USER MOD reduce.3.24.130724 H: found=0, std=0, add=1146, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 957 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 39 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 68 GLN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Set 2.1: A 25 ASN :FLIP amide:sc= 0 F(o=-0.87,f=0.5) USER MOD Set 2.2: A 31 SER OG : rot -76:sc= 0.5 USER MOD Set 3.1: A 5 LYS NZ :NH3+ -131:sc= 0.316 (180deg=-0.102) USER MOD Set 3.2: A 76 ASN : amide:sc= -0.0064 K(o=0.31,f=-2) USER MOD Set 3.3: A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc=-0.00636 USER MOD Single : A 10 TYR OH : rot 150:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 48:sc= 0.35 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 167:sc= 1.68 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 142:sc= 0.525 (180deg=-0.288!) USER MOD Single : A 20 MET CE :methyl 158:sc= -0.184 (180deg=-1.68) USER MOD Single : A 23 LYS NZ :NH3+ -162:sc= -0.127 (180deg=-0.657) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 111:sc= 0.16 USER MOD Single : A 47 MET CE :methyl 170:sc= -0.029 (180deg=-0.323) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 164:sc= 0.0122 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -0.0159 K(o=-0.016,f=-1.2) USER MOD Single : A 59 GLN :FLIP amide:sc= -1.56! C(o=-5!,f=-1.6!) USER MOD Single : A 61 ASN : amide:sc= -0.163 K(o=-0.16,f=-1.8!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN :FLIP amide:sc= -0.0336 F(o=-0.54,f=-0.034) USER MOD Single : A 74 TYR OH : rot 180:sc= -0.0364 USER MOD Single : A 75 ASN : amide:sc= 0.208 X(o=0.21,f=0) USER MOD Single : A 84 SER OG : rot 79:sc= 1.53 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot -33:sc= 0.568 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 153:sc= 1.27 USER MOD Single : A 101 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : A 102 MET CE :methyl 170:sc= -0.124 (180deg=-0.286) USER MOD Single : A 103 LYS NZ :NH3+ -161:sc= 0.352 (180deg=0.0373) USER MOD Single : A 104 ASN : amide:sc= -0.0406 X(o=-0.041,f=-0.46) USER MOD Single : A 105 TYR OH : rot -21:sc= 1.25 USER MOD Single : A 111 SER OG : rot 175:sc= 0.544 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 ASN : amide:sc= -0.167 X(o=-0.17,f=-0.16) USER MOD Single : A 120 HIS :FLIP no HD1:sc= -0.322 F(o=-1.2,f=-0.32) USER MOD Single : A 121 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0429) USER MOD Single : A 123 TYR OH : rot 31:sc= 0.886 USER MOD Single : A 125 SER OG : rot 83:sc= 0.118 USER MOD Single : A 126 HIS : no HE2:sc= -0.483 X(o=-0.48,f=-0.74) USER MOD Single : A 128 ASN : amide:sc= 0.828 K(o=0.83,f=0) USER MOD Single : A 135 ASN : amide:sc= 0.576 K(o=0.58,f=-0.048) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -171:sc= 1.27 (180deg=1.13) USER MOD Single : A 150 SER OG : rot 180:sc= -0.0379 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 33 N LYS A 4 -5.050 -17.365 -2.347 1.00 11.22 N ATOM 34 CA LYS A 4 -3.850 -17.061 -1.544 1.00 45.41 C ATOM 35 C LYS A 4 -2.889 -16.059 -2.188 1.00 70.31 C ATOM 36 O LYS A 4 -1.718 -15.967 -1.821 1.00 25.41 O ATOM 37 CB LYS A 4 -3.103 -18.332 -1.112 1.00 52.42 C ATOM 38 CG LYS A 4 -2.359 -19.122 -2.218 1.00 21.54 C ATOM 39 CD LYS A 4 -3.259 -19.948 -3.156 1.00 42.04 C ATOM 40 CE LYS A 4 -2.935 -19.763 -4.646 1.00 10.23 C ATOM 41 NZ LYS A 4 -1.802 -20.603 -5.075 1.00 1.34 N ATOM 0 HA LYS A 4 -4.242 -16.568 -0.654 1.00 45.41 H new ATOM 0 HB2 LYS A 4 -2.377 -18.055 -0.347 1.00 52.42 H new ATOM 0 HB3 LYS A 4 -3.821 -19.003 -0.641 1.00 52.42 H new ATOM 0 HG2 LYS A 4 -1.784 -18.418 -2.820 1.00 21.54 H new ATOM 0 HG3 LYS A 4 -1.644 -19.794 -1.743 1.00 21.54 H new ATOM 0 HD2 LYS A 4 -3.163 -21.003 -2.901 1.00 42.04 H new ATOM 0 HD3 LYS A 4 -4.299 -19.672 -2.983 1.00 42.04 H new ATOM 0 HE2 LYS A 4 -3.814 -20.009 -5.241 1.00 10.23 H new ATOM 0 HE3 LYS A 4 -2.703 -18.716 -4.839 1.00 10.23 H new ATOM 0 HZ1 LYS A 4 -1.618 -20.447 -6.087 1.00 1.34 H new ATOM 0 HZ2 LYS A 4 -0.956 -20.351 -4.526 1.00 1.34 H new ATOM 0 HZ3 LYS A 4 -2.033 -21.605 -4.916 1.00 1.34 H new ATOM 51 N LYS A 5 -3.353 -15.350 -3.203 1.00 50.13 N ATOM 52 CA LYS A 5 -2.517 -14.499 -4.051 1.00 12.42 C ATOM 53 C LYS A 5 -1.972 -13.301 -3.278 1.00 10.31 C ATOM 54 O LYS A 5 -2.478 -12.972 -2.205 1.00 14.13 O ATOM 55 CB LYS A 5 -3.361 -14.084 -5.261 1.00 45.21 C ATOM 56 CG LYS A 5 -3.061 -14.917 -6.498 1.00 44.15 C ATOM 57 CD LYS A 5 -1.990 -14.273 -7.387 1.00 45.25 C ATOM 58 CE LYS A 5 -2.320 -14.451 -8.876 1.00 44.04 C ATOM 59 NZ LYS A 5 -3.485 -13.641 -9.307 1.00 41.31 N ATOM 0 H LYS A 5 -4.337 -15.346 -3.470 1.00 50.13 H new ATOM 0 HA LYS A 5 -1.637 -15.045 -4.392 1.00 12.42 H new ATOM 0 HB2 LYS A 5 -4.418 -14.179 -5.012 1.00 45.21 H new ATOM 0 HB3 LYS A 5 -3.179 -13.032 -5.483 1.00 45.21 H new ATOM 0 HG2 LYS A 5 -2.729 -15.909 -6.193 1.00 44.15 H new ATOM 0 HG3 LYS A 5 -3.976 -15.050 -7.074 1.00 44.15 H new ATOM 0 HD2 LYS A 5 -1.911 -13.211 -7.154 1.00 45.25 H new ATOM 0 HD3 LYS A 5 -1.019 -14.719 -7.172 1.00 45.25 H new ATOM 0 HE2 LYS A 5 -1.450 -14.174 -9.472 1.00 44.04 H new ATOM 0 HE3 LYS A 5 -2.521 -15.504 -9.076 1.00 44.04 H new ATOM 0 HZ1 LYS A 5 -4.148 -14.241 -9.838 1.00 41.31 H new ATOM 0 HZ2 LYS A 5 -3.965 -13.251 -8.471 1.00 41.31 H new ATOM 0 HZ3 LYS A 5 -3.160 -12.862 -9.914 1.00 41.31 H new ATOM 69 N THR A 6 -0.997 -12.586 -3.839 1.00 44.13 N ATOM 70 CA THR A 6 -0.478 -11.371 -3.223 1.00 62.55 C ATOM 71 C THR A 6 -0.143 -10.346 -4.304 1.00 54.15 C ATOM 72 O THR A 6 0.455 -10.708 -5.319 1.00 2.11 O ATOM 73 CB THR A 6 0.728 -11.726 -2.337 1.00 5.11 C ATOM 74 OG1 THR A 6 0.341 -12.666 -1.351 1.00 2.42 O ATOM 75 CG2 THR A 6 1.342 -10.503 -1.651 1.00 21.14 C ATOM 0 H THR A 6 -0.551 -12.831 -4.723 1.00 44.13 H new ATOM 0 HA THR A 6 -1.230 -10.915 -2.579 1.00 62.55 H new ATOM 0 HB THR A 6 1.487 -12.149 -2.994 1.00 5.11 H new ATOM 0 HG1 THR A 6 1.114 -12.889 -0.791 1.00 2.42 H new ATOM 0 HG21 THR A 6 2.189 -10.816 -1.040 1.00 21.14 H new ATOM 0 HG22 THR A 6 1.682 -9.794 -2.406 1.00 21.14 H new ATOM 0 HG23 THR A 6 0.593 -10.027 -1.018 1.00 21.14 H new ATOM 83 N LEU A 7 -0.537 -9.089 -4.083 1.00 23.50 N ATOM 84 CA LEU A 7 -0.159 -7.926 -4.891 1.00 65.35 C ATOM 85 C LEU A 7 0.676 -6.962 -4.035 1.00 50.25 C ATOM 86 O LEU A 7 0.576 -6.953 -2.806 1.00 45.12 O ATOM 87 CB LEU A 7 -1.439 -7.276 -5.447 1.00 71.23 C ATOM 88 CG LEU A 7 -1.255 -6.132 -6.457 1.00 42.32 C ATOM 89 CD1 LEU A 7 -0.726 -6.579 -7.826 1.00 73.45 C ATOM 90 CD2 LEU A 7 -2.602 -5.433 -6.664 1.00 53.32 C ATOM 0 H LEU A 7 -1.152 -8.844 -3.307 1.00 23.50 H new ATOM 0 HA LEU A 7 0.460 -8.217 -5.739 1.00 65.35 H new ATOM 0 HB2 LEU A 7 -2.037 -8.055 -5.921 1.00 71.23 H new ATOM 0 HB3 LEU A 7 -2.020 -6.896 -4.606 1.00 71.23 H new ATOM 0 HG LEU A 7 -0.504 -5.467 -6.032 1.00 42.32 H new ATOM 0 HD11 LEU A 7 -0.625 -5.711 -8.478 1.00 73.45 H new ATOM 0 HD12 LEU A 7 0.247 -7.055 -7.702 1.00 73.45 H new ATOM 0 HD13 LEU A 7 -1.423 -7.289 -8.271 1.00 73.45 H new ATOM 0 HD21 LEU A 7 -2.483 -4.619 -7.379 1.00 53.32 H new ATOM 0 HD22 LEU A 7 -3.329 -6.150 -7.047 1.00 53.32 H new ATOM 0 HD23 LEU A 7 -2.954 -5.032 -5.713 1.00 53.32 H new ATOM 101 N ILE A 8 1.517 -6.170 -4.696 1.00 1.24 N ATOM 102 CA ILE A 8 2.558 -5.306 -4.151 1.00 2.00 C ATOM 103 C ILE A 8 2.464 -3.993 -4.941 1.00 25.40 C ATOM 104 O ILE A 8 2.763 -3.990 -6.137 1.00 72.25 O ATOM 105 CB ILE A 8 3.920 -6.022 -4.344 1.00 11.13 C ATOM 106 CG1 ILE A 8 3.971 -7.353 -3.557 1.00 70.35 C ATOM 107 CG2 ILE A 8 5.128 -5.150 -3.982 1.00 43.44 C ATOM 108 CD1 ILE A 8 5.288 -8.106 -3.740 1.00 61.34 C ATOM 0 H ILE A 8 1.483 -6.112 -5.714 1.00 1.24 H new ATOM 0 HA ILE A 8 2.449 -5.097 -3.087 1.00 2.00 H new ATOM 0 HB ILE A 8 3.990 -6.231 -5.411 1.00 11.13 H new ATOM 0 HG12 ILE A 8 3.821 -7.148 -2.497 1.00 70.35 H new ATOM 0 HG13 ILE A 8 3.147 -7.990 -3.878 1.00 70.35 H new ATOM 0 HG21 ILE A 8 6.046 -5.716 -4.141 1.00 43.44 H new ATOM 0 HG22 ILE A 8 5.136 -4.260 -4.612 1.00 43.44 H new ATOM 0 HG23 ILE A 8 5.062 -4.853 -2.935 1.00 43.44 H new ATOM 0 HD11 ILE A 8 5.262 -9.031 -3.163 1.00 61.34 H new ATOM 0 HD12 ILE A 8 5.430 -8.340 -4.795 1.00 61.34 H new ATOM 0 HD13 ILE A 8 6.114 -7.485 -3.392 1.00 61.34 H new ATOM 119 N LEU A 9 2.007 -2.902 -4.318 1.00 32.13 N ATOM 120 CA LEU A 9 1.657 -1.628 -4.951 1.00 73.53 C ATOM 121 C LEU A 9 2.307 -0.462 -4.213 1.00 64.55 C ATOM 122 O LEU A 9 1.715 0.066 -3.272 1.00 43.33 O ATOM 123 CB LEU A 9 0.133 -1.417 -4.904 1.00 23.24 C ATOM 124 CG LEU A 9 -0.733 -2.417 -5.663 1.00 62.45 C ATOM 125 CD1 LEU A 9 -2.196 -2.010 -5.477 1.00 34.42 C ATOM 126 CD2 LEU A 9 -0.340 -2.452 -7.138 1.00 54.34 C ATOM 0 H LEU A 9 1.864 -2.883 -3.308 1.00 32.13 H new ATOM 0 HA LEU A 9 2.011 -1.663 -5.981 1.00 73.53 H new ATOM 0 HB2 LEU A 9 -0.177 -1.426 -3.859 1.00 23.24 H new ATOM 0 HB3 LEU A 9 -0.082 -0.421 -5.292 1.00 23.24 H new ATOM 0 HG LEU A 9 -0.586 -3.425 -5.274 1.00 62.45 H new ATOM 0 HD11 LEU A 9 -2.839 -2.710 -6.011 1.00 34.42 H new ATOM 0 HD12 LEU A 9 -2.446 -2.025 -4.416 1.00 34.42 H new ATOM 0 HD13 LEU A 9 -2.347 -1.005 -5.872 1.00 34.42 H new ATOM 0 HD21 LEU A 9 -0.968 -3.171 -7.665 1.00 54.34 H new ATOM 0 HD22 LEU A 9 -0.476 -1.463 -7.574 1.00 54.34 H new ATOM 0 HD23 LEU A 9 0.705 -2.748 -7.229 1.00 54.34 H new ATOM 137 N TYR A 10 3.519 -0.049 -4.585 1.00 54.35 N ATOM 138 CA TYR A 10 4.252 0.957 -3.810 1.00 54.43 C ATOM 139 C TYR A 10 4.432 2.229 -4.645 1.00 64.42 C ATOM 140 O TYR A 10 4.789 2.151 -5.828 1.00 54.02 O ATOM 141 CB TYR A 10 5.589 0.380 -3.305 1.00 45.34 C ATOM 142 CG TYR A 10 5.575 -0.979 -2.604 1.00 11.30 C ATOM 143 CD1 TYR A 10 4.428 -1.489 -1.969 1.00 30.50 C ATOM 144 CD2 TYR A 10 6.763 -1.724 -2.528 1.00 72.34 C ATOM 145 CE1 TYR A 10 4.458 -2.700 -1.261 1.00 42.41 C ATOM 146 CE2 TYR A 10 6.806 -2.945 -1.826 1.00 51.32 C ATOM 147 CZ TYR A 10 5.658 -3.427 -1.166 1.00 14.01 C ATOM 148 OH TYR A 10 5.713 -4.585 -0.456 1.00 51.22 O ATOM 0 H TYR A 10 4.012 -0.391 -5.410 1.00 54.35 H new ATOM 0 HA TYR A 10 3.677 1.230 -2.925 1.00 54.43 H new ATOM 0 HB2 TYR A 10 6.263 0.306 -4.159 1.00 45.34 H new ATOM 0 HB3 TYR A 10 6.025 1.104 -2.617 1.00 45.34 H new ATOM 0 HD1 TYR A 10 3.503 -0.935 -2.028 1.00 30.50 H new ATOM 0 HD2 TYR A 10 7.655 -1.356 -3.014 1.00 72.34 H new ATOM 0 HE1 TYR A 10 3.561 -3.073 -0.790 1.00 42.41 H new ATOM 0 HE2 TYR A 10 7.723 -3.514 -1.794 1.00 51.32 H new ATOM 0 HH TYR A 10 6.386 -5.179 -0.850 1.00 51.22 H new ATOM 157 N TYR A 11 4.202 3.408 -4.059 1.00 51.42 N ATOM 158 CA TYR A 11 4.427 4.684 -4.727 1.00 70.03 C ATOM 159 C TYR A 11 5.904 5.040 -4.615 1.00 25.20 C ATOM 160 O TYR A 11 6.383 5.497 -3.574 1.00 45.55 O ATOM 161 CB TYR A 11 3.546 5.821 -4.200 1.00 10.12 C ATOM 162 CG TYR A 11 3.946 7.194 -4.738 1.00 10.20 C ATOM 163 CD1 TYR A 11 4.376 7.382 -6.073 1.00 11.41 C ATOM 164 CD2 TYR A 11 3.951 8.295 -3.869 1.00 34.32 C ATOM 165 CE1 TYR A 11 4.782 8.648 -6.530 1.00 11.12 C ATOM 166 CE2 TYR A 11 4.412 9.545 -4.302 1.00 50.25 C ATOM 167 CZ TYR A 11 4.784 9.743 -5.644 1.00 72.13 C ATOM 168 OH TYR A 11 5.100 10.992 -6.075 1.00 52.51 O ATOM 0 H TYR A 11 3.853 3.500 -3.105 1.00 51.42 H new ATOM 0 HA TYR A 11 4.141 4.564 -5.772 1.00 70.03 H new ATOM 0 HB2 TYR A 11 2.508 5.622 -4.468 1.00 10.12 H new ATOM 0 HB3 TYR A 11 3.597 5.836 -3.111 1.00 10.12 H new ATOM 0 HD1 TYR A 11 4.393 6.541 -6.750 1.00 11.41 H new ATOM 0 HD2 TYR A 11 3.596 8.178 -2.856 1.00 34.32 H new ATOM 0 HE1 TYR A 11 5.091 8.780 -7.556 1.00 11.12 H new ATOM 0 HE2 TYR A 11 4.482 10.363 -3.600 1.00 50.25 H new ATOM 0 HH TYR A 11 5.047 11.620 -5.325 1.00 52.51 H new ATOM 177 N SER A 12 6.622 4.805 -5.702 1.00 32.14 N ATOM 178 CA SER A 12 7.970 5.237 -6.002 1.00 42.31 C ATOM 179 C SER A 12 8.057 6.769 -6.032 1.00 45.12 C ATOM 180 O SER A 12 7.692 7.351 -7.052 1.00 5.52 O ATOM 181 CB SER A 12 8.282 4.617 -7.370 1.00 73.44 C ATOM 182 OG SER A 12 7.202 4.839 -8.271 1.00 74.12 O ATOM 0 H SER A 12 6.234 4.253 -6.467 1.00 32.14 H new ATOM 0 HA SER A 12 8.690 4.920 -5.247 1.00 42.31 H new ATOM 0 HB2 SER A 12 9.197 5.051 -7.774 1.00 73.44 H new ATOM 0 HB3 SER A 12 8.459 3.547 -7.260 1.00 73.44 H new ATOM 0 HG SER A 12 6.936 5.782 -8.237 1.00 74.12 H new ATOM 187 N TRP A 13 8.546 7.415 -4.960 1.00 74.31 N ATOM 188 CA TRP A 13 8.617 8.875 -4.831 1.00 74.41 C ATOM 189 C TRP A 13 9.418 9.495 -5.986 1.00 4.43 C ATOM 190 O TRP A 13 8.850 9.850 -7.014 1.00 71.23 O ATOM 191 CB TRP A 13 9.192 9.251 -3.450 1.00 24.30 C ATOM 192 CG TRP A 13 9.201 10.722 -3.122 1.00 2.42 C ATOM 193 CD1 TRP A 13 8.100 11.479 -2.912 1.00 42.41 C ATOM 194 CD2 TRP A 13 10.332 11.647 -2.983 1.00 31.10 C ATOM 195 NE1 TRP A 13 8.465 12.764 -2.578 1.00 43.12 N ATOM 196 CE2 TRP A 13 9.826 12.934 -2.626 1.00 72.45 C ATOM 197 CE3 TRP A 13 11.733 11.545 -3.137 1.00 61.11 C ATOM 198 CZ2 TRP A 13 10.654 14.047 -2.418 1.00 72.13 C ATOM 199 CZ3 TRP A 13 12.574 12.661 -2.949 1.00 44.35 C ATOM 200 CH2 TRP A 13 12.040 13.908 -2.582 1.00 63.34 C ATOM 0 H TRP A 13 8.910 6.924 -4.143 1.00 74.31 H new ATOM 0 HA TRP A 13 7.611 9.289 -4.897 1.00 74.41 H new ATOM 0 HB2 TRP A 13 8.617 8.731 -2.684 1.00 24.30 H new ATOM 0 HB3 TRP A 13 10.214 8.878 -3.389 1.00 24.30 H new ATOM 0 HD1 TRP A 13 7.082 11.127 -2.994 1.00 42.41 H new ATOM 0 HE1 TRP A 13 7.805 13.499 -2.326 1.00 43.12 H new ATOM 0 HE3 TRP A 13 12.168 10.593 -3.404 1.00 61.11 H new ATOM 0 HZ2 TRP A 13 10.230 14.999 -2.135 1.00 72.13 H new ATOM 0 HZ3 TRP A 13 13.640 12.556 -3.089 1.00 44.35 H new ATOM 0 HH2 TRP A 13 12.693 14.754 -2.427 1.00 63.34 H new ATOM 210 N SER A 14 10.743 9.554 -5.862 1.00 21.33 N ATOM 211 CA SER A 14 11.644 10.104 -6.873 1.00 2.33 C ATOM 212 C SER A 14 12.952 9.297 -6.914 1.00 22.23 C ATOM 213 O SER A 14 14.003 9.796 -7.315 1.00 72.02 O ATOM 214 CB SER A 14 11.829 11.608 -6.614 1.00 25.13 C ATOM 215 OG SER A 14 11.961 12.332 -7.822 1.00 45.54 O ATOM 0 H SER A 14 11.232 9.212 -5.035 1.00 21.33 H new ATOM 0 HA SER A 14 11.219 10.011 -7.872 1.00 2.33 H new ATOM 0 HB2 SER A 14 10.976 11.989 -6.052 1.00 25.13 H new ATOM 0 HB3 SER A 14 12.713 11.765 -5.996 1.00 25.13 H new ATOM 0 HG SER A 14 12.075 13.284 -7.622 1.00 45.54 H new ATOM 220 N GLY A 15 12.894 8.026 -6.512 1.00 53.53 N ATOM 221 CA GLY A 15 13.978 7.046 -6.548 1.00 4.32 C ATOM 222 C GLY A 15 14.104 6.282 -5.235 1.00 31.34 C ATOM 223 O GLY A 15 14.860 5.318 -5.174 1.00 70.11 O ATOM 0 H GLY A 15 12.035 7.630 -6.129 1.00 53.53 H new ATOM 0 HA2 GLY A 15 13.803 6.342 -7.361 1.00 4.32 H new ATOM 0 HA3 GLY A 15 14.918 7.554 -6.763 1.00 4.32 H new ATOM 227 N GLU A 16 13.382 6.705 -4.197 1.00 11.14 N ATOM 228 CA GLU A 16 13.412 6.105 -2.871 1.00 31.33 C ATOM 229 C GLU A 16 12.644 4.790 -2.893 1.00 74.45 C ATOM 230 O GLU A 16 13.242 3.720 -2.851 1.00 74.32 O ATOM 231 CB GLU A 16 12.823 7.079 -1.837 1.00 52.25 C ATOM 232 CG GLU A 16 13.696 8.349 -1.760 1.00 25.30 C ATOM 233 CD GLU A 16 13.455 9.269 -0.554 1.00 12.23 C ATOM 234 OE1 GLU A 16 13.088 8.778 0.538 1.00 74.21 O ATOM 235 OE2 GLU A 16 13.698 10.493 -0.695 1.00 2.14 O ATOM 0 H GLU A 16 12.743 7.498 -4.262 1.00 11.14 H new ATOM 0 HA GLU A 16 14.443 5.898 -2.584 1.00 31.33 H new ATOM 0 HB2 GLU A 16 11.803 7.344 -2.113 1.00 52.25 H new ATOM 0 HB3 GLU A 16 12.774 6.600 -0.859 1.00 52.25 H new ATOM 0 HG2 GLU A 16 14.743 8.045 -1.754 1.00 25.30 H new ATOM 0 HG3 GLU A 16 13.538 8.929 -2.669 1.00 25.30 H new ATOM 240 N THR A 17 11.319 4.848 -2.998 1.00 13.13 N ATOM 241 CA THR A 17 10.467 3.713 -2.690 1.00 53.33 C ATOM 242 C THR A 17 10.646 2.583 -3.714 1.00 54.15 C ATOM 243 O THR A 17 10.397 1.426 -3.393 1.00 31.54 O ATOM 244 CB THR A 17 9.007 4.183 -2.606 1.00 2.23 C ATOM 245 OG1 THR A 17 8.869 5.599 -2.585 1.00 44.25 O ATOM 246 CG2 THR A 17 8.270 3.585 -1.406 1.00 63.33 C ATOM 0 H THR A 17 10.812 5.681 -3.298 1.00 13.13 H new ATOM 0 HA THR A 17 10.757 3.301 -1.723 1.00 53.33 H new ATOM 0 HB THR A 17 8.549 3.815 -3.524 1.00 2.23 H new ATOM 0 HG1 THR A 17 7.931 5.839 -2.738 1.00 44.25 H new ATOM 0 HG21 THR A 17 7.242 3.948 -1.392 1.00 63.33 H new ATOM 0 HG22 THR A 17 8.269 2.498 -1.484 1.00 63.33 H new ATOM 0 HG23 THR A 17 8.772 3.882 -0.485 1.00 63.33 H new ATOM 254 N LYS A 18 11.174 2.893 -4.910 1.00 3.10 N ATOM 255 CA LYS A 18 11.596 1.902 -5.899 1.00 54.31 C ATOM 256 C LYS A 18 12.567 0.883 -5.293 1.00 52.05 C ATOM 257 O LYS A 18 12.509 -0.296 -5.651 1.00 62.11 O ATOM 258 CB LYS A 18 12.202 2.618 -7.124 1.00 50.25 C ATOM 259 CG LYS A 18 12.683 1.618 -8.194 1.00 21.30 C ATOM 260 CD LYS A 18 13.355 2.273 -9.401 1.00 65.34 C ATOM 261 CE LYS A 18 14.711 2.872 -9.004 1.00 25.44 C ATOM 262 NZ LYS A 18 15.632 2.970 -10.153 1.00 12.02 N ATOM 0 H LYS A 18 11.319 3.855 -5.216 1.00 3.10 H new ATOM 0 HA LYS A 18 10.723 1.338 -6.228 1.00 54.31 H new ATOM 0 HB2 LYS A 18 11.458 3.286 -7.559 1.00 50.25 H new