A 122 -11.465 19.799 -12.506 1.00 21.52 C ATOM 0 H ALA A 122 -13.139 17.920 -12.008 1.00 22.35 H new ATOM 0 HA ALA A 122 -10.503 18.647 -11.010 1.00 63.34 H new ATOM 0 HB1 ALA A 122 -10.860 20.688 -12.326 1.00 21.52 H new ATOM 0 HB2 ALA A 122 -11.020 19.214 -13.311 1.00 21.52 H new ATOM 0 HB3 ALA A 122 -12.474 20.098 -12.790 1.00 21.52 H new ATOM 1774 N ASP A 123 -11.574 19.408 -8.902 1.00 14.15 N ATOM 1775 CA ASP A 123 -11.880 20.119 -7.682 1.00 34.43 C ATOM 1776 C ASP A 123 -10.641 20.370 -6.901 1.00 75.23 C ATOM 1777 O ASP A 123 -10.091 19.448 -6.304 1.00 64.23 O ATOM 1778 CB ASP A 123 -12.927 19.413 -6.784 1.00 53.13 C ATOM 1779 CG ASP A 123 -14.348 19.699 -7.179 1.00 54.14 C ATOM 1780 OD1 ASP A 123 -14.816 20.816 -6.904 1.00 65.42 O ATOM 1781 OD2 ASP A 123 -15.022 18.828 -7.754 1.00 2.22 O ATOM 0 H ASP A 123 -10.964 18.602 -8.767 1.00 14.15 H new ATOM 0 HA ASP A 123 -12.328 21.061 -7.998 1.00 34.43 H new ATOM 0 HB2 ASP A 123 -12.758 18.337 -6.820 1.00 53.13 H new ATOM 0 HB3 ASP A 123 -12.776 19.725 -5.750 1.00 53.13 H new ATOM 1786 N PRO A 124 -10.156 21.623 -6.888 1.00 44.14 N ATOM 1787 CA PRO A 124 -8.976 22.008 -6.103 1.00 65.12 C ATOM 1788 C PRO A 124 -9.228 21.808 -4.614 1.00 21.14 C ATOM 1789 O PRO A 124 -8.300 21.745 -3.813 1.00 72.33 O ATOM 1790 CB PRO A 124 -8.799 23.504 -6.412 1.00 11.30 C ATOM 1791 CG PRO A 124 -9.549 23.727 -7.679 1.00 3.14 C ATOM 1792 CD PRO A 124 -10.698 22.764 -7.652 1.00 23.13 C ATOM 0 HA PRO A 124 -8.098 21.412 -6.352 1.00 65.12 H new ATOM 0 HB2 PRO A 124 -9.193 24.123 -5.606 1.00 11.30 H new ATOM 0 HB3 PRO A 124 -7.746 23.762 -6.526 1.00 11.30 H new ATOM 0 HG2 PRO A 124 -9.903 24.756 -7.747 1.00 3.14 H new ATOM 0 HG3 PRO A 124 -8.912 23.551 -8.546 1.00 3.14 H new ATOM 0 HD2 PRO A 124 -11.574 23.195 -7.167 1.00 23.13 H new ATOM 0 HD3 PRO A 124 -11.002 22.469 -8.657 1.00 23.13 H new ATOM 1800 N ASP A 125 -10.509 21.694 -4.270 1.00 1.12 N ATOM 1801 CA ASP A 125 -10.954 21.480 -2.907 1.00 72.21 C ATOM 1802 C ASP A 125 -10.393 20.176 -2.342 1.00 5.02 C ATOM 1803 O ASP A 125 -10.017 20.109 -1.174 1.00 51.43 O ATOM 1804 CB ASP A 125 -12.485 21.498 -2.843 1.00 33.10 C ATOM 1805 CG ASP A 125 -13.028 21.282 -1.444 1.00 2.32 C ATOM 1806 OD1 ASP A 125 -12.748 22.110 -0.549 1.00 53.15 O ATOM 1807 OD2 ASP A 125 -13.790 20.328 -1.245 1.00 72.33 O ATOM 0 H ASP A 125 -11.273 21.749 -4.944 1.00 1.12 H new ATOM 0 HA ASP A 125 -10.574 22.293 -2.288 1.00 72.21 H new ATOM 0 HB2 ASP A 125 -12.847 22.454 -3.222 1.00 33.10 H new ATOM 0 HB3 ASP A 125 -12.879 20.724 -3.502 1.00 33.10 H new ATOM 1812 N MET A 126 -10.289 19.156 -3.179 1.00 23.43 N ATOM 1813 CA MET A 126 -9.725 17.902 -2.738 1.00 2.53 C ATOM 1814 C MET A 126 -8.352 17.677 -3.333 1.00 14.33 C ATOM 1815 O MET A 126 -8.109 17.970 -4.510 1.00 51.23 O ATOM 1816 CB MET A 126 -10.691 16.689 -2.935 1.00 5.23 C ATOM 1817 CG MET A 126 -11.235 16.443 -4.351 1.00 73.24 C ATOM 1818 SD MET A 126 -10.035 15.955 -5.581 1.00 14.13 S ATOM 1819 CE MET A 126 -11.105 15.760 -7.005 1.00 30.41 C ATOM 0 H MET A 126 -10.585 19.176 -4.155 1.00 23.43 H new ATOM 0 HA MET A 126 -9.592 17.976 -1.659 1.00 2.53 H new ATOM 0 HB2 MET A 126 -10.170 15.787 -2.613 1.00 5.23 H new ATOM 0 HB3 MET A 126 -11.541 16.823 -2.266 1.00 5.23 H new ATOM 0 HG2 MET A 126 -12.002 15.670 -4.294 1.00 73.24 H new ATOM 0 HG3 MET A 126 -11.726 17.354 -4.693 1.00 73.24 H new ATOM 0 HE1 MET A 126 -10.634 15.091 -7.725 1.00 30.41 H new ATOM 0 HE2 MET A 126 -12.059 15.339 -6.688 1.00 30.41 H new ATOM 0 HE3 MET A 126 -11.274 16.732 -7.469 1.00 30.41 H new ATOM 2066 N LYS A 140 3.261 -7.383 0.614 1.00 33.14 N ATOM 2067 CA LYS A 140 4.215 -8.477 0.748 1.00 61.51 C ATOM 2068 C LYS A 140 3.461 -9.786 0.723 1.00 73.43 C ATOM 2069 O LYS A 140 3.934 -10.774 0.186 1.00 42.24 O ATOM 2070 CB LYS A 140 4.984 -8.381 2.079 1.00 13.22 C ATOM 2071 CG LYS A 140 5.972 -9.548 2.328 1.00 74.21 C ATOM 2072 CD LYS A 140 6.677 -9.430 3.677 1.00 31.02 C ATOM 2073 CE LYS A 140 5.695 -9.554 4.838 1.00 62.54 C ATOM 2074 NZ LYS A 140 6.367 -9.443 6.146 1.00 4.45 N ATOM 0 HA LYS A 140 4.927 -8.419 -0.075 1.00 61.51 H new ATOM 0 HB2 LYS A 140 5.536 -7.442 2.099 1.00 13.22 H new ATOM 0 HB3 LYS A 140 4.266 -8.346 2.899 1.00 13.22 H new ATOM 0 HG2 LYS A 140 5.432 -10.494 2.284 1.00 74.21 H new ATOM 0 HG3 LYS A 140 6.716 -9.568 1.532 1.00 74.21 H new ATOM 0 HD2 LYS A 140 7.438 -10.206 3.759 1.00 31.02 H new ATOM 0 HD3 LYS A 140 7.192 -8.471 3.736 1.00 31.02 H new ATOM 0 HE2 LYS A 140 4.935 -8.777 4.754 1.00 62.54 H new ATOM 0 HE3 LYS A 140 5.180 -10.512 4.776 1.00 62.54 H new ATOM 0 HZ1 LYS A 140 5.663 -9.533 6.907 1.00 4.45 H new ATOM 0 HZ2 LYS A 140 7.075 -10.200 6.238 1.00 4.45 H new ATOM 0 HZ3 LYS A 140 6.838 -8.518 6.217 1.00 4.45 H new ATOM 2088 N LYS A 141 2.260 -9.766 1.290 1.00 73.21 N ATOM 2089 CA LYS A 141 1.451 -10.944 1.391 1.00 44.50 C ATOM 2090 C LYS A 141 1.132 -11.543 0.022 1.00 61.50 C ATOM 2091 O LYS A 141 1.091 -12.734 -0.096 1.00 