USER MOD reduce.3.24.130724 H: found=0, std=0, add=1258, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1259 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 79 MET CE :methyl -113:sc= -0.927 (180deg=-2.08) USER MOD Set 1.2: A 87 MET CE :methyl 168:sc= 0 (180deg=-0.165) USER MOD Set 2.1: A 80 ASN : amide:sc= -1.67 K(o=-1.7,f=-4.2!) USER MOD Set 2.2: A 82 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 73 ASN :FLIP amide:sc= 1.2 F(o=0.42,f=1.6) USER MOD Set 3.2: A 74 HIS : no HE2:sc= 0.403 K(o=1.6,f=-3.3!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -132:sc= 0.0933 (180deg=-0.131) USER MOD Single : A 4 TYR OH : rot 30:sc= 1.24 USER MOD Single : A 5 LYS NZ :NH3+ 179:sc= 0.304 (180deg=0.286) USER MOD Single : A 9 THR OG1 : rot 81:sc= -0.165 USER MOD Single : A 14 SER OG : rot 180:sc= 0.0806 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 20 MET CE :methyl -106:sc= -0.124 (180deg=-1.97!) USER MOD Single : A 21 LYS NZ :NH3+ 177:sc= 0.373 (180deg=0.367) USER MOD Single : A 28 TYR OH : rot -83:sc= 1.09 USER MOD Single : A 31 LYS NZ :NH3+ -128:sc= 0.448 (180deg=-0.849) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 HIS : no HD1:sc= -0.428 X(o=-0.43,f=-0.028) USER MOD Single : A 75 LYS NZ :NH3+ 157:sc= 0.0263 (180deg=0) USER MOD Single : A 81 CYS SG : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ -171:sc=-0.00967 (180deg=-0.0979) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ -166:sc= -0.0275 (180deg=-0.207) USER MOD Single : A 94 LYS NZ :NH3+ -115:sc= -0.06 (180deg=-0.698) USER MOD Single : A 96 MET CE :methyl 146:sc= -0.254 (180deg=-0.963) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN :FLIP amide:sc=-0.00191 F(o=-0.95,f=-0.0019) USER MOD Single : A 102 HIS : no HD1:sc= -0.0135 X(o=-0.013,f=0) USER MOD Single : A 103 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ -166:sc= -0.0137 (180deg=-0.202) USER MOD Single : A 106 ASN : amide:sc= -0.486 K(o=-0.49,f=-2.7!) USER MOD Single : A 107 ASN : amide:sc= -1.39! C(o=-1.4!,f=-5.1!) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ -158:sc= 1.25 (180deg=0.827) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ -148:sc= -0.362 (180deg=-2.44) USER MOD Single : A 121 GLN : amide:sc= -0.0829 X(o=-0.083,f=-0.51) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ -140:sc= -1.58 (180deg=-4.09!) USER MOD Single : A 134 LYS NZ :NH3+ -142:sc= -1.21 (180deg=-3.37!) USER MOD Single : A 135 ASN :FLIP amide:sc= 0 F(o=-0.77,f=0) USER MOD Single : A 150 ASN : amide:sc= -0.915 K(o=-0.92,f=-2.2!) USER MOD Single : A 152 GLN : amide:sc= -2.29! K(o=-2.3!,f=-2.8) USER MOD Single : A 158 TYR OH : rot 180:sc= 0 USER MOD Single : A 164 THR OG1 : rot 180:sc= 0 USER MOD Single : A 168 THR OG1 : rot 180:sc= -0.611 USER MOD Single : A 170 MET CE :methyl 148:sc= 0 (180deg=-1.73!) USER MOD Single : A 173 LYS NZ :NH3+ -134:sc= 1.23 (180deg=-0.753) USER MOD Single : A 180 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.266 4.623 20.916 1.00 44.00 N ATOM 2 CA MET A 1 -3.437 4.844 19.702 1.00 73.24 C ATOM 3 C MET A 1 -4.022 4.103 18.491 1.00 32.13 C ATOM 4 O MET A 1 -5.108 3.528 18.570 1.00 53.34 O ATOM 5 CB MET A 1 -1.998 4.374 19.960 1.00 4.11 C ATOM 6 CG MET A 1 -1.325 5.098 21.115 1.00 43.33 C ATOM 7 SD MET A 1 -1.354 6.887 20.902 1.00 64.51 S ATOM 8 CE MET A 1 -0.619 7.428 22.445 1.00 63.31 C ATOM 0 H1 MET A 1 -4.450 5.535 21.381 1.00 44.00 H new ATOM 0 H2 MET A 1 -5.169 4.184 20.645 1.00 44.00 H new ATOM 0 H3 MET A 1 -3.760 3.995 21.573 1.00 44.00 H new ATOM 0 HA MET A 1 -3.435 5.911 19.479 1.00 73.24 H new ATOM 0 HB2 MET A 1 -2.005 3.304 20.166 1.00 4.11 H new ATOM 0 HB3 MET A 1 -1.408 4.521 19.055 1.00 4.11 H new ATOM 0 HG2 MET A 1 -1.825 4.836 22.047 1.00 43.33 H new ATOM 0 HG3 MET A 1 -0.292 4.760 21.202 1.00 43.33 H new ATOM 0 HE1 MET A 1 -0.569 8.517 22.462 1.00 63.31 H new ATOM 0 HE2 MET A 1 -1.227 7.080 23.280 1.00 63.31 H new ATOM 0 HE3 MET A 1 0.387 7.017 22.533 1.00 63.31 H new ATOM 20 N LEU A 2 -3.313 4.139 17.366 1.00 11.01 N ATOM 21 CA LEU A 2 -3.712 3.376 16.183 1.00 32.25 C ATOM 22 C LEU A 2 -2.970 2.037 16.146 1.00 63.24 C ATOM 23 O LEU A 2 -1.742 2.001 16.178 1.00 4.44 O ATOM 24 CB LEU A 2 -3.412 4.154 14.899 1.00 53.34 C ATOM 25 CG LEU A 2 -3.985 3.515 13.624 1.00 2.14 C ATOM 26 CD1 LEU A 2 -5.497 3.691 13.567 1.00 71.14 C ATOM 27 CD2 LEU A 2 -3.323 4.077 12.376 1.00 64.25 C ATOM 0 H LEU A 2 -2.461 4.687 17.247 1.00 11.01 H new ATOM 0 HA LEU A 2 -4.786 3.201 16.244 1.00 32.25 H new ATOM 0 HB2 LEU A 2 -3.813 5.163 14.997 1.00 53.34 H new ATOM 0 HB3 LEU A 2 -2.332 4.249 14.790 1.00 53.34 H new ATOM 0 HG LEU A 2 -3.767 2.448 13.658 1.00 2.14 H new ATOM 0 HD11 LEU A 2 -5.883 3.232 12.657 1.00 71.14 H new ATOM 0 HD12 LEU A 2 -5.952 3.214 14.435 1.00 71.14 H new ATOM 0 HD13 LEU A 2 -5.740 4.754 13.568 1.00 71.14 H new ATOM 0 HD21 LEU A 2 -3.751 3.604 11.492 1.00 64.25 H new ATOM 0 HD22 LEU A 2 -3.490 5.153 12.329 1.00 64.25 H new ATOM 0 HD23 LEU A 2 -2.252 3.878 12.411 1.00 64.25 H new ATOM 39 N ILE A 3 -3.712 0.942 16.079 1.00 71.53 N ATOM 40 CA ILE A 3 -3.115 -0.399 16.097 1.00 13.02 C ATOM 41 C ILE A 3 -3.149 -1.047 14.702 1.00 10.10 C ATOM 42 O ILE A 3 -4.196 -1.086 14.057 1.00 24.11 O ATOM 43 CB ILE A 3 -3.845 -1.314 17.115 1.00 72.04 C ATOM 44 CG1 ILE A 3 -3.827 -0.674 18.516 1.00 12.05 C ATOM 45 CG2 ILE A 3 -3.212 -2.703 17.149 1.00 11.31 C ATOM 46 CD1 ILE A 3 -4.513 -1.503 19.584 1.00 11.41 C ATOM 0 H ILE A 3 -4.730 0.948 16.011 1.00 71.53 H new ATOM 0 HA ILE A 3 -2.074 -0.286 16.401 1.00 13.02 H new ATOM 0 HB ILE A 3 -4.882 -1.424 16.797 1.00 72.04 H new ATOM 0 HG12 ILE A 3 -2.792 -0.503 18.813 1.00 12.05 H new ATOM 0 HG13 ILE A 3 -4.309 0.302 18.464 1.00 12.05 H new ATOM 0 HG21 ILE A 3 -3.741 -3.326 17.870 1.00 11.31 H new ATOM 0 HG22 ILE A 3 -3.277 -3.157 16.160 1.00 11.31 H new ATOM 0 HG23 ILE A 3 -2.165 -2.619 17.441 1.00 11.31 H new ATOM 0 HD11 ILE A 3 -4.457 -0.983 20.540 1.00 11.41 H new ATOM 0 HD12 ILE A 3 -5.558 -1.652 19.313 1.00 11.41 H new ATOM 0 HD13 ILE A 3 -4.018 -2.471 19.667 1.00 11.41 H new ATOM 58 N TYR A 4 -2.000 -1.551 14.242 1.00 12.23 N ATOM 59 CA TYR A 4 -1.904 -2.164 12.909 1.00 20.54 C ATOM 60 C TYR A 4 -1.396 -3.619 12.968 1.00 5.45 C ATOM 61 O TYR A 4 -0.551 -3.972 13.800 1.00 31.11 O ATOM 62 CB TYR A 4 -0.998 -1.322 11.993 1.00 42.41 C ATOM 63 CG TYR A 4 0.469 -1.272 12.410 1.00 3.43 C ATOM 64 CD1 TYR A 4 0.927 -0.325 13.323 1.00 61.51 C ATOM 65 CD2 TYR A 4 1.398 -2.166 11.879 1.00 43.32 C ATOM 66 CE1 TYR A 4 2.260 -0.273 13.692 1.00 62.24 C ATOM 67 CE2 TYR A 4 2.731 -2.117 12.245 1.00 12.42 C ATOM 68 CZ TYR A 4 3.157 -1.171 13.152 1.00 45.13 C ATOM 69 OH TYR A 4 4.487 -1.119 13.518 1.00 62.22 O ATOM 0 H TYR A 4 -1.126 -1.548 14.768 1.00 12.23 H new ATOM 0 HA TYR A 4 -2.912 -2.188 12.496 1.00 20.54 H new ATOM 0 HB2 TYR A 4 -1.059 -1.720 10.980 1.00 42.41 H new ATOM 0 HB3 TYR A 4 -1.386 -0.304 11.959 1.00 42.41 H new ATOM 0 HD1 TYR A 4 0.230 0.381 13.750 1.00 61.51 H new ATOM 0 HD2 TYR A 4 1.071 -2.911 11.169 1.00 43.32 H new ATOM 0 HE1 TYR A 4 2.597 0.469 14.401 1.00 62.24 H new ATOM 0 HE2 TYR A 4 3.435 -2.818 11.821 1.00 12.42 H new ATOM 0 HH TYR A 4 4.561 -0.781 14.435 1.00 62.22 H new ATOM 79 N LYS A 5 -1.922 -4.454 12.072 1.00 1.44 N ATOM 80 CA LYS A 5 -1.479 -5.846 11.927 1.00 64.25 C ATOM 81 C LYS A 5 -1.377 -6.238 10.442 1.00 61.55 C ATOM 82 O LYS A 5 -2.388 -6.349 9.754 1.00 2.12 O ATOM 83 CB LYS A 5 -2.455 -6.793 12.647 1.00 41.41 C ATOM 84 CG LYS A 5 -2.139 -8.278 12.458 1.00 14.04 C ATOM 85 CD LYS A 5 -3.184 -9.178 13.115 1.00 35.23 C ATOM 86 CE LYS A 5 -3.098 -9.156 14.638 1.00 23.41 C ATOM 87 NZ LYS A 5 -1.881 -9.848 15.142 1.00 22.22 N ATOM 0 H LYS A 5 -2.666 -4.188 11.426 1.00 1.44 H new ATOM 0 HA LYS A 5 -0.491 -5.935 12.379 1.00 64.25 H new ATOM 0 HB2 LYS A 5 -2.447 -6.564 13.713 1.00 41.41 H new ATOM 0 HB3 LYS A 5 -3.465 -6.599 12.287 1.00 41.41 H new ATOM 0 HG2 LYS A 5 -2.085 -8.504 11.393 1.00 14.04 H new ATOM 0 HG3 LYS A 5 -1.158 -8.496 12.880 1.00 14.04 H new ATOM 0 HD2 LYS A 5 -4.179 -8.859 12.806 1.00 35.23 H new ATOM 0 HD3 LYS A 5 -3.052 -10.201 12.761 1.00 35.23 H new ATOM 0 HE2 LYS A 5 -3.097 -8.123 14.985 1.00 23.41 H new ATOM 0 HE3 LYS A 5 -3.984 -9.632 15.057 1.00 23.41 H new ATOM 0 HZ1 LYS A 5 -1.856 -9.794 16.180 1.00 22.22 H new ATOM 0 HZ2 LYS A 5 -1.902 -10.845 14.848 1.00 22.22 H new ATOM 0 HZ3 LYS A 5 -1.034 -9.389 14.751 1.00 22.22 H new ATOM 101 N ASP A 6 -0.154 -6.448 9.963 1.00 53.23 N ATOM 102 CA ASP A 6 0.092 -6.859 8.571 1.00 13.41 C ATOM 103 C ASP A 6 -0.069 -8.387 8.400 1.00 71.13 C ATOM 104 O ASP A 6 -0.121 -9.117 9.382 1.00 41.12 O ATOM 105 CB ASP A 6 1.496 -6.386 8.154 1.00 32.33 C ATOM 106 CG ASP A 6 2.018 -7.068 6.900 1.00 71.23 C ATOM 107 OD1 ASP A 6 1.417 -6.885 5.822 1.00 15.42 O ATOM 108 OD2 ASP A 6 3.007 -7.824 7.005 1.00 53.02 O ATOM 0 H ASP A 6 0.694 -6.341 10.519 1.00 53.23 H new ATOM 0 HA ASP A 6 -0.648 -6.395 7.919 1.00 13.41 H new ATOM 0 HB2 ASP A 6 1.474 -5.309 7.990 1.00 32.33 H new ATOM 0 HB3 ASP A 6 2.191 -6.569 8.974 1.00 32.33 H new ATOM 113 N ILE A 7 -0.155 -8.861 7.156 1.00 1.01 N ATOM 114 CA ILE A 7 -0.380 -10.289 6.876 1.00 3.44 C ATOM 115 C ILE A 7 0.911 -11.133 6.960 1.00 74.51 C ATOM 116 O ILE A 7 0.852 -12.361 7.064 1.00 72.54 O ATOM 117 CB ILE A 7 -1.038 -10.490 5.486 1.00 22.43 C ATOM 118 CG1 ILE A 7 -0.216 -9.787 4.390 1.00 63.12 C ATOM 119 CG2 ILE A 7 -2.476 -9.977 5.500 1.00 24.10 C ATOM 120 CD1 ILE A 7 -0.813 -9.897 3.002 1.00 10.14 C ATOM 0 H ILE A 7 -0.073 -8.280 6.322 1.00 1.01 H new ATOM 0 HA ILE A 7 -1.055 -10.641 7.656 1.00 3.44 H new ATOM 0 HB ILE A 7 -1.057 -11.557 5.262 1.00 22.43 H new ATOM 0 HG12 ILE A 7 -0.114 -8.733 4.647 1.00 63.12 H new ATOM 0 HG13 ILE A 7 0.788 -10.210 4.376 1.00 63.12 H new ATOM 0 HG21 ILE A 7 -2.925 -10.125 4.518 1.00 24.10 H new ATOM 0 HG22 ILE A 7 -3.050 -10.524 6.247 1.00 24.10 H new ATOM 0 HG23 ILE A 7 -2.481 -8.915 5.745 1.00 24.10 H new ATOM 0 HD11 ILE A 7 -0.174 -9.376 2.289 1.00 10.14 H new ATOM 0 HD12 ILE A 7 -0.889 -10.947 2.721 1.00 10.14 H new ATOM 0 HD13 ILE A 7 -1.806 -9.447 2.996 1.00 10.14 H new ATOM 132 N PHE A 8 2.071 -10.485 6.893 1.00 22.30 N ATOM 133 CA PHE A 8 3.360 -11.184 7.014 1.00 74.24 C ATOM 134 C PHE A 8 3.920 -11.094 8.445 1.00 70.44 C ATOM 135 O PHE A 8 4.442 -12.070 8.986 1.00 45.34 O ATOM 136 CB PHE A 8 4.388 -10.592 6.042 1.00 3.13 C ATOM 137 CG PHE A 8 3.972 -10.628 4.594 1.00 32.42 C ATOM 138 CD1 PHE A 8 4.159 -11.773 3.830 1.00 23.34 C ATOM 139 CD2 PHE A 8 3.405 -9.515 3.993 1.00 61.10 C ATOM 140 CE1 PHE A 8 3.787 -11.803 2.500 1.00 0.04 C ATOM 141 CE2 PHE A 8 3.032 -9.543 2.666 1.00 4.23 C ATOM 142 CZ PHE A 8 3.223 -10.687 1.917 1.00 73.03 C ATOM 0 H PHE A 8 2.151 -9.477 6.756 1.00 22.30 H new ATOM 0 HA PHE A 8 3.180 -12.231 6.771 1.00 74.24 H new ATOM 0 HB2 PHE A 8 4.583 -9.558 6.325 1.00 3.13 H new ATOM 0 HB3 PHE A 8 5.327 -11.135 6.151 1.00 3.13 H new ATOM 0 HD1 PHE A 8 4.600 -12.650 4.281 1.00 23.34 H new ATOM 0 HD2 PHE A 8 3.254 -8.615 4.571 1.00 61.10 H new ATOM 0 HE1 PHE A 8 3.938 -12.700 1.917 1.00 0.04 H new ATOM 0 HE2 PHE A 8 2.590 -8.669 2.212 1.00 4.23 H new ATOM 0 HZ PHE A 8 2.932 -10.708 0.877 1.00 73.03 H new ATOM 152 N THR A 9 3.823 -9.907 9.035 1.00 13.53 N ATOM 153 CA THR A 9 4.376 -9.633 10.374 1.00 64.01 C ATOM 154 C THR A 9 3.279 -9.587 11.456 1.00 5.32 C ATOM 155 O THR A 9 3.490 -9.049 12.540 1.00 42.55 O ATOM 156 CB THR A 9 5.192 -8.309 10.383 1.00 3.30 C ATOM 157 OG1 THR A 9 5.882 -8.138 11.633 1.00 22.44 O ATOM 158 CG2 THR A 9 4.302 -7.098 10.131 1.00 23.54 C ATOM 0 H THR A 9 3.362 -9.104 8.607 1.00 13.53 H new ATOM 0 HA THR A 9 5.045 -10.460 10.612 1.00 64.01 H new ATOM 0 HB THR A 9 5.920 -8.381 9.575 1.00 3.30 H new ATOM 0 HG1 THR A 9 6.708 -8.666 11.626 1.00 22.44 H new ATOM 0 HG21 THR A 9 4.908 -6.192 10.145 1.00 23.54 H new ATOM 0 HG22 THR A 9 3.819 -7.197 9.159 1.00 23.54 H new ATOM 0 HG23 THR A 9 3.541 -7.037 10.909 1.00 23.54 H new ATOM 166 N ASP A 10 2.118 -10.175 11.157 1.00 11.11 N ATOM 167 CA ASP A 10 0.921 -10.084 12.016 1.00 41.03 C ATOM 168 C ASP A 10 1.210 -10.326 13.512 1.00 41.23 C ATOM 169 O ASP A 10 0.650 -9.640 14.375 1.00 53.14 O ATOM 170 CB ASP A 10 -0.139 -11.084 11.533 1.00 12.20 C ATOM 171 CG ASP A 10 0.316 -12.529 11.639 1.00 71.14 C ATOM 172 OD1 ASP A 10 1.333 -12.884 11.016 1.00 3.23 O ATOM 173 OD2 ASP A 10 -0.354 -13.316 12.346 1.00 11.25 O ATOM 0 H ASP A 10 1.975 -10.730 10.313 1.00 11.11 H new ATOM 0 HA ASP A 10 0.559 -9.060 11.930 1.00 41.03 H new ATOM 0 HB2 ASP A 10 -1.049 -10.952 12.118 1.00 12.20 H new ATOM 0 HB3 ASP A 10 -0.392 -10.864 10.496 1.00 12.20 H new ATOM 178 N ASP A 11 2.070 -11.297 13.810 1.00 23.33 N ATOM 179 CA ASP A 11 2.455 -11.606 15.194 1.00 52.11 C ATOM 180 C ASP A 11 2.957 -10.356 15.946 1.00 0.44 C ATOM 181 O ASP A 11 2.712 -10.192 17.142 1.00 3.32 O ATOM 182 CB ASP A 11 3.536 -12.692 15.192 1.00 21.14 C ATOM 183 CG ASP A 11 4.085 -12.972 16.581 1.00 43.23 C ATOM 184 OD1 ASP A 11 3.407 -13.656 17.372 1.00 53.23 O ATOM 185 OD2 ASP A 11 5.202 -12.510 16.892 1.00 64.45 O ATOM 0 H ASP A 11 2.518 -11.889 13.111 1.00 23.33 H new ATOM 0 HA ASP A 11 1.570 -11.965 15.719 1.00 52.11 H new ATOM 0 HB2 ASP A 11 3.122 -13.611 14.777 1.00 21.14 H new ATOM 0 HB3 ASP A 11 4.352 -12.386 14.538 1.00 21.14 H new ATOM 190 N GLU A 12 3.634 -9.470 15.224 1.00 64.10 N ATOM 191 CA GLU A 12 4.199 -8.242 15.799 1.00 75.32 C ATOM 192 C GLU A 12 3.171 -7.101 15.896 1.00 73.54 C ATOM 193 O GLU A 12 3.542 -5.927 15.861 1.00 72.00 O ATOM 194 CB GLU A 12 5.416 -7.795 14.985 1.00 60.52 C ATOM 195 CG GLU A 12 6.598 -8.746 15.101 1.00 53.21 C ATOM 196 CD GLU A 12 7.840 -8.217 14.414 1.00 30.21 C ATOM 197 OE1 GLU A 12 8.434 -7.239 14.919 1.00 31.02 O ATOM 198 OE2 GLU A 12 8.242 -8.784 13.374 1.00 45.10 O ATOM 0 H GLU A 12 3.810 -9.577 14.225 1.00 64.10 H new ATOM 0 HA GLU A 12 4.504 -8.476 16.819 1.00 75.32 H new ATOM 0 HB2 GLU A 12 5.131 -7.706 13.937 1.00 60.52 H new ATOM 0 HB3 GLU A 12 5.722 -6.803 15.317 1.00 60.52 H new ATOM 0 HG2 GLU A 12 6.817 -8.921 16.154 1.00 53.21 H new ATOM 0 HG3 GLU A 12 6.329 -9.709 14.667 1.00 53.21 H new ATOM 205 N LEU A 13 1.887 -7.462 15.996 1.00 52.31 N ATOM 206 CA LEU A 13 0.789 -6.499 16.219 1.00 33.33 C ATOM 207 C LEU A 13 1.241 -5.293 17.070 1.00 11.21 C ATOM 208 O LEU A 13 1.487 -5.422 18.273 1.00 53.14 O ATOM 209 CB LEU A 13 -0.374 -7.229 16.911 1.00 51.25 C ATOM 210 CG LEU A 13 -1.594 -6.369 17.279 1.00 4.43 C ATOM 211 CD1 LEU A 13 -2.237 -5.777 16.029 1.00 72.22 C ATOM 212 CD2 LEU A 13 -2.610 -7.192 18.070 1.00 31.32 C ATOM 0 H LEU A 13 1.574 -8.430 15.925 1.00 52.31 H new ATOM 0 HA LEU A 13 0.471 -6.107 15.253 