ATOM 0 HB3 LYS A 18 13.039 3.239 -6.804 1.00 50.25 H new ATOM 0 HG2 LYS A 18 13.384 0.920 -7.735 1.00 21.30 H new ATOM 0 HG3 LYS A 18 11.830 1.033 -8.539 1.00 21.30 H new ATOM 0 HD2 LYS A 18 13.494 1.535 -10.191 1.00 65.34 H new ATOM 0 HD3 LYS A 18 12.710 3.054 -9.804 1.00 65.34 H new ATOM 0 HE2 LYS A 18 14.558 3.863 -8.577 1.00 25.44 H new ATOM 0 HE3 LYS A 18 15.165 2.257 -8.227 1.00 25.44 H new ATOM 0 HZ1 LYS A 18 16.535 3.380 -9.840 1.00 12.02 H new ATOM 0 HZ2 LYS A 18 15.799 2.022 -10.546 1.00 12.02 H new ATOM 0 HZ3 LYS A 18 15.211 3.578 -10.884 1.00 12.02 H new ATOM 272 N LYS A 19 13.469 1.315 -4.406 1.00 50.22 N ATOM 273 CA LYS A 19 14.386 0.407 -3.728 1.00 31.31 C ATOM 274 C LYS A 19 13.648 -0.478 -2.741 1.00 34.43 C ATOM 275 O LYS A 19 13.991 -1.648 -2.583 1.00 24.54 O ATOM 276 CB LYS A 19 15.483 1.206 -2.993 1.00 21.32 C ATOM 277 CG LYS A 19 16.808 1.092 -3.735 1.00 42.11 C ATOM 278 CD LYS A 19 17.397 -0.308 -3.541 1.00 25.40 C ATOM 279 CE LYS A 19 18.360 -0.609 -4.679 1.00 10.11 C ATOM 280 NZ LYS A 19 18.675 -2.041 -4.705 1.00 73.41 N ATOM 0 H LYS A 19 13.580 2.294 -4.143 1.00 50.22 H new ATOM 0 HA LYS A 19 14.848 -0.229 -4.483 1.00 31.31 H new ATOM 0 HB2 LYS A 19 15.190 2.253 -2.917 1.00 21.32 H new ATOM 0 HB3 LYS A 19 15.595 0.832 -1.975 1.00 21.32 H new ATOM 0 HG2 LYS A 19 16.658 1.289 -4.797 1.00 42.11 H new ATOM 0 HG3 LYS A 19 17.506 1.844 -3.367 1.00 42.11 H new ATOM 0 HD2 LYS A 19 17.916 -0.368 -2.584 1.00 25.40 H new ATOM 0 HD3 LYS A 19 16.600 -1.051 -3.518 1.00 25.40 H new ATOM 0 HE2 LYS A 19 17.918 -0.308 -5.629 1.00 10.11 H new ATOM 0 HE3 LYS A 19 19.275 -0.029 -4.555 1.00 10.11 H new ATOM 0 HZ1 LYS A 19 18.743 -2.364 -5.691 1.00 73.41 H new ATOM 0 HZ2 LYS A 19 19.582 -2.206 -4.224 1.00 73.41 H new ATOM 0 HZ3 LYS A 19 17.924 -2.571 -4.218 1.00 73.41 H new ATOM 290 N MET A 20 12.636 0.062 -2.076 1.00 54.31 N ATOM 291 CA MET A 20 11.853 -0.649 -1.087 1.00 10.44 C ATOM 292 C MET A 20 10.745 -1.466 -1.760 1.00 4.21 C ATOM 293 O MET A 20 9.648 -1.569 -1.224 1.00 33.51 O ATOM 294 CB MET A 20 11.332 0.372 -0.059 1.00 51.11 C ATOM 295 CG MET A 20 11.395 -0.216 1.354 1.00 5.12 C ATOM 296 SD MET A 20 13.058 -0.680 1.934 1.00 45.31 S ATOM 297 CE MET A 20 13.929 0.872 1.627 1.00 22.52 C ATOM 0 H MET A 20 12.334 1.026 -2.215 1.00 54.31 H new ATOM 0 HA MET A 20 12.464 -1.377 -0.554 1.00 10.44 H new ATOM 0 HB2 MET A 20 11.928 1.283 -0.108 1.00 51.11 H new ATOM 0 HB3 MET A 20 10.306 0.649 -0.299 1.00 51.11 H new ATOM 0 HG2 MET A 20 10.975 0.510 2.050 1.00 5.12 H new ATOM 0 HG3 MET A 20 10.757 -1.099 1.391 1.00 5.12 H new ATOM 0 HE1 MET A 20 14.819 0.920 2.255 1.00 22.52 H new ATOM 0 HE2 MET A 20 14.221 0.924 0.578 1.00 22.52 H new ATOM 0 HE3 MET A 20 13.273 1.710 1.863 1.00 22.52 H new ATOM 305 N ALA A 21 11.012 -2.026 -2.944 1.00 1.44 N ATOM 306 CA ALA A 21 10.031 -2.734 -3.746 1.00 23.52 C ATOM 307 C ALA A 21 10.592 -4.091 -4.147 1.00 65.55 C ATOM 308 O ALA A 21 10.079 -5.108 -3.689 1.00 44.13 O ATOM 309 CB ALA A 21 9.606 -1.846 -4.921 1.00 34.13 C ATOM 0 H ALA A 21 11.937 -1.995 -3.373 1.00 1.44 H new ATOM 0 HA ALA A 21 9.123 -2.942 -3.181 1.00 23.52 H new ATOM 0 HB1 ALA A 21 8.869 -2.373 -5.527 1.00 34.13 H new ATOM 0 HB2 ALA A 21 9.169 -0.923 -4.540 1.00 34.13 H new ATOM 0 HB3 ALA A 21 10.477 -1.610 -5.532 1.00 34.13 H new ATOM 315 N GLU A 22 11.684 -4.103 -4.916 1.00 25.52 N ATOM 316 CA GLU A 22 12.500 -5.292 -5.202 1.00 53.03 C ATOM 317 C GLU A 22 12.794 -6.077 -3.926 1.00 64.15 C ATOM 318 O GLU A 22 12.538 -7.277 -3.867 1.00 53.23 O ATOM 319 CB GLU A 22 13.842 -4.928 -5.888 1.00 70.52 C ATOM 320 CG GLU A 22 14.339 -3.516 -5.538 1.00 12.40 C ATOM 321 CD GLU A 22 15.870 -3.360 -5.502 1.00 74.42 C ATOM 322 OE1 GLU A 22 16.504 -3.809 -4.513 1.00 10.22 O ATOM 323 OE2 GLU A 22 16.497 -2.671 -6.339 1.00 53.05 O ATOM 0 H GLU A 22 12.038 -3.262 -5.372 1.00 25.52 H new ATOM 0 HA GLU A 22 11.915 -5.907 -5.886 1.00 53.03 H new ATOM 0 HB2 GLU A 22 14.600 -5.655 -5.597 1.00 70.52 H new ATOM 0 HB3 GLU A 22 13.723 -5.007 -6.969 1.00 70.52 H new ATOM 0 HG2 GLU A 22 13.933 -2.813 -6.265 1.00 12.40 H new ATOM 0 HG3 GLU A 22 13.936 -3.235 -4.565 1.00 12.40 H new ATOM 328 N LYS A 23 13.309 -5.388 -2.899 1.00 52.33 N ATOM 329 CA LYS A 23 13.708 -5.980 -1.628 1.00 53.25 C ATOM 330 C LYS A 23 12.570 -6.844 -1.075 1.00 23.20 C ATOM 331 O LYS A 23 12.705 -8.065 -0.985 1.00 22.10 O ATOM 332 CB LYS A 23 14.213 -4.857 -0.694 1.00 45.14 C ATOM 333 CG LYS A 23 14.810 -5.388 0.621 1.00 42.45 C ATOM 334 CD LYS A 23 15.978 -4.554 1.169 1.00 64.22 C ATOM 335 CE LYS A 23 15.546 -3.183 1.715 1.00 21.13 C ATOM 336 NZ LYS A 23 15.728 -3.080 3.180 1.00 13.34 N ATOM 0 H LYS A 23 13.461 -4.380 -2.936 1.00 52.33 H new ATOM 0 HA LYS A 23 14.544 -6.670 -1.741 1.00 53.25 H new ATOM 0 HB2 LYS A 23 14.967 -4.269 -1.217 1.00 45.14 H new ATOM 0 HB3 LYS A 23 13.387 -4.184 -0.465 1.00 45.14 H new ATOM 0 HG2 LYS A 23 14.023 -5.427 1.374 1.00 42.45 H new ATOM 0 HG3 LYS A 23 15.152 -6.411 0.464 1.00 42.45 H new ATOM 0 HD2 LYS A 23 16.473 -5.113 1.963 1.00 64.22 H new ATOM 0 HD3 LYS A 23 16.712 -4.406 0.377 1.00 64.22 H new ATOM 0 HE2 LYS A 23 16.123 -2.400 1.223 1.00 21.13 H new ATOM 0 HE3 LYS A 23 14.499 -3.009 1.468 1.00 21.13 H new ATOM 0 HZ1 LYS A 23 15.160 -2.289 3.546 1.00 13.34 H new ATOM 0 HZ2 LYS A 23 15.421 -3.965 3.631 1.00 13.34 H new ATOM 0 HZ3 LYS A 23 16.732 -2.913 3.394 1.00 13.34 H new ATOM 346 N ILE A 24 11.434 -6.205 -0.799 1.00 45.41 N ATOM 347 CA ILE A 24 10.243 -6.834 -0.246 1.00 25.42 C ATOM 348 C ILE A 24 9.716 -7.931 -1.176 1.00 34.23 C ATOM 349 O ILE A 24 9.326 -8.994 -0.702 1.00 23.43 O ATOM 350 CB ILE A 24 9.158 -5.772 0.068 1.00 1.13 C ATOM 351 CG1 ILE A 24 9.767 -4.444 0.593 1.00 73.43 C ATOM 352 CG2 ILE A 24 8.189 -6.388 1.088 1.00 13.01 C ATOM 353 CD1 ILE A 24 8.799 -3.529 1.356 1.00 44.42 C ATOM 0 H ILE A 24 11.317 -5.205 -0.960 1.00 45.41 H new ATOM 0 HA ILE A 24 10.514 -7.314 0.694 1.00 25.42 H new ATOM 0 HB ILE A 24 8.630 -5.508 -0.848 1.00 1.13 H new ATOM 0 HG12 ILE A 24 10.606 -4.683 1.247 1.00 73.43 H new ATOM 0 HG13 ILE A 24 10.171 -3.890 -0.254 1.00 73.43 H new ATOM 0 HG21 ILE A 24 7.410 -5.666 1.332 1.00 13.01 H new ATOM 0 HG22 ILE A 24 7.734 -7.283 0.663 1.00 13.01 H new ATOM 0 HG23 ILE A 24 8.734 -6.654 1.994 1.00 13.01 H new ATOM 0 HD11 ILE A 24 9.325 -2.630 1.678 1.00 44.42 H new ATOM 0 HD12 ILE A 24 7.971 -3.250 0.704 1.00 44.42 H new ATOM 0 HD13 ILE A 24 8.412 -4.055 2.229 1.00 44.42 H new ATOM 364 N ASN A 25 9.693 -7.706 -2.490 1.00 74.13 N ATOM 365 CA ASN A 25 9.142 -8.662 -3.443 1.00 10.01 C ATOM 366 C ASN A 25 9.855 -10.013 -3.387 1.00 3.22 C ATOM 367 O ASN A 25 9.195 -11.046 -3.501 1.00 24.21 O ATOM 368 CB ASN A 25 9.161 -8.075 -4.859 1.00 11.32 C ATOM 369 CG ASN A 25 8.731 -9.099 -5.900 1.00 74.22 C ATOM 370 OD1 ASN A 25 7.539 -9.651 -5.779 1.00 23.34 O flip ATOM 371 ND2 ASN A 25 9.470 -9.421 -6.825 1.00 22.31 N flip ATOM 0 H ASN A 25 10.056 -6.856 -2.921 1.00 74.13 H new ATOM 0 HA ASN A 25 8.106 -8.849 -3.161 1.00 10.01 H new ATOM 0 HB2 ASN A 25 8.498 -7.211 -4.903 1.00 11.32 H new ATOM 0 HB3 ASN A 25 10.165 -7.719 -5.092 1.00 11.32 H new ATOM 0 HD21 ASN A 25 10.391 -8.992 -6.915 1.00 22.31 H new ATOM 0 HD22 ASN A 25 9.163 -10.118 -7.504 1.00 22.31 H new ATOM 377 N SER A 26 11.169 -10.017 -3.167 1.00 51.34 N ATOM 378 CA SER A 26 11.953 -11.211 -2.977 1.00 73.15 C ATOM 379 C SER A 26 11.601 -11.935 -1.668 1.00 65.43 C ATOM 380 O SER A 26 11.596 -13.166 -1.647 1.00 51.23 O ATOM 381 CB SER A 26 13.421 -10.782 -2.998 1.00 31.53 C ATOM 382 OG SER A 26 14.020 -11.088 -4.243 1.00 44.04 O ATOM 0 H SER A 26 11.721 -9.161 -3.117 1.00 51.34 H new ATOM 0 HA SER A 26 11.743 -11.928 -3.771 1.00 73.15 H new ATOM 0 HB2 SER A 26 13.494 -9.711 -2.809 1.00 31.53 H new ATOM 0 HB3 SER A 26 13.962 -11.285 -2.196 1.00 31.53 H new ATOM 0 HG SER A 26 14.958 -10.803 -4.234 1.00 44.04 H new ATOM 387 N GLU A 27 11.303 -11.217 -0.580 1.00 52.14 N ATOM 388 CA GLU A 27 10.885 -11.842 0.677 1.00 63.54 C ATOM 389 C GLU A 27 9.505 -12.496 0.558 1.00 64.41 C ATOM 390 O GLU A 27 9.204 -13.421 1.317 1.00 64.41 O ATOM 391 CB GLU A 27 10.880 -10.806 1.819 1.00 13.30 C ATOM 392 CG GLU A 27 12.231 -10.661 2.524 1.00 21.42 C ATOM 393 CD GLU A 27 12.597 -11.878 3.375 1.00 50.43 C ATOM 394 OE1 GLU A 27 13.211 -12.831 2.838 1.00 22.32 O ATOM 395 OE2 GLU A 27 12.328 -11.867 4.595 1.00 43.05 O ATOM 0 H GLU A 27 11.344 -10.198 -0.546 1.00 52.14 H new ATOM 0 HA GLU A 27 11.607 -12.626 0.905 1.00 63.54 H new ATOM 0 HB2 GLU A 27 10.584 -9.837 1.417 1.00 13.30 H new ATOM 0 HB3 GLU A 27 10.126 -11.091 2.553 1.00 13.30 H new ATOM 0 HG2 GLU A 27 13.008 -10.500 1.777 1.00 21.42 H new ATOM 0 HG3 GLU A 27 12.210 -9.775 3.158 1.00 21.42 H new ATOM 400 N ILE A 28 8.654 -12.020 -0.351 1.00 25.14 N ATOM 401 CA ILE A 28 7.296 -12.522 -0.503 1.00 32.10 C ATOM 402 C ILE A 28 7.334 -13.794 -1.365 1.00 1.13 C ATOM 403 O ILE A 28 8.320 -14.126 -2.032 1.00 3.33 O ATOM 404 CB ILE A 28 6.374 -11.374 -1.005 1.00 53.05 C ATOM 405 CG1 ILE A 28 6.300 -10.274 0.089 1.00 41.14 C ATOM 406 CG2 ILE A 28 4.923 -11.799 -1.321 1.00 33.11 C ATOM 407 CD1 ILE A 28 5.857 -8.905 -0.434 1.00 23.43 C ATOM 0 H ILE A 28 8.892 -11.273 -1.003 1.00 25.14 H new ATOM 0 HA ILE A 28 6.853 -12.832 0.443 1.00 32.10 H new ATOM 0 HB ILE A 28 6.821 -11.028 -1.937 1.00 53.05 H new ATOM 0 HG12 ILE A 28 5.608 -10.596 0.867 1.00 41.14 H new ATOM 0 HG13 ILE A 28 7.280 -10.174 0.556 1.00 41.14 H new ATOM 0 HG21 ILE A 28 4.357 -10.933 -1.664 1.00 33.11 H new ATOM 0 HG22 ILE A 28 4.929 -12.561 -2.101 1.00 33.11 H new ATOM 0 HG23 ILE A 28 4.458 -12.204 -0.422 1.00 33.11 H new ATOM 0 HD11 ILE A 28 5.830 -8.192 0.390 1.00 23.43 H new ATOM 0 HD12 ILE A 28 6.561 -8.559 -1.191 1.00 23.43 H new ATOM 0 HD13 ILE A 28 4.863 -8.988 -0.874 1.00 23.43 H new ATOM 418 N LYS A 29 6.221 -14.523 -1.329 1.00 1.44 N ATOM 419 CA LYS A 29 5.851 -15.602 -2.234 1.00 2.33 C ATOM 420 C LYS A 29 5.825 -15.109 -3.688 1.00 73.53 C ATOM 421 O LYS A 29 6.073 -13.937 -3.982 1.00 70.32 O ATOM 422 CB LYS A 29 4.454 -16.068 -1.783 1.00 1.31 C ATOM 423 CG LYS A 29 4.061 -17.508 -2.152 1.00 22.52 C ATOM 424 CD LYS A 29 2.677 -17.623 -2.807 1.00 11.11 C ATOM 425 CE LYS A 29 1.553 -16.880 -2.069 1.00 23.32 C ATOM 426 NZ LYS A 29 1.366 -17.328 -0.669 1.00 41.23 N ATOM 0 H LYS A 29 5.508 -14.363 -0.618 1.00 1.44 H new ATOM 0 HA LYS A 29 6.572 -16.419 -2.199 1.00 2.33 H new ATOM 0 HB2 LYS A 29 4.393 -15.964 -0.700 1.00 1.31 H new ATOM 0 HB3 LYS A 29 3.714 -15.392 -2.211 1.00 1.31 H new ATOM 0 HG2 LYS A 29 4.809 -17.916 -2.831 1.00 22.52 H new ATOM 0 HG3 LYS A 29 4.079 -18.122 -1.251 1.00 22.52 H new ATOM 0 HD2 LYS A 29 2.739 -17.240 -3.826 1.00 11.11 H new ATOM 0 HD3 LYS A 29 2.411 -18.678 -2.879 1.00 11.11 H new ATOM 0 HE2 LYS A 29 1.770 -15.812 -2.074 1.00 23.32 H new ATOM 0 HE3 LYS A 29 0.619 -17.018 -2.614 1.00 23.32 H new ATOM 0 HZ1 LYS A 29 0.594 -16.786 -0.231 1.00 41.23 H new ATOM 0 HZ2 LYS A 29 1.129 -18.341 -0.657 1.00 41.23 H new ATOM 0 HZ3 LYS A 29 2.244 -17.172 -0.134 1.00 41.23 H new ATOM 436 N ASP A 30 5.397 -15.997 -4.588 1.00 24.44 N ATOM 437 CA ASP A 30 5.177 -15.833 -6.027 1.00 71.43 C ATOM 438 C ASP A 30 3.987 -14.908 -6.342 1.00 14.24 C ATOM 439 O ASP A 30 3.009 -15.275 -6.995 1.00 23.12 O ATOM 440 CB ASP A 30 5.003 -17.226 -6.648 1.00 11.42 C ATOM 441 CG ASP A 30 4.957 -17.209 -8.181 1.00 24.50 C ATOM 442 OD1 ASP A 30 5.435 -16.238 -8.811 1.00 32.53 O ATOM 443 OD2 ASP A 30 4.528 -18.235 -8.755 1.00 71.55 O ATOM 0 H ASP A 30 5.173 -16.948 -4.296 1.00 24.44 H new ATOM 0 HA ASP A 30 6.044 -15.340 -6.467 1.00 71.43 H new ATOM 0 HB2 ASP A 30 5.824 -17.865 -6.324 1.00 11.42 H new ATOM 0 HB3 ASP A 30 4.083 -17.672 -6.269 1.00 11.42 H new ATOM 447 N SER A 31 4.055 -13.714 -5.775 1.00 30.14 N ATOM 448 CA SER A 31 3.313 -12.486 -5.994 1.00 52.04 C ATOM 449 C SER A 31 3.508 -11.939 -7.427 1.00 50.34 C ATOM 450 O SER A 31 3.887 -12.664 -8.349 1.00 43.15 O ATOM 451 CB SER A 31 3.783 -11.513 -4.889 1.00 32.44 C ATOM 452 OG SER A 31 5.197 -11.369 -4.827 1.00 11.10 O ATOM 0 H SER A 31 4.741 -13.566 -5.035 1.00 30.14 H new ATOM 0 HA SER A 31 2.237 -12.643 -5.924 1.00 52.04 H new ATOM 0 HB2 SER A 31 3.333 -10.535 -5.061 1.00 32.44 H new ATOM 0 HB3 SER A 31 3.419 -11.867 -3.925 1.00 32.44 H new ATOM 0 HG SER A 31 5.588 -12.162 -4.404 1.00 11.10 H new ATOM 457 N GLU A 32 3.206 -10.658 -7.630 1.00 61.24 N ATOM 458 CA GLU A 32 3.634 -9.810 -8.732 1.00 23.51 C ATOM 459 C GLU A 32 4.250 -8.561 -8.087 1.00 63.55 C ATOM 460 O GLU A 32 4.101 -8.351 -6.878 1.00 42.05 O ATOM 461 CB GLU A 32 2.412 -9.385 -9.547 1.00 63.42 C ATOM 462 CG GLU A 32 1.873 -10.421 -10.529 1.00 4.00 C ATOM 463 CD GLU A 32 2.641 -10.552 -11.850 1.00 31.54 C ATOM 464 OE1 GLU A 32 3.693 -11.226 -11.903 1.00 71.53 O ATOM 465 OE2 GLU A 32 2.166 -9.990 -12.871 1.00 22.44 O ATOM 0 H GLU A 32 2.610 -10.151 -6.976 1.00 61.24 H new ATOM 0 HA GLU A 32 4.336 -10.326 -9.386 1.00 23.51 H new ATOM 0 HB2 GLU A 32 1.613 -9.118 -8.855 1.00 63.42 H new ATOM 0 HB3 GLU A 32 2.666 -8.483 -10.104 1.00 63.42 H new ATOM 0 HG2 GLU A 32 1.868 -11.393 -10.036 1.00 4.00 H new ATOM 0 HG3 GLU A 32 0.836 -10.173 -10.756 1.00 4.00 H new ATOM 470 N LEU A 33 4.806 -7.651 -8.886 1.00 32.20 N ATOM 471 CA LEU A 33 5.391 -6.374 -8.447 1.00 14.44 C ATOM 472 C LEU A 33 4.778 -5.259 -9.297 1.00 45.11 C ATOM 473 O LEU A 33 4.850 -5.328 -10.521 1.00 23.43 O ATOM 474 CB LEU A 33 6.942 -6.405 -8.548 1.00 44.23 C ATOM 475 CG LEU A 33 7.700 -5.738 -7.381 1.00 25.13 C ATOM 476 CD1 LEU A 33 9.224 -5.653 -7.620 1.00 22.12 C ATOM 477 CD2 LEU A 33 7.232 -4.330 -7.022 1.00 44.01 C ATOM 0 H LEU A 33 4.866 -7.783 -9.896 1.00 32.20 H new ATOM 0 HA LEU A 33 5.163 -6.192 -7.397 1.00 14.44 H new ATOM 0 HB2 LEU A 33 7.263 -7.444 -8.619 1.00 44.23 H new ATOM 0 HB3 LEU A 33 7.238 -5.916 -9.476 1.00 44.23 H new ATOM 0 HG LEU A 33 7.469 -6.407 -6.552 1.00 25.13 H new ATOM 0 HD11 LEU A 33 9.700 -5.174 -6.764 1.00 22.12 H new ATOM 0 HD12 LEU A 33 9.629 -6.657 -7.746 1.00 22.12 H new ATOM 0 HD13 LEU A 33 9.419 -5.067 -8.518 1.00 22.12 H new ATOM 0 HD21 LEU A 33 7.827 -3.950 -6.191 1.00 44.01 H new ATOM 0 HD22 LEU A 33 7.353 -3.675 -7.885 1.00 44.01 H new ATOM 0 HD23 LEU A 33 6.181 -4.358 -6.733 1.00 44.01 H new ATOM 488 N LYS A 34 4.122 -4.258 -8.686 1.00 73.21 N ATOM 489 CA LYS A 34 3.481 -3.148 -9.390 1.00 34.44 C ATOM 490 C LYS A 34 3.780 -1.840 -8.652 1.00 71.41 C ATOM 491 O LYS A 34 4.318 -1.852 -7.540 1.00 21.20 O ATOM 492 CB LYS A 34 1.976 -3.438 -9.548 1.00 62.52 C ATOM 493 CG LYS A 34 1.711 -4.103 -10.902 1.00 52.03 C ATOM 494 CD LYS A 34 0.258 -4.563 -11.073 1.00 71.54 C ATOM 495 CE LYS A 34 -0.058 -4.722 -12.564 1.00 52.25 C ATOM 496 NZ LYS A 34 -1.080 -5.754 -12.825 1.00 43.14 N ATOM 0 H LYS A 34 4.024 -4.202 -7.672 1.00 73.21 H new ATOM 0 HA LYS A 34 3.883 -3.039 -10.397 1.00 34.44 H new ATOM 0 HB2 LYS A 34 1.636 -4.088 -8.742 1.00 62.52 H new ATOM 0 HB3 LYS A 34 1.408 -2.511 -9.472 1.00 62.52 H new ATOM 0 HG2 LYS A 34 1.960 -3.402 -11.699 1.00 52.03 H new ATOM 0 HG3 LYS A 34 2.373 -4.962 -11.014 1.00 52.03 H new ATOM 0 HD2 LYS A 34 0.102 -5.509 -10.555 1.00 71.54 H new ATOM 0 HD3 LYS A 34 -0.419 -3.837 -10.623 1.00 71.54 H new ATOM 0 HE2 LYS A 34 -0.402 -3.767 -12.962 1.00 52.25 H new ATOM 0 HE3 LYS A 34 0.856 -4.979 -13.099 1.00 52.25 H new ATOM 0 HZ1 LYS A 34 -1.254 -5.819 -13.848 1.00 43.14 H new ATOM 0 HZ2 LYS A 34 -0.744 -6.673 -12.472 1.00 43.14 H new ATOM 0 HZ3 LYS A 34 -1.963 -5.499 -12.339 1.00 43.14 H new ATOM 506 N GLU A 35 3.452 -0.695 -9.251 1.00 54.21 N ATOM 507 CA GLU A 35 3.715 0.629 -8.689 1.00 51.21 C ATOM 508 C GLU A 35 2.500 1.529 -8.917 1.00 31.24 C ATOM 509 O GLU A 35 1.682 1.267 -9.804 1.00 41.45 O ATOM 510 CB GLU A 35 5.000 1.229 -9.302 1.00 53.14 C ATOM 511 CG GLU A 35 4.775 1.868 -10.685 1.00 25.12 C ATOM 512 CD GLU A 35 6.042 1.920 -11.537 1.00 33.12 C ATOM 513 OE1 GLU A 35 6.412 0.863 -12.108 1.00 44.22 O ATOM 514 OE2 GLU A 35 6.601 3.017 -11.751 1.00 25.14 O ATOM 0 H GLU A 35 2.987 -0.662 -10.158 1.00 54.21 H new ATOM 0 HA GLU A 35 3.880 0.547 -7.615 1.00 51.21 H new ATOM 0 HB2 GLU A 35 5.401 1.981 -8.623 1.00 53.14 H new ATOM 0 HB3 GLU A 35 5.752 0.445 -9.390 1.00 53.14 H new ATOM 0 HG2 GLU A 35 4.009 1.305 -11.218 1.00 25.12 H new ATOM 0 HG3 GLU A 35 4.392 2.880 -10.553 1.00 25.12 H new ATOM 519 N VAL A 36 2.408 2.621 -8.158 1.00 65.55 N ATOM 520 CA VAL A 36 1.303 3.572 -8.235 1.00 23.32 C ATOM 521 C VAL A 36 1.912 4.969 -8.316 1.00 31.11 C ATOM 522 O VAL A 36 2.226 5.548 -7.277 1.00 1.23 O ATOM 523 CB VAL A 36 0.362 3.409 -7.023 1.00 41.41 C ATOM 524 CG1 VAL A 36 -0.922 4.218 -7.264 1.00 63.23 C ATOM 525 CG2 VAL A 36 0.034 1.935 -6.736 1.00 5.01 C ATOM 0 H VAL A 36 3.111 2.872 -7.462 1.00 65.55 H new ATOM 0 