31.31 O ATOM 2092 CB LYS A 141 0.189 -10.690 2.213 1.00 75.22 C ATOM 2093 CG LYS A 141 -0.662 -11.927 2.402 1.00 73.22 C ATOM 2094 CD LYS A 141 -1.843 -11.662 3.293 1.00 42.24 C ATOM 2095 CE LYS A 141 -2.695 -12.906 3.445 1.00 5.41 C ATOM 2096 NZ LYS A 141 -1.938 -14.057 4.013 1.00 10.04 N ATOM 0 H LYS A 141 1.834 -8.929 1.687 1.00 73.21 H new ATOM 0 HA LYS A 141 2.039 -11.690 1.926 1.00 44.50 H new ATOM 0 HB2 LYS A 141 0.473 -10.300 3.190 1.00 75.22 H new ATOM 0 HB3 LYS A 141 -0.406 -9.919 1.723 1.00 75.22 H new ATOM 0 HG2 LYS A 141 -1.011 -12.280 1.431 1.00 73.22 H new ATOM 0 HG3 LYS A 141 -0.055 -12.724 2.831 1.00 73.22 H new ATOM 0 HD2 LYS A 141 -1.498 -11.331 4.272 1.00 42.24 H new ATOM 0 HD3 LYS A 141 -2.444 -10.853 2.877 1.00 42.24 H new ATOM 0 HE2 LYS A 141 -3.545 -12.682 4.089 1.00 5.41 H new ATOM 0 HE3 LYS A 141 -3.098 -13.186 2.472 1.00 5.41 H new ATOM 0 HZ1 LYS A 141 -2.595 -14.836 4.222 1.00 10.04 H new ATOM 0 HZ2 LYS A 141 -1.227 -14.379 3.325 1.00 10.04 H new ATOM 0 HZ3 LYS A 141 -1.462 -13.761 4.889 1.00 10.04 H new ATOM 2110 N LYS A 142 0.936 -10.707 -1.019 1.00 44.31 N ATOM 2111 CA LYS A 142 0.705 -11.230 -2.392 1.00 14.10 C ATOM 2112 C LYS A 142 1.850 -12.132 -2.759 1.00 40.13 C ATOM 2113 O LYS A 142 1.677 -13.262 -3.241 1.00 54.01 O ATOM 2114 CB LYS A 142 0.724 -10.111 -3.445 1.00 40.21 C ATOM 2115 CG LYS A 142 0.475 -10.646 -4.859 1.00 4.32 C ATOM 2116 CD LYS A 142 0.742 -9.614 -5.935 1.00 5.42 C ATOM 2117 CE LYS A 142 0.539 -10.223 -7.315 1.00 10.50 C ATOM 2118 NZ LYS A 142 0.938 -9.305 -8.400 1.00 32.11 N ATOM 0 H LYS A 142 0.932 -9.690 -0.945 1.00 44.31 H new ATOM 0 HA LYS A 142 -0.264 -11.730 -2.385 1.00 14.10 H new ATOM 0 HB2 LYS A 142 -0.036 -9.370 -3.199 1.00 40.21 H new ATOM 0 HB3 LYS A 142 1.687 -9.602 -3.415 1.00 40.21 H new ATOM 0 HG2 LYS A 142 1.110 -11.515 -5.030 1.00 4.32 H new ATOM 0 HG3 LYS A 142 -0.558 -10.986 -4.937 1.00 4.32 H new ATOM 0 HD2 LYS A 142 0.075 -8.762 -5.805 1.00 5.42 H new ATOM 0 HD3 LYS A 142 1.761 -9.238 -5.843 1.00 5.42 H new ATOM 0 HE2 LYS A 142 1.117 -11.144 -7.391 1.00 10.50 H new ATOM 0 HE3 LYS A 142 -0.510 -10.494 -7.439 1.00 10.50 H new ATOM 0 HZ1 LYS A 142 0.781 -9.765 -9.319 1.00 32.11 H new ATOM 0 HZ2 LYS A 142 0.369 -8.436 -8.346 1.00 32.11 H new ATOM 0 HZ3 LYS A 142 1.945 -9.066 -8.300 1.00 32.11 H new ATOM 2132 N PHE A 143 3.017 -11.610 -2.509 1.00 12.44 N ATOM 2133 CA PHE A 143 4.243 -12.222 -2.863 1.00 5.32 C ATOM 2134 C PHE A 143 4.414 -13.497 -2.048 