1.00 33.33 H new ATOM 0 HB2 LEU A 13 -0.708 -8.036 16.259 1.00 51.25 H new ATOM 0 HB3 LEU A 13 0.006 -7.692 17.822 1.00 51.25 H new ATOM 0 HG LEU A 13 -1.254 -5.545 17.907 1.00 4.43 H new ATOM 0 HD11 LEU A 13 -3.098 -5.173 16.314 1.00 72.22 H new ATOM 0 HD12 LEU A 13 -1.512 -5.152 15.508 1.00 72.22 H new ATOM 0 HD13 LEU A 13 -2.561 -6.583 15.370 1.00 72.22 H new ATOM 0 HD21 LEU A 13 -3.467 -6.567 18.322 1.00 31.32 H new ATOM 0 HD22 LEU A 13 -2.942 -8.037 17.467 1.00 31.32 H new ATOM 0 HD23 LEU A 13 -2.147 -7.559 18.986 1.00 31.32 H new ATOM 224 N SER A 14 1.346 -4.124 16.437 1.00 13.03 N ATOM 225 CA SER A 14 1.919 -2.937 17.093 1.00 35.21 C ATOM 226 C SER A 14 1.029 -1.702 16.917 1.00 64.32 C ATOM 227 O SER A 14 -0.057 -1.786 16.342 1.00 50.23 O ATOM 228 CB SER A 14 3.323 -2.659 16.538 1.00 73.24 C ATOM 229 OG SER A 14 3.971 -1.616 17.255 1.00 64.21 O ATOM 0 H SER A 14 1.045 -3.969 15.475 1.00 13.03 H new ATOM 0 HA SER A 14 1.983 -3.146 18.161 1.00 35.21 H new ATOM 0 HB2 SER A 14 3.923 -3.567 16.593 1.00 73.24 H new ATOM 0 HB3 SER A 14 3.252 -2.388 15.485 1.00 73.24 H new ATOM 0 HG SER A 14 4.863 -1.465 16.878 1.00 64.21 H new ATOM 235 N SER A 15 1.494 -0.548 17.400 1.00 53.44 N ATOM 236 CA SER A 15 0.671 0.672 17.388 1.00 52.44 C ATOM 237 C SER A 15 1.501 1.960 17.277 1.00 73.35 C ATOM 238 O SER A 15 2.590 2.065 17.844 1.00 63.12 O ATOM 239 CB SER A 15 -0.178 0.747 18.666 1.00 41.34 C ATOM 240 OG SER A 15 0.638 0.879 19.825 1.00 74.55 O ATOM 0 H SER A 15 2.424 -0.428 17.801 1.00 53.44 H new ATOM 0 HA SER A 15 0.040 0.605 16.502 1.00 52.44 H new ATOM 0 HB2 SER A 15 -0.861 1.594 18.602 1.00 41.34 H new ATOM 0 HB3 SER A 15 -0.791 -0.151 18.751 1.00 41.34 H new ATOM 0 HG SER A 15 0.069 0.926 20.622 1.00 74.55 H new ATOM 246 N ASP A 16 0.955 2.940 16.558 1.00 52.45 N ATOM 247 CA ASP A 16 1.513 4.299 16.498 1.00 25.13 C ATOM 248 C ASP A 16 0.371 5.334 16.399 1.00 71.32 C ATOM 249 O ASP A 16 -0.760 5.053 16.805 1.00 35.24 O ATOM 250 CB ASP A 16 2.492 4.438 15.320 1.00 4.53 C ATOM 251 CG ASP A 16 1.875 4.079 13.977 1.00 42.04 C ATOM 252 OD1 ASP A 16 1.111 4.901 13.428 1.00 32.15 O ATOM 253 OD2 ASP A 16 2.168 2.979 13.460 1.00 75.43 O ATOM 0 H ASP A 16 0.111 2.818 15.998 1.00 52.45 H new ATOM 0 HA ASP A 16 2.073 4.489 17.414 1.00 25.13 H new ATOM 0 HB2 ASP A 16 2.858 5.464 15.281 1.00 4.53 H new ATOM 0 HB3 ASP A 16 3.356 3.798 15.498 1.00 4.53 H new ATOM 258 N SER A 17 0.660 6.531 15.891 1.00 64.11 N ATOM 259 CA SER A 17 -0.381 7.559 15.730 1.00 41.33 C ATOM 260 C SER A 17 -0.114 8.470 14.524 1.00 4.02 C ATOM 261 O SER A 17 0.517 9.527 14.650 1.00 32.40 O ATOM 262 CB SER A 17 -0.509 8.404 17.003 1.00 12.30 C ATOM 263 OG SER A 17 -1.557 9.353 16.892 1.00 20.44 O ATOM 0 H SER A 17 1.591 6.816 15.586 1.00 64.11 H new ATOM 0 HA SER A 17 -1.319 7.034 15.549 1.00 41.33 H new ATOM 0 HB2 SER A 17 -0.695 7.752 17.857 1.00 12.30 H new ATOM 0 HB3 SER A 17 0.432 8.920 17.195 1.00 12.30 H new ATOM 0 HG SER A 17 -1.615 9.875 17.719 1.00 20.44 H new ATOM 269 N PHE A 18 -0.575 8.040 13.348 1.00 4.25 N ATOM 270 CA PHE A 18 -0.479 8.844 12.120 1.00 33.15 C ATOM 271 C PHE A 18 -1.781 8.758 11.293 1.00 3.34 C ATOM 272 O PHE A 18 -2.028 7.767 10.604 1.00 51.13 O ATOM 273 CB PHE A 18 0.723 8.393 11.275 1.00 52.44 C ATOM 274 CG PHE A 18 2.055 8.630 11.945 1.00 60.51 C ATOM 275 CD1 PHE A 18 2.618 9.898 11.965 1.00 61.40 C ATOM 276 CD2 PHE A 18 2.738 7.593 12.564 1.00 24.22 C ATOM 277 CE1 PHE A 18 3.830 10.123 12.585 1.00 42.41 C ATOM 278 CE2 PHE A 18 3.951 7.814 13.185 1.00 74.21 C ATOM 279 CZ PHE A 18 4.499 9.080 13.195 1.00 73.35 C ATOM 0 H PHE A 18 -1.022 7.133 13.216 1.00 4.25 H new ATOM 0 HA PHE A 18 -0.333 9.884 12.411 1.00 33.15 H new ATOM 0 HB2 PHE A 18 0.622 7.331 11.052 1.00 52.44 H new ATOM 0 HB3 PHE A 18 0.706 8.922 10.322 1.00 52.44 H new ATOM 0 HD1 PHE A 18 2.101 10.719 11.490 1.00 61.40 H new ATOM 0 HD2 PHE A 18 2.315 6.599 12.560 1.00 24.22 H new ATOM 0 HE1 PHE A 18 4.256 11.115 12.593 1.00 42.41 H new ATOM 0 HE2 PHE A 18 4.471 6.996 13.663 1.00 74.21 H new ATOM 0 HZ PHE A 18 5.449 9.255 13.679 1.00 73.35 H new ATOM 289 N PRO A 19 -2.637 9.805 11.363 1.00 64.02 N ATOM 290 CA PRO A 19 -3.948 9.828 10.674 1.00 33.12 C ATOM 291 C PRO A 19 -3.861 9.710 9.140 1.00 32.35 C ATOM 292 O PRO A 19 -2.957 10.265 8.504 1.00 32.32 O ATOM 293 CB PRO A 19 -4.537 11.196 11.070 1.00 4.11 C ATOM 294 CG PRO A 19 -3.794 11.591 12.302 1.00 52.21 C ATOM 295 CD PRO A 19 -2.405 11.041 12.128 1.00 53.34 C ATOM 0 HA PRO A 19 -4.552 8.970 10.969 1.00 33.12 H new ATOM 0 HB2 PRO A 19 -4.402 11.929 10.275 1.00 4.11 H new ATOM 0 HB3 PRO A 19 -5.608 11.125 11.260 1.00 4.11 H new ATOM 0 HG2 PRO A 19 -3.775 12.675 12.418 1.00 52.21 H new ATOM 0 HG3 PRO A 19 -4.269 11.183 13.194 1.00 52.21 H new ATOM 0 HD2 PRO A 19 -1.760 11.735 11.589 1.00 53.34 H new ATOM 0 HD3 PRO A 19 -1.927 10.840 13.087 1.00 53.34 H new ATOM 303 N MET A 20 -4.822 8.991 8.556 1.00 51.32 N ATOM 304 CA MET A 20 -4.908 8.805 7.101 1.00 34.20 C ATOM 305 C MET A 20 -6.377 8.717 6.641 1.00 21.32 C ATOM 306 O MET A 20 -7.270 8.451 7.449 1.00 42.35 O ATOM 307 CB MET A 20 -4.148 7.535 6.693 1.00 63.12 C ATOM 308 CG MET A 20 -4.688 6.258 7.331 1.00 33.23 C ATOM 309 SD MET A 20 -3.668 4.815 6.966 1.00 61.11 S ATOM 310 CE MET A 20 -2.149 5.234 7.822 1.00 25.14 C ATOM 0 H MET A 20 -5.563 8.521 9.075 1.00 51.32 H new ATOM 0 HA MET A 20 -4.453 9.668 6.615 1.00 34.20 H new ATOM 0 HB2 MET A 20 -4.188 7.432 5.609 1.00 63.12 H new ATOM 0 HB3 MET A 20 -3.098 7.649 6.964 1.00 63.12 H new ATOM 0 HG2 MET A 20 -4.747 6.393 8.411 1.00 33.23 H new ATOM 0 HG3 MET A 20 -5.703 6.080 6.976 1.00 33.23 H new ATOM 0 HE1 MET A 20 -1.389 5.519 7.095 1.00 25.14 H new ATOM 0 HE2 MET A 20 -2.332 6.066 8.501 1.00 25.14 H new ATOM 0 HE3 MET A 20 -1.802 4.371 8.391 1.00 25.14 H new ATOM 320 N LYS A 21 -6.623 8.932 5.347 1.00 4.30 N ATOM 321 CA LYS A 21 -7.987 8.867 4.794 1.00 63.22 C ATOM 322 C LYS A 21 -8.242 7.513 4.109 1.00 72.45 C ATOM 323 O LYS A 21 -7.303 6.830 3.704 1.00 12.40 O ATOM 324 CB LYS A 21 -8.212 9.983 3.765 1.00 74.22 C ATOM 325 CG LYS A 21 -7.453 9.756 2.462 1.00 24.31 C ATOM 326 CD LYS A 21 -7.902 10.691 1.345 1.00 11.31 C ATOM 327 CE LYS A 21 -7.525 12.140 1.611 1.00 41.31 C ATOM 328 NZ LYS A 21 -7.757 12.988 0.414 1.00 24.11 N ATOM 0 H LYS A 21 -5.901 9.152 4.660 1.00 4.30 H new ATOM 0 HA LYS A 21 -8.678 8.989 5.628 1.00 63.22 H new ATOM 0 HB2 LYS A 21 -9.278 10.061 3.549 1.00 74.22 H new ATOM 0 HB3 LYS A 21 -7.904 10.935 4.197 1.00 74.22 H new ATOM 0 HG2 LYS A 21 -6.387 9.895 2.639 1.00 24.31 H new ATOM 0 HG3 LYS A 21 -7.591 8.723 2.142 1.00 24.31 H new ATOM 0 HD2 LYS A 21 -7.454 10.369 0.405 1.00 11.31 H new ATOM 0 HD3 LYS A 21 -8.983 10.616 1.226 1.00 11.31 H new ATOM 0 HE2 LYS A 21 -8.109 12.522 2.448 1.00 41.31 H new ATOM 0 HE3 LYS A 21 -6.476 12.197 1.902 1.00 41.31 H new ATOM 0 HZ1 LYS A 21 -7.539 13.979 0.643 1.00 24.11 H new ATOM 0 HZ2 LYS A 21 -7.143 12.668 -0.362 1.00 24.11 H new ATOM 0 HZ3 LYS A 21 -8.752 12.911 0.122 1.00 24.11 H new ATOM 342 N LEU A 22 -9.512 7.139 3.955 1.00 62.25 N ATOM 343 CA LEU A 22 -9.866 5.908 3.236 1.00 13.22 C ATOM 344 C LEU A 22 -10.474 6.223 1.858 1.00 34.10 C ATOM 345 O LEU A 22 -11.589 6.737 1.761 1.00 21.30 O ATOM 346 CB LEU A 22 -10.844 5.060 4.063 1.00 45.50 C ATOM 347 CG LEU A 22 -11.286 3.742 