HA VAL A 36 0.689 3.394 -9.118 1.00 23.32 H new ATOM 0 HB VAL A 36 0.875 3.791 -6.140 1.00 41.41 H new ATOM 0 HG11 VAL A 36 -1.589 4.105 -6.409 1.00 63.23 H new ATOM 0 HG12 VAL A 36 -0.670 5.271 -7.391 1.00 63.23 H new ATOM 0 HG13 VAL A 36 -1.419 3.853 -8.163 1.00 63.23 H new ATOM 0 HG21 VAL A 36 -0.631 1.871 -5.875 1.00 5.01 H new ATOM 0 HG22 VAL A 36 -0.455 1.495 -7.605 1.00 5.01 H new ATOM 0 HG23 VAL A 36 0.955 1.392 -6.524 1.00 5.01 H new ATOM 535 N LYS A 37 2.145 5.500 -9.521 1.00 11.10 N ATOM 536 CA LYS A 37 2.582 6.896 -9.642 1.00 14.20 C ATOM 537 C LYS A 37 1.360 7.820 -9.683 1.00 31.43 C ATOM 538 O LYS A 37 0.239 7.372 -9.940 1.00 21.00 O ATOM 539 CB LYS A 37 3.581 7.107 -10.797 1.00 62.35 C ATOM 540 CG LYS A 37 3.007 6.876 -12.202 1.00 12.12 C ATOM 541 CD LYS A 37 3.407 5.546 -12.862 1.00 23.50 C ATOM 542 CE LYS A 37 4.740 5.671 -13.613 1.00 32.32 C ATOM 543 NZ LYS A 37 4.922 4.586 -14.601 1.00 24.33 N ATOM 0 H LYS A 37 2.042 5.001 -10.405 1.00 11.10 H new ATOM 0 HA LYS A 37 3.154 7.166 -8.754 1.00 14.20 H new ATOM 0 HB2 LYS A 37 3.967 8.125 -10.742 1.00 62.35 H new ATOM 0 HB3 LYS A 37 4.428 6.436 -10.652 1.00 62.35 H new ATOM 0 HG2 LYS A 37 1.919 6.922 -12.145 1.00 12.12 H new ATOM 0 HG3 LYS A 37 3.327 7.694 -12.847 1.00 12.12 H new ATOM 0 HD2 LYS A 37 3.488 4.770 -12.101 1.00 23.50 H new ATOM 0 HD3 LYS A 37 2.626 5.232 -13.554 1.00 23.50 H new ATOM 0 HE2 LYS A 37 4.781 6.635 -14.121 1.00 32.32 H new ATOM 0 HE3 LYS A 37 5.562 5.652 -12.898 1.00 32.32 H new ATOM 0 HZ1 LYS A 37 5.834 4.707 -15.086 1.00 24.33 H new ATOM 0 HZ2 LYS A 37 4.908 3.667 -14.114 1.00 24.33 H new ATOM 0 HZ3 LYS A 37 4.152 4.619 -15.299 1.00 24.33 H new ATOM 553 N VAL A 38 1.594 9.107 -9.444 1.00 32.33 N ATOM 554 CA VAL A 38 0.610 10.177 -9.473 1.00 42.24 C ATOM 555 C VAL A 38 0.690 10.871 -10.835 1.00 72.21 C ATOM 556 O VAL A 38 1.549 10.518 -11.649 1.00 42.55 O ATOM 557 CB VAL A 38 0.864 11.142 -8.293 1.00 63.13 C ATOM 558 CG1 VAL A 38 0.526 10.486 -6.949 1.00 12.34 C ATOM 559 CG2 VAL A 38 2.314 11.651 -8.203 1.00 41.15 C ATOM 0 H VAL A 38 2.527 9.447 -9.212 1.00 32.33 H new ATOM 0 HA VAL A 38 -0.402 9.790 -9.353 1.00 42.24 H new ATOM 0 HB VAL A 38 0.209 11.990 -8.494 1.00 63.13 H new ATOM 0 HG11 VAL A 38 0.716 11.193 -6.141 1.00 12.34 H new ATOM 0 HG12 VAL A 38 -0.525 10.198 -6.939 1.00 12.34 H new ATOM 0 HG13 VAL A 38 1.146 9.601 -6.810 1.00 12.34 H new ATOM 0 HG21 VAL A 38 2.412 12.322 -7.350 1.00 41.15 H new ATOM 0 HG22 VAL A 38 2.990 10.805 -8.078 1.00 41.15 H new ATOM 0 HG23 VAL A 38 2.569 12.187 -9.117 1.00 41.15 H new ATOM 569 N SER A 39 -0.166 11.861 -11.081 1.00 1.11 N ATOM 570 CA SER A 39 -0.071 12.777 -12.191 1.00 4.22 C ATOM 571 C SER A 39 1.209 13.618 -12.053 1.00 31.14 C ATOM 572 O SER A 39 1.978 13.484 -11.102 1.00 25.44 O ATOM 573 CB SER A 39 -1.321 13.672 -12.107 1.00 32.34 C ATOM 574 OG SER A 39 -2.316 13.323 -13.050 1.00 50.53 O ATOM 0 H SER A 39 -0.972 12.045 -10.483 1.00 1.11 H new ATOM 0 HA SER A 39 -0.023 12.260 -13.149 1.00 4.22 H new ATOM 0 HB2 SER A 39 -1.741 13.607 -11.103 1.00 32.34 H new ATOM 0 HB3 SER A 39 -1.029 14.710 -12.263 1.00 32.34 H new ATOM 0 HG SER A 39 -3.086 13.922 -12.950 1.00 50.53 H new ATOM 579 N GLU A 40 1.433 14.525 -12.990 1.00 4.52 N ATOM 580 CA GLU A 40 2.390 15.595 -12.877 1.00 41.41 C ATOM 581 C GLU A 40 1.755 16.735 -12.061 1.00 34.02 C ATOM 582 O GLU A 40 0.543 16.747 -11.820 1.00 32.41 O ATOM 583 CB GLU A 40 2.690 15.969 -14.327 1.00 34.00 C ATOM 584 CG GLU A 40 3.536 17.215 -14.471 1.00 11.20 C ATOM 585 CD GLU A 40 4.052 17.374 -15.895 1.00 70.21 C ATOM 586 OE1 GLU A 40 3.250 17.602 -16.830 1.00 64.11 O ATOM 587 OE2 GLU A 40 5.277 17.238 -16.103 1.00 63.44 O ATOM 0 H GLU A 40 0.932 14.530 -13.878 1.00 4.52 H new ATOM 0 HA GLU A 40 3.313 15.341 -12.356 1.00 41.41 H new ATOM 0 HB2 GLU A 40 3.201 15.136 -14.810 1.00 34.00 H new ATOM 0 HB3 GLU A 40 1.749 16.116 -14.857 1.00 34.00 H new ATOM 0 HG2 GLU A 40 2.947 18.090 -14.196 1.00 11.20 H new ATOM 0 HG3 GLU A 40 4.378 17.167 -13.780 1.00 11.20 H new ATOM 592 N GLY A 41 2.561 17.696 -11.616 1.00 51.11 N ATOM 593 CA GLY A 41 2.104 18.914 -10.968 1.00 73.03 C ATOM 594 C GLY A 41 1.786 18.722 -9.491 1.00 51.14 C ATOM 595 O GLY A 41 1.414 19.689 -8.822 1.00 64.15 O ATOM 0 H GLY A 41 3.576 17.644 -11.700 1.00 51.11 H new ATOM 0 HA2 GLY A 41 2.870 19.683 -11.072 1.00 73.03 H new ATOM 0 HA3 GLY A 41 1.214 19.279 -11.481 1.00 73.03 H new ATOM 599 N THR A 42 1.889 17.500 -8.971 1.00 1.31 N ATOM 600 CA THR A 42 1.389 17.124 -7.662 1.00 13.44 C ATOM 601 C THR A 42 2.174 17.809 -6.543 1.00 61.02 C ATOM 602 O THR A 42 1.563 18.402 -5.657 1.00 52.23 O ATOM 603 CB THR A 42 1.404 15.589 -7.559 1.00 32.30 C ATOM 604 OG1 THR A 42 1.025 15.007 -8.794 1.00 1.11 O ATOM 605 CG2 THR A 42 0.394 15.102 -6.532 1.00 72.32 C ATOM 0 H THR A 42 2.335 16.728 -9.466 1.00 1.31 H new ATOM 0 HA THR A 42 0.362 17.468 -7.540 1.00 13.44 H new ATOM 0 HB THR A 42 2.417 15.302 -7.276 1.00 32.30 H new ATOM 0 HG1 THR A 42 1.800 14.564 -9.198 1.00 1.11 H new ATOM 0 HG21 THR A 42 0.425 14.014 -6.479 1.00 72.32 H new ATOM 0 HG22 THR A 42 0.638 15.520 -5.555 1.00 72.32 H new ATOM 0 HG23 THR A 42 -0.606 15.423 -6.825 1.00 72.32 H new ATOM 613 N PHE A 43 3.507 17.741 -6.587 1.00 42.35 N ATOM 614 CA PHE A 43 4.434 18.341 -5.629 1.00 64.33 C ATOM 615 C PHE A 43 5.738 18.666 -6.375 1.00 2.43 C ATOM 616 O PHE A 43 5.808 18.485 -7.592 1.00 12.12 O ATOM 617 CB PHE A 43 4.673 17.383 -4.447 1.00 3.34 C ATOM 618 CG PHE A 43 3.461 17.182 -3.554 1.00 14.12 C ATOM 619 CD1 PHE A 43 3.091 18.178 -2.630 1.00 43.22 C ATOM 620 CD2 PHE A 43 2.656 16.035 -3.693 1.00 1.12 C ATOM 621 CE1 PHE A 43 1.932 18.032 -1.854 1.00 65.45 C ATOM 622 CE2 PHE A 43 1.475 15.906 -2.937 1.00 30.00 C ATOM 623 CZ PHE A 43 1.120 16.897 -2.007 1.00 42.43 C ATOM 0 H PHE A 43 3.992 17.240 -7.331 1.00 42.35 H new ATOM 0 HA PHE A 43 4.021 19.259 -5.212 1.00 64.33 H new ATOM 0 HB2 PHE A 43 4.988 16.415 -4.836 1.00 3.34 H new ATOM 0 HB3 PHE A 43 5.496 17.767 -3.843 1.00 3.34 H new ATOM 0 HD1 PHE A 43 3.704 19.060 -2.518 1.00 43.22 H new ATOM 0 HD2 PHE A 43 2.945 15.253 -4.380 1.00 1.12 H new ATOM 0 HE1 PHE A 43 1.664 18.794 -1.137 1.00 65.45 H new ATOM 0 HE2 PHE A 43 0.840 15.043 -3.073 1.00 30.00 H new ATOM 0 HZ PHE A 43 0.226 16.786 -1.412 1.00 42.43 H new ATOM 632 N ASP A 44 6.756 19.196 -5.689 1.00 54.21 N ATOM 633 CA ASP A 44 7.983 19.699 -6.339 1.00 65.32 C ATOM 634 C ASP A 44 9.240 19.400 -5.530 1.00 61.01 C ATOM 635 O ASP A 44 10.233 20.124 -5.593 1.00 52.41 O ATOM 636 CB ASP A 44 7.853 21.200 -6.588 1.00 12.54 C ATOM 637 CG ASP A 44 8.732 21.680 -7.745 1.00 23.20 C ATOM 638 OD1 ASP A 44 8.645 21.098 -8.850 1.00 70.14 O ATOM 639 OD2 ASP A 44 9.487 22.658 -7.557 1.00 45.20 O ATOM 0 H ASP A 44 6.759 19.291 -4.673 1.00 54.21 H new ATOM 0 HA ASP A 44 8.090 19.175 -7.288 1.00 65.32 H new ATOM 0 HB2 ASP A 44 6.812 21.441 -6.803 1.00 12.54 H new ATOM 0 HB3 ASP A 44 8.124 21.740 -5.681 1.00 12.54 H new ATOM 643 N ALA A 45 9.144 18.357 -4.706 1.00 71.13 N ATOM 644 CA ALA A 45 10.178 17.876 -3.777 1.00 23.04 C ATOM 645 C ALA A 45 10.763 18.994 -2.895 1.00 3.13 C ATOM 646 O ALA A 45 11.931 18.951 -2.494 1.00 42.24 O ATOM 647 CB ALA A 45 11.261 17.132 -4.564 1.00 11.31 C ATOM 0 H ALA A 45 8.297 17.790 -4.663 1.00 71.13 H new ATOM 0 HA ALA A 45 9.709 17.183 -3.078 1.00 23.04 H new ATOM 0 HB1 ALA A 45 12.029 16.774 -3.878 1.00 11.31 H new ATOM 0 HB2 ALA A 45 10.815 16.284 -5.084 1.00 11.31 H new ATOM 0 HB3 ALA A 45 11.711 17.808 -5.292 1.00 11.31 H new ATOM 653 N ASP A 46 9.967 20.034 -2.646 1.00 74.32 N ATOM 654 CA ASP A 46 10.382 21.266 -2.022 1.00 41.21 C ATOM 655 C ASP A 46 10.372 21.135 -0.494 1.00 11.51 C ATOM 656 O ASP A 46 10.364 20.032 0.069 1.00 64.04 O ATOM 657 CB ASP A 46 9.455 22.368 -2.545 1.00 3.21 C ATOM 658 CG ASP A 46 10.155 23.711 -2.471 1.00 33.13 C ATOM 659 OD1 ASP A 46 10.990 23.967 -3.364 1.00 2.23 O ATOM 660 OD2 ASP A 46 9.884 24.433 -1.490 1.00 34.31 O ATOM 0 H ASP A 46 8.976 20.029 -2.888 1.00 74.32 H new ATOM 0 HA ASP A 46 11.411 21.518 -2.276 1.00 41.21 H new ATOM 0 HB2 ASP A 46 9.167 22.155 -3.574 1.00 3.21 H new ATOM 0 HB3 ASP A 46 8.538 22.393 -1.956 1.00 3.21 H new ATOM 664 N MET A 47 10.390 22.265 0.198 1.00 44.54 N ATOM 665 CA MET A 47 10.288 22.412 1.627 1.00 63.41 C ATOM 666 C MET A 47 9.143 23.372 1.935 1.00 53.51 C ATOM 667 O MET A 47 8.306 23.070 2.787 1.00 1.31 O ATOM 668 CB MET A 47 11.645 22.931 2.105 1.00 14.23 C ATOM 669 CG MET A 47 11.646 23.310 3.578 1.00 21.23 C ATOM 670 SD MET A 47 13.300 23.578 4.267 1.00 21.24 S ATOM 671 CE MET A 47 13.960 24.784 3.084 1.00 23.24 C ATOM 0 H MET A 47 10.484 23.167 -0.269 1.00 44.54 H new ATOM 0 HA MET A 47 10.064 21.478 2.142 1.00 63.41 H new ATOM 0 HB2 MET A 47 12.403 22.167 1.931 1.00 14.23 H new ATOM 0 HB3 MET A 47 11.926 23.800 1.511 1.00 14.23 H new ATOM 0 HG2 MET A 47 11.057 24.218 3.710 1.00 21.23 H new ATOM 0 HG3 MET A 47 11.150 22.523 4.146 1.00 21.23 H new ATOM 0 HE1 MET A 47 14.900 25.186 3.461 1.00 23.24 H new ATOM 0 HE2 MET A 47 14.133 24.296 2.125 1.00 23.24 H new ATOM 0 HE3 MET A 47 13.244 25.596 2.954 1.00 23.24 H new ATOM 679 N TYR A 48 9.089 24.521 1.260 1.00 1.21 N ATOM 680 CA TYR A 48 8.086 25.559 1.461 1.00 44.41 C ATOM 681 C TYR A 48 6.957 25.428 0.439 1.00 65.22 C ATOM 682 O TYR A 48 5.792 25.535 0.819 1.00 45.40 O ATOM 683 CB TYR A 48 8.742 26.949 1.434 1.00 23.21 C ATOM 684 CG TYR A 48 9.719 27.203 0.299 1.00 70.34 C ATOM 685 CD1 TYR A 48 11.045 26.739 0.403 1.00 73.22 C ATOM 686 CD2 TYR A 48 9.309 27.888 -0.860 1.00 50.54 C ATOM 687 CE1 TYR A 48 11.932 26.879 -0.677 1.00 14.52 C ATOM 688 CE2 TYR A 48 10.197 28.046 -1.939 1.00 42.22 C ATOM 689 CZ TYR A 48 11.500 27.505 -1.866 1.00 51.22 C ATOM 690 OH TYR A 48 12.348 27.596 -2.929 1.00 1.44 O ATOM 0 H TYR A 48 9.766 24.759 0.535 1.00 1.21 H new ATOM 0 HA TYR A 48 7.636 25.432 2.446 1.00 44.41 H new ATOM 0 HB2 TYR A 48 7.954 27.700 1.383 1.00 23.21 H new ATOM 0 HB3 TYR A 48 9.265 27.100 2.378 1.00 23.21 H new ATOM 0 HD1 TYR A 48 11.381 26.273 1.318 1.00 73.22 H new ATOM 0 HD2 TYR A 48 8.310 28.293 -0.921 1.00 50.54 H new ATOM 0 HE1 TYR A 48 12.943 26.508 -0.598 1.00 14.52 H new ATOM 0 HE2 TYR A 48 9.883 28.581 -2.823 1.00 42.22 H new ATOM 0 HH TYR A 48 11.897 28.054 -3.669 1.00 1.44 H new ATOM 699 N LYS A 49 7.254 25.125 -0.830 1.00 41.51 N ATOM 700 CA LYS A 49 6.208 24.994 -1.845 1.00 21.44 C ATOM 701 C LYS A 49 5.294 23.826 -1.502 1.00 4.23 C ATOM 702 O LYS A 49 4.079 23.984 -1.442 1.00 43.14 O ATOM 703 CB LYS A 49 6.818 24.830 -3.246 1.00 30.13 C ATOM 704 CG LYS A 49 5.782 25.084 -4.356 1.00 70.44 C ATOM 705 CD LYS A 49 5.473 26.570 -4.556 1.00 25.23 C ATOM 706 CE LYS A 49 4.375 26.734 -5.611 1.00 74.45 C ATOM 707 NZ LYS A 49 4.194 28.137 -6.022 1.00 14.54 N ATOM 0 H LYS A 49 8.201 24.968 -1.174 1.00 41.51 H new ATOM 0 HA LYS A 49 5.613 25.907 -1.853 1.00 21.44 H new ATOM 0 HB2 LYS A 49 7.652 25.522 -3.362 1.00 30.13 H new ATOM 0 HB3 LYS A 49 7.223 23.823 -3.350 1.00 30.13 H new ATOM 0 HG2 LYS A 49 6.151 24.666 -5.293 1.00 70.44 H new ATOM 0 HG3 LYS A 49 4.860 24.556 -4.113 1.00 70.44 H new ATOM 0 HD2 LYS A 49 5.154 27.015 -3.613 1.00 25.23 H new ATOM 0 HD3 LYS A 49 6.373 27.099 -4.869 1.00 25.23 H new ATOM 0 HE2 LYS A 49 4.622 26.132 -6.485 1.00 74.45 H new ATOM 0 HE3 LYS A 49 3.435 26.350 -5.215 1.00 74.45 H new ATOM 0 HZ1 LYS A 49 3.441 28.195 -6.737 1.00 14.54 H new ATOM 0 HZ2 LYS A 49 3.931 28.710 -5.195 1.00 14.54 H new ATOM 0 HZ3 LYS A 49 5.082 28.498 -6.425 1.00 14.54 H new ATOM 717 N THR A 50 5.872 22.651 -1.254 1.00 41.22 N ATOM 718 CA THR A 50 5.112 21.458 -0.922 1.00 32.44 C ATOM 719 C THR A 50 4.319 21.616 0.385 1.00 5.42 C ATOM 720 O THR A 50 3.326 20.909 0.569 1.00 4.51 O ATOM 721 CB THR A 50 6.064 20.249 -0.907 1.00 21.23 C ATOM 722 OG1 THR A 50 7.251 20.500 -0.183 1.00 10.22 O ATOM 723 CG2 THR A 50 6.537 19.904 -2.322 1.00 54.22 C ATOM 0 H THR A 50 6.881 22.505 -1.279 1.00 41.22 H new ATOM 0 HA THR A 50 4.354 21.291 -1.687 1.00 32.44 H new ATOM 0 HB THR A 50 5.487 19.446 -0.449 1.00 21.23 H new ATOM 0 HG1 THR A 50 7.693 19.651 0.025 1.00 10.22 H new ATOM 0 HG21 THR A 50 7.208 19.046 -2.282 1.00 54.22 H new ATOM 0 HG22 THR A 50 5.676 19.662 -2.945 1.00 54.22 H new ATOM 0 HG23 THR A 50 7.064 20.758 -2.748 1.00 54.22 H new ATOM 731 N SER A 51 4.731 22.540 1.261 1.00 30.20 N ATOM 732 CA SER A 51 4.035 22.931 2.477 1.00 54.33 C ATOM 733 C SER A 51 2.648 23.435 2.085 1.00 31.04 C ATOM 734 O SER A 51 1.635 22.847 2.472 1.00 63.42 O ATOM 735 CB SER A 51 4.885 23.995 3.205 1.00 54.32 C ATOM 736 OG SER A 51 5.047 23.754 4.585 1.00 31.23 O ATOM 0 H SER A 51 5.601 23.056 1.128 1.00 30.20 H new ATOM 0 HA SER A 51 3.901 22.098 3.167 1.00 54.33 H new ATOM 0 HB2 SER A 51 5.868 24.042 2.737 1.00 54.32 H new ATOM 0 HB3 SER A 51 4.420 24.972 3.069 1.00 54.32 H new ATOM 0 HG SER A 51 5.595 24.464 4.979 1.00 31.23 H new ATOM 741 N ASP A 52 2.623 24.493 1.269 1.00 53.21 N ATOM 742 CA ASP A 52 1.398 25.186 0.879 1.00 3.31 C ATOM 743 C ASP A 52 0.445 24.246 0.144 1.00 33.22 C ATOM 744 O ASP A 52 -0.748 24.221 0.442 1.00 34.13 O ATOM 745 CB ASP A 52 1.754 26.396 -0.004 1.00 11.32 C ATOM 746 CG ASP A 52 0.603 27.395 -0.103 1.00 61.35 C ATOM 747 OD1 ASP A 52 0.195 27.892 0.973 1.00 54.33 O ATOM 748 OD2 ASP A 52 0.167 27.695 -1.240 1.00 45.51 O ATOM 0 H ASP A 52 3.465 24.895 0.857 1.00 53.21 H new ATOM 0 HA ASP A 52 0.889 25.533 1.778 1.00 3.31 H new ATOM 0 HB2 ASP A 52 2.633 26.896 0.404 1.00 11.32 H new ATOM 0 HB3 ASP A 52 2.019 26.049 -1.003 1.00 11.32 H new ATOM 752 N ILE A 53 0.991 23.436 -0.773 1.00 71.41 N ATOM 753 CA ILE A 53 0.233 22.477 -1.573 1.00 25.21 C ATOM 754 C ILE A 53 -0.510 21.500 -0.656 1.00 62.25 C ATOM 755 O ILE A 53 -1.738 21.435 -0.719 1.00 24.44 O ATOM 756 CB ILE A 53 1.139 21.746 -2.592 1.00 41.54 C ATOM 757 CG1 ILE A 53 1.771 22.721 -3.614 1.00 3.40 C ATOM 758 CG2 ILE A 53 0.350 20.658 -3.346 1.00 45.12 C ATOM 759 CD1 ILE A 53 2.809 22.039 -4.514 1.00 63.44 C ATOM 0 H ILE A 53 1.990 23.432 -0.980 1.00 71.41 H new ATOM 0 HA ILE A 53 -0.509 23.021 -2.157 1.00 25.21 H new ATOM 0 HB ILE A 53 1.943 21.283 -2.019 1.00 41.54 H new ATOM 0 HG12 ILE A 53 0.985 23.152 -4.234 1.00 3.40 H new ATOM 0 HG13 ILE A 53 2.244 23.545 -3.080 1.00 3.40 H new ATOM 0 HG21 ILE A 53 1.008 20.158 -4.057 1.00 45.12 H new ATOM 0 HG22 ILE A 53 -0.036 19.929 -2.634 1.00 45.12 H new ATOM 0 HG23 ILE A 53 -0.481 21.117 -3.882 1.00 45.12 H new ATOM 0 HD11 ILE A 53 3.221 22.768 -5.212 1.00 63.44 H new ATOM 0 HD12 ILE A 53 3.612 21.631 -3.899 1.00 63.44 H new ATOM 0 HD13 ILE A 53 2.333 21.232 -5.071 1.00 63.44 H new ATOM 770 N ALA A 54 0.197 20.685 0.148 1.00 50.45 N ATOM 771 CA ALA A 54 -0.503 19.618 0.866 1.00 63.43 C ATOM 772 C ALA A 54 -1.506 20.222 1.845 1.00 43.42 C ATOM 773 O ALA A 54 -2.577 19.652 2.018 1.00 51.11 O ATOM 774 CB ALA A 54 0.438 18.643 1.589 1.00 32.31 C ATOM 0 H ALA A 54 1.203 20.742 0.309 1.00 50.45 H new ATOM 0 HA ALA A 54 -1.027 19.027 0.115 1.00 63.43 H new ATOM 0 HB1 ALA A 54 -0.150 17.880 2.099 1.00 32.31 H new ATOM 0 HB2 ALA A 54 1.097 18.168 0.863 1.00 32.31 H new ATOM 0 HB3 ALA A 54 1.036 19.188 2.319 1.00 32.31 H new ATOM 780 N LEU A 55 -1.189 21.376 2.443 1.00 71.21 N ATOM 781 CA LEU A 55 -2.059 22.065 3.383 1.00 71.22 C ATOM 782 C LEU A 55 -3.422 22.372 2.755 1.00 74.34 C ATOM 783 O LEU A 55 -4.456 22.085 3.360 1.00 1.50 O ATOM 784 CB LEU A 55 -1.336 23.341 3.853 1.00 43.31 C ATOM 785 CG LEU A 55 -2.032 24.144 4.959 1.00 60.35 C ATOM 786 CD1 LEU A 55 -3.192 24.959 4.386 1.00 14.51 C ATOM 787 CD2 LEU A 55 -2.454 23.266 6.141 1.00 71.33 C ATOM 0 H LEU A 55 -0.306 21.859 2.280 1.00 71.21 H new ATOM 0 HA LEU A 55 -2.263 21.429 4.244 1.00 71.22 H new ATOM 0 HB2 LEU A 55 -0.343 23.062 4.205 1.00 43.31 H new ATOM 0 HB3 LEU A 55 -1.197 23.994 2.991 1.00 43.31 H new ATOM 0 HG LEU A 55 -1.306 24.849 5.364 1.00 60.35 H new ATOM 0 HD11 LEU A 55 -3.672 25.521 5.187 1.00 14.51 H new ATOM 0 HD12 LEU A 55 -2.814 25.651 3.633 1.00 14.51 H new ATOM 0 HD13 LEU A 55 -3.918 24.287 3.929 1.00 14.51 H new ATOM 0 HD21 LEU A 55 -2.942 23.882 6.896 1.00 71.33 H new ATOM 0 HD22 LEU A 55 -3.147 22.499 5.795 1.00 71.33 H new ATOM 0 HD23 LEU A 55 -1.574 22.791 6.574 1.00 71.33 H new ATOM 798 N ASP A 56 -3.423 22.958 1.555 1.00 14.34 N ATOM 799 CA ASP A 56 -4.614 23.331 0.778 1.00 64.03 C ATOM 800 C ASP A 56 -5.445 22.066 0.543 1.00 41.51 C ATOM 801 O ASP A 56 -6.651 22.041 0.778 1.00 4.52 O ATOM 802 CB ASP A 56 -4.066 23.990 -0.504 1.00 54.15 C ATOM 803 CG ASP A 56 -4.944 24.650 -1.552 1.00 32.34 C ATOM 804 OD1 ASP A 56 -5.855 25.435 -1.205 1.00 62.23 O ATOM 805 OD2 ASP A 56 -4.553 24.531 -2.745 1.00 32.33 O ATOM 0 H ASP A 56 -2.556 23.197 1.074 1.00 14.34 H new ATOM 0 HA ASP A 56 -5.286 24.034 