1.00 31.44 C ATOM 2135 O PHE A 143 4.836 -14.530 -2.569 1.00 34.44 O ATOM 2136 CB PHE A 143 5.361 -11.219 -2.587 1.00 11.52 C ATOM 2137 CG PHE A 143 6.659 -11.537 -3.224 1.00 73.23 C ATOM 2138 CD1 PHE A 143 6.836 -11.265 -4.562 1.00 35.41 C ATOM 2139 CD2 PHE A 143 7.702 -12.084 -2.505 1.00 33.32 C ATOM 2140 CE1 PHE A 143 8.034 -11.534 -5.187 1.00 51.33 C ATOM 2141 CE2 PHE A 143 8.907 -12.356 -3.117 1.00 1.43 C ATOM 2142 CZ PHE A 143 9.075 -12.079 -4.461 1.00 72.21 C ATOM 0 H PHE A 143 3.133 -10.714 -2.036 1.00 12.44 H new ATOM 0 HA PHE A 143 4.267 -12.497 -3.917 1.00 5.32 H new ATOM 0 HB2 PHE A 143 5.038 -10.235 -2.927 1.00 11.52 H new ATOM 0 HB3 PHE A 143 5.509 -11.151 -1.509 1.00 11.52 H new ATOM 0 HD1 PHE A 143 6.024 -10.835 -5.130 1.00 35.41 H new ATOM 0 HD2 PHE A 143 7.573 -12.301 -1.455 1.00 33.32 H new ATOM 0 HE1 PHE A 143 8.158 -11.320 -6.238 1.00 51.33 H new ATOM 0 HE2 PHE A 143 9.718 -12.785 -2.548 1.00 1.43 H new ATOM 0 HZ PHE A 143 10.019 -12.288 -4.943 1.00 72.21 H new ATOM 2152 N ILE A 144 4.029 -13.436 -0.780 1.00 60.00 N ATOM 2153 CA ILE A 144 4.147 -14.585 0.082 1.00 64.24 C ATOM 2154 C ILE A 144 3.106 -15.629 -0.286 1.00 34.23 C ATOM 2155 O ILE A 144 3.406 -16.775 -0.299 1.00 62.21 O ATOM 2156 CB ILE A 144 3.998 -14.266 1.586 1.00 65.51 C ATOM 2157 CG1 ILE A 144 4.873 -13.072 1.997 1.00 32.20 C ATOM 2158 CG2 ILE A 144 4.419 -15.493 2.386 1.00 21.21 C ATOM 2159 CD1 ILE A 144 6.352 -13.244 1.736 1.00 41.12 C ATOM 0 H ILE A 144 3.636 -12.606 -0.336 1.00 60.00 H new ATOM 0 HA ILE A 144 5.160 -14.956 -0.074 1.00 64.24 H new ATOM 0 HB ILE A 144 2.958 -14.007 1.786 1.00 65.51 H new ATOM 0 HG12 ILE A 144 4.526 -12.186 1.465 1.00 32.20 H new ATOM 0 HG13 ILE A 144 4.727 -12.883 3.060 1.00 32.20 H new ATOM 0 HG21 ILE A 144 4.320 -15.284 3.451 1.00 21.21 H new ATOM 0 HG22 ILE A 144 3.782 -16.337 2.120 1.00 21.21 H new ATOM 0 HG23 ILE A 144 5.457 -15.737 2.159 1.00 21.21 H new ATOM 0 HD11 ILE A 144 6.885 -12.350 2.059 1.00 41.12 H new ATOM 0 HD12 ILE A 144 6.721 -14.107 2.290 1.00 41.12 H new ATOM 0 HD13 ILE A 144 6.518 -13.400 0.670 1.00 41.12 H new ATOM 2171 N GLU A 145 1.876 -15.207 -0.589 1.00 43.15 N ATOM 2172 CA GLU A 145 0.813 -16.145 -0.978 1.00 23.45 C ATOM 2173 C GLU A 145 1.203 -16.873 -2.248 1.00 41.15 C ATOM 2174 O GLU A 145 0.884 -18.053 -2.428 1.00 2.10 O ATOM 2175 CB GLU A 145 -0.534 -15.440 -1.176 1.00 21.13 C ATOM 2176 CG GLU A 145 -1.097 -14.760 0.066 1.00 41.33 C ATOM 2177 CD GLU A 145 -1.332 -15.701 1.221 1.00 2.40 C ATOM 2178 OE1 GLU A 145 -2.348 -16.415 1.222 1.00 70.32 O ATOM 2179 OE2 GLU A 145 -0.518 -15.722 2.159 1.00 33.52 O ATOM 0 H GLU A 145 1.590 -14.228 -0.574 1.00 43.15 H new ATOM 0 HA GLU A 145 0.695 -16.860 -0.164 1.00 23.45 H new ATOM 0 HB2 GLU A 145 -0.423 -14.693 -1.962 1.00 21.13 H new ATOM 0 HB3 GLU A 145 -1.260 -16.171 -1.532 1.00 21.13 H new ATOM 0 HG2 GLU A 145 -0.410 -13.976 0.383 1.00 41.33 H new ATOM 0 HG3 GLU A 145 -2.038 -14.274 -0.192 1.00 41.33 H new ATOM 2186 N THR A 146 1.911 -16.172 -3.112 1.00 51.12 N ATOM 2187 CA THR A 146 2.411 -16.761 -4.321 1.00 14.22 C ATOM 2188 C THR A 146 3.445 -17.844 -3.968 1.00 75.52 C ATOM 2189 O THR A 146 3.346 -18.980 -4.429 1.00 22.03 O ATOM 2190 CB THR A 146 3.046 -15.680 -5.227 1.00 54.43 C ATOM 2191 OG1 THR A 146 2.059 -14.669 -5.527 1.00 54.03 O ATOM 2192 CG2 THR A 146 3.556 -16.288 -6.528 1.00 24.34 C ATOM 0 H THR A 146 2.150 -15.188 -2.990 1.00 51.12 H new ATOM 0 HA THR A 146 1.586 -17.217 -4.868 1.00 14.22 H new ATOM 0 HB THR A 146 3.890 -15.238 -4.698 1.00 54.43 H new ATOM 0 HG1 THR A 146 1.967 -14.064 -4.762 1.00 54.03 H new ATOM 0 HG21 THR A 146 3.998 -15.506 -7.146 1.00 24.34 H new ATOM 0 HG22 THR A 146 4.309 -17.044 -6.306 1.00 24.34 H new ATOM 0 HG23 THR A 146 2.726 -16.749 -7.064 1.00 24.34 H new ATOM 2200 N PHE A 147 4.382 -17.506 -3.090 1.00 35.41 N ATOM 2201 CA PHE A 147 5.391 -18.460 -2.646 1.00 20.13 C ATOM 2202 C PHE A 147 4.837 -19.534 -1.760 1.00 63.41 C ATOM 2203 O PHE A 147 5.337 -20.656 -1.757 1.00 33.21 O ATOM 2204 CB PHE A 147 6.630 -17.795 -2.070 1.00 70.34 C ATOM 2205 CG PHE A 147 7.495 -17.244 -3.157 1.00 33.42 C ATOM 2206 CD1 PHE A 147 8.357 -18.087 -3.830 1.00 41.32 C ATOM 2207 CD2 PHE A 147 7.437 -15.918 -3.532 1.00 14.51 C ATOM 2208 CE1 PHE A 147 9.143 -17.629 -4.850 1.00 12.34 C ATOM 2209 CE2 PHE A 147 8.227 -15.447 -4.563 1.00 3.35 C ATOM 2210 CZ PHE A 147 9.083 -16.304 -5.223 1.00 12.03 C ATOM 0 H PHE A 147 4.464 -16.579 -2.672 1.00 35.41 H new ATOM 0 HA PHE A 147 5.726 -18.969 -3.550 1.00 20.13 H new ATOM 0 HB2 PHE A 147 6.336 -16.993 -1.393 1.00 70.34 H new ATOM 0 HB3 PHE A 147 7.195 -18.518 -1.482 1.00 70.34 H new ATOM 0 HD1 PHE A 147 8.411 -19.127 -3.545 1.00 41.32 H new ATOM 0 HD2 PHE A 147 6.770 -15.243 -3.016 1.00 14.51 H new ATOM 0 HE1 PHE A 147 9.811 -18.305 -5.363 1.00 12.34 H new ATOM 0 HE2 PHE A 147 8.174 -14.408 -4.852 1.00 3.35 H new ATOM 0 HZ PHE A 147 9.703 -15.938 -6.028 1.00 12.03 H new ATOM 