3.399 1.00 51.32 C ATOM 348 CD1 LEU A 22 -10.082 2.866 3.055 1.00 13.41 C ATOM 349 CD2 LEU A 22 -12.256 2.984 4.298 1.00 53.53 C ATOM 0 H LEU A 22 -10.310 7.664 4.314 1.00 62.25 H new ATOM 0 HA LEU A 22 -8.949 5.339 3.083 1.00 13.22 H new ATOM 0 HB2 LEU A 22 -10.380 4.828 5.022 1.00 45.50 H new ATOM 0 HB3 LEU A 22 -11.731 5.658 4.274 1.00 45.50 H new ATOM 0 HG LEU A 22 -11.798 3.993 2.470 1.00 51.32 H new ATOM 0 HD11 LEU A 22 -10.425 1.943 2.588 1.00 13.41 H new ATOM 0 HD12 LEU A 22 -9.428 3.400 2.366 1.00 13.41 H new ATOM 0 HD13 LEU A 22 -9.532 2.629 3.966 1.00 13.41 H new ATOM 0 HD21 LEU A 22 -12.555 2.057 3.810 1.00 53.53 H new ATOM 0 HD22 LEU A 22 -11.770 2.754 5.246 1.00 53.53 H new ATOM 0 HD23 LEU A 22 -13.138 3.598 4.482 1.00 53.53 H new ATOM 361 N VAL A 23 -9.737 5.912 0.794 1.00 2.05 N ATOM 362 CA VAL A 23 -10.196 6.170 -0.576 1.00 23.22 C ATOM 363 C VAL A 23 -10.667 4.876 -1.269 1.00 31.15 C ATOM 364 O VAL A 23 -10.144 3.788 -1.009 1.00 42.22 O ATOM 365 CB VAL A 23 -9.079 6.850 -1.421 1.00 5.31 C ATOM 366 CG1 VAL A 23 -7.832 5.972 -1.506 1.00 44.14 C ATOM 367 CG2 VAL A 23 -9.585 7.211 -2.817 1.00 43.54 C ATOM 0 H VAL A 23 -8.815 5.479 0.851 1.00 2.05 H new ATOM 0 HA VAL A 23 -11.046 6.849 -0.507 1.00 23.22 H new ATOM 0 HB VAL A 23 -8.802 7.774 -0.913 1.00 5.31 H new ATOM 0 HG11 VAL A 23 -7.072 6.476 -2.103 1.00 44.14 H new ATOM 0 HG12 VAL A 23 -7.445 5.791 -0.503 1.00 44.14 H new ATOM 0 HG13 VAL A 23 -8.088 5.021 -1.973 1.00 44.14 H new ATOM 0 HG21 VAL A 23 -8.783 7.684 -3.384 1.00 43.54 H new ATOM 0 HG22 VAL A 23 -9.908 6.306 -3.332 1.00 43.54 H new ATOM 0 HG23 VAL A 23 -10.425 7.900 -2.733 1.00 43.54 H new ATOM 377 N ASP A 24 -11.690 5.003 -2.119 1.00 32.44 N ATOM 378 CA ASP A 24 -12.214 3.879 -2.913 1.00 41.22 C ATOM 379 C ASP A 24 -12.815 2.766 -2.022 1.00 55.12 C ATOM 380 O ASP A 24 -13.138 1.676 -2.501 1.00 2.11 O ATOM 381 CB ASP A 24 -11.099 3.321 -3.818 1.00 42.10 C ATOM 382 CG ASP A 24 -11.621 2.376 -4.886 1.00 3.20 C ATOM 383 OD1 ASP A 24 -12.218 2.861 -5.875 1.00 52.10 O ATOM 384 OD2 ASP A 24 -11.447 1.146 -4.747 1.00 51.03 O ATOM 0 H ASP A 24 -12.180 5.883 -2.279 1.00 32.44 H new ATOM 0 HA ASP A 24 -13.028 4.254 -3.534 1.00 41.22 H new ATOM 0 HB2 ASP A 24 -10.578 4.150 -4.297 1.00 42.10 H new ATOM 0 HB3 ASP A 24 -10.367 2.797 -3.203 1.00 42.10 H new ATOM 389 N ASP A 25 -12.977 3.060 -0.725 1.00 33.22 N ATOM 390 CA ASP A 25 -13.508 2.093 0.255 1.00 74.21 C ATOM 391 C ASP A 25 -12.615 0.840 0.368 1.00 30.45 C ATOM 392 O ASP A 25 -12.995 -0.152 0.993 1.00 1.23 O ATOM 393 CB ASP A 25 -14.941 1.676 -0.123 1.00 71.35 C ATOM 394 CG ASP A 25 -15.870 2.863 -0.287 1.00 44.21 C ATOM 395 OD1 ASP A 25 -16.332 3.412 0.735 1.00 44.02 O ATOM 396 OD2 ASP A 25 -16.144 3.259 -1.439 1.00 74.14 O ATOM 0 H ASP A 25 -12.746 3.969 -0.324 1.00 33.22 H new ATOM 0 HA ASP A 25 -13.517 2.589 1.225 1.00 74.21 H new ATOM 0 HB2 ASP A 25 -14.917 1.107 -1.053 1.00 71.35 H new ATOM 0 HB3 ASP A 25 -15.337 1.013 0.646 1.00 71.35 H new ATOM 401 N LEU A 26 -11.415 0.907 -0.206 1.00 42.21 N ATOM 402 CA LEU A 26 -10.538 -0.264 -0.321 1.00 73.11 C ATOM 403 C LEU A 26 -9.132 0.020 0.237 1.00 22.14 C ATOM 404 O LEU A 26 -8.553 -0.806 0.951 1.00 23.10 O ATOM 405 CB LEU A 26 -10.441 -0.680 -1.799 1.00 54.53 C ATOM 406 CG LEU A 26 -9.735 -2.018 -2.076 1.00 25.15 C ATOM 407 CD1 LEU A 26 -10.560 -3.191 -1.547 1.00 23.12 C ATOM 408 CD2 LEU A 26 -9.457 -2.178 -3.571 1.00 12.22 C ATOM 0 H LEU A 26 -11.024 1.762 -0.601 1.00 42.21 H new ATOM 0 HA LEU A 26 -10.968 -1.073 0.269 1.00 73.11 H new ATOM 0 HB2 LEU A 26 -11.450 -0.732 -2.208 1.00 54.53 H new ATOM 0 HB3 LEU A 26 -9.916 0.105 -2.344 1.00 54.53 H new ATOM 0 HG LEU A 26 -8.781 -2.016 -1.549 1.00 25.15 H new ATOM 0 HD11 LEU A 26 -10.039 -4.125 -1.755 1.00 23.12 H new ATOM 0 HD12 LEU A 26 -10.697 -3.084 -0.471 1.00 23.12 H new ATOM 0 HD13 LEU A 26 -11.534 -3.201 -2.037 1.00 23.12 H new ATOM 0 HD21 LEU A 26 -8.957 -3.130 -3.748 1.00 12.22 H new ATOM 0 HD22 LEU A 26 -10.398 -2.154 -4.121 1.00 12.22 H new ATOM 0 HD23 LEU A 26 -8.817 -1.364 -3.911 1.00 12.22 H new ATOM 420 N VAL A 27 -8.587 1.193 -0.083 1.00 71.02 N ATOM 421 CA VAL A 27 -7.220 1.552 0.323 1.00 11.30 C ATOM 422 C VAL A 27 -7.161 2.910 1.041 1.00 75.11 C ATOM 423 O VAL A 27 -7.961 3.806 0.778 1.00 11.32 O ATOM 424 CB VAL A 27 -6.257 1.580 -0.895 1.00 73.53 C ATOM 425 CG1 VAL A 27 -6.025 0.175 -1.444 1.00 25.12 C ATOM 426 CG2 VAL A 27 -6.792 2.498 -1.992 1.00 42.45 C ATOM 0 H VAL A 27 -9.067 1.914 -0.622 1.00 71.02 H new ATOM 0 HA VAL A 27 -6.901 0.778 1.021 1.00 11.30 H new ATOM 0 HB VAL A 27 -5.301 1.974 -0.552 1.00 73.53 H new ATOM 0 HG11 VAL A 27 -5.347 0.225 -2.296 1.00 25.12 H new ATOM 0 HG12 VAL A 27 -5.586 -0.451 -0.667 1.00 25.12 H new ATOM 0 HG13 VAL A 27 -6.976 -0.253 -1.761 1.00 25.12 H new ATOM 0 HG21 VAL A 27 -6.100 2.501 -2.834 1.00 42.45 H new ATOM 0 HG22 VAL A 27 -7.766 2.139 -2.324 1.00 42.45 H new ATOM 0 HG23 VAL A 27 -6.893 3.511 -1.602 1.00 42.45 H new ATOM 436 N TYR A 28 -6.218 3.046 1.965 1.00 62.33 N ATOM 437 CA TYR A 28 -5.971 4.315 2.650 1.00 23.41 C ATOM 438 C TYR A 28 -4.993 5.191 1.856 1.00 43.11 C ATOM 439 O TYR A 28 -3.965 4.707 1.376 1.00 51.11 O ATOM 440 CB TYR A 28 -5.403 4.067 4.057 1.00 53.10 C ATOM 441 CG TYR A 28 -6.363 3.366 5.000 1.00 1.21 C ATOM 442 CD1 TYR A 28 -7.520 4.000 5.438 1.00 53.13 C ATOM 443 CD2 TYR A 28 -6.111 2.076 5.461 1.00 45.24 C ATOM 444 CE1 TYR A 28 -8.399 3.374 6.300 1.00 21.43 C ATOM 445 CE2 TYR A 28 -6.988 1.444 6.324 1.00 25.53 C ATOM 446 CZ TYR A 28 -8.130 2.096 6.738 1.00 21.02 C ATOM 447 OH TYR A 28 -9.008 1.468 7.592 1.00 24.42 O ATOM 0 H TYR A 28 -5.605 2.287 2.261 1.00 62.33 H new ATOM 0 HA TYR A 28 -6.925 4.836 2.730 1.00 23.41 H new ATOM 0 HB2 TYR A 28 -4.495 3.470 3.970 1.00 53.10 H new ATOM 0 HB3 TYR A 28 -5.115 5.023 4.494 1.00 53.10 H new ATOM 0 HD1 TYR A 28 -7.736 5.002 5.097 1.00 53.13 H new ATOM 0 HD2 TYR A 28 -5.217 1.561 5.140 1.00 45.24 H new ATOM 0 HE1 TYR A 28 -9.293 3.884 6.629 1.00 21.43 H new ATOM 0 HE2 TYR A 28 -6.779 0.443 6.672 1.00 25.53 H new ATOM 0 HH TYR A 28 -8.827 1.751 8.513 1.00 24.42 H new ATOM 457 N GLU A 29 -5.327 6.474 1.719 1.00 53.02 N ATOM 458 CA GLU A 29 -4.435 7.453 1.090 1.00 72.00 C ATOM 459 C GLU A 29 -3.777 8.339 2.161 1.00 21.03 C ATOM 460 O GLU A 29 -4.435 9.173 2.790 1.00 3.42 O ATOM 461 CB GLU A 29 -5.210 8.325 0.082 1.00 54.44 C ATOM 462 CG GLU A 29 -4.365 9.421 -0.574 1.00 44.41 C ATOM 463 CD GLU A 29 -5.167 10.324 -1.506 1.00 34.14 C ATOM 464 OE1 GLU A 29 -5.277 10.004 -2.711 1.00 54.21 O ATOM 465 OE2 GLU A 29 -5.689 11.361 -1.038 1.00 1.10 O ATOM 0 H GLU A 29 -6.215 6.863 2.037 1.00 53.02 H new ATOM 0 HA GLU A 29 -3.656 6.913 0.552 1.00 72.00 H new ATOM 0 HB2 GLU A 29 -5.621 7.683 -0.697 1.00 54.44 H new ATOM 0 HB3 GLU A 29 -6.054 8.788 0.592 1.00 54.44 H new ATOM 0 HG2 GLU A 29 -3.905 10.030 0.204 1.00 44.41 H new ATOM 0 HG3 GLU A 29 -3.555 8.958 -1.137 1.00 44.41 H new ATOM 472 N PHE A 30 -2.486 8.136 2.391 1.00 21.21 N ATOM 473 CA PHE A 30 -1.747 8.937 3.374 1.00 33.33 C ATOM 474 C PHE A 30 -1.138 10.176 2.703 1.00 11.53 C ATOM 475 O PHE A 30 -0.439 10.061 1.696 1.00 11.23 O ATOM 476 CB PHE A 30 -0.646 8.095 4.031 1.00 62.14 C ATOM 477 CG PHE A 30 -0.049 8.716 5.272 1.00 51.13 C ATOM 478 CD1 PHE A 30 0.981 9.640 5.180 1.00 64.02 C ATOM 479 