1.270 1.00 64.03 H new ATOM 0 HB2 ASP A 56 -3.355 24.749 -0.178 1.00 54.15 H new ATOM 0 HB3 ASP A 56 -3.495 23.221 -1.024 1.00 54.15 H new ATOM 809 N GLN A 57 -4.777 20.967 0.189 1.00 53.15 N ATOM 810 CA GLN A 57 -5.387 19.663 -0.067 1.00 61.22 C ATOM 811 C GLN A 57 -5.831 18.967 1.235 1.00 42.25 C ATOM 812 O GLN A 57 -6.582 17.995 1.154 1.00 64.41 O ATOM 813 CB GLN A 57 -4.467 18.798 -0.965 1.00 11.11 C ATOM 814 CG GLN A 57 -3.746 19.545 -2.118 1.00 3.50 C ATOM 815 CD GLN A 57 -4.300 19.308 -3.519 1.00 14.24 C ATOM 816 OE1 GLN A 57 -5.088 20.114 -4.002 1.00 12.43 O ATOM 817 NE2 GLN A 57 -3.828 18.306 -4.243 1.00 51.15 N ATOM 0 H GLN A 57 -3.764 20.961 0.069 1.00 53.15 H new ATOM 0 HA GLN A 57 -6.309 19.813 -0.628 1.00 61.22 H new ATOM 0 HB2 GLN A 57 -3.712 18.330 -0.334 1.00 11.11 H new ATOM 0 HB3 GLN A 57 -5.064 17.995 -1.396 1.00 11.11 H new ATOM 0 HG2 GLN A 57 -3.783 20.614 -1.910 1.00 3.50 H new ATOM 0 HG3 GLN A 57 -2.695 19.255 -2.111 1.00 3.50 H new ATOM 0 HE21 GLN A 57 -3.173 17.642 -3.830 1.00 51.15 H new ATOM 0 HE22 GLN A 57 -4.119 18.197 -5.215 1.00 51.15 H new ATOM 824 N ILE A 58 -5.456 19.452 2.426 1.00 40.42 N ATOM 825 CA ILE A 58 -5.803 18.872 3.728 1.00 51.32 C ATOM 826 C ILE A 58 -6.987 19.597 4.358 1.00 60.22 C ATOM 827 O ILE A 58 -7.925 18.936 4.788 1.00 4.24 O ATOM 828 CB ILE A 58 -4.569 18.861 4.666 1.00 35.14 C ATOM 829 CG1 ILE A 58 -3.605 17.738 4.232 1.00 21.41 C ATOM 830 CG2 ILE A 58 -4.910 18.666 6.161 1.00 71.43 C ATOM 831 CD1 ILE A 58 -2.179 17.984 4.728 1.00 73.13 C ATOM 0 H ILE A 58 -4.881 20.290 2.511 1.00 40.42 H new ATOM 0 HA ILE A 58 -6.110 17.838 3.571 1.00 51.32 H new ATOM 0 HB ILE A 58 -4.113 19.847 4.572 1.00 35.14 H new ATOM 0 HG12 ILE A 58 -3.963 16.783 4.617 1.00 21.41 H new ATOM 0 HG13 ILE A 58 -3.603 17.662 3.145 1.00 21.41 H new ATOM 0 HG21 ILE A 58 -3.991 18.670 6.747 1.00 71.43 H new ATOM 0 HG22 ILE A 58 -5.558 19.477 6.495 1.00 71.43 H new ATOM 0 HG23 ILE A 58 -5.422 17.713 6.296 1.00 71.43 H new ATOM 0 HD11 ILE A 58 -1.534 17.169 4.400 1.00 73.13 H new ATOM 0 HD12 ILE A 58 -1.810 18.925 4.321 1.00 73.13 H new ATOM 0 HD13 ILE A 58 -2.176 18.033 5.817 1.00 73.13 H new ATOM 842 N GLN A 59 -6.935 20.927 4.491 1.00 71.41 N ATOM 843 CA GLN A 59 -7.841 21.649 5.391 1.00 71.13 C ATOM 844 C GLN A 59 -9.296 21.711 4.895 1.00 33.42 C ATOM 845 O GLN A 59 -10.124 22.340 5.560 1.00 35.11 O ATOM 846 CB GLN A 59 -7.262 23.038 5.738 1.00 3.51 C ATOM 847 CG GLN A 59 -6.282 22.939 6.922 1.00 2.54 C ATOM 848 CD GLN A 59 -5.867 24.302 7.468 1.00 42.35 C ATOM 849 OE1 GLN A 59 -5.150 25.073 6.673 1.00 24.33 O flip ATOM 850 NE2 GLN A 59 -6.190 24.689 8.586 1.00 72.23 N flip ATOM 0 H GLN A 59 -6.278 21.524 3.989 1.00 71.41 H new ATOM 0 HA GLN A 59 -7.902 21.069 6.312 1.00 71.13 H new ATOM 0 HB2 GLN A 59 -6.750 23.451 4.869 1.00 3.51 H new ATOM 0 HB3 GLN A 59 -8.072 23.724 5.986 1.00 3.51 H new ATOM 0 HG2 GLN A 59 -6.744 22.359 7.721 1.00 2.54 H new ATOM 0 HG3 GLN A 59 -5.392 22.394 6.606 1.00 2.54 H new ATOM 0 HE21 GLN A 59 -6.744 24.086 9.194 1.00 72.23 H new ATOM 0 HE22 GLN A 59 -5.904 25.614 8.908 1.00 72.23 H new ATOM 857 N GLY A 60 -9.648 21.034 3.800 1.00 1.13 N ATOM 858 CA GLY A 60 -10.960 21.116 3.173 1.00 61.05 C ATOM 859 C GLY A 60 -10.984 22.170 2.071 1.00 61.32 C ATOM 860 O GLY A 60 -12.033 22.429 1.488 1.00 60.15 O ATOM 0 H GLY A 60 -9.011 20.400 3.317 1.00 1.13 H new ATOM 0 HA2 GLY A 60 -11.227 20.145 2.756 1.00 61.05 H new ATOM 0 HA3 GLY A 60 -11.711 21.357 3.926 1.00 61.05 H new ATOM 864 N ASN A 61 -9.836 22.795 1.798 1.00 42.45 N ATOM 865 CA ASN A 61 -9.721 23.907 0.865 1.00 64.33 C ATOM 866 C ASN A 61 -9.591 23.374 -0.561 1.00 61.34 C ATOM 867 O ASN A 61 -9.867 24.102 -1.516 1.00 42.15 O ATOM 868 CB ASN A 61 -8.508 24.799 1.202 1.00 24.03 C ATOM 869 CG ASN A 61 -8.432 25.281 2.653 1.00 62.25 C ATOM 870 OD1 ASN A 61 -9.220 24.913 3.519 1.00 40.14 O ATOM 871 ND2 ASN A 61 -7.437 26.080 2.979 1.00 34.44 N ATOM 0 H ASN A 61 -8.949 22.535 2.229 1.00 42.45 H new ATOM 0 HA ASN A 61 -10.622 24.515 0.949 1.00 64.33 H new ATOM 0 HB2 ASN A 61 -7.597 24.247 0.972 1.00 24.03 H new ATOM 0 HB3 ASN A 61 -8.526 25.671 0.548 1.00 24.03 H new ATOM 0 HD21 ASN A 61 -7.326 26.388 3.945 1.00 34.44 H new ATOM 0 HD22 ASN A 61 -6.778 26.391 2.266 1.00 34.44 H new ATOM 877 N LYS A 62 -9.172 22.116 -0.729 1.00 12.11 N ATOM 878 CA LYS A 62 -9.004 21.429 -2.002 1.00 3.51 C ATOM 879 C LYS A 62 -9.369 19.965 -1.877 1.00 22.10 C ATOM 880 O LYS A 62 -9.789 19.479 -0.821 1.00 61.32 O ATOM 881 CB LYS A 62 -7.551 21.561 -2.505 1.00 43.53 C ATOM 882 CG LYS A 62 -7.155 22.941 -2.959 1.00 0.20 C ATOM 883 CD LYS A 62 -7.945 23.490 -4.154 1.00 42.21 C ATOM 884 CE LYS A 62 -8.142 24.994 -4.020 1.00 23.43 C ATOM 885 NZ LYS A 62 -9.155 25.463 -4.982 1.00 1.33 N ATOM 0 H LYS A 62 -8.930 21.523 0.065 1.00 12.11 H new ATOM 0 HA LYS A 62 -9.673 21.898 -2.724 1.00 3.51 H new ATOM 0 HB2 LYS A 62 -6.877 21.251 -1.707 1.00 43.53 H new ATOM 0 HB3 LYS A 62 -7.405 20.867 -3.333 1.00 43.53 H new ATOM 0 HG2 LYS A 62 -7.271 23.628 -2.121 1.00 0.20 H new ATOM 0 HG3 LYS A 62 -6.096 22.930 -3.218 1.00 0.20 H new ATOM 0 HD2 LYS A 62 -7.415 23.268 -5.080 1.00 42.21 H new ATOM 0 HD3 LYS A 62 -8.914 22.995 -4.215 1.00 42.21 H new ATOM 0 HE2 LYS A 62 -8.454 25.238 -3.005 1.00 23.43 H new ATOM 0 HE3 LYS A 62 -7.197 25.509 -4.196 1.00 23.43 H new ATOM 0 HZ1 LYS A 62 -9.280 26.490 -4.881 1.00 1.33 H new ATOM 0 HZ2 LYS A 62 -8.842 25.246 -5.950 1.00 1.33 H new ATOM 0 HZ3 LYS A 62 -10.059 24.984 -4.795 1.00 1.33 H new ATOM 895 N ASP A 63 -9.203 19.301 -3.005 1.00 61.23 N ATOM 896 CA ASP A 63 -9.557 17.929 -3.295 1.00 0.21 C ATOM 897 C ASP A 63 -8.287 17.073 -3.170 1.00 15.32 C ATOM 898 O ASP A 63 -7.418 17.400 -2.357 1.00 42.42 O ATOM 899 CB ASP A 63 -10.281 17.905 -4.647 1.00 75.41 C ATOM 900 CG ASP A 63 -11.648 18.597 -4.577 1.00 0.54 C ATOM 901 OD1 ASP A 63 -11.694 19.850 -4.609 1.00 54.33 O ATOM 902 OD2 ASP A 63 -12.694 17.910 -4.486 1.00 14.22 O ATOM 0 H ASP A 63 -8.777 19.752 -3.815 1.00 61.23 H new ATOM 0 HA ASP A 63 -10.261 17.487 -2.590 1.00 0.21 H new ATOM 0 HB2 ASP A 63 -9.663 18.397 -5.398 1.00 75.41 H new ATOM 0 HB3 ASP A 63 -10.413 16.872 -4.970 1.00 75.41 H new ATOM 906 N PHE A 64 -8.195 15.915 -3.838 1.00 33.34 N ATOM 907 CA PHE A 64 -7.079 14.969 -3.683 1.00 72.13 C ATOM 908 C PHE A 64 -6.216 14.918 -4.946 1.00 13.34 C ATOM 909 O PHE A 64 -6.725 15.197 -6.032 1.00 3.14 O ATOM 910 CB PHE A 64 -7.609 13.564 -3.314 1.00 41.35 C ATOM 911 CG PHE A 64 -8.709 12.986 -4.202 1.00 52.12 C ATOM 912 CD1 PHE A 64 -8.472 12.696 -5.562 1.00 2.22 C ATOM 913 CD2 PHE A 64 -9.973 12.689 -3.659 1.00 55.11 C ATOM 914 CE1 PHE A 64 -9.496 12.181 -6.375 1.00 72.05 C ATOM 915 CE2 PHE A 64 -10.996 12.166 -4.469 1.00 64.15 C ATOM 916 CZ PHE A 64 -10.764 11.922 -5.831 1.00 61.31 C ATOM 0 H PHE A 64 -8.899 15.605 -4.508 1.00 33.34 H new ATOM 0 HA PHE A 64 -6.446 15.321 -2.868 1.00 72.13 H new ATOM 0 HB2 PHE A 64 -6.768 12.871 -3.322 1.00 41.35 H new ATOM 0 HB3 PHE A 64 -7.983 13.600 -2.291 1.00 41.35 H new ATOM 0 HD1 PHE A 64 -7.493 12.872 -5.983 1.00 2.22 H new ATOM 0 HD2 PHE A 64 -10.159 12.865 -2.610 1.00 55.11 H new ATOM 0 HE1 PHE A 64 -9.307 11.984 -7.420 1.00 72.05 H new ATOM 0 HE2 PHE A 64 -11.964 11.951 -4.041 1.00 64.15 H new ATOM 0 HZ PHE A 64 -11.556 11.537 -6.457 1.00 61.31 H new ATOM 925 N PRO A 65 -4.939 14.516 -4.844 1.00 42.32 N ATOM 926 CA PRO A 65 -4.149 14.145 -6.006 1.00 15.52 C ATOM 927 C PRO A 65 -4.581 12.807 -6.587 1.00 75.21 C ATOM 928 O PRO A 65 -5.150 11.950 -5.909 1.00 51.34 O ATOM 929 CB PRO A 65 -2.716 14.055 -5.518 1.00 1.54 C ATOM 930 CG PRO A 65 -2.860 13.723 -4.035 1.00 44.35 C ATOM 931 CD PRO A 65 -4.161 14.398 -3.622 1.00 32.33 C ATOM 0 HA PRO A 65 -4.275 14.880 -6.801 1.00 15.52 H new ATOM 0 HB2 PRO A 65 -2.160 13.283 -6.049 1.00 1.54 H new ATOM 0 HB3 PRO A 65 -2.182 14.993 -5.668 1.00 1.54 H new ATOM 0 HG2 PRO A 65 -2.901 12.646 -3.871 1.00 44.35 H new ATOM 0 HG3 PRO A 65 -2.015 14.101 -3.459 1.00 44.35 H new ATOM 0 HD2 PRO A 65 -4.690 13.807 -2.875 1.00 32.33 H new ATOM 0 HD3 PRO A 65 -3.973 15.376 -3.180 1.00 32.33 H new ATOM 936 N GLU A 66 -4.223 12.597 -7.840 1.00 12.34 N ATOM 937 CA GLU A 66 -4.722 11.503 -8.665 1.00 72.43 C ATOM 938 C GLU A 66 -3.650 10.428 -8.875 1.00 61.21 C ATOM 939 O GLU A 66 -2.561 10.529 -8.297 1.00 54.52 O ATOM 940 CB GLU A 66 -5.314 12.092 -9.949 1.00 42.34 C ATOM 941 CG GLU A 66 -6.546 12.958 -9.621 1.00 63.43 C ATOM 942 CD GLU A 66 -7.543 12.977 -10.776 1.00 24.22 C ATOM 943 OE1 GLU A 66 -8.103 11.901 -11.093 1.00 12.34 O ATOM 944 OE2 GLU A 66 -7.839 14.055 -11.336 1.00 24.34 O ATOM 0 H GLU A 66 -3.559 13.197 -8.329 1.00 12.34 H new ATOM 0 HA GLU A 66 -5.528 10.970 -8.161 1.00 72.43 H new ATOM 0 HB2 GLU A 66 -4.563 12.694 -10.461 1.00 42.34 H new ATOM 0 HB3 GLU A 66 -5.596 11.289 -10.629 1.00 42.34 H new ATOM 0 HG2 GLU A 66 -7.034 12.574 -8.725 1.00 63.43 H new ATOM 0 HG3 GLU A 66 -6.227 13.976 -9.398 1.00 63.43 H new ATOM 949 N ILE A 67 -3.977 9.360 -9.613 1.00 41.21 N ATOM 950 CA ILE A 67 -3.086 8.236 -9.883 1.00 44.14 C ATOM 951 C ILE A 67 -3.179 7.843 -11.355 1.00 54.34 C ATOM 952 O ILE A 67 -4.242 7.943 -11.966 1.00 55.41 O ATOM 953 CB ILE A 67 -3.418 7.041 -8.960 1.00 23.14 C ATOM 954 CG1 ILE A 67 -4.835 6.475 -9.224 1.00 41.22 C ATOM 955 CG2 ILE A 67 -3.223 7.417 -7.479 1.00 11.12 C ATOM 956 CD1 ILE A 67 -5.180 5.250 -8.382 1.00 3.44 C ATOM 0 H ILE A 67 -4.894 9.256 -10.048 1.00 41.21 H new ATOM 0 HA ILE A 67 -2.060 8.537 -9.672 1.00 44.14 H new ATOM 0 HB ILE A 67 -2.715 6.243 -9.198 1.00 23.14 H new ATOM 0 HG12 ILE A 67 -5.570 7.256 -9.029 1.00 41.22 H new ATOM 0 HG13 ILE A 67 -4.920 6.214 -10.279 1.00 41.22 H new ATOM 0 HG21 ILE A 67 -3.463 6.559 -6.851 1.00 11.12 H new ATOM 0 HG22 ILE A 67 -2.187 7.710 -7.312 1.00 11.12 H new ATOM 0 HG23 ILE A 67 -3.881 8.248 -7.225 1.00 11.12 H new ATOM 0 HD11 ILE A 67 -6.188 4.914 -8.625 1.00 3.44 H new ATOM 0 HD12 ILE A 67 -4.470 4.451 -8.594 1.00 3.44 H new ATOM 0 HD13 ILE A 67 -5.129 5.509 -7.325 1.00 3.44 H new ATOM 967 N GLN A 68 -2.085 7.299 -11.888 1.00 61.23 N ATOM 968 CA GLN A 68 -1.966 6.870 -13.284 1.00 21.43 C ATOM 969 C GLN A 68 -2.304 5.387 -13.453 1.00 62.55 C ATOM 970 O GLN A 68 -1.833 4.720 -14.380 1.00 63.34 O ATOM 971 CB GLN A 68 -0.527 7.128 -13.756 1.00 10.12 C ATOM 972 CG GLN A 68 -0.091 8.593 -13.638 1.00 12.50 C ATOM 973 CD GLN A 68 -0.661 9.447 -14.766 1.00 23.23 C ATOM 974 OE1 GLN A 68 -0.360 9.223 -15.937 1.00 30.13 O ATOM 975 NE2 GLN A 68 -1.519 10.396 -14.444 1.00 45.41 N ATOM 0 H GLN A 68 -1.234 7.140 -11.348 1.00 61.23 H new ATOM 0 HA GLN A 68 -2.677 7.439 -13.883 1.00 21.43 H new ATOM 0 HB2 GLN A 68 0.154 6.508 -13.173 1.00 10.12 H new ATOM 0 HB3 GLN A 68 -0.433 6.813 -14.795 1.00 10.12 H new ATOM 0 HG2 GLN A 68 -0.418 8.993 -12.678 1.00 12.50 H new ATOM 0 HG3 GLN A 68 0.997 8.651 -13.653 1.00 12.50 H new ATOM 0 HE21 GLN A 68 -1.752 10.562 -13.465 1.00 45.41 H new ATOM 0 HE22 GLN A 68 -1.949 10.964 -15.174 1.00 45.41 H new ATOM 982 N LEU A 69 -3.016 4.824 -12.484 1.00 61.44 N ATOM 983 CA LEU A 69 -3.209 3.386 -12.407 1.00 53.22 C ATOM 984 C LEU A 69 -4.362 2.944 -13.311 1.00 43.15 C ATOM 985 O LEU A 69 -5.324 3.686 -13.544 1.00 60.21 O ATOM 986 CB LEU A 69 -3.435 2.939 -10.958 1.00 71.32 C ATOM 987 CG LEU A 69 -2.350 2.012 -10.383 1.00 32.43 C ATOM 988 CD1 LEU A 69 -2.830 1.574 -8.994 1.00 23.50 C ATOM 989 CD2 LEU A 69 -2.083 0.768 -11.240 1.00 31.11 C ATOM 0 H LEU A 69 -3.471 5.348 -11.737 1.00 61.44 H new ATOM 0 HA LEU A 69 -2.300 2.902 -12.764 1.00 53.22 H new ATOM 0 HB2 LEU A 69 -3.505 3.825 -10.328 1.00 71.32 H new ATOM 0 HB3 LEU A 69 -4.396 2.429 -10.898 1.00 71.32 H new ATOM 0 HG LEU A 69 -1.410 2.562 -10.353 1.00 32.43 H new ATOM 0 HD11 LEU A 69 -2.089 0.912 -8.545 1.00 23.50 H new ATOM 0 HD12 LEU A 69 -2.963 2.452 -8.362 1.00 23.50 H new ATOM 0 HD13 LEU A 69 -3.779 1.046 -9.087 1.00 23.50 H new ATOM 0 HD21 LEU A 69 -1.307 0.163 -10.771 1.00 31.11 H new ATOM 0 HD22 LEU A 69 -2.998 0.182 -11.325 1.00 31.11 H new ATOM 0 HD23 LEU A 69 -1.754 1.074 -12.233 1.00 31.11 H new ATOM 1000 N ASP A 70 -4.257 1.699 -13.759 1.00 64.51 N ATOM 1001 CA ASP A 70 -5.132 1.037 -14.734 1.00 63.15 C ATOM 1002 C ASP A 70 -6.322 0.382 -14.030 1.00 4.41 C ATOM 1003 O ASP A 70 -6.477 0.533 -12.809 1.00 41.41 O ATOM 1004 CB ASP A 70 -4.312 0.009 -15.539 1.00 22.20 C ATOM 1005 CG ASP A 70 -3.544 0.612 -16.718 1.00 1.44 C ATOM 1006 OD1 ASP A 70 -3.510 1.853 -16.885 1.00 30.53 O ATOM 1007 OD2 ASP A 70 -2.973 -0.180 -17.496 1.00 11.44 O ATOM 0 H ASP A 70 -3.513 1.081 -13.434 1.00 64.51 H new ATOM 0 HA ASP A 70 -5.534 1.777 -15.426 1.00 63.15 H new ATOM 0 HB2 ASP A 70 -3.604 -0.480 -14.870 1.00 22.20 H new ATOM 0 HB3 ASP A 70 -4.984 -0.764 -15.913 1.00 22.20 H new ATOM 1011 N ASN A 71 -7.208 -0.294 -14.777 1.00 52.32 N ATOM 1012 CA ASN A 71 -8.337 -1.024 -14.197 1.00 42.34 C ATOM 1013 C ASN A 71 -7.905 -2.453 -13.893 1.00 13.04 C ATOM 1014 O ASN A 71 -7.718 -3.294 -14.774 1.00 14.33 O ATOM 1015 CB ASN A 71 -9.578 -1.041 -15.084 1.00 0.03 C ATOM 1016 CG ASN A 71 -10.783 -1.452 -14.249 1.00 12.24 C ATOM 1017 OD1 ASN A 71 -10.918 -2.725 -13.916 1.00 34.54 O flip ATOM 1018 ND2 ASN A 71 -11.586 -0.617 -13.841 1.00 62.55 N flip ATOM 0 H ASN A 71 -7.160 -0.348 -15.794 1.00 52.32 H new ATOM 0 HA ASN A 71 -8.619 -0.496 -13.286 1.00 42.34 H new ATOM 0 HB2 ASN A 71 -9.742 -0.056 -15.520 1.00 0.03 H new ATOM 0 HB3 ASN A 71 -9.439 -1.737 -15.911 1.00 0.03 H new ATOM 0 HD21 ASN A 71 -11.478 0.364 -14.100 1.00 62.55 H new ATOM 0 HD22 ASN A 71 -12.361 -0.904 -13.243 1.00 62.55 H new ATOM 1024 N ILE A 72 -7.754 -2.719 -12.612 1.00 0.10 N ATOM 1025 CA ILE A 72 -7.114 -3.889 -12.045 1.00 74.15 C ATOM 1026 C ILE A 72 -8.098 -4.480 -11.052 1.00 43.43 C ATOM 1027 O ILE A 72 -8.638 -3.782 -10.190 1.00 64.44 O ATOM 1028 CB ILE A 72 -5.746 -3.511 -11.442 1.00 55.12 C ATOM 1029 CG1 ILE A 72 -4.787 -3.135 -12.598 1.00 32.54 C ATOM 1030 CG2 ILE A 72 -5.140 -4.640 -10.588 1.00 15.44 C ATOM 1031 CD1 ILE A 72 -3.451 -2.577 -12.120 1.00 13.14 C ATOM 0 H ILE A 72 -8.097 -2.083 -11.892 1.00 0.10 H new ATOM 0 HA ILE A 72 -6.882 -4.647 -12.793 1.00 74.15 H new ATOM 0 HB ILE A 72 -5.891 -2.664 -10.771 1.00 55.12 H new ATOM 0 HG12 ILE A 72 -4.605 -4.018 -13.211 1.00 32.54 H new ATOM 0 HG13 ILE A 72 -5.272 -2.398 -13.237 1.00 32.54 H new ATOM 0 HG21 ILE A 72 -4.178 -4.318 -10.189 1.00 15.44 H new ATOM 0 HG22 ILE A 72 -5.814 -4.875 -9.764 1.00 15.44 H new ATOM 0 HG23 ILE A 72 -4.999 -5.527 -11.205 1.00 15.44 H new ATOM 0 HD11 ILE A 72 -2.829 -2.335 -12.981 1.00 13.14 H new ATOM 0 HD12 ILE A 72 -3.623 -1.676 -11.532 1.00 13.14 H new ATOM 0 HD13 ILE A 72 -2.945 -3.321 -11.505 1.00 13.14 H new ATOM 1042 N ASP A 73 -8.323 -5.781 -11.188 1.00 4.11 N ATOM 1043 CA ASP A 73 -9.058 -6.580 -10.225 1.00 14.24 C ATOM 1044 C ASP A 73 -8.211 -6.676 -8.973 1.00 54.35 C ATOM 1045 O ASP A 73 -7.230 -7.416 -8.975 1.00 23.24 O ATOM 1046 CB ASP A 73 -9.343 -7.995 -10.761 1.00 4.00 C ATOM 1047 CG ASP A 73 -10.819 -8.165 -11.058 1.00 42.13 C ATOM 1048 OD1 ASP A 73 -11.307 -7.528 -12.018 1.00 35.20 O ATOM 1049 OD2 ASP A 73 -11.483 -8.908 -10.301 1.00 32.21 O ATOM 0 H ASP A 73 -7.991 -6.318 -11.989 1.00 4.11 H new ATOM 0 HA ASP A 73 -10.020 -6.108 -10.023 1.00 14.24 H new ATOM 0 HB2 ASP A 73 -8.762 -8.171 -11.666 1.00 4.00 H new ATOM 0 HB3 ASP A 73 -9.026 -8.738 -10.029 1.00 4.00 H new ATOM 1053 N TYR A 74 -8.550 -5.954 -7.912 1.00 23.30 N ATOM 1054 CA TYR A 74 -7.920 -6.168 -6.615 1.00 60.14 C ATOM 1055 C TYR A 74 -8.530 -7.380 -5.914 1.00 15.04 C ATOM 1056 O TYR A 74 -7.907 -7.955 -5.024 1.00 52.41 O ATOM 1057 CB TYR A 74 -8.056 -4.898 -5.771 1.00 42.45 C ATOM 1058 CG TYR A 74 -7.366 -3.708 -6.409 1.00 74.21 C ATOM 1059 CD1 TYR A 74 -5.994 -3.787 -6.693 1.00 42.15 C ATOM 1060 CD2 TYR A 74 -8.103 -2.582 -6.823 1.00 12.30 C ATOM 1061 CE1 TYR A 74 -5.377 -2.782 -7.447 1.00 72.32 C ATOM 1062 CE2 TYR A 74 -7.482 -1.548 -7.546 1.00 74.32 C ATOM 1063 CZ TYR A 74 -6.116 -1.665 -7.895 1.00 13.31 C ATOM 1064 OH TYR A 74 -5.499 -0.735 -8.674 1.00 20.40 O ATOM 0 H TYR A 74 -9.255 -5.217 -7.924 1.00 23.30 H new ATOM 0 HA TYR A 74 -6.860 -6.379 -6.754 1.00 60.14 H new ATOM 0 HB2 TYR A 74 -9.112 -4.670 -5.629 1.00 42.45 H new ATOM 0 HB3 TYR A 74 -7.632 -5.074 -4.782 1.00 42.45 H new ATOM 0 HD1 TYR A 74 -5.414 -4.623 -6.330 1.00 42.15 H new ATOM 0 HD2 TYR A 74 -9.154 -2.512 -6.583 1.00 12.30 H new ATOM 0 HE1 TYR A 74 -4.327 -2.861 -7.688 1.00 72.32 H new ATOM 0 HE2 TYR A 74 -8.044 -0.671 -7.833 1.00 74.32 H new ATOM 0 HH TYR A 74 -6.136 -0.027 -8.904 1.00 20.40 H new ATOM 1073 N ASN A 75 -9.723 -7.817 -6.324 1.00 15.31 N ATOM 1074 CA ASN A 75 -10.522 -8.780 -5.569 1.00 1.41 C ATOM 1075 C ASN A 75 -9.979 -10.208 -5.614 1.00 53.43 C ATOM 1076 O ASN A 75 -10.624 -11.100 -5.069 1.00 42.13 O ATOM 1077 CB ASN A 75 -11.980 -8.783 -6.063 1.00 63.51 C ATOM 1078 CG ASN A 75 -12.979 -8.712 -4.917 1.00 1.14 C ATOM 1079 OD1 ASN A 75 -13.882 -7.886 -4.980 1.00 24.21 O ATOM 1080 ND2 ASN A 75 -12.806 -9.441 -3.829 1.00 3.30 N ATOM 0 H ASN A 75 -10.162 -7.511 -7.192 1.00 15.31 H new ATOM 0 HA ASN A 75 -10.468 -8.448 -4.532 1.00 1.41 H new ATOM 0 HB2 ASN A 75 -12.136 -7.936 -6.731 1.00 63.51 H new ATOM 0 HB3 ASN A 75 -12.162 -9.686 -6.645 1.00 63.51 H new ATOM 0 HD21 ASN A 75 -13.428 -9.319 -3.030 1.00 3.30 H new ATOM 0 HD22 ASN A 75 -12.051 -10.125 -3.788 1.00 3.30 H new ATOM 1086 N ASN A 76 -8.866 -10.463 -6.308 1.00 61.41 N ATOM 1087 CA ASN A 76 -8.293 -11.783 -6.497 1.00 22.12 C ATOM 1088 C ASN A 76 -7.062 -12.056 -5.634 1.00 31.10 C ATOM 1089 O ASN A 76 -6.633 -13.211 -5.579 1.00 1.10 O ATOM 1090 CB ASN A 76 -8.024 -12.021 -7.980 1.00 22.20 C ATOM 1091 CG ASN A 76 -6.717 -11.421 -8.431 1.00 3.23 C ATOM 1092 OD1 ASN A 76 -5.650 -12.022 -8.324 1.00 35.21 O ATOM 1093 ND2 ASN A 76 -6.800 -10.200 -8.901 1.00 73.23 N ATOM 0 H ASN A 76 -8.328 -9.727 -6.765 1.00 61.41 H new ATOM 0 HA ASN A 76 -9.031 -12.506 -6.149 1.00 22.12 H new ATOM 0 HB2 ASN A 76 -8.016 -13.093 -8.177 1.00 22.20 H new ATOM 0 HB3 ASN A 76 -8.838 -11.595 -8.567 1.00 22.20 H new ATOM 0 HD21 ASN A 76 -5.956 -9.709 -9.196 1.00 73.23 H new ATOM 0 HD22 ASN A 76 -7.708 -9.741 -8.971 1.00 73.23 H new ATOM 1099 N TYR A 77 -6.497 -11.048 -4.966 1.00 32.42 N ATOM 1100 CA TYR A 77 -5.345 -11.206 -4.084 1.00 75.24 C ATOM 1101 C TYR A 77 -5.844 -11.501 -2.670 1.00 0.13 C ATOM 1102 O TYR A 77 -6.832 -10.899 -2.240 1.00 32.14 O ATOM 1103 CB TYR A 77 -4.451 -9.963 -4.177 1.00 53.31 C ATOM 1104 CG TYR A 77 -4.081 -9.628 -5.613 1.00 45.35 C ATOM 1105 CD1 TYR A 77 -3.105 -10.374 -6.303 1.00 51.22 C ATOM 1106 CD2 TYR A 77 -4.763 -8.600 -6.287 1.00 42.24 C ATOM 1107 CE1 TYR A 77 -2.879 -10.170 -7.676 1.00 54.44 C ATOM 1108 CE2 TYR A 77 -4.516 -8.368 -7.650 1.00 4.43 C ATOM 1109 CZ TYR A 77 -3.616 -9.182 -8.363 1.00 42.45 C ATOM 1110 OH TYR A 77 -3.500 -9.024 -9.711 1.00 31.44 O ATOM 0 H TYR A 77 -6.834 -10.087 -5.025 1.00 32.42 H new ATOM 0 HA TYR A 77 -4.725 -12.050 -4.387 1.00 75.24 H new ATOM 0 HB2 TYR A 77 -4.965 -9.113 -3.728 1.00 53.31 H new ATOM 0 HB3 TYR A 77 -3.542 -10.127 -3.598 1.00 53.31 H new ATOM 0 HD1 TYR A 77 -2.523 -11.112 -5.771 1.00 51.22 H new ATOM 0 HD2 TYR A 77 -5.477 -7.988 -5.756 1.00 42.24 H new ATOM 0 HE1 TYR A 77 -2.147 -10.765 -8.201 1.00 54.44 H new ATOM 0 HE2 TYR A 77 -5.021 -7.558 -8.155 1.00 4.43 H new ATOM 0 HH TYR A 77 -4.085 -8.295 -10.007 1.00 31.44 H new ATOM 1119 N ASP A 78 -5.200 -12.425 -1.947 1.00 53.04 N ATOM 1120 CA ASP A 78 -5.493 -12.652 -0.523 1.00 64.42 C ATOM 1121 C ASP A 78 -4.808 -11.615 0.371 1.00 44.04 C ATOM 1122 O ASP A 78 -5.264 -11.372 1.486 1.00 62.34 O ATOM 1123 CB ASP A 78 -5.114 -14.071 -0.054 1.00 53.23 C ATOM 1124 CG ASP A 78 -5.782 -14.424 1.285 1.00 33.33 C ATOM 1125 OD1 ASP A 78 -6.962 -14.048 1.513 1.00 60.55 O ATOM 1126 OD2 ASP A 78 -5.222 -15.265 2.024 1.00 73.12 O ATOM 0 H ASP A 78 -4.470 -13.030 -2.324 1.00 53.04 H new ATOM 0 HA ASP A 78 -6.573 -12.545 -0.427 1.00 64.42 H new ATOM 0 HB2 ASP A 78 -5.411 -14.796 -0.811 1.00 53.23 H new ATOM 0 HB3 ASP A 78 -4.031 -14.143 0.049 1.00 53.23 H new ATOM 1130 N LEU A 79 -3.745 -10.985 -0.137 1.00 64.55 N ATOM 1131 CA LEU A 79 -2.924 -9.997 0.556 1.00 71.35 C ATOM 1132 C LEU A 79 -2.586 -8.873 -0.439 1.00 24.12 C ATOM 1133 O LEU A 79 -2.240 -9.168 -1.587 1.00 62.55 O ATOM 1134 CB LEU A 79 -1.655 -10.726 1.045 1.00 50.21 C ATOM 1135 CG LEU A 79 -0.859 -10.127 2.224 1.00 23.44 C ATOM 1136 CD1 LEU A 79 0.552 -10.700 2.177 1.00 53.45 C ATOM 1137 CD2 LEU A 79 -0.770 -8.599 2.284 1.00 54.05 C ATOM 0 H LEU A 79 -3.421 -11.161 -1.088 1.00 64.55 H new ATOM 0 HA LEU A 79 -3.433 -9.552 1.411 1.00 71.35 H new ATOM 0 HB2 LEU A 79 -1.944 -11.740 1.323 1.00 50.21 H new ATOM 0 HB3 LEU A 79 -0.975 -10.810 0.197 1.00 50.21 H new ATOM 0 HG LEU A 79 -1.415 -10.404 3.120 1.00 23.44 H new ATOM 0 HD11 LEU A 79 1.138 -10.293 3.001 1.00 53.45 H new ATOM 0 HD12 LEU A 79 0.507 -11.785 2.266 1.00 53.45 H new ATOM 0 HD13 LEU A 79 1.022 -10.432 1.231 1.00 53.45 H new ATOM 0 HD21 LEU A 79 -0.186 -8.302 3.156 1.00 54.05 H new ATOM 0 HD22 LEU A 79 -0.287 -8.227 1.380 1.00 54.05 H new ATOM 0 HD23 LEU A 79 -1.773 -8.179 2.359 1.00 54.05 H new ATOM 1148 N ILE A 80 -2.646 -7.600 -0.038 1.00 10.43 N ATOM 1149 CA ILE A 80 -2.198 -6.454 -0.837 1.00 62.41 C ATOM 1150 C ILE A 80 -1.288 -5.586 0.033 1.00 3.01 C ATOM 1151 O ILE A 80 -1.758 -4.870 0.917 1.00 30.11 O ATOM 1152 CB ILE A 80 -3.388 -5.674 -1.449 1.00 62.34 C ATOM 1153 CG1 ILE A 80 -4.220 -6.616 -2.347 1.00 13.41 C ATOM 1154 CG2 ILE A 80 -2.882 -4.455 -2.251 1.00 30.51 C ATOM 1155 CD1 ILE A 80 -5.300 -5.932 -3.190 1.00 41.15 C ATOM 0 H ILE A 80 -3.016 -7.330 0.873 1.00 10.43 H new ATOM 0 HA ILE A 80 -1.625 -6.801 -1.697 1.00 62.41 H new ATOM 0 HB ILE A 80 -4.024 -5.304 -0.644 1.00 62.34 H new ATOM 0 HG12 ILE A 80 -3.542 -7.146 -3.016 1.00 13.41 H new ATOM 0 HG13 ILE A 80 -4.696 -7.366 -1.716 1.00 13.41 H new ATOM 0 HG21 ILE A 80 -3.732 -3.919 -2.674 1.00 30.51 H new ATOM 0 HG22 ILE A 80 -2.326 -3.790 -1.590 1.00 30.51 H new ATOM 0 HG23 ILE A 80 -2.230 -4.794 -3.056 1.00 30.51 H new ATOM 0 HD11 ILE A 80 -5.826 -6.680 -3.784 1.00 41.15 H new ATOM 0 HD12 ILE A 80 -6.008 -5.426 -2.533 1.00 41.15 H new ATOM 0 HD13 ILE A 80 -4.836 -5.203 -3.854 1.00 41.15 H new ATOM 1166 N LEU A 81 0.025 -5.639 -0.195 1.00 54.25 N ATOM 1167 CA LEU A 81 0.948 -4.721 0.464 1.00 31.51 C ATOM 1168 C LEU A 81 1.029 -3.430 -0.337 1.00 32.13 C ATOM 1169 O LEU A 81 1.001 -3.452 -1.573 1.00 32.34 O ATOM 1170 CB LEU A 81 2.344 -5.334 0.622 1.00 11.21 C ATOM 1171 CG LEU A 81 2.336 -6.495 1.635 1.00 11.23 C ATOM 1172 CD1 LEU A 81 2.476 -7.835 0.918 1.00 45.11 C ATOM 1173 CD2 LEU A 81 3.454 -6.326 2.660 1.00 30.41 C ATOM 0 H LEU A 81 0.469 -6.305 -0.828 1.00 54.25 H new ATOM 0 HA LEU A 81 0.569 -4.514 1.465 1.00 31.51 H new ATOM 0 HB2 LEU A 81 2.696 -5.695 -0.344 1.00 11.21 H new ATOM 0 HB3 LEU A 81 3.045 -4.567 0.951 1.00 11.21 H new ATOM 0 HG LEU A 81 1.381 -6.479 2.160 1.00 11.23 H new ATOM 0 HD11 LEU A 81 2.468 -8.642 1.650 1.00 45.11 H new ATOM 0 HD12 LEU A 81 1.645 -7.966 0.225 1.00 45.11 H new ATOM 0 HD13 LEU A 81 3.415 -7.856 0.365 1.00 45.11 H new ATOM 0 HD21 LEU A 81 3.430 -7.157 3.365 1.00 30.41 H new ATOM 0 HD22 LEU A 81 4.417 -6.312 2.149 1.00 30.41 H new ATOM 0 HD23 LEU A 81 3.315 -5.389 3.199 1.00 30.41 H new ATOM 1184 N ILE A 82 1.191 -2.308 0.365 1.00 50.35 N ATOM 1185 CA ILE A 82 1.284 -0.970 -0.205 1.00 62.53 C ATOM 1186 C ILE A 82 2.464 -0.256 0.481 1.00 61.22 C ATOM 1187 O ILE A 82 2.903 -0.668 1.558 1.00 50.01 O ATOM 1188 CB ILE A 82 -0.091 -0.254 -0.085 1.00 74.12 C ATOM 1189 CG1 ILE A 82 -1.189 -1.153 -0.722 1.00 64.21 C ATOM 1190 CG2 ILE A 82 -0.134 1.148 -0.715 1.00 43.45 C ATOM 1191 CD1 ILE A 82 -2.592 -0.564 -0.862 1.00 61.43 C ATOM 0 H ILE A 82 1.263 -2.310 1.382 1.00 50.35 H new ATOM 0 HA ILE A 82 1.497 -0.977 -1.274 1.00 62.53 H new ATOM 0 HB ILE A 82 -0.270 -0.104 0.980 1.00 74.12 H new ATOM 0 HG12 ILE A 82 -0.848 -1.448 -1.714 1.00 64.21 H new ATOM 0 HG13 ILE A 82 -1.265 -2.063 -0.127 1.00 64.21 H new ATOM 0 HG21 ILE A 82 -1.129 1.574 -0.586 1.00 43.45 H new ATOM 0 HG22 ILE A 82 0.601 1.788 -0.228 1.00 43.45 H new ATOM 0 HG23 ILE A 82 0.095 1.076 -1.778 1.00 43.45 H new ATOM 0 HD11 ILE A 82 -3.252 -1.300 -1.321 1.00 61.43 H new ATOM 0 HD12 ILE A 82 -2.975 -0.298 0.123 1.00 61.43 H new ATOM 0 HD13 ILE A 82 -2.552 0.327 -1.488 1.00 61.43 H new ATOM 1202 N GLY A 83 3.010 0.779 -0.161 1.00 54.22 N ATOM 1203 CA GLY A 83 4.127 1.569 0.334 1.00 23.23 C ATOM 1204 C GLY A 83 3.983 3.010 -0.133 1.00 43.14 C ATOM 1205 O GLY A 83 3.504 3.238 -1.246 1.00 14.23 O ATOM 0 H GLY A 83 2.672 1.096 -1.069 1.00 54.22 H new ATOM 0 HA2 GLY A 83 4.158 1.531 1.423 1.00 23.23 H new ATOM 0 HA3 GLY A 83 5.068 1.152 -0.026 1.00 23.23 H new ATOM 1209 N SER A 84 4.416 3.990 0.665 1.00 71.45 N ATOM 1210 CA SER A 84 4.305 5.405 0.306 1.00 64.04 C ATOM 1211 C SER A 84 5.401 6.253 0.987 1.00 31.00 C ATOM 1212 O SER A 84 5.811 5.936 2.101 1.00 3.32 O ATOM 1213 CB SER A 84 2.896 5.917 0.655 1.00 41.45 C ATOM 1214 OG SER A 84 2.283 5.231 1.736 1.00 43.11 O ATOM 0 H SER A 84 4.851 3.826 1.573 1.00 71.45 H new ATOM 0 HA SER A 84 4.458 5.505 -0.769 1.00 64.04 H new ATOM 0 HB2 SER A 84 2.956 6.978 0.899 1.00 41.45 H new ATOM 0 HB3 SER A 84 2.260 5.828 -0.226 1.00 41.45 H new ATOM 0 HG SER A 84 2.645 5.565 2.583 1.00 43.11 H new ATOM 1219 N PRO A 85 5.839 7.366 0.373 1.00 23.11 N ATOM 1220 CA PRO A 85 6.785 8.307 0.966 1.00 13.32 C ATOM 1221 C PRO A 85 6.134 9.109 2.100 1.00 53.44 C ATOM 1222 O PRO A 85 4.903 9.209 2.172 1.00 33.41 O ATOM 1223 CB PRO A 85 7.215 9.216 -0.185 1.00 51.13 C ATOM 1224 CG PRO A 85 6.046 9.184 -1.162 1.00 53.24 C ATOM 1225 CD PRO A 85 5.404 7.824 -0.929 1.00 1.34 C ATOM 0 HA PRO A 85 7.636 7.798 1.418 1.00 13.32 H new ATOM 0 HB2 PRO A 85 7.412 10.230 0.164 1.00 51.13 H new ATOM 0 HB3 PRO A 85 8.132 8.856 -0.652 1.00 51.13 H new ATOM 0 HG2 PRO A 85 5.343 9.995 -0.969 1.00 53.24 H new ATOM 0 HG3 PRO A 85 6.385 9.294 -2.192 1.00 53.24 H new ATOM 0 HD2 PRO A 85 4.317 7.899 -0.968 1.00 1.34 H new ATOM 0 HD3 PRO A 85 5.702 7.119 -1.705 1.00 1.34 H new ATOM 1230 N VAL A 86 6.954 9.784 2.902 1.00 4.51 N ATOM 1231 CA VAL A 86 6.550 10.768 3.896 1.00 73.02 C ATOM 1232 C VAL A 86 7.269 12.070 3.565 1.00 24.40 C ATOM 1233 O VAL A 86 8.500 12.119 3.481 1.00 3.23 O ATOM 1234 CB VAL A 86 6.872 10.309 5.330 1.00 1.34 C ATOM 1235 CG1 VAL A 86 6.246 11.298 6.321 1.00 63.25 C ATOM 1236 CG2 VAL A 86 6.330 8.913 5.645 1.00 61.05 C ATOM 0 H VAL A 86 7.965 9.652 2.873 1.00 4.51 H new ATOM 0 HA VAL A 86 5.469 10.903 3.861 1.00 73.02 H new ATOM 0 HB VAL A 86 7.958 10.275 5.419 1.00 1.34 H new ATOM 0 HG11 VAL A 86 6.468 10.982 7.340 1.00 63.25 H new ATOM 0 HG12 VAL A 86 6.658 12.293 6.152 1.00 63.25 H new ATOM 0 HG13 VAL A 86 5.166 11.323 6.176 1.00 63.25 H new ATOM 0 HG21 VAL A 86 6.588 8.645 6.669 1.00 61.05 H new ATOM 0 HG22 VAL A 86 5.246 8.909 5.531 1.00 61.05 H new ATOM 0 HG23 VAL A 86 6.769 8.189 4.959 1.00 61.05 H new ATOM 1246 N TRP A 87 6.492 13.130 3.391 1.00 2.42 N ATOM 1247 CA TRP A 87 6.983 14.474 3.185 1.00 1.54 C ATOM 1248 C TRP A 87 7.482 15.081 4.497 1.00 3.12 C ATOM 1249 O TRP A 87 7.710 14.390 5.493 1.00 73.33 O ATOM 1250 CB TRP A 87 5.882 15.302 2.486 1.00 44.13 C ATOM 1251 CG TRP A 87 6.293 15.821 1.143 1.00 1.31 C ATOM 1252 CD1 TRP A 87 6.867 17.015 0.879 1.00 10.23 C ATOM 1253 CD2 TRP A 87 6.134 15.165 -0.148 1.00 72.02 C ATOM 1254 NE1 TRP A 87 7.162 17.093 -0.468 1.00 64.02 N ATOM 1255 CE2 TRP A 87 6.700 15.994 -1.158 1.00 30.43 C ATOM 1256 CE3 TRP A 87 5.523 13.969 -0.571 1.00 65.45 C ATOM 1257 CZ2 TRP A 87 6.692 15.633 -2.515 1.00 43.34 C ATOM 1258 CZ3 TRP A 87 5.416 13.646 -1.935 1.00 45.24 C ATOM 1259 CH2 TRP A 87 6.002 14.475 -2.910 1.00 13.31 C ATOM 0 H TRP A 87 5.474 13.071 3.390 1.00 2.42 H new ATOM 0 HA TRP A 87 7.853 14.470 2.528 1.00 1.54 H new ATOM 0 HB2 TRP A 87 4.991 14.685 2.372 1.00 44.13 H new ATOM 0 HB3 TRP A 87 5.609 16.142 3.124 1.00 44.13 H new ATOM 0 HD1 TRP A 87 7.064 17.788 1.607 1.00 10.23 H new ATOM 0 HE1 TRP A 87 7.662 17.870 -0.900 1.00 64.02 H new ATOM 0 HE3 TRP A 87 5.129 13.286 0.167 1.00 65.45 H new ATOM 0 HZ2 TRP A 87 7.209 16.238 -3.245 1.00 43.34 H new ATOM 0 HZ3 TRP A 87 4.881 12.757 -2.236 1.00 45.24 H new ATOM 0 HH2 TRP A 87 5.921 14.222 -3.957 1.00 13.31 H new ATOM 1269 N SER A 88 7.662 16.396 4.502 1.00 24.41 N ATOM 1270 CA SER A 88 7.647 17.223 5.683 1.00 62.12 C ATOM 1271 C SER A 88 6.353 16.937 6.453 1.00 53.22 C ATOM 1272 O SER A 88 5.270 17.429 6.131 1.00 11.10 O ATOM 1273 CB SER A 88 7.776 18.691 5.269 1.00 11.11 C ATOM 1274 OG SER A 88 9.062 18.984 4.738 1.00 12.23 O ATOM 0 H SER A 88 7.828 16.927 3.647 1.00 24.41 H new ATOM 0 HA SER A 88 8.487 17.000 6.341 1.00 62.12 H new ATOM 0 HB2 SER A 88 7.015 18.926 4.525 1.00 11.11 H new ATOM 0 HB3 SER A 88 7.586 19.329 6.132 1.00 11.11 H new ATOM 0 HG SER A 88 9.103 19.930 4.484 1.00 12.23 H new ATOM 1279 N GLY A 89 6.484 16.062 7.440 1.00 62.01 N ATOM 1280 CA GLY A 89 5.478 15.710 8.432 1.00 50.42 C ATOM 1281 C GLY A 89 4.661 14.496 8.023 1.00 61.21 C ATOM 1282 O GLY A 89 4.580 13.530 8.785 1.00 42.45 O ATOM 0 H GLY A 89 7.353 15.545 7.578 1.00 62.01 H new ATOM 0 HA2 GLY A 89 5.966 15.511 9.386 1.00 50.42 H new ATOM 0 HA3 GLY A 89 4.811 16.558 8.586 1.00 50.42 H new ATOM 1286 N TYR A 90 4.014 14.557 6.860 1.00 30.44 N ATOM 1287 CA TYR A 90 2.854 13.723 6.565 1.00 63.23 C ATOM 1288 C TYR A 90 3.020 13.102 5.178 1.00 2.44 C ATOM 1289 O TYR A 90 3.892 13.526 4.416 1.00 23.33 O ATOM 1290 CB TYR A 90 1.575 14.582 6.663 1.00 33.22 C ATOM 1291 CG TYR A 90 1.611 15.651 7.744 1.00 71.03 C ATOM 1292 CD1 TYR A 90 1.683 15.282 9.099 1.00 10.13 C ATOM 1293 CD2 TYR A 90 1.654 17.013 7.390 1.00 14.33 C ATOM 1294 CE1 TYR A 90 1.780 16.266 10.099 1.00 61.25 C ATOM 1295 CE2 TYR A 90 1.771 18.000 8.384 1.00 21.30 C ATOM 1296 CZ TYR A 90 1.821 17.632 9.743 1.00 30.12 C ATOM 1297 OH TYR A 90 1.908 18.597 10.699 1.00 52.43 O ATOM 0 H TYR A 90 4.279 15.184 6.100 1.00 30.44 H new ATOM 0 HA TYR A 90 2.769 12.911 7.287 1.00 63.23 H new ATOM 0 HB2 TYR A 90 1.402 15.063 5.700 1.00 33.22 H new ATOM 0 HB3 TYR A 90 0.725 13.925 6.848 1.00 33.22 H new ATOM 0 HD1 TYR A 90 1.664 14.238 9.373 1.00 10.13 H new ATOM 0 HD2 TYR A 90 1.597 17.301 6.351 1.00 14.33 H new ATOM 0 HE1 TYR A 90 1.823 15.977 11.139 1.00 61.25 H new ATOM 0 HE2 TYR A 90 1.823 19.042 8.105 1.00 21.30 H new ATOM 0 HH TYR A 90 1.926 19.479 10.273 1.00 52.43 H new ATOM 1306 N PRO A 91 2.233 12.080 4.812 1.00 45.32 N ATOM 1307 CA PRO A 91 2.128 11.699 3.414 1.00 2.34 C ATOM 1308 C PRO A 91 1.494 12.807 2.564 1.00 73.25 C ATOM 1309 O PRO A 91 0.936 13.785 3.061 1.00 11.34 O ATOM 1310 CB PRO A 91 1.373 10.372 3.389 1.00 32.30 C ATOM 1311 CG PRO A 91 0.673 10.270 4.748 1.00 53.53 C ATOM 1312 CD PRO A 91 1.446 11.209 5.674 1.00 25.41 C ATOM 0 HA PRO A 91 3.107 11.563 2.955 1.00 2.34 H new ATOM 0 HB2 PRO A 91 0.650 10.348 2.573 1.00 32.30 H new ATOM 0 HB3 PRO A 91 2.055 9.536 3.236 1.00 32.30 H new ATOM 0 HG2 PRO A 91 -0.374 10.565 4.674 1.00 53.53 H new ATOM 0 HG3 PRO A 91 0.690 9.247 5.123 1.00 53.53 H new ATOM 0 HD2 PRO A 91 0.764 11.790 6.295 1.00 25.41 H new ATOM 0 HD3 PRO A 91 2.090 10.645 6.349 1.00 25.41 H new ATOM 1317 N ALA A 92 1.623 12.644 1.251 1.00 25.24 N ATOM 1318 CA ALA A 92 1.181 13.534 0.177 1.00 24.33 C ATOM 1319 C ALA A 92 -0.209 13.109 -0.334 1.00 14.12 C ATOM 1320 O ALA A 92 -0.541 13.278 -1.501 1.00 63.45 O ATOM 1321 CB ALA A 92 2.254 13.497 -0.921 1.00 22.20 C ATOM 0 H ALA A 92 2.080 11.813 0.876 1.00 25.24 H new ATOM 0 HA ALA A 92 1.070 14.559 0.530 1.00 24.33 H new ATOM 0 HB1 ALA A 92 1.958 14.151 -1.741 1.00 22.20 H new ATOM 0 HB2 ALA A 92 3.205 13.836 -0.512 1.00 22.20 H new ATOM 0 HB3 ALA A 92 2.361 12.477 -1.291 1.00 22.20 H new ATOM 1327 N THR A 93 -0.981 12.439 0.523 1.00 1.40 N ATOM 1328 CA THR A 93 -2.244 11.767 0.216 1.00 50.31 C ATOM 1329 C THR A 93 -2.170 10.934 -1.093 1.00 3.41 C ATOM 1330 O THR A 93 -2.987 11.078 -1.994 1.00 70.11 O ATOM 1331 CB THR A 93 -3.428 12.756 0.453 1.00 32.23 C ATOM 1332 OG1 THR A 93 -4.632 12.453 -0.209 1.00 1.32 O ATOM 1333 CG2 THR A 93 -3.150 14.259 0.227 1.00 60.41 C ATOM 0 H THR A 93 -0.727 12.346 1.506 1.00 1.40 H new ATOM 0 HA THR A 93 -2.465 10.959 0.914 1.00 50.31 H new ATOM 0 HB THR A 93 -3.543 12.584 1.523 1.00 32.23 H new ATOM 0 HG1 THR A 93 -4.434 12.033 -1.072 1.00 1.32 H new ATOM 0 HG21 THR A 93 -4.056 14.831 0.427 1.00 60.41 H new ATOM 0 HG22 THR A 93 -2.358 14.588 0.900 1.00 60.41 H new ATOM 0 HG23 THR A 93 -2.839 14.420 -0.805 1.00 60.41 H new ATOM 1341 N PRO A 94 -1.195 10.005 -1.232 1.00 32.13 N ATOM 1342 CA PRO A 94 -1.143 9.112 -2.385 1.00 52.12 C ATOM 1343 C PRO A 94 -2.218 8.027 -2.340 1.00 54.53 C ATOM 1344 O PRO A 94 -2.869 7.739 -3.351 1.00 11.23 O ATOM 1345 CB PRO A 94 0.269 8.517 -2.367 1.00 74.01 C ATOM 1346 CG PRO A 94 0.643 8.508 -0.888 1.00 41.45 C ATOM 1347 CD PRO A 94 -0.060 9.750 -0.355 1.00 5.42 C ATOM 0 HA PRO A 94 -1.346 9.653 -3.309 1.00 52.12 H new ATOM 0 HB2 PRO A 94 0.285 7.512 -2.789 1.00 74.01 H new ATOM 0 HB3 PRO A 94 0.964 9.120 -2.952 1.00 74.01 H new ATOM 0 HG2 PRO A 94 0.298 7.602 -0.389 1.00 41.45 H new ATOM 0 HG3 PRO A 94 1.722 8.560 -0.743 1.00 41.45 H new ATOM 0 HD2 PRO A 94 -0.393 9.595 0.671 1.00 5.42 H new ATOM 0 HD3 PRO A 94 0.619 10.603 -0.344 1.00 5.42 H new ATOM 1352 N ILE A 95 -2.381 7.381 -1.183 1.00 30.42 N ATOM 1353 CA ILE A 95 -3.158 6.147 -1.106 