2220 N LYS A 148 3.800 -19.196 -1.022 1.00 61.40 N ATOM 2221 CA LYS A 148 3.086 -20.128 -0.195 1.00 3.34 C ATOM 2222 C LYS A 148 2.626 -21.283 -1.090 1.00 52.24 C ATOM 2223 O LYS A 148 2.812 -22.457 -0.782 1.00 23.25 O ATOM 2224 CB LYS A 148 1.827 -19.459 0.380 1.00 52.11 C ATOM 2225 CG LYS A 148 1.023 -20.351 1.323 1.00 65.34 C ATOM 2226 CD LYS A 148 -0.316 -19.730 1.704 1.00 31.45 C ATOM 2227 CE LYS A 148 -1.239 -19.611 0.493 1.00 51.32 C ATOM 2228 NZ LYS A 148 -2.556 -19.055 0.849 1.00 71.31 N ATOM 0 H LYS A 148 3.428 -18.247 -0.984 1.00 61.40 H new ATOM 0 HA LYS A 148 3.728 -20.469 0.617 1.00 3.34 H new ATOM 0 HB2 LYS A 148 2.120 -18.555 0.914 1.00 52.11 H new ATOM 0 HB3 LYS A 148 1.185 -19.148 -0.444 1.00 52.11 H new ATOM 0 HG2 LYS A 148 0.851 -21.317 0.848 1.00 65.34 H new ATOM 0 HG3 LYS A 148 1.604 -20.539 2.226 1.00 65.34 H new ATOM 0 HD2 LYS A 148 -0.796 -20.338 2.471 1.00 31.45 H new ATOM 0 HD3 LYS A 148 -0.151 -18.743 2.136 1.00 31.45 H new ATOM 0 HE2 LYS A 148 -0.770 -18.976 -0.258 1.00 51.32 H new ATOM 0 HE3 LYS A 148 -1.372 -20.594 0.042 1.00 51.32 H new ATOM 0 HZ1 LYS A 148 -3.291 -19.499 0.262 1.00 71.31 H new ATOM 0 HZ2 LYS A 148 -2.753 -19.244 1.852 1.00 71.31 H new ATOM 0 HZ3 LYS A 148 -2.555 -18.028 0.684 1.00 71.31 H new ATOM 2242 N LYS A 149 2.080 -20.892 -2.244 1.00 62.01 N ATOM 2243 CA LYS A 149 1.535 -21.802 -3.228 1.00 13.40 C ATOM 2244 C LYS A 149 2.660 -22.565 -3.925 1.00 43.15 C ATOM 2245 O LYS A 149 2.505 -23.736 -4.283 1.00 33.42 O ATOM 2246 CB LYS A 149 0.719 -20.999 -4.249 1.00 51.12 C ATOM 2247 CG LYS A 149 0.026 -21.829 -5.322 1.00 24.53 C ATOM 2248 CD LYS A 149 -0.712 -20.944 -6.331 1.00 54.21 C ATOM 2249 CE LYS A 149 -1.798 -20.099 -5.671 1.00 41.43 C ATOM 2250 NZ LYS A 149 -2.509 -19.241 -6.645 1.00 21.43 N ATOM 0 H LYS A 149 2.008 -19.912 -2.517 1.00 62.01 H new ATOM 0 HA LYS A 149 0.888 -22.529 -2.736 1.00 13.40 H new ATOM 0 HB2 LYS A 149 -0.036 -20.422 -3.714 1.00 51.12 H new ATOM 0 HB3 LYS A 149 1.381 -20.283 -4.737 1.00 51.12 H new ATOM 0 HG2 LYS A 149 0.763 -22.439 -5.844 1.00 24.53 H new ATOM 0 HG3 LYS A 149 -0.680 -22.514 -4.853 1.00 24.53 H new ATOM 0 HD2 LYS A 149 0.003 -20.289 -6.829 1.00 54.21 H new ATOM 0 HD3 LYS A 149 -1.160 -21.571 -7.102 1.00 54.21 H new ATOM 0 HE2 LYS A 149 -2.515 -20.754 -5.176 1.00 41.43 H new ATOM 0 HE3 LYS A 149 -1.350 -19.474 -4.898 1.00 41.43 H new ATOM 0 HZ1 LYS A 149 -3.237 -18.686 -6.152 1.00 21.43 H new ATOM 0 HZ2 LYS A 149 -1.831 -18.597 -7.100 1.00 21.43 H new ATOM 0 HZ3 LYS A 149 -2.959 -19.837 -7.369 1.00 21.43 H new ATOM 2264 N ILE A 150 3.784 -21.899 -4.122 1.00 54.02 N ATOM 2265 CA ILE A 150 4.948 -22.519 -4.738 1.00 60.42 C ATOM 2266 C ILE A 150 5.527 -23.596 -3.815 1.00 10.41 C ATOM 2267 O ILE A 150 5.942 -24.654 -4.272 1.00 71.33 O ATOM 2268 CB ILE A 150 6.027 -21.462 -5.140 1.00 40.32 C ATOM 2269 CG1 ILE A 150 5.402 -20.475 -6.129 1.00 51.35 C ATOM 2270 CG2 ILE A 150 7.236 -22.143 -5.780 1.00 55.45 C ATOM 2271 CD1 ILE A 150 6.289 -19.322 -6.502 1.00 11.14 C ATOM 0 H ILE A 150 3.917 -20.922 -3.863 1.00 54.02 H new ATOM 0 HA ILE A 150 4.625 -22.999 -5.662 1.00 60.42 H new ATOM 0 HB ILE A 150 6.366 -20.935 -4.248 1.00 40.32 H new ATOM 0 HG12 ILE A 150 5.127 -21.014 -7.036 1.00 51.35 H new ATOM 0 HG13 ILE A 150 4.480 -20.084 -5.699 1.00 51.35 H new ATOM 0 HG21 ILE A 150 7.976 -21.390 -6.053 1.00 55.45 H new ATOM 0 HG22 ILE A 150 7.676 -22.844 -5.071 1.00 55.45 H new ATOM 0 HG23 ILE A 150 6.920 -22.681 -6.674 1.00 55.45 H new ATOM 0 HD11 ILE A 150 5.767 -18.674 -7.206 1.00 11.14 H new ATOM 0 HD12 ILE A 150 6.544 -18.755 -5.607 1.00 11.14 H new ATOM 0 HD13 ILE A 150 7.201 -19.699 -6.965 1.00 11.14 H new ATOM 2283 N MET A 151 5.503 -23.341 -2.513 1.00 30.30 N ATOM 2284 CA MET A 151 5.959 -24.334 -1.536 1.00 41.40 C ATOM 2285 C MET A 151 5.030 -25.543 -1.544 1.00 3.34 C ATOM 2286 O MET A 151 5.465 -26.680 -1.337 1.00 75.15 O ATOM 2287 CB MET A 151 6.054 -23.748 -0.121 1.00 5.25 C ATOM 2288 CG MET A 151 7.074 -22.629 0.040 1.00 42.31 C ATOM 2289 SD MET A 151 8.762 -23.142 -0.357 1.00 5.31 S ATOM 2290 CE MET A 151 9.648 -21.615 -0.040 1.00 41.30 C ATOM 0 H MET A 151 5.176 -22.464 -2.107 1.00 30.30 H new ATOM 0 HA MET A 151 6.962 -24.645 -1.828 1.00 41.40 H new ATOM 0 HB2 MET A 151 5.073 -23.370 0.167 1.00 5.25 H new ATOM 0 HB3 MET A 151 6.303 -24.550 0.573 1.00 5.25 H new ATOM 0 HG2 MET A 151 6.794 -21.795 -0.604 1.00 42.31 H new ATOM 0 HG3 MET A 151 7.044 -22.264 1.066 1.00 42.31 H new ATOM 0 HE1 MET A 151 10.710 -21.762 -0.238 1.00 41.30 H new ATOM 0 HE2 MET A 151 9.263 -20.829 -0.690 1.00 41.30 H new ATOM 0 HE3 MET A 151 9.511 -21.324 1.001 1.00 41.30 H new ATOM 2300 N GLU A 152 3.752 -25.302 -1.800 1.00 15.33 N ATOM 2301 CA GLU A 152 2.776 -26.378 -1.895 1.00 20.44 C ATOM 2302 C GLU A 152 2.973 -27.148 -3.196 1.00 41.01 C ATOM 2303 O GLU A 152 2.742 -28.353 -3.261 1.00 1.52 O ATOM 2304 CB GLU A 152 1.345 -25.844 -1.804 1.00 51.23 C ATOM 2305 CG GLU