CD2 PHE A 30 -0.514 8.366 6.531 1.00 63.11 C ATOM 480 CE1 PHE A 30 1.531 10.202 6.314 1.00 11.11 C ATOM 481 CE2 PHE A 30 0.033 8.926 7.669 1.00 71.05 C ATOM 482 CZ PHE A 30 1.057 9.846 7.560 1.00 1.33 C ATOM 0 H PHE A 30 -1.926 7.428 1.916 1.00 21.21 H new ATOM 0 HA PHE A 30 -2.443 9.264 4.147 1.00 33.33 H new ATOM 0 HB2 PHE A 30 -1.056 7.118 4.288 1.00 62.14 H new ATOM 0 HB3 PHE A 30 0.149 7.926 3.305 1.00 62.14 H new ATOM 0 HD1 PHE A 30 1.358 9.923 4.208 1.00 64.02 H new ATOM 0 HD2 PHE A 30 -1.314 7.646 6.623 1.00 63.11 H new ATOM 0 HE1 PHE A 30 2.333 10.921 6.226 1.00 11.11 H new ATOM 0 HE2 PHE A 30 -0.340 8.645 8.643 1.00 71.05 H new ATOM 0 HZ PHE A 30 1.486 10.286 8.448 1.00 1.33 H new ATOM 492 N LYS A 31 -1.401 11.353 3.269 1.00 71.14 N ATOM 493 CA LYS A 31 -0.935 12.616 2.677 1.00 74.23 C ATOM 494 C LYS A 31 0.579 12.828 2.882 1.00 65.14 C ATOM 495 O LYS A 31 1.108 12.674 3.988 1.00 23.11 O ATOM 496 CB LYS A 31 -1.725 13.819 3.240 1.00 30.43 C ATOM 497 CG LYS A 31 -1.369 14.225 4.674 1.00 51.15 C ATOM 498 CD LYS A 31 -1.754 13.160 5.703 1.00 72.22 C ATOM 499 CE LYS A 31 -1.343 13.571 7.113 1.00 2.12 C ATOM 500 NZ LYS A 31 -1.712 12.548 8.127 1.00 31.20 N ATOM 0 H LYS A 31 -1.932 11.463 4.133 1.00 71.14 H new ATOM 0 HA LYS A 31 -1.118 12.548 1.605 1.00 74.23 H new ATOM 0 HB2 LYS A 31 -1.563 14.676 2.587 1.00 30.43 H new ATOM 0 HB3 LYS A 31 -2.789 13.584 3.200 1.00 30.43 H new ATOM 0 HG2 LYS A 31 -0.298 14.415 4.738 1.00 51.15 H new ATOM 0 HG3 LYS A 31 -1.874 15.160 4.918 1.00 51.15 H new ATOM 0 HD2 LYS A 31 -2.831 12.994 5.671 1.00 72.22 H new ATOM 0 HD3 LYS A 31 -1.277 12.214 5.445 1.00 72.22 H new ATOM 0 HE2 LYS A 31 -0.266 13.737 7.142 1.00 2.12 H new ATOM 0 HE3 LYS A 31 -1.818 14.519 7.366 1.00 2.12 H new ATOM 0 HZ1 LYS A 31 -2.246 12.999 8.897 1.00 31.20 H new ATOM 0 HZ2 LYS A 31 -2.300 11.814 7.682 1.00 31.20 H new ATOM 0 HZ3 LYS A 31 -0.849 12.114 8.512 1.00 31.20 H new ATOM 514 N GLY A 32 1.267 13.168 1.795 1.00 71.20 N ATOM 515 CA GLY A 32 2.695 13.476 1.849 1.00 34.43 C ATOM 516 C GLY A 32 3.072 14.652 0.956 1.00 4.20 C ATOM 517 O GLY A 32 2.235 15.160 0.207 1.00 1.21 O ATOM 0 H GLY A 32 0.858 13.238 0.863 1.00 71.20 H new ATOM 0 HA2 GLY A 32 2.976 13.700 2.878 1.00 34.43 H new ATOM 0 HA3 GLY A 32 3.265 12.597 1.547 1.00 34.43 H new ATOM 521 N LYS A 33 4.329 15.091 1.018 1.00 1.12 N ATOM 522 CA LYS A 33 4.765 16.253 0.236 1.00 72.41 C ATOM 523 C LYS A 33 6.259 16.206 -0.117 1.00 62.45 C ATOM 524 O LYS A 33 7.028 15.414 0.440 1.00 12.45 O ATOM 525 CB LYS A 33 4.443 17.543 1.003 1.00 61.22 C ATOM 526 CG LYS A 33 5.071 17.612 2.393 1.00 2.12 C ATOM 527 CD LYS A 33 4.583 18.833 3.174 1.00 13.23 C ATOM 528 CE LYS A 33 3.066 18.825 3.338 1.00 2.02 C ATOM 529 NZ LYS A 33 2.578 20.003 4.102 1.00 22.25 N ATOM 0 H LYS A 33 5.057 14.667 1.593 1.00 1.12 H new ATOM 0 HA LYS A 33 4.218 16.232 -0.707 1.00 72.41 H new ATOM 0 HB2 LYS A 33 4.786 18.397 0.418 1.00 61.22 H new ATOM 0 HB3 LYS A 33 3.361 17.636 1.099 1.00 61.22 H new ATOM 0 HG2 LYS A 33 4.829 16.705 2.947 1.00 2.12 H new ATOM 0 HG3 LYS A 33 6.156 17.649 2.301 1.00 2.12 H new ATOM 0 HD2 LYS A 33 5.056 18.850 4.156 1.00 13.23 H new ATOM 0 HD3 LYS A 33 4.889 19.743 2.657 1.00 13.23 H new ATOM 0 HE2 LYS A 33 2.596 18.812 2.355 1.00 2.02 H new ATOM 0 HE3 LYS A 33 2.762 17.911 3.849 1.00 2.02 H new ATOM 0 HZ1 LYS A 33 1.543 19.956 4.189 1.00 22.25 H new ATOM 0 HZ2 LYS A 33 3.005 20.003 5.050 1.00 22.25 H new ATOM 0 HZ3 LYS A 33 2.844 20.875 3.602 1.00 22.25 H new ATOM 543 N HIS A 34 6.645 17.070 -1.052 1.00 23.14 N ATOM 544 CA HIS A 34 8.031 17.195 -1.516 1.00 53.33 C ATOM 545 C HIS A 34 8.913 17.849 -0.435 1.00 30.41 C ATOM 546 O HIS A 34 8.821 19.056 -0.202 1.00 35.43 O ATOM 547 CB HIS A 34 8.034 18.050 -2.799 1.00 4.04 C ATOM 548 CG HIS A 34 9.358 18.174 -3.502 1.00 54.04 C ATOM 549 ND1 HIS A 34 9.508 17.935 -4.851 1.00 75.30 N ATOM 550 CD2 HIS A 34 10.581 18.556 -3.057 1.00 3.13 C ATOM 551 CE1 HIS A 34 10.758 18.164 -5.203 1.00 33.11 C ATOM 552 NE2 HIS A 34 11.431 18.546 -4.135 1.00 2.43 N ATOM 0 H HIS A 34 6.001 17.711 -1.516 1.00 23.14 H new ATOM 0 HA HIS A 34 8.441 16.206 -1.721 1.00 53.33 H new ATOM 0 HB2 HIS A 34 7.312 17.626 -3.497 1.00 4.04 H new ATOM 0 HB3 HIS A 34 7.683 19.051 -2.547 1.00 4.04 H new ATOM 0 HD2 HIS A 34 10.839 18.819 -2.042 1.00 3.13 H new ATOM 0 HE1 HIS A 34 11.163 18.057 -6.199 1.00 33.11 H new ATOM 0 HE2 HIS A 34 12.420 18.793 -4.114 1.00 2.43 H new ATOM 561 N VAL A 35 9.768 17.057 0.217 1.00 53.12 N ATOM 562 CA VAL A 35 10.666 17.578 1.259 1.00 63.04 C ATOM 563 C VAL A 35 12.080 16.980 1.146 1.00 63.21 C ATOM 564 O VAL A 35 12.270 15.889 0.609 1.00 50.44 O ATOM 565 CB VAL A 35 10.112 17.311 2.686 1.00 44.30 C ATOM 566 CG1 VAL A 35 8.817 18.086 2.932 1.00 0.34 C ATOM 567 CG2 VAL A 35 9.895 15.819 2.908 1.00 0.24 C ATOM 0 H VAL A 35 9.860 16.056 0.045 1.00 53.12 H new ATOM 0 HA VAL A 35 10.723 18.655 1.098 1.00 63.04 H new ATOM 0 HB VAL A 35 10.854 17.663 3.403 1.00 44.30 H new ATOM 0 HG11 VAL A 35 8.454 17.878 3.939 1.00 0.34 H new ATOM 0 HG12 VAL A 35 9.007 19.154 2.828 1.00 0.34 H new ATOM 0 HG13 VAL A 35 8.065 17.779 2.205 1.00 0.34 H new ATOM 0 HG21 VAL A 35 9.507 15.653 3.913 1.00 0.24 H new ATOM 0 HG22 VAL A 35 9.180 15.442 2.176 1.00 0.24 H new ATOM 0 HG23 VAL A 35 10.843 15.293 2.794 1.00 0.24 H new ATOM 577 N VAL A 36 13.074 17.714 1.647 1.00 74.44 N ATOM 578 CA VAL A 36 14.475 17.270 1.613 1.00 72.11 C ATOM 579 C VAL A 36 15.219 17.686 2.892 1.00 65.20 C ATOM 580 O VAL A 36 14.983 18.768 3.428 1.00 64.41 O ATOM 581 CB VAL A 36 15.236 17.856 0.387 1.00 55.13 C ATOM 582 CG1 VAL A 36 14.618 17.388 -0.929 1.00 53.35 C ATOM 583 CG2 VAL A 36 15.274 19.384 0.449 1.00 0.03 C ATOM 0 H VAL A 36 12.937 18.625 2.085 1.00 74.44 H new ATOM 0 HA VAL A 36 14.452 16.183 1.535 1.00 72.11 H new ATOM 0 HB VAL A 36 16.260 17.483 0.427 1.00 55.13 H new ATOM 0 HG11 VAL A 36 15.173 17.815 -1.764 1.00 53.35 H new ATOM 0 HG12 VAL A 36 14.660 16.300 -0.984 1.00 53.35 H new ATOM 0 HG13 VAL A 36 13.579 17.714 -0.979 1.00 53.35 H new ATOM 0 HG21 VAL A 36 15.811 19.770 -0.418 1.00 0.03 H new ATOM 0 HG22 VAL A 36 14.256 19.774 0.449 1.00 0.03 H new ATOM 0 HG23 VAL A 36 15.783 19.699 1.360 1.00 0.03 H new ATOM 593 N ARG A 37 16.109 16.826 3.384 1.00 43.34 N ATOM 594 CA ARG A 37 16.961 17.175 4.528 1.00 50.53 C ATOM 595 C ARG A 37 18.450 17.038 4.167 1.00 22.32 C ATOM 596 O ARG A 37 18.953 15.928 3.964 1.00 52.03 O ATOM 597 CB ARG A 37 16.653 16.284 5.746 1.00 61.15 C ATOM 598 CG ARG A 37 17.225 16.831 7.061 1.00 31.24 C ATOM 599 CD ARG A 37 17.452 15.740 8.111 1.00 21.10 C ATOM 600 NE ARG A 37 16.304 14.851 8.267 1.00 32.30 N ATOM 601 CZ ARG A 37 15.689 14.620 9.398 1.00 60.52 C ATOM 602 NH1 ARG A 37 15.947 15.327 10.454 1.00 5.12 N ATOM 603 NH2 ARG A 37 14.781 13.704 9.451 1.00 34.12 N ATOM 0 H ARG A 37 16.261 15.888 3.014 1.00 43.34 H new ATOM 0 HA ARG A 37 16.746 18.213 4.784 1.00 50.53 H new ATOM 0 HB2 ARG A 37 15.573 16.177 5.845 1.00 61.15 H new ATOM 0 HB3 ARG A 37 17.057 15.287 5.569 1.00 61.15 H new ATOM 0 HG2 ARG A 37 18.170 17.336 6.858 1.00 31.24 H new ATOM 0 HG3 ARG A 37 16.544 17.580 7.464 1.00 31.24 H new ATOM 0 HD2 ARG A 37 18.326 15.151 7.832 1.00 21.10 H new ATOM 0 HD3 ARG A 37 17.676 16.207 9.070 1.00 21.10 H new ATOM 0 HE ARG A 37 15.957 14.376 7.434 1.00 32.30 