1.00 32.34 C ATOM 1354 C ILE A 95 -4.658 6.466 -1.192 1.00 12.21 C ATOM 1355 O ILE A 95 -5.426 5.659 -1.714 1.00 4.32 O ATOM 1356 CB ILE A 95 -2.769 5.312 0.142 1.00 5.44 C ATOM 1357 CG1 ILE A 95 -1.244 5.113 0.339 1.00 51.23 C ATOM 1358 CG2 ILE A 95 -3.426 3.927 0.097 1.00 15.30 C ATOM 1359 CD1 ILE A 95 -0.459 4.678 -0.910 1.00 62.31 C ATOM 0 H ILE A 95 -1.988 7.691 -0.294 1.00 30.42 H new ATOM 0 HA ILE A 95 -2.920 5.515 -1.961 1.00 32.34 H new ATOM 0 HB ILE A 95 -3.132 5.900 0.985 1.00 5.44 H new ATOM 0 HG12 ILE A 95 -0.819 6.048 0.705 1.00 51.23 H new ATOM 0 HG13 ILE A 95 -1.092 4.367 1.119 1.00 51.23 H new ATOM 0 HG21 ILE A 95 -3.139 3.359 0.982 1.00 15.30 H new ATOM 0 HG22 ILE A 95 -4.510 4.039 0.073 1.00 15.30 H new ATOM 0 HG23 ILE A 95 -3.097 3.397 -0.797 1.00 15.30 H new ATOM 0 HD11 ILE A 95 0.596 4.569 -0.657 1.00 62.31 H new ATOM 0 HD12 ILE A 95 -0.846 3.725 -1.269 1.00 62.31 H new ATOM 0 HD13 ILE A 95 -0.569 5.432 -1.690 1.00 62.31 H new ATOM 1370 N LYS A 96 -5.071 7.675 -0.790 1.00 20.41 N ATOM 1371 CA LYS A 96 -6.438 8.162 -0.713 1.00 44.35 C ATOM 1372 C LYS A 96 -7.241 7.794 -1.962 1.00 40.52 C ATOM 1373 O LYS A 96 -8.309 7.202 -1.873 1.00 0.11 O ATOM 1374 CB LYS A 96 -6.332 9.685 -0.504 1.00 20.31 C ATOM 1375 CG LYS A 96 -7.682 10.395 -0.336 1.00 74.11 C ATOM 1376 CD LYS A 96 -8.389 10.020 0.979 1.00 34.04 C ATOM 1377 CE LYS A 96 -9.463 11.056 1.342 1.00 75.14 C ATOM 1378 NZ LYS A 96 -10.687 10.919 0.528 1.00 35.42 N ATOM 0 H LYS A 96 -4.402 8.384 -0.490 1.00 20.41 H new ATOM 0 HA LYS A 96 -6.982 7.699 0.110 1.00 44.35 H new ATOM 0 HB2 LYS A 96 -5.721 9.877 0.378 1.00 20.31 H new ATOM 0 HB3 LYS A 96 -5.809 10.121 -1.355 1.00 20.31 H new ATOM 0 HG2 LYS A 96 -7.527 11.474 -0.366 1.00 74.11 H new ATOM 0 HG3 LYS A 96 -8.328 10.142 -1.177 1.00 74.11 H new ATOM 0 HD2 LYS A 96 -8.847 9.035 0.882 1.00 34.04 H new ATOM 0 HD3 LYS A 96 -7.657 9.953 1.783 1.00 34.04 H new ATOM 0 HE2 LYS A 96 -9.720 10.953 2.396 1.00 75.14 H new ATOM 0 HE3 LYS A 96 -9.054 12.058 1.210 1.00 75.14 H new ATOM 0 HZ1 LYS A 96 -11.377 11.642 0.815 1.00 35.42 H new ATOM 0 HZ2 LYS A 96 -10.451 11.044 -0.477 1.00 35.42 H new ATOM 0 HZ3 LYS A 96 -11.096 9.974 0.672 1.00 35.42 H new ATOM 1388 N THR A 97 -6.733 8.123 -3.140 1.00 32.24 N ATOM 1389 CA THR A 97 -7.541 8.052 -4.348 1.00 21.32 C ATOM 1390 C THR A 97 -7.679 6.605 -4.861 1.00 32.23 C ATOM 1391 O THR A 97 -8.692 6.245 -5.463 1.00 43.34 O ATOM 1392 CB THR A 97 -6.891 9.018 -5.346 1.00 13.52 C ATOM 1393 OG1 THR A 97 -6.647 10.218 -4.638 1.00 64.01 O ATOM 1394 CG2 THR A 97 -7.820 9.270 -6.532 1.00 55.34 C ATOM 0 H THR A 97 -5.774 8.439 -3.285 1.00 32.24 H new ATOM 0 HA THR A 97 -8.573 8.354 -4.170 1.00 21.32 H new ATOM 0 HB THR A 97 -5.966 8.605 -5.749 1.00 13.52 H new ATOM 0 HG1 THR A 97 -5.893 10.692 -5.048 1.00 64.01 H new ATOM 0 HG21 THR A 97 -7.342 9.958 -7.229 1.00 55.34 H new ATOM 0 HG22 THR A 97 -8.028 8.327 -7.038 1.00 55.34 H new ATOM 0 HG23 THR A 97 -8.754 9.705 -6.177 1.00 55.34 H new ATOM 1402 N LEU A 98 -6.702 5.737 -4.564 1.00 24.30 N ATOM 1403 CA LEU A 98 -6.742 4.309 -4.882 1.00 3.32 C ATOM 1404 C LEU A 98 -7.674 3.589 -3.915 1.00 64.31 C ATOM 1405 O LEU A 98 -8.508 2.797 -4.339 1.00 52.25 O ATOM 1406 CB LEU A 98 -5.319 3.729 -4.796 1.00 41.21 C ATOM 1407 CG LEU A 98 -5.232 2.193 -4.885 1.00 53.43 C ATOM 1408 CD1 LEU A 98 -5.768 1.656 -6.214 1.00 0.44 C ATOM 1409 CD2 LEU A 98 -3.765 1.778 -4.734 1.00 70.45 C ATOM 0 H LEU A 98 -5.846 6.017 -4.086 1.00 24.30 H new ATOM 0 HA LEU A 98 -7.121 4.168 -5.894 1.00 3.32 H new ATOM 0 HB2 LEU A 98 -4.719 4.158 -5.599 1.00 41.21 H new ATOM 0 HB3 LEU A 98 -4.869 4.049 -3.856 1.00 41.21 H new ATOM 0 HG LEU A 98 -5.848 1.774 -4.089 1.00 53.43 H new ATOM 0 HD11 LEU A 98 -5.685 0.569 -6.227 1.00 0.44 H new ATOM 0 HD12 LEU A 98 -6.814 1.941 -6.326 1.00 0.44 H new ATOM 0 HD13 LEU A 98 -5.187 2.074 -7.036 1.00 0.44 H new ATOM 0 HD21 LEU A 98 -3.686 0.693 -4.795 1.00 70.45 H new ATOM 0 HD22 LEU A 98 -3.175 2.230 -5.531 1.00 70.45 H new ATOM 0 HD23 LEU A 98 -3.389 2.116 -3.768 1.00 70.45 H new ATOM 1420 N LEU A 99 -7.532 3.850 -2.614 1.00 51.34 N ATOM 1421 CA LEU A 99 -8.288 3.175 -1.564 1.00 55.24 C ATOM 1422 C LEU A 99 -9.785 3.385 -1.742 1.00 2.14 C ATOM 1423 O LEU A 99 -10.548 2.472 -1.436 1.00 12.32 O ATOM 1424 CB LEU A 99 -7.736 3.586 -0.198 1.00 20.13 C ATOM 1425 CG LEU A 99 -8.423 4.776 0.492 1.00 35.24 C ATOM 1426 CD1 LEU A 99 -9.709 4.320 1.191 1.00 13.43 C ATOM 1427 CD2 LEU A 99 -7.438 5.394 1.482 1.00 41.31 C ATOM 0 H LEU A 99 -6.878 4.547 -2.258 1.00 51.34 H new ATOM 0 HA LEU A 99 -8.158 2.095 -1.634 1.00 55.24 H new ATOM 0 HB2 LEU A 99 -7.797 2.725 0.467 1.00 20.13 H new ATOM 0 HB3 LEU A 99 -6.679 3.824 -0.315 1.00 20.13 H new ATOM 0 HG LEU A 99 -8.708 5.526 -0.246 1.00 35.24 H new ATOM 0 HD11 LEU A 99 -10.183 5.174 1.674 1.00 13.43 H new ATOM 0 HD12 LEU A 99 -10.392 3.894 0.455 1.00 13.43 H new ATOM 0 HD13 LEU A 99 -9.468 3.567 1.941 1.00 13.43 H new ATOM 0 HD21 LEU A 99 -7.908 6.241 1.982 1.00 41.31 H new ATOM 0 HD22 LEU A 99 -7.151 4.648 2.223 1.00 41.31 H new ATOM 0 HD23 LEU A 99 -6.551 5.734 0.948 1.00 41.31 H new ATOM 1438 N ASP A 100 -10.200 4.531 -2.290 1.00 62.25 N ATOM 1439 CA ASP A 100 -11.598 4.780 -2.622 1.00 42.31 C ATOM 1440 C ASP A 100 -12.102 3.815 -3.699 1.00 51.23 C ATOM 1441 O ASP A 100 -13.199 3.270 -3.578 1.00 55.52 O ATOM 1442 CB ASP A 100 -11.790 6.215 -3.113 1.00 63.23 C ATOM 1443 CG ASP A 100 -13.278 6.525 -3.257 1.00 54.41 C ATOM 1444 OD1 ASP A 100 -14.022 6.412 -2.257 1.00 23.33 O ATOM 1445 OD2 ASP A 100 -13.716 6.932 -4.357 1.00 13.13 O ATOM 0 H ASP A 100 -9.576 5.306 -2.514 1.00 62.25 H new ATOM 0 HA ASP A 100 -12.175 4.622 -1.710 1.00 42.31 H new ATOM 0 HB2 ASP A 100 -11.331 6.912 -2.412 1.00 63.23 H new ATOM 0 HB3 ASP A 100 -11.288 6.350 -4.071 1.00 63.23 H new ATOM 1449 N GLN A 101 -11.306 3.568 -4.748 1.00 40.44 N ATOM 1450 CA GLN A 101 -11.662 2.640 -5.821 1.00 51.05 C ATOM 1451 C GLN A 101 -11.858 1.244 -5.227 1.00 12.03 C ATOM 1452 O GLN A 101 -12.871 0.594 -5.464 1.00 40.32 O ATOM 1453 CB GLN A 101 -10.589 2.615 -6.928 1.00 34.53 C ATOM 1454 CG GLN A 101 -10.443 3.921 -7.731 1.00 35.22 C ATOM 1455 CD GLN A 101 -9.352 3.822 -8.805 1.00 64.41 C ATOM 1456 OE1 GLN A 101 -8.936 2.729 -9.192 1.00 22.31 O ATOM 1457 NE2 GLN A 101 -8.836 4.941 -9.295 1.00 44.04 N ATOM 0 H GLN A 101 -10.395 4.009 -4.873 1.00 40.44 H new ATOM 0 HA GLN A 101 -12.590 2.977 -6.283 1.00 51.05 H new ATOM 0 HB2 GLN A 101 -9.627 2.377 -6.474 1.00 34.53 H new ATOM 0 HB3 GLN A 101 -10.823 1.806 -7.620 1.00 34.53 H new ATOM 0 HG2 GLN A 101 -11.395 4.163 -8.204 1.00 35.22 H new ATOM 0 HG3 GLN A 101 -10.208 4.739 -7.051 1.00 35.22 H new ATOM 0 HE21 GLN A 101 -9.181 5.845 -8.974 1.00 44.04 H new ATOM 0 HE22 GLN A 101 -8.094 4.897 -9.993 1.00 44.04 H new ATOM 1464 N MET A 102 -10.907 0.798 -4.407 1.00 72.35 N ATOM 1465 CA MET A 102 -10.775 -0.591 -3.977 1.00 33.31 C ATOM 1466 C MET A 102 -11.447 -0.898 -2.627 1.00 40.33 C ATOM 1467 O MET A 102 -11.334 -2.020 -2.132 1.00 62.44 O ATOM 1468 CB MET A 102 -9.286 -0.958 -4.020 1.00 43.45 C ATOM 1469 CG MET A 102 -8.416 -0.206 -3.034 1.00 71.34 C ATOM 1470 SD MET A 102 -8.347 -0.863 -1.344 1.00 3.02 S ATOM 1471 CE MET A 102 -7.565 -2.490 -1.581 1.00 35.31 C ATOM 0 H MET A 102 -10.190 1.408 -4.015 1.00 72.35 H new ATOM 0 HA MET A 102 -11.327 -1.229 -4.667 1.00 33.31 H new ATOM 0 HB2 MET A 102 -9.184 -2.027 -3.831 1.00 43.45 H new ATOM 0 HB3 MET A 102 -8.910 -0.775 -5.027 1.00 43.45 H new ATOM 0 HG2 MET A 102 -7.401 -0.176 -3.429 1.00 71.34 H new ATOM 0 HG3 MET A 102 -8.769 0.824 -2.985 1.00 71.34 H new ATOM 0 HE1 MET A 102 -7.306 -2.914 -0.611 1.00 35.31 H new ATOM 0 HE2 MET A 102 -8.259 -3.156 -2.094 1.00 35.31 H new ATOM 0 HE3 MET A 102 -6.662 -2.376 -2.180 1.00 35.31 H new ATOM 1479 N LYS A 103 -12.154 0.065 -2.022 1.00 2.20 N ATOM 1480 CA LYS A 103 -12.608 0.072 -0.626 1.00 15.33 C ATOM 1481 C LYS A 103 -13.288 -1.217 -0.164 1.00 54.35 C ATOM 1482 O LYS A 103 -13.111 -1.608 0.985 1.00 31.40 O ATOM 1483 CB LYS A 103 -13.480 1.335 -0.431 1.00 3.24 C ATOM 1484 CG LYS A 103 -14.495 1.384 0.724 1.00 14.20 C ATOM 1485 CD LYS A 103 -14.005 1.320 2.178 1.00 34.14 C ATOM 1486 CE LYS A 103 -12.819 2.232 2.493 1.00 73.34 C ATOM 1487 NZ LYS A 103 -11.548 1.487 2.467 1.00 73.44 N ATOM 0 H LYS A 103 -12.440 0.907 -2.522 1.00 2.20 H new ATOM 0 HA LYS A 103 -11.736 0.111 0.026 1.00 15.33 H new ATOM 0 HB2 LYS A 103 -12.805 2.182 -0.309 1.00 3.24 H new ATOM 0 HB3 LYS A 103 -14.031 1.498 -1.357 1.00 3.24 H new ATOM 0 HG2 LYS A 103 -15.067 2.305 0.615 1.00 14.20 H new ATOM 0 HG3 LYS A 103 -15.191 0.558 0.580 1.00 14.20 H new ATOM 0 HD2 LYS A 103 -14.832 1.582 2.838 1.00 34.14 H new ATOM 0 HD3 LYS A 103 -13.726 0.292 2.408 1.00 34.14 H new ATOM 0 HE2 LYS A 103 -12.781 3.046 1.769 1.00 73.34 H new ATOM 0 HE3 LYS A 103 -12.957 2.685 3.475 1.00 73.34 H new ATOM 0 HZ1 LYS A 103 -10.821 2.023 2.983 1.00 73.44 H new ATOM 0 HZ2 LYS A 103 -11.680 0.559 2.918 1.00 73.44 H new ATOM 0 HZ3 LYS A 103 -11.244 1.353 1.481 1.00 73.44 H new ATOM 1497 N ASN A 104 -14.022 -1.890 -1.039 1.00 23.14 N ATOM 1498 CA ASN A 104 -14.753 -3.124 -0.743 1.00 12.22 C ATOM 1499 C ASN A 104 -13.849 -4.332 -0.402 1.00 71.43 C ATOM 1500 O ASN A 104 -14.361 -5.352 0.058 1.00 44.42 O ATOM 1501 CB ASN A 104 -15.693 -3.464 -1.915 1.00 53.34 C ATOM 1502 CG ASN A 104 -14.937 -3.938 -3.150 1.00 51.33 C ATOM 1503 OD1 ASN A 104 -14.523 -5.090 -3.223 1.00 22.52 O ATOM 1504 ND2 ASN A 104 -14.674 -3.066 -4.112 1.00 22.42 N ATOM 0 H ASN A 104 -14.132 -1.586 -2.007 1.00 23.14 H new ATOM 0 HA ASN A 104 -15.330 -2.930 0.161 1.00 12.22 H new ATOM 0 HB2 ASN A 104 -16.393 -4.238 -1.602 1.00 53.34 H new ATOM 0 HB3 ASN A 104 -16.284 -2.584 -2.170 1.00 53.34 H new ATOM 0 HD21 ASN A 104 -14.123 -3.351 -4.922 1.00 22.42 H new ATOM 0 HD22 ASN A 104 -15.022 -2.110 -4.043 1.00 22.42 H new ATOM 1510 N TYR A 105 -12.528 -4.259 -0.605 1.00 51.12 N ATOM 1511 CA TYR A 105 -11.596 -5.388 -0.522 1.00 71.31 C ATOM 1512 C TYR A 105 -11.644 -6.168 0.801 1.00 63.22 C ATOM 1513 O TYR A 105 -11.615 -5.589 1.890 1.00 61.55 O ATOM 1514 CB TYR A 105 -10.175 -4.854 -0.754 1.00 71.41 C ATOM 1515 CG TYR A 105 -9.097 -5.914 -0.695 1.00 52.22 C ATOM 1516 CD1 TYR A 105 -8.852 -6.729 -1.818 1.00 0.32 C ATOM 1517 CD2 TYR A 105 -8.361 -6.104 0.491 1.00 43.11 C ATOM 1518 CE1 TYR A 105 -7.889 -7.749 -1.746 1.00 24.52 C ATOM 1519 CE2 TYR A 105 -7.393 -7.118 0.562 1.00 22.40 C ATOM 1520 CZ TYR A 105 -7.171 -7.956 -0.548 1.00 33.30 C ATOM 1521 OH TYR A 105 -6.278 -8.972 -0.460 1.00 63.52 O ATOM 0 H TYR A 105 -12.064 -3.382 -0.840 1.00 51.12 H new ATOM 0 HA TYR A 105 -11.899 -6.103 -1.287 1.00 71.31 H new ATOM 0 HB2 TYR A 105 -10.137 -4.367 -1.728 1.00 71.41 H new ATOM 0 HB3 TYR A 105 -9.959 -4.090 -0.007 1.00 71.41 H new ATOM 0 HD1 TYR A 105 -9.404 -6.570 -2.733 1.00 0.32 H new ATOM 0 HD2 TYR A 105 -8.542 -5.469 1.346 1.00 43.11 H new ATOM 0 HE1 TYR A 105 -7.698 -8.374 -2.606 1.00 24.52 H new ATOM 0 HE2 TYR A 105 -6.819 -7.255 1.467 1.00 22.40 H new ATOM 0 HH TYR A 105 -6.481 -9.646 -1.142 1.00 63.52 H new ATOM 1530 N ARG A 106 -11.597 -7.502 0.694 1.00 51.04 N ATOM 1531 CA ARG A 106 -11.416 -8.447 1.795 1.00 73.44 C ATOM 1532 C ARG A 106 -10.088 -9.180 1.589 1.00 13.44 C ATOM 1533 O ARG A 106 -9.800 -9.611 0.471 1.00 23.33 O ATOM 1534 CB ARG A 106 -12.587 -9.446 1.806 1.00 12.41 C ATOM 1535 CG ARG A 106 -13.959 -8.802 2.074 1.00 72.35 C ATOM 1536 CD ARG A 106 -14.122 -8.412 3.551 1.00 31.21 C ATOM 1537 NE ARG A 106 -15.344 -7.634 3.808 1.00 64.54 N ATOM 1538 CZ ARG A 106 -16.606 -8.062 3.920 1.00 63.14 C ATOM 1539 NH1 ARG A 106 -16.919 -9.333 3.696 1.00 61.24 N ATOM 1540 NH2 ARG A 106 -17.562 -7.218 4.282 1.00 3.21 N ATOM 0 H ARG A 106 -11.689 -7.971 -0.207 1.00 51.04 H new ATOM 0 HA ARG A 106 -11.398 -7.924 2.751 1.00 73.44 H new ATOM 0 HB2 ARG A 106 -12.620 -9.961 0.846 1.00 12.41 H new ATOM 0 HB3 ARG A 106 -12.398 -10.203 2.567 1.00 12.41 H new ATOM 0 HG2 ARG A 106 -14.074 -7.917 1.449 1.00 72.35 H new ATOM 0 HG3 ARG A 106 -14.749 -9.497 1.791 1.00 72.35 H new ATOM 0 HD2 ARG A 106 -14.138 -9.316 4.160 1.00 31.21 H new ATOM 0 HD3 ARG A 106 -13.255 -7.831 3.866 1.00 31.21 H new ATOM 0 HE ARG A 106 -15.210 -6.629 3.916 1.00 64.54 H new ATOM 0 HH11 ARG A 106 -16.192 -9.999 3.434 1.00 61.24 H new ATOM 0 HH12 ARG A 106 -17.886 -9.643 3.786 1.00 61.24 H new ATOM 0 HH21 ARG A 106 -17.335 -6.243 4.475 1.00 3.21 H new ATOM 0 HH22 ARG A 106 -18.525 -7.544 4.368 1.00 3.21 H new ATOM 1551 N GLY A 107 -9.296 -9.339 2.643 1.00 14.23 N ATOM 1552 CA GLY A 107 -7.950 -9.901 2.628 1.00 62.54 C ATOM 1553 C GLY A 107 -7.054 -9.134 3.596 1.00 34.20 C ATOM 1554 O GLY A 107 -7.535 -8.274 4.345 1.00 73.34 O ATOM 0 H GLY A 107 -9.591 -9.065 3.580 1.00 14.23 H new ATOM 0 HA2 GLY A 107 -7.984 -10.954 2.907 1.00 62.54 H new ATOM 0 HA3 GLY A 107 -7.537 -9.851 1.620 1.00 62.54 H new ATOM 1558 N GLU A 108 -5.767 -9.455 3.606 1.00 13.00 N ATOM 1559 CA GLU A 108 -4.755 -8.760 4.393 1.00 35.53 C ATOM 1560 C GLU A 108 -4.289 -7.518 3.634 1.00 42.23 C ATOM 1561 O GLU A 108 -4.199 -7.537 2.403 1.00 75.23 O ATOM 1562 CB GLU A 108 -3.576 -9.703 4.653 1.00 41.04 C ATOM 1563 CG GLU A 108 -3.907 -10.786 5.684 1.00 33.12 C ATOM 1564 CD GLU A 108 -2.655 -11.523 6.180 1.00 54.15 C ATOM 1565 OE1 GLU A 108 -2.078 -12.336 5.420 1.00 4.10 O ATOM 1566 OE2 GLU A 108 -2.242 -11.278 7.341 1.00 63.24 O ATOM 0 H GLU A 108 -5.388 -10.224 3.054 1.00 13.00 H new ATOM 0 HA GLU A 108 -5.175 -8.451 5.350 1.00 35.53 H new ATOM 0 HB2 GLU A 108 -3.280 -10.176 3.717 1.00 41.04 H new ATOM 0 HB3 GLU A 108 -2.721 -9.123 5.002 1.00 41.04 H new ATOM 0 HG2 GLU A 108 -4.418 -10.332 6.533 1.00 33.12 H new ATOM 0 HG3 GLU A 108 -4.598 -11.505 5.243 1.00 33.12 H new ATOM 1571 N VAL A 109 -3.947 -6.447 4.352 1.00 53.05 N ATOM 1572 CA VAL A 109 -3.435 -5.220 3.752 1.00 21.31 C ATOM 1573 C VAL A 109 -2.372 -4.619 4.689 1.00 3.12 C ATOM 1574 O VAL A 109 -2.675 -4.368 5.854 1.00 70.13 O ATOM 1575 CB VAL A 109 -4.588 -4.218 3.467 1.00 55.13 C ATOM 1576 CG1 VAL A 109 -4.160 -3.269 2.342 1.00 72.41 C ATOM 1577 CG2 VAL A 109 -5.927 -4.823 3.015 1.00 35.14 C ATOM 0 H VAL A 109 -4.019 -6.409 5.369 1.00 53.05 H new ATOM 0 HA VAL A 109 -2.973 -5.443 2.790 1.00 21.31 H new ATOM 0 HB VAL A 109 -4.759 -3.739 4.431 1.00 55.13 H new ATOM 0 HG11 VAL A 109 -4.964 -2.563 2.136 1.00 72.41 H new ATOM 0 HG12 VAL A 109 -3.267 -2.723 2.646 1.00 72.41 H new ATOM 0 HG13 VAL A 109 -3.944 -3.845 1.442 1.00 72.41 H new ATOM 0 HG21 VAL A 109 -6.649 -4.024 2.848 1.00 35.14 H new ATOM 0 HG22 VAL A 109 -5.781 -5.379 2.089 1.00 35.14 H new ATOM 0 HG23 VAL A 109 -6.301 -5.495 3.787 1.00 35.14 H new ATOM 1587 N ALA A 110 -1.125 -4.397 4.245 1.00 25.31 N ATOM 1588 CA ALA A 110 -0.130 -3.665 5.043 1.00 45.01 C ATOM 1589 C ALA A 110 0.320 -2.398 4.320 1.00 54.41 C ATOM 1590 O ALA A 110 0.171 -2.294 3.095 1.00 3.31 O ATOM 1591 CB ALA A 110 1.080 -4.547 5.340 1.00 34.23 C ATOM 0 H ALA A 110 -0.782 -4.714 3.338 1.00 25.31 H new ATOM 0 HA ALA A 110 -0.601 -3.383 5.985 1.00 45.01 H new ATOM 0 HB1 ALA A 110 1.803 -3.985 5.931 1.00 34.23 H new ATOM 0 HB2 ALA A 110 0.760 -5.427 5.898 1.00 34.23 H new ATOM 0 HB3 ALA A 110 1.541 -4.859 4.403 1.00 34.23 H new ATOM 1597 N SER A 111 0.897 -1.451 5.056 1.00 5.32 N ATOM 1598 CA SER A 111 1.352 -0.166 4.534 1.00 63.12 C ATOM 1599 C SER A 111 2.698 0.191 5.169 1.00 5.30 C ATOM 1600 O SER A 111 2.734 0.666 6.301 1.00 3.21 O ATOM 1601 CB SER A 111 0.291 0.925 4.779 1.00 32.11 C ATOM 1602 OG SER A 111 -0.494 0.711 5.941 1.00 54.44 O ATOM 0 H SER A 111 1.065 -1.559 6.056 1.00 5.32 H new ATOM 0 HA SER A 111 1.492 -0.236 3.455 1.00 63.12 H new ATOM 0 HB2 SER A 111 0.789 1.891 4.862 1.00 32.11 H new ATOM 0 HB3 SER A 111 -0.368 0.979 3.912 1.00 32.11 H new ATOM 0 HG SER A 111 -1.087 1.478 6.081 1.00 54.44 H new ATOM 1607 N PHE A 112 3.830 -0.038 4.494 1.00 45.43 N ATOM 1608 CA PHE A 112 5.080 0.555 4.985 1.00 10.30 C ATOM 1609 C PHE A 112 5.190 1.997 4.489 1.00 65.13 C ATOM 1610 O PHE A 112 4.473 2.416 3.573 1.00 31.32 O ATOM 1611 CB PHE A 112 6.322 -0.266 4.621 1.00 31.04 C ATOM 1612 CG PHE A 112 6.797 -0.078 3.200 1.00 54.31 C ATOM 1613 CD1 PHE A 112 6.216 -0.837 2.174 1.00 42.11 C ATOM 1614 CD2 PHE A 112 7.794 0.871 2.896 1.00 33.33 C ATOM 1615 CE1 PHE A 112 6.640 -0.646 0.855 1.00 22.23 C ATOM 1616 CE2 PHE A 112 8.188 1.080 1.564 1.00 65.22 C ATOM 1617 CZ PHE A 112 7.617 0.309 0.541 1.00 34.43 C ATOM 0 H PHE A 112 3.909 -0.601 3.647 1.00 45.43 H new ATOM 0 HA PHE A 112 5.043 0.551 6.074 1.00 10.30 H new ATOM 0 HB2 PHE A 112 7.131 0.001 5.301 1.00 31.04 H new ATOM 0 HB3 PHE A 112 6.105 -1.322 4.783 1.00 31.04 H new ATOM 0 HD1 PHE A 112 5.448 -1.562 2.400 1.00 42.11 H new ATOM 0 