A 152 1.042 -25.096 -0.518 1.00 54.24 C ATOM 2306 CD GLU A 152 1.315 -25.921 0.714 1.00 74.42 C ATOM 2307 OE1 GLU A 152 0.436 -26.682 1.144 1.00 45.12 O ATOM 2308 OE2 GLU A 152 2.419 -25.822 1.270 1.00 73.23 O ATOM 0 H GLU A 152 3.366 -24.369 -1.946 1.00 15.33 H new ATOM 0 HA GLU A 152 2.933 -27.052 -1.053 1.00 20.44 H new ATOM 0 HB2 GLU A 152 1.162 -25.180 -2.649 1.00 51.23 H new ATOM 0 HB3 GLU A 152 0.651 -26.679 -1.898 1.00 51.23 H new ATOM 0 HG2 GLU A 152 1.642 -24.187 -0.482 1.00 54.24 H new ATOM 0 HG3 GLU A 152 -0.004 -24.788 -0.520 1.00 54.24 H new ATOM 2315 N CYS A 153 3.432 -26.442 -4.215 1.00 64.44 N ATOM 2316 CA CYS A 153 3.714 -27.029 -5.513 1.00 12.54 C ATOM 2317 C CYS A 153 4.927 -27.955 -5.410 1.00 61.51 C ATOM 2318 O CYS A 153 5.023 -28.955 -6.119 1.00 42.40 O ATOM 2319 CB CYS A 153 3.958 -25.916 -6.549 1.00 44.14 C ATOM 2320 SG CYS A 153 4.275 -26.485 -8.237 1.00 52.45 S ATOM 0 H CYS A 153 3.620 -25.441 -4.165 1.00 64.44 H new ATOM 0 HA CYS A 153 2.857 -27.619 -5.839 1.00 12.54 H new ATOM 0 HB2 CYS A 153 3.089 -25.258 -6.562 1.00 44.14 H new ATOM 0 HB3 CYS A 153 4.807 -25.316 -6.220 1.00 44.14 H new ATOM 0 HG CYS A 153 4.462 -25.459 -9.013 1.00 52.45 H new ATOM 2326 N LYS A 154 5.850 -27.613 -4.520 1.00 1.21 N ATOM 2327 CA LYS A 154 7.018 -28.447 -4.284 1.00 43.22 C ATOM 2328 C LYS A 154 6.601 -29.663 -3.476 1.00 65.42 C ATOM 2329 O LYS A 154 7.076 -30.766 -3.708 1.00 71.40 O ATOM 2330 CB LYS A 154 8.106 -27.669 -3.529 1.00 45.43 C ATOM 2331 CG LYS A 154 8.575 -26.391 -4.216 1.00 5.22 C ATOM 2332 CD LYS A 154 9.151 -26.654 -5.595 1.00 24.21 C ATOM 2333 CE LYS A 154 9.612 -25.361 -6.262 1.00 73.20 C ATOM 2334 NZ LYS A 154 10.710 -24.691 -5.516 1.00 33.24 N ATOM 0 H LYS A 154 5.812 -26.767 -3.952 1.00 1.21 H new ATOM 0 HA LYS A 154 7.430 -28.758 -5.244 1.00 43.22 H new ATOM 0 HB2 LYS A 154 7.729 -27.414 -2.538 1.00 45.43 H new ATOM 0 HB3 LYS A 154 8.966 -28.323 -3.384 1.00 45.43 H new ATOM 0 HG2 LYS A 154 7.737 -25.699 -4.301 1.00 5.22 H new ATOM 0 HG3 LYS A 154 9.329 -25.904 -3.597 1.00 5.22 H new ATOM 0 HD2 LYS A 154 9.992 -27.343 -5.514 1.00 24.21 H new ATOM 0 HD3 LYS A 154 8.400 -27.139 -6.218 1.00 24.21 H new ATOM 0 HE2 LYS A 154 9.947 -25.579 -7.276 1.00 73.20 H new ATOM 0 HE3 LYS A 154 8.766 -24.679 -6.346 1.00 73.20 H new ATOM 0 HZ1 LYS A 154 11.122 -23.939 -6.105 1.00 33.24 H new ATOM 0 HZ2 LYS A 154 10.332 -24.277 -4.640 1.00 33.24 H new ATOM 0 HZ3 LYS A 154 11.445 -25.388 -5.280 1.00 33.24 H new