H new ATOM 0 HH11 ARG A 37 16.638 16.076 10.410 1.00 5.12 H new ATOM 0 HH12 ARG A 37 15.459 15.134 11.329 1.00 5.12 H new ATOM 0 HH21 ARG A 37 14.549 13.167 8.615 1.00 34.12 H new ATOM 0 HH22 ARG A 37 14.296 13.517 10.329 1.00 34.12 H new ATOM 972 N GLU A 65 18.866 13.123 2.545 1.00 70.33 N ATOM 973 CA GLU A 65 17.520 12.658 2.886 1.00 2.21 C ATOM 974 C GLU A 65 16.465 13.364 2.018 1.00 52.43 C ATOM 975 O GLU A 65 15.670 14.178 2.493 1.00 64.31 O ATOM 976 CB GLU A 65 17.240 12.852 4.386 1.00 20.13 C ATOM 977 CG GLU A 65 16.054 12.037 4.892 1.00 34.13 C ATOM 978 CD GLU A 65 15.863 12.132 6.397 1.00 55.23 C ATOM 979 OE1 GLU A 65 16.646 11.500 7.142 1.00 52.40 O ATOM 980 OE2 GLU A 65 14.939 12.846 6.842 1.00 14.20 O ATOM 0 HA GLU A 65 17.460 11.590 2.676 1.00 2.21 H new ATOM 0 HB2 GLU A 65 18.129 12.576 4.953 1.00 20.13 H new ATOM 0 HB3 GLU A 65 17.054 13.908 4.580 1.00 20.13 H new ATOM 0 HG2 GLU A 65 15.147 12.380 4.394 1.00 34.13 H new ATOM 0 HG3 GLU A 65 16.194 10.992 4.615 1.00 34.13 H new ATOM 987 N ARG A 66 16.511 13.070 0.721 1.00 63.22 N ATOM 988 CA ARG A 66 15.554 13.598 -0.254 1.00 3.53 C ATOM 989 C ARG A 66 14.378 12.632 -0.433 1.00 0.43 C ATOM 990 O ARG A 66 14.580 11.426 -0.585 1.00 65.35 O ATOM 991 CB ARG A 66 16.249 13.803 -1.613 1.00 44.44 C ATOM 992 CG ARG A 66 15.319 14.311 -2.716 1.00 2.35 C ATOM 993 CD ARG A 66 15.920 14.144 -4.112 1.00 23.31 C ATOM 994 NE ARG A 66 17.200 14.839 -4.268 1.00 40.42 N ATOM 995 CZ ARG A 66 17.499 15.611 -5.280 1.00 12.25 C ATOM 996 NH1 ARG A 66 16.623 15.879 -6.196 1.00 74.32 N ATOM 997 NH2 ARG A 66 18.680 16.123 -5.367 1.00 65.21 N ATOM 0 H ARG A 66 17.216 12.456 0.313 1.00 63.22 H new ATOM 0 HA ARG A 66 15.179 14.552 0.117 1.00 3.53 H new ATOM 0 HB2 ARG A 66 17.068 14.511 -1.488 1.00 44.44 H new ATOM 0 HB3 ARG A 66 16.690 12.858 -1.930 1.00 44.44 H new ATOM 0 HG2 ARG A 66 14.372 13.773 -2.665 1.00 2.35 H new ATOM 0 HG3 ARG A 66 15.097 15.364 -2.543 1.00 2.35 H new ATOM 0 HD2 ARG A 66 16.061 13.083 -4.317 1.00 23.31 H new ATOM 0 HD3 ARG A 66 15.215 14.521 -4.853 1.00 23.31 H new ATOM 0 HE ARG A 66 17.903 14.713 -3.540 1.00 40.42 H new ATOM 0 HH11 ARG A 66 15.684 15.486 -6.134 1.00 74.32 H new ATOM 0 HH12 ARG A 66 16.872 16.483 -6.979 1.00 74.32 H new ATOM 0 HH21 ARG A 66 19.376 15.925 -4.648 1.00 65.21 H new ATOM 0 HH22 ARG A 66 18.918 16.726 -6.155 1.00 65.21 H new ATOM 1011 N GLY A 67 13.152 13.148 -0.421 1.00 20.30 N ATOM 1012 CA GLY A 67 12.009 12.293 -0.702 1.00 11.25 C ATOM 1013 C GLY A 67 10.673 12.854 -0.234 1.00 22.11 C ATOM 1014 O GLY A 67 10.366 14.033 -0.428 1.00 0.31 O ATOM 0 H GLY A 67 12.930 14.124 -0.226 1.00 20.30 H new ATOM 0 HA2 GLY A 67 11.959 12.116 -1.776 1.00 11.25 H new ATOM 0 HA3 GLY A 67 12.169 11.325 -0.227 1.00 11.25 H new ATOM 1018 N ILE A 68 9.872 11.990 0.379 1.00 63.40 N ATOM 1019 CA ILE A 68 8.501 12.326 0.763 1.00 24.55 C ATOM 1020 C ILE A 68 8.353 12.437 2.283 1.00 14.53 C ATOM 1021 O ILE A 68 8.929 11.640 3.024 1.00 61.30 O ATOM 1022 CB ILE A 68 7.526 11.233 0.271 1.00 63.52 C ATOM 1023 CG1 ILE A 68 7.869 10.813 -1.166 1.00 4.43 C ATOM 1024 CG2 ILE A 68 6.078 11.719 0.361 1.00 43.22 C ATOM 1025 CD1 ILE A 68 7.147 9.563 -1.606 1.00 31.13 C ATOM 0 H ILE A 68 10.151 11.040 0.624 1.00 63.40 H new ATOM 0 HA ILE A 68 8.268 13.287 0.305 1.00 24.55 H new ATOM 0 HB ILE A 68 7.633 10.362 0.918 1.00 63.52 H new ATOM 0 HG12 ILE A 68 7.619 11.628 -1.846 1.00 4.43 H new ATOM 0 HG13 ILE A 68 8.944 10.651 -1.244 1.00 4.43 H new ATOM 0 HG21 ILE A 68 5.408 10.934 0.010 1.00 43.22 H new ATOM 0 HG22 ILE A 68 5.840 11.963 1.396 1.00 43.22 H new ATOM 0 HG23 ILE A 68 5.953 12.607 -0.259 1.00 43.22 H new ATOM 0 HD11 ILE A 68 7.432 9.319 -2.629 1.00 31.13 H new ATOM 0 HD12 ILE A 68 7.416 8.737 -0.948 1.00 31.13 H new ATOM 0 HD13 ILE A 68 6.071 9.729 -1.559 1.00 31.13 H new ATOM 1037 N ASP A 69 7.554 13.398 2.736 1.00 14.32 N ATOM 1038 CA ASP A 69 7.228 13.530 4.161 1.00 32.25 C ATOM 1039 C ASP A 69 6.809 12.176 4.768 1.00 5.31 C ATOM 1040 O ASP A 69 7.183 11.846 5.888 1.00 33.13 O ATOM 1041 CB ASP A 69 6.110 14.565 4.341 1.00 60.31 C ATOM 1042 CG ASP A 69 5.760 14.800 5.800 1.00 52.12 C ATOM 1043 OD1 ASP A 69 6.548 15.461 6.505 1.00 13.44 O ATOM 1044 OD2 ASP A 69 4.692 14.326 6.247 1.00 4.43 O ATOM 0 H ASP A 69 7.117 14.101 2.139 1.00 14.32 H new ATOM 0 HA ASP A 69 8.121 13.867 4.688 1.00 32.25 H new ATOM 0 HB2 ASP A 69 6.417 15.508 3.889 1.00 60.31 H new ATOM 0 HB3 ASP A 69 5.221 14.230 3.807 1.00 60.31 H new ATOM 1049 N ILE A 70 6.070 11.381 3.991 1.00 51.22 N ATOM 1050 CA ILE A 70 5.575 10.073 4.445 1.00 5.23 C ATOM 1051 C ILE A 70 6.720 9.114 4.811 1.00 33.13 C ATOM 1052 O ILE A 70 6.766 8.567 5.921 1.00 31.53 O ATOM 1053 CB ILE A 70 4.720 9.397 3.346 1.00 2.51 C ATOM 1054 CG1 ILE A 70 3.580 10.324 2.908 1.00 71.34 C ATOM 1055 CG2 ILE A 70 4.174 8.053 3.834 1.00 74.24 C ATOM 1056 CD1 ILE A 70 2.773 9.790 1.744 1.00 33.22 C ATOM 0 H ILE A 70 5.798 11.620 3.037 1.00 51.22 H new ATOM 0 HA ILE A 70 4.974 10.267 5.333 1.00 5.23 H new ATOM 0 HB ILE A 70 5.357 9.207 2.482 1.00 2.51 H new ATOM 0 HG12 ILE A 70 2.914 10.490 3.754 1.00 71.34 H new ATOM 0 HG13 ILE A 70 3.997 11.293 2.635 1.00 71.34 H new ATOM 0 HG21 ILE A 70 3.576 7.595 3.046 1.00 74.24 H new ATOM 0 HG22 ILE A 70 5.004 7.394 4.089 1.00 74.24 H new ATOM 0 HG23 ILE A 70 3.553 8.211 4.715 1.00 74.24 H new ATOM 0 HD11 ILE A 70 1.985 10.500 1.491 1.00 33.22 H new ATOM 0 HD12 ILE A 70 3.426 9.650 0.882 1.00 33.22 H new ATOM 0 HD13 ILE A 70 2.326 8.835 2.019 1.00 33.22 H new ATOM 1068 N VAL A 71 7.634 8.914 3.863 1.00 31.14 N ATOM 1069 CA VAL A 71 8.706 7.925 4.007 1.00 54.12 C ATOM 1070 C VAL A 71 9.774 8.372 5.018 1.00 74.45 C ATOM 1071 O VAL A 71 10.282 7.560 5.790 1.00 11.44 O ATOM 1072 CB VAL A 71 9.364 7.616 2.637 1.00 20.40 C ATOM 1073 CG1 VAL A 71 8.308 7.151 1.637 1.00 31.32 C ATOM 1074 CG2 VAL A 71 10.125 8.824 2.093 1.00 54.51 C ATOM 0 H VAL A 71 7.655 9.426 2.981 1.00 31.14 H new ATOM 0 HA VAL A 71 8.246 7.015 4.392 1.00 54.12 H new ATOM 0 HB VAL A 71 10.087 6.814 2.786 1.00 20.40 H new ATOM 0 HG11 VAL A 71 8.783 6.937 0.679 1.00 31.32 H new ATOM 0 HG12 VAL A 71 7.824 6.249 2.012 1.00 31.32 H new ATOM 0 HG13 VAL A 71 7.562 7.934 1.505 1.00 31.32 H new ATOM 0 HG21 VAL A 71 10.572 8.570 1.132 1.00 54.51 H new ATOM 0 HG22 VAL A 71 9.437 9.659 1.963 1.00 54.51 H new ATOM 0 HG23 VAL A 71 10.910 9.106 2.795 1.00 54.51 H new ATOM 1084 N LEU A 72 10.094 9.663 5.022 1.00 30.32 N ATOM 1085 CA LEU A 72 11.076 10.213 5.962 1.00 11.32 C ATOM 1086 C LEU A 72 10.527 10.176 7.399 1.00 73.34 C ATOM 1087 O LEU A 72 11.224 9.794 8.336 1.00 51.42 O ATOM 1088 CB LEU A 72 11.434 11.651 5.555 1.00 71.33 C ATOM 1089 CG LEU A 72 11.846 11.831 4.079 1.00 40.52 C ATOM 1090 CD1 LEU A 72 12.180 13.291 3.778 1.00 13.14 C ATOM 1091 CD2 LEU A 72 13.017 10.921 3.720 1.00 3.44 C ATOM 0 H LEU A 72 9.690 10.351 4.386 1.00 30.32 H new ATOM 0 HA LEU A 72 11.979 9.603 5.930 1.00 11.32 H new ATOM 0 HB2 LEU A 72 10.577 12.293 5.758 1.00 71.33 H new ATOM 0 HB3 LEU A 72 12.250 11.999 6.189 1.00 71.33 H new ATOM 0 HG LEU A 72 10.996 11.544 3.459 1.00 40.52 H new ATOM 0 HD11 LEU A 72 12.467 13.390 2.731 1.00 13.14 H new ATOM 0 HD12 LEU A 72 11.306 13.912 3.975 1.00 13.14 H new ATOM 0 HD13 LEU A 72 13.005 13.614 4.413 1.00 13.14 H new ATOM 0 HD21 LEU A 72 13.286 