HD2 PHE A 112 8.256 1.439 3.690 1.00 33.33 H new ATOM 0 HE1 PHE A 112 6.208 -1.244 0.066 1.00 22.23 H new ATOM 0 HE2 PHE A 112 8.927 1.831 1.329 1.00 65.22 H new ATOM 0 HZ PHE A 112 7.928 0.450 -0.483 1.00 34.43 H new ATOM 1626 N PHE A 113 6.122 2.760 5.054 1.00 54.51 N ATOM 1627 CA PHE A 113 6.483 4.079 4.558 1.00 13.14 C ATOM 1628 C PHE A 113 7.999 4.244 4.597 1.00 33.02 C ATOM 1629 O PHE A 113 8.692 3.484 5.273 1.00 53.41 O ATOM 1630 CB PHE A 113 5.800 5.165 5.398 1.00 42.41 C ATOM 1631 CG PHE A 113 4.308 5.347 5.172 1.00 54.21 C ATOM 1632 CD1 PHE A 113 3.377 4.416 5.676 1.00 14.13 C ATOM 1633 CD2 PHE A 113 3.842 6.474 4.469 1.00 4.21 C ATOM 1634 CE1 PHE A 113 1.998 4.609 5.488 1.00 61.32 C ATOM 1635 CE2 PHE A 113 2.465 6.670 4.286 1.00 53.53 C ATOM 1636 CZ PHE A 113 1.547 5.737 4.788 1.00 23.43 C ATOM 0 H PHE A 113 6.652 2.474 5.878 1.00 54.51 H new ATOM 0 HA PHE A 113 6.144 4.181 3.527 1.00 13.14 H new ATOM 0 HB2 PHE A 113 5.962 4.936 6.451 1.00 42.41 H new ATOM 0 HB3 PHE A 113 6.295 6.115 5.198 1.00 42.41 H new ATOM 0 HD1 PHE A 113 3.727 3.546 6.212 1.00 14.13 H new ATOM 0 HD2 PHE A 113 4.546 7.189 4.070 1.00 4.21 H new ATOM 0 HE1 PHE A 113 1.290 3.893 5.880 1.00 61.32 H new ATOM 0 HE2 PHE A 113 2.111 7.542 3.757 1.00 53.53 H new ATOM 0 HZ PHE A 113 0.489 5.888 4.635 1.00 23.43 H new ATOM 1645 N THR A 114 8.531 5.253 3.923 1.00 22.10 N ATOM 1646 CA THR A 114 9.957 5.571 3.937 1.00 54.53 C ATOM 1647 C THR A 114 10.109 7.024 4.370 1.00 25.31 C ATOM 1648 O THR A 114 9.328 7.885 3.952 1.00 43.51 O ATOM 1649 CB THR A 114 10.583 5.276 2.556 1.00 3.10 C ATOM 1650 OG1 THR A 114 9.688 5.559 1.491 1.00 2.24 O ATOM 1651 CG2 THR A 114 10.974 3.799 2.454 1.00 32.20 C ATOM 0 H THR A 114 7.979 5.884 3.342 1.00 22.10 H new ATOM 0 HA THR A 114 10.497 4.946 4.648 1.00 54.53 H new ATOM 0 HB THR A 114 11.458 5.920 2.469 1.00 3.10 H new ATOM 0 HG1 THR A 114 10.124 5.360 0.636 1.00 2.24 H new ATOM 0 HG21 THR A 114 11.414 3.606 1.476 1.00 32.20 H new ATOM 0 HG22 THR A 114 11.700 3.560 3.232 1.00 32.20 H new ATOM 0 HG23 THR A 114 10.087 3.178 2.582 1.00 32.20 H new ATOM 1659 N SER A 115 11.075 7.307 5.242 1.00 23.11 N ATOM 1660 CA SER A 115 11.295 8.620 5.819 1.00 10.22 C ATOM 1661 C SER A 115 12.769 8.795 6.192 1.00 12.12 C ATOM 1662 O SER A 115 13.530 7.826 6.253 1.00 51.34 O ATOM 1663 CB SER A 115 10.377 8.757 7.036 1.00 44.44 C ATOM 1664 OG SER A 115 10.552 7.701 7.961 1.00 13.33 O ATOM 0 H SER A 115 11.740 6.607 5.571 1.00 23.11 H new ATOM 0 HA SER A 115 11.058 9.405 5.101 1.00 10.22 H new ATOM 0 HB2 SER A 115 10.574 9.708 7.532 1.00 44.44 H new ATOM 0 HB3 SER A 115 9.339 8.779 6.705 1.00 44.44 H new ATOM 0 HG SER A 115 9.948 7.829 8.722 1.00 13.33 H new ATOM 1669 N ALA A 116 13.162 10.025 6.529 1.00 61.43 N ATOM 1670 CA ALA A 116 14.493 10.389 7.008 1.00 34.42 C ATOM 1671 C ALA A 116 14.613 10.177 8.527 1.00 5.14 C ATOM 1672 O ALA A 116 15.425 10.821 9.201 1.00 4.14 O ATOM 1673 CB ALA A 116 14.759 11.849 6.629 1.00 50.34 C ATOM 0 H ALA A 116 12.534 10.827 6.473 1.00 61.43 H new ATOM 0 HA ALA A 116 15.240 9.747 6.541 1.00 34.42 H new ATOM 0 HB1 ALA A 116 15.749 12.141 6.978 1.00 50.34 H new ATOM 0 HB2 ALA A 116 14.709 11.959 5.546 1.00 50.34 H new ATOM 0 HB3 ALA A 116 14.008 12.488 7.093 1.00 50.34 H new ATOM 1679 N GLY A 117 13.747 9.342 9.107 1.00 42.24 N ATOM 1680 CA GLY A 117 13.718 9.134 10.539 1.00 54.10 C ATOM 1681 C GLY A 117 13.182 10.343 11.303 1.00 41.30 C ATOM 1682 O GLY A 117 13.512 10.509 12.482 1.00 3.45 O ATOM 0 H GLY A 117 13.054 8.799 8.592 1.00 42.24 H new ATOM 0 HA2 GLY A 117 13.099 8.265 10.763 1.00 54.10 H new ATOM 0 HA3 GLY A 117 14.725 8.906 10.889 1.00 54.10 H new ATOM 1686 N THR A 118 12.362 11.191 10.677 1.00 22.44 N ATOM 1687 CA THR A 118 11.680 12.295 11.343 1.00 14.42 C ATOM 1688 C THR A 118 10.159 12.082 11.282 1.00 65.12 C ATOM 1689 O THR A 118 9.662 11.289 10.478 1.00 11.13 O ATOM 1690 CB THR A 118 12.168 13.640 10.762 1.00 43.33 C ATOM 1691 OG1 THR A 118 12.360 13.611 9.356 1.00 70.14 O ATOM 1692 CG2 THR A 118 13.504 14.031 11.397 1.00 44.23 C ATOM 0 H THR A 118 12.153 11.126 9.681 1.00 22.44 H new ATOM 0 HA THR A 118 11.930 12.325 12.403 1.00 14.42 H new ATOM 0 HB THR A 118 11.383 14.361 10.988 1.00 43.33 H new ATOM 0 HG1 THR A 118 12.667 14.490 9.050 1.00 70.14 H new ATOM 0 HG21 THR A 118 13.840 14.981 10.981 1.00 44.23 H new ATOM 0 HG22 THR A 118 13.379 14.131 12.475 1.00 44.23 H new ATOM 0 HG23 THR A 118 14.246 13.260 11.188 1.00 44.23 H new ATOM 1700 N ASN A 119 9.426 12.759 12.175 1.00 51.50 N ATOM 1701 CA ASN A 119 7.965 12.821 12.275 1.00 10.10 C ATOM 1702 C ASN A 119 7.305 11.441 12.286 1.00 21.02 C ATOM 1703 O ASN A 119 6.192 11.283 11.784 1.00 21.30 O ATOM 1704 CB ASN A 119 7.382 13.738 11.186 1.00 44.55 C ATOM 1705 CG ASN A 119 7.993 15.131 11.193 1.00 11.41 C ATOM 1706 OD1 ASN A 119 7.998 15.819 12.213 1.00 31.23 O ATOM 1707 ND2 ASN A 119 8.566 15.552 10.085 1.00 23.13 N ATOM 0 H ASN A 119 9.874 13.319 12.900 1.00 51.50 H new ATOM 0 HA ASN A 119 7.730 13.260 13.245 1.00 10.10 H new ATOM 0 HB2 ASN A 119 7.543 13.281 10.210 1.00 44.55 H new ATOM 0 HB3 ASN A 119 6.304 13.819 11.326 1.00 44.55 H new ATOM 0 HD21 ASN A 119 9.024 16.463 10.062 1.00 23.13 H new ATOM 0 HD22 ASN A 119 8.552 14.967 9.249 1.00 23.13 H new ATOM 1713 N HIS A 120 7.969 10.421 12.844 1.00 5.21 N ATOM 1714 CA HIS A 120 7.522 9.047 12.697 1.00 62.43 C ATOM 1715 C HIS A 120 6.154 8.821 13.331 1.00 23.41 C ATOM 1716 O HIS A 120 5.426 7.930 12.912 1.00 13.42 O ATOM 1717 CB HIS A 120 8.561 8.052 13.244 1.00 65.05 C ATOM 1718 CG HIS A 120 8.605 7.872 14.746 1.00 31.21 C ATOM 1719 ND1 HIS A 120 7.625 7.349 15.550 1.00 22.30 N flip ATOM 1720 CD2 HIS A 120 9.692 8.123 15.546 1.00 31.30 C flip ATOM 1721 CE1 HIS A 120 8.103 7.346 16.867 1.00 3.12 C flip ATOM 1722 NE2 HIS A 120 9.377 7.781 16.804 1.00 10.11 N flip ATOM 0 H HIS A 120 8.817 10.530 13.400 1.00 5.21 H new ATOM 0 HA HIS A 120 7.417 8.862 11.628 1.00 62.43 H new ATOM 0 HB2 HIS A 120 8.372 7.079 12.790 1.00 65.05 H new ATOM 0 HB3 HIS A 120 9.548 8.373 12.911 1.00 65.05 H new ATOM 0 HD2 HIS A 120 10.639 8.527 15.218 1.00 31.30 H new ATOM 0 HE1 HIS A 120 7.560 7.054 17.754 1.00 3.12 H new ATOM 0 HE2 HIS A 120 10.012 7.842 17.600 1.00 10.11 H new ATOM 1729 N LYS A 121 5.785 9.599 14.352 1.00 50.21 N ATOM 1730 CA LYS A 121 4.457 9.456 14.934 1.00 14.53 C ATOM 1731 C LYS A 121 3.408 9.988 13.968 1.00 1.10 C ATOM 1732 O LYS A 121 2.370 9.355 13.787 1.00 41.13 O ATOM 1733 CB LYS A 121 4.382 10.207 16.272 1.00 21.40 C ATOM 1734 CG LYS A 121 4.125 9.284 17.462 1.00 30.10 C ATOM 1735 CD LYS A 121 2.812 8.491 17.367 1.00 45.35 C ATOM 1736 CE LYS A 121 2.444 7.798 18.682 1.00 3.24 C ATOM 1737 NZ LYS A 121 3.545 6.976 19.233 1.00 2.22 N ATOM 0 H LYS A 121 6.372 10.315 14.780 1.00 50.21 H new ATOM 0 HA LYS A 121 4.261 8.400 15.118 1.00 14.53 H new ATOM 0 HB2 LYS A 121 5.316 10.746 16.432 1.00 21.40 H new ATOM 0 HB3 LYS A 121 3.589 10.953 16.220 1.00 21.40 H new ATOM 0 HG2 LYS A 121 4.955 8.583 17.551 1.00 30.10 H new ATOM 0 HG3 LYS A 121 4.112 9.880 18.375 1.00 30.10 H new ATOM 0 HD2 LYS A 121 2.005 9.165 17.078 1.00 45.35 H new ATOM 0 HD3 LYS A 121 2.900 7.743 16.579 1.00 45.35 H new ATOM 0 HE2 LYS A 121 2.159 8.552 19.416 1.00 3.24 H new ATOM 0 HE3 LYS A 121 1.572 7.165 18.520 1.00 3.24 H new ATOM 0 HZ1 LYS A 121 3.200 6.440 20.055 1.00 2.22 H new ATOM 0 HZ2 LYS A 121 3.882 6.314 18.505 1.00 2.22 H new ATOM 0 HZ3 LYS A 121 4.327 7.595 19.527 1.00 2.22 H new ATOM 1747 N ALA A 122 3.697 11.143 13.361 1.00 30.04 N ATOM 1748 CA ALA A 122 2.747 11.858 12.535 1.00 5.51 C ATOM 1749 C ALA A 122 2.314 10.976 11.376 1.00 73.01 C ATOM 1750 O ALA A 122 1.117 10.892 11.136 1.00 51.44 O ATOM 1751 CB ALA A 122 3.316 13.188 12.029 1.00 25.00 C ATOM 0 H ALA A 122 4.605 11.602 13.436 1.00 30.04 H new ATOM 0 HA ALA A 122 1.878 12.100 13.147 1.00 5.51 H new ATOM 0 HB1 ALA A 122 2.571 13.692 11.413 1.00 25.00 H new ATOM 0 HB2 ALA A 122 3.573 13.821 12.879 1.00 25.00 H new ATOM 0 HB3 ALA A 122 4.210 12.999 11.434 1.00 25.00 H new ATOM 1757 N TYR A 123 3.254 10.309 10.689 1.00 42.14 N ATOM 1758 CA TYR A 123 2.945 9.569 9.465 1.00 11.10 C ATOM 1759 C TYR A 123 1.870 8.518 9.745 1.00 1.32 C ATOM 1760 O TYR A 123 0.891 8.442 9.009 1.00 45.53 O ATOM 1761 CB TYR A 123 4.213 8.960 8.831 1.00 61.03 C ATOM 1762 CG TYR A 123 4.577 7.513 9.123 1.00 3.21 C ATOM 1763 CD1 TYR A 123 3.910 6.449 8.489 1.00 62.45 C ATOM 1764 CD2 TYR A 123 5.642 7.230 9.983 1.00 52.41 C ATOM 1765 CE1 TYR A 123 4.300 5.120 8.746 1.00 63.22 C ATOM 1766 CE2 TYR A 123 6.054 5.913 10.237 1.00 2.23 C ATOM 1767 CZ TYR A 123 5.381 4.846 9.613 1.00 73.45 C ATOM 1768 OH TYR A 123 5.792 3.575 9.854 1.00 73.14 O ATOM 0 H TYR A 123 4.235 10.270 10.965 1.00 42.14 H new ATOM 0 HA TYR A 123 2.546 10.266 8.729 1.00 11.10 H new ATOM 0 HB2 TYR A 123 4.118 9.061 7.750 1.00 61.03 H new ATOM 0 HB3 TYR A 123 5.058 9.577 9.135 1.00 61.03 H new ATOM 0 HD1 TYR A 123 3.099 6.651 7.805 1.00 62.45 H new ATOM 0 HD2 TYR A 123 6.161 8.046 10.464 1.00 52.41 H new ATOM 0 HE1 TYR A 123 3.769 4.305 8.277 1.00 63.22 H new ATOM 0 HE2 TYR A 123 6.880 5.720 10.905 1.00 2.23 H new ATOM 0 HH TYR A 123 5.628 3.022 9.062 1.00 73.14 H new ATOM 1777 N VAL A 124 2.035 7.754 10.829 1.00 43.33 N ATOM 1778 CA VAL A 124 1.159 6.660 11.223 1.00 53.35 C ATOM 1779 C VAL A 124 -0.241 7.236 11.493 1.00 34.24 C ATOM 1780 O VAL A 124 -1.245 6.780 10.939 1.00 50.22 O ATOM 1781 CB VAL A 124 1.786 5.944 12.450 1.00 31.31 C ATOM 1782 CG1 VAL A 124 1.020 4.737 13.015 1.00 4.43 C ATOM 1783 CG2 VAL A 124 3.193 5.426 12.123 1.00 42.15 C ATOM 0 H VAL A 124 2.812 7.890 11.476 1.00 43.33 H new ATOM 0 HA VAL A 124 1.052 5.910 10.439 1.00 53.35 H new ATOM 0 HB VAL A 124 1.768 6.730 13.205 1.00 31.31 H new ATOM 0 HG11 VAL A 124 1.563 4.328 13.868 1.00 4.43 H new ATOM 0 HG12 VAL A 124 0.027 5.053 13.335 1.00 4.43 H new ATOM 0 HG13 VAL A 124 0.926 3.972 12.244 1.00 4.43 H new ATOM 0 HG21 VAL A 124 3.610 4.929 12.999 1.00 42.15 H new ATOM 0 HG22 VAL A 124 3.137 4.718 11.296 1.00 42.15 H new ATOM 0 HG23 VAL A 124 3.833 6.263 11.842 1.00 42.15 H new ATOM 1793 N SER A 125 -0.323 8.267 12.336 1.00 43.24 N ATOM 1794 CA SER A 125 -1.599 8.822 12.775 1.00 10.30 C ATOM 1795 C SER A 125 -2.337 9.542 11.632 1.00 31.20 C ATOM 1796 O SER A 125 -3.544 9.361 11.459 1.00 75.05 O ATOM 1797 CB SER A 125 -1.328 9.735 13.973 1.00 64.22 C ATOM 1798 OG SER A 125 -0.573 9.016 14.941 1.00 13.43 O ATOM 0 H SER A 125 0.491 8.737 12.731 1.00 43.24 H new ATOM 0 HA SER A 125 -2.270 8.020 13.081 1.00 10.30 H new ATOM 0 HB2 SER A 125 -0.783 10.623 13.654 1.00 64.22 H new ATOM 0 HB3 SER A 125 -2.268 10.077 14.406 1.00 64.22 H new ATOM 0 HG SER A 125 0.376 9.040 14.699 1.00 13.43 H new ATOM 1803 N HIS A 126 -1.621 10.320 10.815 1.00 25.04 N ATOM 1804 CA HIS A 126 -2.157 11.011 9.660 1.00 74.42 C ATOM 1805 C HIS A 126 -2.622 10.039 8.588 1.00 33.41 C ATOM 1806 O HIS A 126 -3.652 10.296 7.960 1.00 31.33 O ATOM 1807 CB HIS A 126 -1.084 11.944 9.099 1.00 32.22 C ATOM 1808 CG HIS A 126 -0.961 13.192 9.928 1.00 13.40 C ATOM 1809 ND1 HIS A 126 -0.613 13.309 11.255 1.00 25.20 N ATOM 1810 CD2 HIS A 126 -1.410 14.402 9.514 1.00 44.33 C ATOM 1811 CE1 HIS A 126 -0.862 14.578 11.624 1.00 10.30 C ATOM 1812 NE2 HIS A 126 -1.347 15.292 10.591 1.00 13.12 N ATOM 0 H HIS A 126 -0.624 10.485 10.951 1.00 25.04 H new ATOM 0 HA HIS A 126 -3.028 11.587 9.973 1.00 74.42 H new ATOM 0 HB2 HIS A 126 -0.125 11.426 9.073 1.00 32.22 H new ATOM 0 HB3 HIS A 126 -1.331 12.210 8.071 1.00 32.22 H new ATOM 0 HD1 HIS A 126 -0.236 12.570 11.848 1.00 25.20 H new ATOM 0 HD2 HIS A 126 -1.758 14.639 8.519 1.00 44.33 H new ATOM 0 HE1 HIS A 126 -0.695 14.971 12.616 1.00 10.30 H new ATOM 1819 N PHE A 127 -1.872 8.959 8.345 1.00 53.45 N ATOM 1820 CA PHE A 127 -2.282 7.928 7.406 1.00 50.45 C ATOM 1821 C PHE A 127 -3.621 7.356 7.846 1.00 2.22 C ATOM 1822 O PHE A 127 -4.542 7.321 7.033 1.00 24.40 O ATOM 1823 CB PHE A 127 -1.223 6.829 7.278 1.00 71.35 C ATOM 1824 CG PHE A 127 -1.709 5.602 6.525 1.00 10.10 C ATOM 1825 CD1 PHE A 127 -1.953 5.653 5.136 1.00 22.24 C ATOM 1826 CD2 PHE A 127 -1.941 4.405 7.229 1.00 44.12 C ATOM 1827 CE1 PHE A 127 -2.344 4.491 4.450 1.00 41.42 C ATOM 1828 CE2 PHE A 127 -2.353 3.250 6.544 1.00 31.44 C ATOM 1829 CZ PHE A 127 -2.535 3.290 5.153 1.00 63.22 C ATOM 0 H PHE A 127 -0.973 8.782 8.793 1.00 53.45 H new ATOM 0 HA PHE A 127 -2.390 8.374 6.417 1.00 50.45 H new ATOM 0 HB2 PHE A 127 -0.349 7.235 6.769 1.00 71.35 H new ATOM 0 HB3 PHE A 127 -0.900 6.529 8.275 1.00 71.35 H new ATOM 0 HD1 PHE A 127 -1.839 6.584 4.601 1.00 22.24 H new ATOM 0 HD2 PHE A 127 -1.802 4.375 8.300 1.00 44.12 H new ATOM 0 HE1 PHE A 127 -2.498 4.521 3.381 1.00 41.42 H new ATOM 0 HE2 PHE A 127 -2.529 2.333 7.087 1.00 31.44 H new ATOM 0 HZ PHE A 127 -2.823 2.395 4.622 1.00 63.22 H new ATOM 1838 N ASN A 128 -3.730 6.956 9.120 1.00 53.22 N ATOM 1839 CA ASN A 128 -4.923 6.308 9.650 1.00 40.21 C ATOM 1840 C ASN A 128 -6.168 7.124 9.358 1.00 51.15 C ATOM 1841 O ASN A 128 -7.129 6.562 8.847 1.00 34.33 O ATOM 1842 CB ASN A 128 -4.824 6.034 11.156 1.00 32.41 C ATOM 1843 CG ASN A 128 -4.253 4.654 11.408 1.00 21.02 C ATOM 1844 OD1 ASN A 128 -4.970 3.655 11.388 1.00 2.13 O ATOM 1845 ND2 ASN A 128 -2.953 4.558 11.575 1.00 71.03 N ATOM 0 H ASN A 128 -2.987 7.076 9.809 1.00 53.22 H new ATOM 0 HA ASN A 128 -4.998 5.347 9.141 1.00 40.21 H new ATOM 0 HB2 ASN A 128 -4.193 6.787 11.628 1.00 32.41 H new ATOM 0 HB3 ASN A 128 -5.811 6.114 11.612 1.00 32.41 H new ATOM 0 HD21 ASN A 128 -2.520 3.642 11.691 1.00 71.03 H new ATOM 0 HD22 ASN A 128 -2.377 5.400 11.588 1.00 71.03 H new ATOM 1851 N GLU A 129 -6.153 8.430 9.633 1.00 22.23 N ATOM 1852 CA GLU A 129 -7.323 9.280 9.417 1.00 64.43 C ATOM 1853 C GLU A 129 -7.818 9.251 7.971 1.00 60.43 C ATOM 1854 O GLU A 129 -9.022 9.368 7.741 1.00 41.12 O ATOM 1855 CB GLU A 129 -6.999 10.729 9.779 1.00 64.44 C ATOM 1856 CG GLU A 129 -7.063 11.006 11.277 1.00 12.53 C ATOM 1857 CD GLU A 129 -7.225 12.504 11.505 1.00 71.33 C ATOM 1858 OE1 GLU A 129 -6.259 13.250 11.223 1.00 41.31 O ATOM 1859 OE2 GLU A 129 -8.349 12.929 11.849 1.00 11.10 O ATOM 0 H GLU A 129 -5.341 8.922 10.006 1.00 22.23 H new ATOM 0 HA GLU A 129 -8.110 8.883 10.058 1.00 64.43 H new ATOM 0 HB2 GLU A 129 -6.001 10.973 9.414 1.00 64.44 H new ATOM 0 HB3 GLU A 129 -7.697 11.389 9.264 1.00 64.44 H new ATOM 0 HG2 GLU A 129 -7.898 10.466 11.723 1.00 12.53 H new ATOM 0 HG3 GLU A 129 -6.156 10.648 11.764 1.00 12.53 H new ATOM 1864 N TRP A 130 -6.899 9.137 7.013 1.00 75.24 N ATOM 1865 CA TRP A 130 -7.165 9.285 5.588 1.00 24.21 C ATOM 1866 C TRP A 130 -7.326 7.938 4.894 1.00 42.21 C ATOM 1867 O TRP A 130 -7.616 7.918 3.702 1.00 63.44 O ATOM 1868 CB TRP A 130 -5.990 10.037 4.943 1.00 52.21 C ATOM 1869 CG TRP A 130 -5.945 11.507 5.212 1.00 33.42 C ATOM 1870 CD1 TRP A 130 -5.858 12.092 6.426 1.00 63.14 C ATOM 1871 CD2 TRP A 130 -6.089 12.598 4.262 1.00 73.31 C ATOM 1872 NE1 TRP A 130 -5.947 13.462 6.298 1.00 13.31 N ATOM 1873 CE2 TRP A 130 -6.096 13.828 4.983 1.00 0.11 C ATOM 1874 CE3 TRP A 130 -6.253 12.668 2.864 1.00 35.20 C ATOM 1875 CZ2 TRP A 130 -6.252 15.066 4.351 1.00 32.21 C ATOM 1876 CZ3 TRP A 130 -6.485 13.897 2.229 1.00 12.32 C ATOM 1877 CH2 TRP A 130 -6.494 15.088 2.971 1.00 63.24 C ATOM 0 H TRP A 130 -5.920 8.933 7.216 1.00 75.24 H new ATOM 0 HA TRP A 130 -8.099 9.836 5.474 1.00 24.21 H new ATOM 0 HB2 TRP A 130 -5.059 9.592 5.294 1.00 52.21 H new ATOM 0 HB3 TRP A 130 -6.030 9.883 3.865 1.00 52.21 H new ATOM 0 HD1 TRP A 130 -5.737 11.564 7.360 1.00 63.14 H new ATOM 0 HE1 TRP A 130 -5.907 14.118 7.078 1.00 13.31 H new ATOM 0 HE3 TRP A 130 -6.199 11.765 2.275 1.00 35.20 H new ATOM 0 HZ2 TRP A 130 -6.187 15.985 4.914 1.00 32.21 H new ATOM 0 HZ3 TRP A 130 -6.658 13.927 1.163 1.00 12.32 H new ATOM 0 HH2 TRP A 130 -6.689 16.028 2.475 1.00 63.24 H new ATOM 1887 N ALA A 131 -7.069 6.831 5.592 1.00 71.12 N ATOM 1888 CA ALA A 131 -7.023 5.494 5.023 1.00 14.23 C ATOM 1889 C ALA A 131 -7.724 4.478 5.917 1.00 15.50 C ATOM 1890 O ALA A 131 -7.547 3.265 5.764 1.00 0.43 O ATOM 1891 CB ALA A 131 -5.574 5.111 4.720 1.00 1.54 C ATOM 0 H ALA A 131 -6.883 6.846 6.595 1.00 71.12 H new ATOM 0 HA ALA A 131 -7.573 5.491 4.082 1.00 14.23 H new ATOM 0 HB1 ALA A 131 -5.544 4.108 4.294 1.00 1.54 H new ATOM 0 HB2 ALA A 131 -5.151 5.820 4.009 1.00 1.54 H new ATOM 0 HB3 ALA A 131 -4.992 5.131 5.641 1.00 1.54 H new ATOM 1897 N ASP A 132 -8.553 4.966 6.835 1.00 62.35 N ATOM 1898 CA ASP A 132 -9.423 4.171 7.655 1.00 20.34 C ATOM 1899 C ASP A 132 -10.369 3.401 6.741 1.00 0.23 C ATOM 1900 O ASP A 132 -10.823 3.924 5.716 1.00 35.03 O ATOM 1901 CB ASP A 132 -10.186 5.079 8.628 1.00 72.44 C ATOM 1902 CG ASP A 132 -10.698 4.344 9.863 1.00 54.41 C ATOM 1903 OD1 ASP A 132 -10.387 3.143 10.063 1.00 71.25 O ATOM 1904 OD2 ASP A 132 -11.383 5.014 10.664 1.00 72.24 O ATOM 0 H ASP A 132 -8.630 5.965 7.025 1.00 62.35 H new ATOM 0 HA ASP A 132 -8.853 3.459 8.252 1.00 20.34 H new ATOM 0 HB2 ASP A 132 -9.533 5.893 8.943 1.00 72.44 H new ATOM 0 HB3 ASP A 132 -11.030 5.531 8.107 1.00 72.44 H new ATOM 1908 N GLY A 133 -10.620 2.146 7.069 1.00 14.42 N ATOM 1909 CA GLY A 133 -11.642 1.334 6.419 1.00 40.51 C ATOM 1910 C GLY A 133 -11.124 0.146 5.612 1.00 35.40 C ATOM 1911 O GLY A 133 -11.811 -0.257 4.673 1.00 31.13 O ATOM 0 H GLY A 133 -10.114 1.652 7.804 1.00 14.42 H new ATOM 0 HA2 GLY A 133 -12.325 0.962 7.182 1.00 40.51 H new ATOM 0 HA3 GLY A 133 -12.223 1.975 5.756 1.00 40.51 H new ATOM 1915 N LEU A 134 -9.934 -0.399 5.889 1.00 61.21 N ATOM 1916 CA LEU A 134 -9.534 -1.744 5.459 1.00 13.10 C ATOM 1917 C LEU A 134 -8.869 -2.475 6.622 1.00 63.22 C ATOM 1918 O LEU A 134 -8.489 -1.851 7.616 1.00 52.54 O ATOM 1919 CB LEU A 134 -8.531 -1.676 4.303 1.00 74.03 C ATOM 1920 CG LEU A 134 -9.102 -1.091 3.007 1.00 71.22 C ATOM 1921 CD1 LEU A 134 -7.948 -0.748 2.083 1.00 51.02 C ATOM 1922 CD2 LEU A 134 -10.080 -2.032 2.296 1.00 64.15 C ATOM 0 H LEU A 134 -9.214 0.086 6.424 1.00 61.21 H new ATOM 0 HA LEU A 134 -10.429 -2.271 5.130 1.00 13.10 H new ATOM 0 HB2 LEU A 134 -7.676 -1.075 4.614 1.00 74.03 H new ATOM 0 HB3 LEU A 134 -8.158 -2.680 4.101 1.00 74.03 H new ATOM 0 HG LEU A 134 -9.674 -0.201 3.270 1.00 71.22 H new ATOM 0 HD11 LEU A 134 -8.337 -0.330 1.155 1.00 51.02 H new ATOM 0 HD12 LEU A 134 -7.300 -0.017 2.566 1.00 51.02 H new ATOM 0 HD13 LEU A 134 -7.377 -1.650 1.863 1.00 51.02 H new ATOM 0 HD21 LEU A 134 -10.446 -1.556 1.386 1.00 64.15 H new ATOM 0 HD22 LEU A 134 -9.570 -2.961 2.040 1.00 64.15 H new ATOM 0 HD23 LEU A 134 -10.920 -2.249 2.955 1.00 64.15 H new ATOM 1933 N ASN A 135 -8.691 -3.783 6.476 1.00 73.54 N ATOM 1934 CA ASN A 135 -8.005 -4.647 7.428 1.00 3.30 C ATOM 1935 C ASN A 135 -6.493 -4.416 7.378 1.00 21.14 C ATOM 1936 O ASN A 135 -5.790 -5.020 6.565 1.00 44.15 O ATOM 1937 CB ASN A 135 -8.349 -6.094 7.086 1.00 35.11 C ATOM 1938 CG ASN A 135 -7.499 -7.087 7.858 1.00 21.40 C ATOM 1939 OD1 ASN A 135 -7.359 -6.992 9.073 1.00 43.05 O ATOM 1940 ND2 ASN A 135 -6.938 -8.061 7.166 1.00 62.45 N ATOM 0 H ASN A 135 -9.034 -4.290 5.660 1.00 73.54 H new ATOM 0 HA ASN A 135 -8.330 -4.419 8.443 1.00 3.30 H new ATOM 0 HB2 ASN A 135 -9.402 -6.275 7.302 1.00 35.11 H new ATOM 0 HB3 ASN A 135 -8.211 -6.255 6.017 1.00 35.11 H new ATOM 0 HD21 ASN A 135 -6.369 -8.762 7.641 1.00 62.45 H new ATOM 0 HD22 ASN A 135 -7.073 -8.113 6.156 1.00 62.45 H new ATOM 1946 N VAL A 136 -5.990 -3.524 8.228 1.00 4.44 N ATOM 1947 CA VAL A 136 -4.567 -3.219 8.310 1.00 41.55 C ATOM 1948 C VAL A 136 -3.902 -4.279 9.188 1.00 23.21 C ATOM 1949 O VAL A 136 -4.243 -4.411 10.367 1.00 13.14 O ATOM 1950 CB VAL A 136 -4.347 -1.778 8.816 1.00 41.14 C ATOM 1951 CG1 VAL A 136 -2.854 -1.442 8.946 1.00 21.34 C ATOM 1952 CG2 VAL A 136 -4.966 -0.781 7.825 1.00 22.23 C ATOM 0 H VAL A 136 -6.563 -2.990 8.882 1.00 4.44 H new ATOM 0 HA VAL A 136 -4.103 -3.255 7.325 1.00 41.55 H new ATOM 0 HB VAL A 136 -4.818 -1.705 9.796 1.00 41.14 H new ATOM 0 HG11 VAL A 136 -2.741 -0.419 9.305 1.00 21.34 H new ATOM 0 HG12 VAL A 136 -2.387 -2.128 9.653 1.00 21.34 H new ATOM 0 HG13 VAL A 136 -2.373 -1.540 7.973 1.00 21.34 H new ATOM 0 HG21 VAL A 136 -4.809 0.236 8.186 1.00 22.23 H new ATOM 0 HG22 VAL A 136 -4.494 -0.897 6.849 1.00 22.23 H new ATOM 0 HG23 VAL A 136 -6.035 -0.973 7.736 1.00 22.23 H new ATOM 1962 N ILE A 137 -2.960 -5.046 8.637 1.00 34.11 N ATOM 1963 CA ILE A 137 -2.193 -6.046 9.382 1.00 2.24 C ATOM 1964 C ILE A 137 -0.898 -5.475 9.982 1.00 70.43 C ATOM 1965 O ILE A 137 -0.265 -6.157 10.785 1.00 63.41 O ATOM 1966 CB ILE A 137 -1.936 -7.280 8.497 1.00 62.45 C ATOM 1967 CG1 ILE A 137 -1.224 -6.905 7.188 1.00 22.41 C ATOM 1968 CG2 ILE A 137 -3.262 -7.984 8.172 1.00 63.11 C ATOM 1969 CD1 ILE A 137 -0.356 -8.026 6.637 1.00 32.33 C ATOM 0 H ILE A 137 -2.705 -4.990 7.651 1.00 34.11 H new ATOM 0 HA ILE A 137 -2.792 -6.359 10.237 1.00 2.24 H new ATOM 0 HB ILE A 137 -1.287 -7.953 9.057 1.00 62.45 H new ATOM 0 HG12 ILE A 137 -1.970 -6.631 6.442 1.00 22.41 H new ATOM 0 HG13 ILE A 137 -0.605 -6.024 7.358 1.00 22.41 H new ATOM 0 HG21 ILE A 137 -3.068 -8.855 7.546 1.00 63.11 H new ATOM 0 HG22 ILE A 137 -3.741 -8.302 9.098 1.00 63.11 H new ATOM 0 HG23 ILE A 137 -3.919 -7.295 7.641 1.00 63.11 H new ATOM 0 HD11 ILE A 137 0.119 -7.698 5.712 1.00 32.33 H new ATOM 0 HD12 ILE A 137 0.411 -8.284 7.367 1.00 32.33 H new ATOM 0 HD13 ILE A 137 -0.975 -8.900 6.436 1.00 32.33 H new ATOM 1980 N GLY A 138 -0.510 -4.239 9.642 1.00 73.31 N ATOM 1981 CA GLY A 138 0.607 -3.539 10.262 1.00 61.23 C ATOM 1982 C GLY A 138 1.022 -2.329 9.430 1.00 2.50 C ATOM 1983 O GLY A 138 0.805 -2.305 8.214 1.00 52.21 O ATOM 0 H GLY A 138 -0.975 -3.694 8.916 1.00 73.31 H new ATOM 0 HA2 GLY A 138 0.328 -3.217 11.265 1.00 61.23 H new ATOM 0 HA3 GLY A 138 1.452 -4.219 10.369 1.00 61.23 H new ATOM 1987 N VAL A 139 1.629 -1.331 10.081 1.00 1.23 N ATOM 1988 CA VAL A 139 2.230 -0.164 9.453 1.00 74.11 C ATOM 1989 C VAL A 139 3.607 -0.006 10.097 1.00 22.21 C ATOM 1990 O VAL A 139 3.716 0.381 11.267 1.00 52.33 O ATOM 1991 CB VAL A 139 1.346 1.096 9.608 1.00 30.30 C ATOM 1992 CG1 VAL A 139 1.873 2.246 8.731 1.00 24.30 C ATOM 1993 CG2 VAL A 139 -0.117 0.779 9.256 1.00 61.11 C ATOM 0 H VAL A 139 1.715 -1.320 11.097 1.00 1.23 H new ATOM 0 HA VAL A 139 2.324 -0.295 8.375 1.00 74.11 H new ATOM 0 HB VAL A 139 1.390 1.413 10.650 1.00 30.30 H new ATOM 0 HG11 VAL A 139 1.235 3.121 8.857 1.00 24.30 H new ATOM 0 HG12 VAL A 139 2.892 2.494 9.029 1.00 24.30 H new ATOM 0 HG13 VAL A 139 1.866 1.939 7.685 1.00 24.30 H new ATOM 0 HG21 VAL A 139 -0.722 1.678 9.371 1.00 61.11 H new ATOM 0 HG22 VAL A 139 -0.176 0.432 8.224 1.00 61.11 H new ATOM 0 HG23 VAL A 139 -0.491 0.002 9.922 1.00 61.11 H new ATOM 2003 N ALA A 140 4.666 -0.353 9.372 1.00 64.35 N ATOM 2004 CA ALA A 140 6.052 -0.126 9.777 1.00 42.41 C ATOM 2005 C ALA A 140 6.698 0.817 8.768 1.00 65.02 C ATOM 2006 O ALA A 140 5.997 1.538 8.044 1.00 1.23 O ATOM 2007 CB ALA A 140 6.803 -1.452 9.951 1.00 43.52 C ATOM 0 H ALA A 140 4.584 -0.811 8.464 1.00 64.35 H new ATOM 0 HA ALA A 140 6.093 0.350 10.757 1.00 42.41 H new ATOM 0 HB1 ALA A 140 7.831 -1.251 10.252 1.00 43.52 H new ATOM 0 HB2 ALA A 140 6.311 -2.051 10.717 1.00 43.52 H new ATOM 0 HB3 ALA A 140 6.802 -1.997 9.007 1.00 43.52 H new ATOM 2013 N ARG A 141 8.028 0.889 8.755 1.00 2.34 N ATOM 2014 CA ARG A 141 8.768 1.749 7.845 1.00 53.52 C ATOM 2015 C ARG A 141 9.894 0.951 7.204 1.00 62.22 C ATOM 2016 O ARG A 141 10.323 -0.053 7.778 1.00 71.41 O ATOM 2017 CB ARG A 141 9.267 2.987 8.606 1.00 1.30 C ATOM 2018 CG ARG A 141 10.412 2.637 9.572 1.00 72.42 C ATOM 2019 CD ARG A 141 10.234 3.236 10.968 1.00 44.13 C ATOM 2020 NE ARG A 141 10.835 4.569 11.055 1.00 13.24 N ATOM 2021 CZ ARG A 141 11.091 5.231 12.180 1.00 13.42 C ATOM 2022 NH1 ARG A 141 10.514 4.884 13.330 1.00 43.11 N ATOM 2023 NH2 ARG A 141 11.969 6.215 12.135 1.00 72.05 N ATOM 0 H ARG A 141 8.623 0.347 9.382 1.00 2.34 H new ATOM 0 HA ARG A 141 8.127 2.106 7.039 1.00 53.52 H new ATOM 0 HB2 ARG A 141 9.608 3.739 7.894 1.00 1.30 H new ATOM 0 HB3 ARG A 141 8.442 3.428 9.165 1.00 1.30 H new ATOM 0 HG2 ARG A 141 10.487 1.553 9.657 1.00 72.42 H new ATOM 0 HG3 ARG A 141 11.353 2.990 9.151 1.00 72.42 H new ATOM 0 HD2 ARG A 141 9.172 3.297 11.207 1.00 44.13 H new ATOM 0 HD3 ARG A 141 10.691 2.580 11.709 1.00 44.13 H new ATOM 0 HE ARG A 141 11.078 5.029 10.178 1.00 13.24 H new ATOM 0 HH11 ARG A 141 9.864 4.099 13.358 1.00 43.11 H new ATOM 0 HH12 ARG A 141 10.723 5.404 14.183 1.00 43.11 H new ATOM 0 HH21 ARG A 141 12.429 6.448 11.255 1.00 72.05 H new ATOM 0 HH22 ARG A 141 12.188 6.742 12.980 1.00 72.05 H new ATOM 2034 N ASP A 142 10.393 1.441 6.065 1.00 53.31 N ATOM 2035 CA ASP A 142 11.361 0.730 5.234 1.00 50.22 C ATOM 2036 C ASP A 142 10.872 -0.711 5.040 1.00 53.43 C ATOM 2037 O ASP A 142 9.667 -0.984 5.071 1.00 65.32 O ATOM 2038 CB ASP A 142 12.789 0.883 5.812 1.00 45.15 C ATOM 2039 CG ASP A 142 13.417 2.232 5.434 1.00 5.10 C ATOM 2040 OD1 ASP A 142 13.870 2.359 4.280 1.00 10.23 O ATOM 2041 OD2 ASP A 142 13.500 3.179 6.258 1.00 52.32 O ATOM 0 H ASP A 142 10.131 2.354 5.692 1.00 53.31 H new ATOM 0 HA ASP A 142 11.433 1.163 4.236 1.00 50.22 H new ATOM 0 HB2 ASP A 142 12.753 0.790 6.897 1.00 45.15 H new ATOM 0 HB3 ASP A 142 13.419 0.073 5.444 1.00 45.15 H new ATOM 2045 N ASP A 143 11.801 -1.626 4.789 1.00 65.43 N ATOM 2046 CA ASP A 143 11.569 -3.055 4.888 1.00 45.34 C ATOM 2047 C ASP A 143 12.082 -3.537 6.232 1.00 72.15 C ATOM 2048 O ASP A 143 13.200 -4.040 6.338 1.00 3.33 O ATOM 2049 CB ASP A 143 12.180 -3.784 3.706 1.00 71.23 C ATOM 2050 CG ASP A 143 11.716 -5.214 3.779 1.00 1.31 C ATOM 2051 OD1 ASP A 143 10.512 -5.404 3.517 1.00 65.41 O ATOM 2052 OD2 ASP A 143 12.540 -6.108 4.086 1.00 5.42 O ATOM 0 H ASP A 143 12.752 -1.388 4.506 1.00 65.43 H new ATOM 0 HA ASP A 143 10.503 -3.276 4.842 1.00 45.34 H new ATOM 0 HB2 ASP A 143 11.868 -3.325 2.768 1.00 71.23 H new ATOM 0 HB3 ASP A 143 13.268 -3.730 3.741 1.00 71.23 H new ATOM 2056 N SER A 144 11.293 -3.295 7.276 1.00 1.23 N ATOM 2057 CA SER A 144 11.596 -3.669 8.648 1.00 70.41 C ATOM 2058 C SER A 144 10.687 -4.790 9.178 1.00 64.24 C ATOM 2059 O SER A 144 11.095 -5.423 10.149 1.00 1.31 O ATOM 2060 CB SER A 144 11.460 -2.410 9.514 1.00 41.34 C ATOM 2061 OG SER A 144 12.000 -2.591 10.812 1.00 51.31 O ATOM 0 H SER A 144 10.397 -2.817 7.183 1.00 1.23 H new ATOM 0 HA SER A 144 12.610 -4.067 8.687 1.00 70.41 H new ATOM 0 HB2 SER A 144 11.967 -1.578 9.025 1.00 41.34 H new ATOM 0 HB3 SER A 144 10.407 -2.139 9.595 1.00 41.34 H new ATOM 0 HG SER A 144 11.894 -1.765 11.329 1.00 51.31 H new ATOM 2066 N GLU A 145 9.486 -5.028 8.623 1.00 12.43 N ATOM 2067 CA GLU A 145 8.486 -5.918 9.245 1.00 72.35 C ATOM 2068 C GLU A 145 7.752 -6.838 8.243 1.00 2.03 C ATOM 2069 O GLU A 145 6.786 -7.495 8.615 1.00 2.01 O ATOM 2070 CB GLU A 145 7.527 -5.095 10.147 1.00 32.12 C ATOM 2071 CG GLU A 145 8.171 -4.803 11.521 1.00 14.10 C ATOM 2072 CD GLU A 145 7.387 -3.900 12.486 1.00 50.23 C ATOM 2073 OE1 GLU A 145 6.201 -4.172 12.790 1.00 23.12 O ATOM 2074 OE2 GLU A 145 8.003 -2.972 13.062 1.00 32.23 O ATOM 0 H GLU A 145 9.182 -4.615 7.741 1.00 12.43 H new ATOM 0 HA GLU A 145 9.027 -6.618 9.881 1.00 72.35 H new ATOM 0 HB2 GLU A 145 7.274 -4.157 9.653 1.00 32.12 H new ATOM 0 HB3 GLU A 145 6.595 -5.643 10.287 1.00 32.12 H new ATOM 0 HG2 GLU A 145 8.350 -5.756 12.020 1.00 14.10 H new ATOM 0 HG3 GLU A 145 9.145 -4.346 11.347 1.00 14.10 H new ATOM 2079 N VAL A 146 8.210 -6.976 6.996 1.00 51.42 N ATOM 2080 CA VAL A 146 7.665 -7.960 6.046 1.00 61.45 C ATOM 2081 C VAL A 146 7.587 -9.381 6.626 1.00 54.12 C ATOM 2082 O VAL A 146 6.621 -10.091 6.348 1.00 42.43 O ATOM 2083 CB VAL A 146 8.432 -7.898 4.708 1.00 51.25 C ATOM 2084 CG1 VAL A 146 9.955 -7.818 4.904 1.00 65.51 C ATOM 2085 CG2 VAL A 146 8.092 -9.051 3.755 1.00 53.15 C ATOM 0 H VAL A 146 8.968 -6.411 6.613 1.00 51.42 H new ATOM 0 HA VAL A 146 6.629 -7.686 5.848 1.00 61.45 H new ATOM 0 HB VAL A 146 8.092 -6.973 4.242 1.00 51.25 H new ATOM 0 HG11 VAL A 146 10.445 -7.777 3.931 1.00 65.51 H new ATOM 0 HG12 VAL A 146 10.202 -6.922 5.473 1.00 65.51 H new ATOM 0 HG13 VAL A 146 10.299 -8.699 5.446 1.00 65.51 H new ATOM 0 HG21 VAL A 146 8.667 -8.944 2.835 1.00 53.15 H new ATOM 0 HG22 VAL A 146 8.340 -10.000 4.230 1.00 53.15 H new ATOM 0 HG23 VAL A 146 7.027 -9.029 3.522 1.00 53.15 H new ATOM 2095 N ASP A 147 8.539 -9.779 7.477 1.00 10.43 N ATOM 2096 CA ASP A 147 8.640 -11.132 8.036 1.00 71.14 C ATOM 2097 C ASP A 147 7.410 -11.533 8.870 1.00 42.14 C ATOM 2098 O ASP A 147 7.200 -12.721 9.126 1.00 51.21 O ATOM 2099 CB ASP A 147 9.916 -11.211 8.888 1.00 70.21 C ATOM 2100 CG ASP A 147 10.184 -12.592 9.493 1.00 21.21 C ATOM 2101 OD1 ASP A 147 10.577 -13.529 8.763 1.00 30.33 O ATOM 2102 OD2 ASP A 147 10.070 -12.732 10.732 1.00 21.20 O ATOM 0 H ASP A 147 9.277 -9.156 7.804 1.00 10.43 H new ATOM 0 HA ASP A 147 8.683 -11.839 7.207 1.00 71.14 H new ATOM 0 HB2 ASP A 147 10.769 -10.925 8.272 1.00 70.21 H new ATOM 0 HB3 ASP A 147 9.846 -10.481 9.694 1.00 70.21 H new ATOM 2106 N LYS A 148 6.579 -10.573 9.302 1.00 12.32 N ATOM 2107 CA LYS A 148 5.296 -10.825 9.973 1.00 52.33 C ATOM 2108 C LYS A 148 4.091 -10.566 9.063 1.00 44.31 C ATOM 2109 O LYS A 148 2.978 -10.936 9.429 1.00 24.24 O ATOM 2110 CB LYS A 148 5.184 -9.989 11.262 1.00 51.25 C ATOM 2111 CG LYS A 148 5.409 -8.495 11.020 1.00 21.21 C ATOM 2112 CD LYS A 148 4.939 -7.581 12.146 1.00 21.32 C ATOM 2113 CE LYS A 148 5.954 -7.592 13.284 1.00 25.23 C ATOM 2114 NZ LYS A 148 5.742 -6.473 14.216 1.00 54.42 N ATOM 0 H LYS A 148 6.785 -9.580 9.192 1.00 12.32 H new ATOM 0 HA LYS A 148 5.279 -11.884 10.229 1.00 52.33 H new ATOM 0 HB2 LYS A 148 4.197 -10.137 11.701 1.00 51.25 H new ATOM 0 HB3 LYS A 148 5.913 -10.349 11.988 1.00 51.25 H new ATOM 0 HG2 LYS A 148 6.473 -8.325 10.855 1.00 21.21 H new ATOM 0 HG3 LYS A 148 4.895 -8.210 10.102 1.00 21.21 H new ATOM 0 HD2 LYS A 148 4.811 -6.565 11.772 1.00 21.32 H new ATOM 0 HD3 LYS A 148 3.967 -7.911 12.512 1.00 21.32 H new ATOM 0 HE2 LYS A 148 5.882 -8.535 13.826 1.00 25.23 H new ATOM 0 HE3 LYS A 148 6.962 -7.537 12.873 1.00 25.23 H new ATOM 0 HZ1 LYS A 148 6.536 -6.423 14.885 1.00 54.42 H new ATOM 0 HZ2 LYS A 148 5.683 -5.583 13.682 1.00 54.42 H new ATOM 0 HZ3 LYS A 148 4.856 -6.621 14.740 1.00 54.42 H new ATOM 2124 N TRP A 149 4.261 -9.919 7.910 1.00 65.22 N ATOM 2125 CA TRP A 149 3.132 -9.579 7.046 1.00 70.22 C ATOM 2126 C TRP A 149 2.809 -10.673 6.027 1.00 41.42 C ATOM 2127 O TRP A 149 1.733 -10.647 5.428 1.00 33.42 O ATOM 2128 CB TRP A 149 3.400 -8.240 6.356 1.00 50.23 C ATOM 2129 CG TRP A 149 3.564 -7.072 7.282 1.00 34.53 C ATOM 2130 CD1 TRP A 149 3.135 -7.000 8.565 1.00 63.25 C ATOM 2131 CD2 TRP A 149 4.215 -5.799 7.016 1.00 3.22 C ATOM 2132 NE1 TRP A 149 3.539 -5.811 9.128 1.00 34.43 N ATOM 2133 CE2 TRP A 149 4.178 -5.014 8.204 1.00 24.11 C ATOM 2134 CE3 TRP A 149 4.838 -5.235 5.885 1.00 64.42 C ATOM 2135 CZ2 TRP A 149 4.734 -3.732 8.267 1.00 24.12 C ATOM 2136 CZ3 TRP A 149 5.373 -3.937 5.926 1.00 41.13 C ATOM 2137 CH2 TRP A 149 5.319 -3.182 7.111 1.00 13.21 C ATOM 0 H TRP A 149 5.169 -9.620 7.554 1.00 65.22 H new ATOM 0 HA TRP A 149 2.248 -9.492 7.678 1.00 70.22 H new ATOM 0 HB2 TRP A 149 4.302 -8.334 5.751 1.00 50.23 H new ATOM 0 HB3 TRP A 149 2.578 -8.030 5.672 1.00 50.23 H new ATOM 0 HD1 TRP A 149 2.561 -7.762 9.071 1.00 63.25 H new ATOM 0 HE1 TRP A 149 3.385 -5.553 10.103 1.00 34.43 H new ATOM 0 HE3 TRP A 149 4.905 -5.809 4.973 1.00 64.42 H new ATOM 0 HZ2 TRP A 149 4.715 -3.172 9.190 1.00 24.12 H new ATOM 0 HZ3 TRP A 149 5.829 -3.516 5.042 1.00 41.13 H new ATOM 0 HH2 TRP A 149 5.726 -2.182 7.134 1.00 13.21 H new ATOM 2147 N SER A 150 3.697 -11.640 5.812 1.00 64.14 N ATOM 2148 CA SER A 150 3.533 -12.724 4.851 1.00 31.10 C ATOM 2149 C SER A 150 4.013 -14.021 5.510 1.00 70.44 C ATOM 2150 O SER A 150 4.972 -14.645 5.066 1.00 42.32 O ATOM 2151 CB SER A 150 4.270 -12.322 3.556 1.00 41.42 C ATOM 2152 OG SER A 150 3.331 -11.867 2.599 1.00 73.43 O ATOM 0 H SER A 150 4.580 -11.691 6.320 1.00 64.14 H new ATOM 0 HA SER A 150 2.497 -12.904 4.564 1.00 31.10 H new ATOM 0 HB2 SER A 150 4.998 -11.539 3.768 1.00 41.42 H new ATOM 0 HB3 SER A 150 4.824 -13.174 3.161 1.00 41.42 H new ATOM 0 HG SER A 150 3.800 -11.610 1.777 1.00 73.43 H new ATOM 2157 N LYS A 151 3.370 -14.402 6.617 1.00 51.34 N ATOM 2158 CA LYS A 151 3.853 -15.428 7.541 1.00 25.51 C ATOM 2159 C LYS A 151 3.096 -16.740 7.374 1.00 30.41 C ATOM 2160 O LYS A 151 2.839 -17.139 6.215 1.00 4.33 O ATOM 2161 CB LYS A 151 3.944 -14.825 8.959 1.00 1.32 C ATOM 2162 CG LYS A 151 2.649 -14.208 9.534 1.00 63.41 C ATOM 2163 CD LYS A 151 1.959 -15.096 10.561 1.00 52.15 C ATOM 2164 CE LYS A 151 2.744 -15.058 11.878 1.00 25.43 C ATOM 2165 NZ LYS A 151 2.490 -16.252 12.700 1.00 50.12 N ATOM 0 H LYS A 151 2.479 -13.995 6.901 1.00 51.34 H new ATOM 0 HA LYS A 151 4.872 -15.735 7.306 1.00 25.51 H new ATOM 0 HB2 LYS A 151 4.281 -15.606 9.640 1.00 1.32 H new ATOM 0 HB3 LYS A 151 4.715 -14.054 8.952 1.00 1.32 H new ATOM 0 HG2 LYS A 151 2.886 -13.249 9.995 1.00 63.41 H new ATOM 0 HG3 LYS A 151 1.957 -14.006 8.716 1.00 63.41 H new ATOM 0 HD2 LYS A 151 0.937 -14.755 10.724 1.00 52.15 H new ATOM 0 HD3 LYS A 151 1.898 -16.119 10.191 1.00 52.15 H new ATOM 0 HE2 LYS A 151 3.810 -14.984 11.664 1.00 25.43 H new ATOM 0 HE3 LYS A 151 2.469 -14.165 12.439 1.00 25.43 H new ATOM 0 HZ1 LYS A 151 3.038 -16.190 13.582 1.00 50.12 H new ATOM 0 HZ2 LYS A 151 1.476 -16.309 12.926 1.00 50.12 H new ATOM 0 HZ3 LYS A 151 2.776 -17.103 12.174 1.00 50.12 H new