11.069 2.674 1.00 3.44 H new ATOM 0 HD22 LEU A 72 13.872 11.162 4.352 1.00 3.44 H new ATOM 0 HD23 LEU A 72 12.731 9.881 3.877 1.00 3.44 H new ATOM 1103 N ASN A 73 9.256 10.553 7.548 1.00 30.41 N ATOM 1104 CA ASN A 73 8.557 10.522 8.842 1.00 33.11 C ATOM 1105 C ASN A 73 8.611 9.127 9.497 1.00 63.14 C ATOM 1106 O ASN A 73 8.825 8.999 10.704 1.00 32.01 O ATOM 1107 CB ASN A 73 7.095 10.931 8.625 1.00 51.53 C ATOM 1108 CG ASN A 73 6.279 10.935 9.899 1.00 14.11 C ATOM 1109 OD1 ASN A 73 6.106 12.099 10.492 1.00 31.11 O flip ATOM 1110 ND2 ASN A 73 5.773 9.905 10.324 1.00 22.23 N flip ATOM 0 H ASN A 73 8.679 10.889 6.777 1.00 30.41 H new ATOM 0 HA ASN A 73 9.057 11.218 9.515 1.00 33.11 H new ATOM 0 HB2 ASN A 73 7.066 11.926 8.180 1.00 51.53 H new ATOM 0 HB3 ASN A 73 6.636 10.248 7.910 1.00 51.53 H new ATOM 0 HD21 ASN A 73 5.929 9.022 9.838 1.00 22.23 H new ATOM 0 HD22 ASN A 73 5.195 9.930 11.164 1.00 22.23 H new ATOM 1117 N HIS A 74 8.410 8.084 8.695 1.00 41.52 N ATOM 1118 CA HIS A 74 8.353 6.706 9.207 1.00 31.42 C ATOM 1119 C HIS A 74 9.680 5.950 9.028 1.00 14.33 C ATOM 1120 O HIS A 74 9.782 4.782 9.402 1.00 44.22 O ATOM 1121 CB HIS A 74 7.229 5.936 8.503 1.00 53.34 C ATOM 1122 CG HIS A 74 5.854 6.414 8.861 1.00 62.13 C ATOM 1123 ND1 HIS A 74 5.214 7.449 8.209 1.00 42.01 N ATOM 1124 CD2 HIS A 74 4.986 5.977 9.804 1.00 75.31 C ATOM 1125 CE1 HIS A 74 4.017 7.625 8.737 1.00 60.53 C ATOM 1126 NE2 HIS A 74 3.855 6.745 9.704 1.00 63.42 N ATOM 0 H HIS A 74 8.283 8.161 7.686 1.00 41.52 H new ATOM 0 HA HIS A 74 8.157 6.772 10.277 1.00 31.42 H new ATOM 0 HB2 HIS A 74 7.364 6.020 7.425 1.00 53.34 H new ATOM 0 HB3 HIS A 74 7.313 4.879 8.754 1.00 53.34 H new ATOM 0 HD1 HIS A 74 5.605 7.993 7.440 1.00 42.01 H new ATOM 0 HD2 HIS A 74 5.154 5.173 10.505 1.00 75.31 H new ATOM 0 HE1 HIS A 74 3.293 8.365 8.429 1.00 60.53 H new ATOM 1135 N LYS A 75 10.692 6.627 8.479 1.00 51.32 N ATOM 1136 CA LYS A 75 11.987 5.996 8.170 1.00 25.53 C ATOM 1137 C LYS A 75 11.808 4.742 7.290 1.00 14.34 C ATOM 1138 O LYS A 75 12.005 3.608 7.740 1.00 14.12 O ATOM 1139 CB LYS A 75 12.775 5.651 9.453 1.00 35.13 C ATOM 1140 CG LYS A 75 13.223 6.867 10.272 1.00 32.31 C ATOM 1141 CD LYS A 75 12.080 7.496 11.071 1.00 23.44 C ATOM 1142 CE LYS A 75 11.530 6.540 12.126 1.00 62.14 C ATOM 1143 NZ LYS A 75 10.473 7.173 12.958 1.00 60.14 N ATOM 0 H LYS A 75 10.643 7.617 8.237 1.00 51.32 H new ATOM 0 HA LYS A 75 12.569 6.725 7.606 1.00 25.53 H new ATOM 0 HB2 LYS A 75 12.156 5.013 10.083 1.00 35.13 H new ATOM 0 HB3 LYS A 75 13.655 5.070 9.178 1.00 35.13 H new ATOM 0 HG2 LYS A 75 14.016 6.566 10.956 1.00 32.31 H new ATOM 0 HG3 LYS A 75 13.647 7.615 9.602 1.00 32.31 H new ATOM 0 HD2 LYS A 75 12.433 8.406 11.555 1.00 23.44 H new ATOM 0 HD3 LYS A 75 11.279 7.787 10.391 1.00 23.44 H new ATOM 0 HE2 LYS A 75 11.124 5.655 11.636 1.00 62.14 H new ATOM 0 HE3 LYS A 75 12.343 6.203 12.769 1.00 62.14 H new ATOM 0 HZ1 LYS A 75 9.869 6.435 13.373 1.00 60.14 H new ATOM 0 HZ2 LYS A 75 10.915 7.727 13.719 1.00 60.14 H new ATOM 0 HZ3 LYS A 75 9.894 7.801 12.365 1.00 60.14 H new ATOM 1157 N LEU A 76 11.405 4.960 6.039 1.00 60.54 N ATOM 1158 CA LEU A 76 11.187 3.867 5.081 1.00 52.45 C ATOM 1159 C LEU A 76 12.310 3.831 4.032 1.00 63.13 C ATOM 1160 O LEU A 76 12.722 4.873 3.522 1.00 41.22 O ATOM 1161 CB LEU A 76 9.830 4.042 4.381 1.00 42.24 C ATOM 1162 CG LEU A 76 8.610 4.170 5.310 1.00 70.41 C ATOM 1163 CD1 LEU A 76 7.330 4.367 4.498 1.00 0.21 C ATOM 1164 CD2 LEU A 76 8.488 2.950 6.223 1.00 51.01 C ATOM 0 H LEU A 76 11.221 5.889 5.659 1.00 60.54 H new ATOM 0 HA LEU A 76 11.192 2.925 5.630 1.00 52.45 H new ATOM 0 HB2 LEU A 76 9.879 4.931 3.752 1.00 42.24 H new ATOM 0 HB3 LEU A 76 9.671 3.191 3.719 1.00 42.24 H new ATOM 0 HG LEU A 76 8.755 5.049 5.938 1.00 70.41 H new ATOM 0 HD11 LEU A 76 6.480 4.455 5.175 1.00 0.21 H new ATOM 0 HD12 LEU A 76 7.414 5.275 3.901 1.00 0.21 H new ATOM 0 HD13 LEU A 76 7.182 3.512 3.839 1.00 0.21 H new ATOM 0 HD21 LEU A 76 7.618 3.065 6.870 1.00 51.01 H new ATOM 0 HD22 LEU A 76 8.373 2.052 5.616 1.00 51.01 H new ATOM 0 HD23 LEU A 76 9.386 2.862 6.835 1.00 51.01 H new ATOM 1176 N VAL A 77 12.797 2.636 3.703 1.00 75.52 N ATOM 1177 CA VAL A 77 13.891 2.498 2.736 1.00 40.14 C ATOM 1178 C VAL A 77 13.365 2.392 1.291 1.00 21.25 C ATOM 1179 O VAL A 77 12.253 1.903 1.049 1.00 4.15 O ATOM 1180 CB VAL A 77 14.783 1.272 3.050 1.00 0.31 C ATOM 1181 CG1 VAL A 77 14.050 -0.025 2.735 1.00 25.14 C ATOM 1182 CG2 VAL A 77 16.109 1.349 2.293 1.00 31.33 C ATOM 0 H VAL A 77 12.457 1.754 4.087 1.00 75.52 H new ATOM 0 HA VAL A 77 14.494 3.402 2.825 1.00 40.14 H new ATOM 0 HB VAL A 77 15.007 1.283 4.117 1.00 0.31 H new ATOM 0 HG11 VAL A 77 14.696 -0.873 2.963 1.00 25.14 H new ATOM 0 HG12 VAL A 77 13.144 -0.086 3.338 1.00 25.14 H new ATOM 0 HG13 VAL A 77 13.785 -0.045 1.678 1.00 25.14 H new ATOM 0 HG21 VAL A 77 16.716 0.476 2.532 1.00 31.33 H new ATOM 0 HG22 VAL A 77 15.915 1.374 1.221 1.00 31.33 H new ATOM 0 HG23 VAL A 77 16.643 2.253 2.586 1.00 31.33 H new ATOM 1192 N GLU A 78 14.193 2.846 0.351 1.00 12.12 N ATOM 1193 CA GLU A 78 13.845 2.917 -1.074 1.00 44.34 C ATOM 1194 C GLU A 78 13.712 1.531 -1.742 1.00 53.55 C ATOM 1195 O GLU A 78 14.577 0.662 -1.592 1.00 12.43 O ATOM 1196 CB GLU A 78 14.919 3.742 -1.801 1.00 5.15 C ATOM 1197 CG GLU A 78 16.326 3.155 -1.677 1.00 41.24 C ATOM 1198 CD GLU A 78 17.410 4.078 -2.211 1.00 65.33 C ATOM 1199 OE1 GLU A 78 17.604 4.125 -3.444 1.00 72.20 O ATOM 1200 OE2 GLU A 78 18.079 4.751 -1.395 1.00 3.23 O ATOM 0 H GLU A 78 15.135 3.179 0.556 1.00 12.12 H new ATOM 0 HA GLU A 78 12.865 3.389 -1.149 1.00 44.34 H new ATOM 0 HB2 GLU A 78 14.656 3.816 -2.856 1.00 5.15 H new ATOM 0 HB3 GLU A 78 14.920 4.756 -1.401 1.00 5.15 H new ATOM 0 HG2 GLU A 78 16.530 2.935 -0.629 1.00 41.24 H new ATOM 0 HG3 GLU A 78 16.366 2.208 -2.216 1.00 41.24 H new ATOM 1207 N MET A 79 12.611 1.338 -2.472 1.00 11.10 N ATOM 1208 CA MET A 79 12.415 0.159 -3.329 1.00 34.25 C ATOM 1209 C MET A 79 11.774 0.582 -4.668 1.00 62.22 C ATOM 1210 O MET A 79 11.081 1.604 -4.738 1.00 54.42 O ATOM 1211 CB MET A 79 11.544 -0.893 -2.618 1.00 51.50 C ATOM 1212 CG MET A 79 12.165 -1.453 -1.343 1.00 73.03 C ATOM 1213 SD MET A 79 11.171 -2.757 -0.587 1.00 20.41 S ATOM 1214 CE MET A 79 11.172 -3.992 -1.888 1.00 50.03 C ATOM 0 H MET A 79 11.829 1.992 -2.488 1.00 11.10 H new ATOM 0 HA MET A 79 13.387 -0.291 -3.532 1.00 34.25 H new ATOM 0 HB2 MET A 79 10.580 -0.447 -2.375 1.00 51.50 H new ATOM 0 HB3 MET A 79 11.350 -1.715 -3.307 1.00 51.50 H new ATOM 0 HG2 MET A 79 13.156 -1.845 -1.570 1.00 73.03 H new ATOM 0 HG3 MET A 79 12.299 -0.644 -0.625 1.00 73.03 H new ATOM 0 HE1 MET A 79 10.164 -4.099 -2.289 1.00 50.03 H new ATOM 0 HE2 MET A 79 11.848 -3.681 -2.684 1.00 50.03 H new ATOM 0 HE3 MET A 79 11.504 -4.948 -1.482 1.00 50.03 H new ATOM 1224 N ASN A 80 12.007 -0.191 -5.730 1.00 22.33 N ATOM 1225 CA ASN A 80 11.554 0.192 -7.074 1.00 52.34 C ATOM 1226 C ASN A 80 11.389 -1.013 -8.026 1.00 3.21 C ATOM 1227 O ASN A 80 11.865 -2.120 -7.760 1.00 25.42 O ATOM 1228 CB ASN A 80 12.504 1.244 -7.680 1.00 30.43 C ATOM 1229 CG ASN A 80 13.944 1.086 -7.213 1.00 40.51 C ATOM 1230 OD1 ASN A 80 14.385 -0.001 -6.861 1.00 14.40 O ATOM 1231 ND2 ASN A 80 14.689 2.173 -7.214 1.00 75.52 N ATOM 0 H ASN A 80 12.503 -1.081 -5.690 1.00 22.33 H new ATOM 0 HA ASN A 80 10.561 0.627 -6.959 1.00 52.34 H new ATOM 0 HB2 ASN A 80 12.471 1.172 -8.767 1.00 30.43 H new ATOM 0 HB3 ASN A 80 12.150 2.240 -7.416 1.00 30.43 H new ATOM 0 HD21 ASN A 80 15.663 2.124 -6.916 1.00 75.52 H new ATOM 0 HD22 ASN A 80 14.291 3.063 -7.513 1.00 75.52 H new ATOM 1238 N CYS A 81 10.748 -0.742 -9.168 1.00 25.32 N ATOM 1239 CA CYS A 81 10.269 -1.766 -10.121 1.00 0.52 C ATOM 1240 C CYS A 81 11.182 -2.996 -10.296 1.00 51.15 C ATOM 1241 O CYS A 81 10.727 -4.126 -10.123 1.00 14.32 O ATOM 1242 CB CYS A 81 10.039 -1.125 -11.494 1.00 60.01 C ATOM 1243 SG CYS A 81 9.562 -2.296 -12.791 1.00 62.31 S ATOM 0 H CYS A 81 10.541 0.211 -9.467 1.00 25.32 H new ATOM 0 HA CYS A 81 9.346 -2.143 -9.681 1.00 0.52 H new ATOM 0 HB2 CYS A 81 9.262 -0.366 -11.402 1.00 60.01 H new ATOM 0 HB3 CYS A 81 10.951 -0.613 -11.800 1.00 60.01 H new ATOM 0 HG CYS A 81 9.389 -1.657 -13.910 1.00 62.31 H new ATOM 1249 N TYR A 82 12.453 -2.793 -10.654 1.00 65.52 N ATOM 1250 CA TYR A 82 13.332 -3.918 -11.032 1.00 64.41 C ATOM 1251 C TYR A 82 13.447 -4.989 -9.929 1.00 73.22 C ATOM 1252 O TYR A 82 13.607 -6.176 -10.224 1.00 75.13 O ATOM 1253 CB TYR A 82 14.722 -3.416 -11.455 1.00 75.44 C ATOM 1254 CG TYR A 82 15.497 -2.686 -10.372 1.00 3.13 C ATOM 1255 CD1 TYR A 82 15.266 -1.341 -10.110 1.00 73.34 C ATOM 1256 CD2 TYR A 82 16.467 -3.341 -9.621 1.00 1.32 C ATOM 1257 CE1 TYR A 82 15.975 -0.675 -9.130 1.00 2.53 C ATOM 1258 CE2 TYR A 82 17.180 -2.679 -8.639 1.00 2.11 C ATOM 1259 CZ TYR A 82 16.930 -1.346 -8.398 1.00 61.55 C ATOM 1260 OH TYR A 82 17.636 -0.685 -7.420 1.00 13.13 O ATOM 0 H TYR A 82 12.898 -1.876 -10.692 1.00 65.52 H new ATOM 0 HA TYR A 82 12.861 -4.402 -11.888 1.00 64.41 H new ATOM 0 HB2 TYR A 82 15.313 -4.268 -11.792 1.00 75.44 H new ATOM 0 HB3 TYR A 82 14.607 -2.750 -12.310 1.00 75.44 H new ATOM 0 HD1 TYR A 82 14.520 -0.808 -10.682 1.00 73.34 H new ATOM 0 HD2 TYR A 82 16.667 -4.386 -9.808 1.00 1.32 H new ATOM 0 HE1 TYR A 82 15.781 0.370 -8.938 1.00 2.53 H new ATOM 0 HE2 TYR A 82 17.929 -3.204 -8.064 1.00 2.11 H new ATOM 0 HH TYR A 82 18.269 -1.303 -6.999 1.00 13.13 H new ATOM 1270 N GLU A 83 13.359 -4.576 -8.666 1.00 10.53 N ATOM 1271 CA GLU A 83 13.341 -5.528 -7.545 1.00 34.23 C ATOM 1272 C GLU A 83 11.905 -5.905 -7.164 1.00 31.55 C ATOM 1273 O GLU A 83 11.588 -7.080 -6.949 1.00 5.41 O ATOM 1274 CB GLU A 83 14.059 -4.945 -6.317 1.00 21.22 C ATOM 1275 CG GLU A 83 15.575 -4.878 -6.452 1.00 65.14 C ATOM 1276 CD GLU A 83 16.207 -6.242 -6.701 1.00 33.52 C ATOM 1277 OE1 GLU A 83 16.166 -7.099 -5.793 1.00 73.55 O ATOM 1278 OE2 GLU A 83 16.751 -6.464 -7.804 1.00 2.42 O ATOM 0 H GLU A 83 13.299 -3.596 -8.389 1.00 10.53 H new ATOM 0 HA GLU A 83 13.867 -6.425 -7.873 1.00 34.23 H new ATOM 0 HB2 GLU A 83 13.678 -3.941 -6.130 1.00 21.22 H new ATOM 0 HB3 GLU A 83 13.810 -5.548 -5.444 1.00 21.22 H new ATOM 0 HG2 GLU A 83 15.833 -4.208 -7.272 1.00 65.14 H new ATOM 0 HG3 GLU A 83 15.997 -4.447 -5.544 1.00 65.14 H new ATOM 1285 N ASP A 84 11.039 -4.902 -7.091 1.00 3.42 N ATOM 1286 CA ASP A 84 9.665 -5.097 -6.635 1.00 20.44 C ATOM 1287 C ASP A 84 8.809 -5.934 -7.594 1.00 60.32 C ATOM 1288 O ASP A 84 7.776 -6.453 -7.185 1.00 50.05 O ATOM 1289 CB ASP A 84 9.002 -3.749 -6.369 1.00 54.53 C ATOM 1290 CG ASP A 84 9.548 -3.119 -5.109 1.00 4.11 C ATOM 1291 OD1 ASP A 84 10.649 -2.541 -5.164 1.00 63.42 O ATOM 1292 OD2 ASP A 84 8.890 -3.242 -4.055 1.00 45.10 O ATOM 0 H ASP A 84 11.264 -3.940 -7.343 1.00 3.42 H new ATOM 0 HA ASP A 84 9.728 -5.669 -5.709 1.00 20.44 H new ATOM 0 HB2 ASP A 84 9.170 -3.083 -7.216 1.00 54.53 H new ATOM 0 HB3 ASP A 84 7.924 -3.881 -6.277 1.00 54.53 H new ATOM 1297 N ALA A 85 9.232 -6.081 -8.850 1.00 61.33 N ATOM 1298 CA ALA A 85 8.479 -6.884 -9.825 1.00 22.32 C ATOM 1299 C ALA A 85 7.997 -8.212 -9.204 1.00 64.24 C ATOM 1300 O ALA A 85 6.788 -8.462 -9.089 1.00 4.43 O ATOM 1301 CB ALA A 85 9.328 -7.143 -11.064 1.00 74.12 C ATOM 0 H ALA A 85 10.085 -5.660 -9.218 1.00 61.33 H new ATOM 0 HA ALA A 85 7.595 -6.318 -10.120 1.00 22.32 H new ATOM 0 HB1 ALA A 85 8.758 -7.738 -11.777 1.00 74.12 H new ATOM 0 HB2 ALA A 85 9.603 -6.193 -11.522 1.00 74.12 H new ATOM 0 HB3 ALA A 85 10.231 -7.683 -10.780 1.00 74.12 H new ATOM 1307 N SER A 86 8.945 -9.038 -8.766 1.00 14.53 N ATOM 1308 CA SER A 86 8.620 -10.294 -8.076 1.00 0.34 C ATOM 1309 C SER A 86 8.093 -10.041 -6.655 1.00 2.20 C ATOM 1310 O SER A 86 7.316 -10.836 -6.124 1.00 55.15 O ATOM 1311 CB SER A 86 9.846 -11.218 -8.018 1.00 73.33 C ATOM 1312 OG SER A 86 10.246 -11.623 -9.322 1.00 44.13 O ATOM 0 H SER A 86 9.944 -8.865 -8.874 1.00 14.53 H new ATOM 0 HA SER A 86 7.832 -10.781 -8.650 1.00 0.34 H new ATOM 0 HB2 SER A 86 10.670 -10.703 -7.525 1.00 73.33 H new ATOM 0 HB3 SER A 86 9.614 -12.097 -7.416 1.00 73.33 H new ATOM 0 HG SER A 86 11.029 -12.209 -9.257 1.00 44.13 H new ATOM 1318 N MET A 87 8.507 -8.927 -6.044 1.00 63.13 N ATOM 1319 CA MET A 87 8.060 -8.581 -4.688 1.00 74.12 C ATOM 1320 C MET A 87 6.541 -8.347 -4.638 1.00 2.13 C ATOM 1321 O MET A 87 5.816 -9.110 -4.003 1.00 64.50 O ATOM 1322 CB MET A 87 8.805 -7.345 -4.163 1.00 14.32 C ATOM 1323 CG MET A 87 8.356 -6.898 -2.776 1.00 31.03 C ATOM 1324 SD MET A 87 8.598 -8.176 -1.523 1.00 4.13 S ATOM 1325 CE MET A 87 10.387 -8.200 -1.394 1.00 1.40 C ATOM 0 H MET A 87 9.147 -8.252 -6.462 1.00 63.13 H new ATOM 0 HA MET A 87 8.293 -9.429 -4.044 1.00 74.12 H new ATOM 0 HB2 MET A 87 9.873 -7.560 -4.137 1.00 14.32 H new ATOM 0 HB3 MET A 87 8.663 -6.522 -4.863 1.00 14.32 H new ATOM 0 HG2 MET A 87 8.910 -6.004 -2.489 1.00 31.03 H new ATOM 0 HG3 MET A 87 7.302 -6.623 -2.810 1.00 31.03 H new ATOM 0 HE1 MET A 87 10.681 -8.778 -0.518 1.00 1.40 H new ATOM 0 HE2 MET A 87 10.810 -8.656 -2.289 1.00 1.40 H new ATOM 0 HE3 MET A 87 10.758 -7.180 -1.296 1.00 1.40 H new ATOM 1335 N PHE A 88 6.054 -7.296 -5.309 1.00 33.23 N ATOM 1336 CA PHE A 88 4.618 -7.012 -5.319 1.00 51.20 C ATOM 1337 C PHE A 88 3.831 -8.132 -6.013 1.00 52.20 C ATOM 1338 O PHE A 88 2.641 -8.294 -5.764 1.00 33.21 O ATOM 1339 CB PHE A 88 4.295 -5.629 -5.936 1.00 71.02 C ATOM 1340 CG PHE A 88 4.565 -5.472 -7.420 1.00 71.13 C ATOM 1341 CD1 PHE A 88 3.726 -6.051 -8.365 1.00 11.03 C ATOM 1342 CD2 PHE A 88 5.639 -4.714 -7.870 1.00 60.21 C ATOM 1343 CE1 PHE A 88 3.955 -5.882 -9.716 1.00 74.33 C ATOM 1344 CE2 PHE A 88 5.874 -4.547 -9.222 1.00 31.53 C ATOM 1345 CZ PHE A 88 5.030 -5.132 -10.146 1.00 71.33 C ATOM 0 H PHE A 88 6.624 -6.640 -5.843 1.00 33.23 H new ATOM 0 HA PHE A 88 4.298 -6.974 -4.278 1.00 51.20 H new ATOM 0 HB2 PHE A 88 3.242 -5.412 -5.756 1.00 71.02 H new ATOM 0 HB3 PHE A 88 4.872 -4.874 -5.402 1.00 71.02 H new ATOM 0 HD1 PHE A 88 2.883 -6.641 -8.038 1.00 11.03 H new ATOM 0 HD2 PHE A 88 6.300 -4.249 -7.153 1.00 60.21 H new ATOM 0 HE1 PHE A 88 3.292 -6.337 -10.437 1.00 74.33 H new ATOM 0 HE2 PHE A 88 6.717 -3.960 -9.556 1.00 31.53 H new ATOM 0 HZ PHE A 88 5.211 -5.002 -11.203 1.00 71.33 H new ATOM 1355 N LYS A 89 4.493 -8.908 -6.881 1.00 72.13 N ATOM 1356 CA LYS A 89 3.870 -10.112 -7.451 1.00 31.14 C ATOM 1357 C LYS A 89 3.499 -11.114 -6.343 1.00 53.54 C ATOM 1358 O LYS A 89 2.345 -11.528 -6.226 1.00 70.30 O ATOM 1359 CB LYS A 89 4.803 -10.786 -8.465 1.00 11.52 C ATOM 1360 CG LYS A 89 4.218 -12.050 -9.095 1.00 73.32 C ATOM 1361 CD LYS A 89 5.194 -12.710 -10.067 1.00 34.32 C ATOM 1362 CE LYS A 89 5.547 -11.796 -11.235 1.00 24.13 C ATOM 1363 NZ LYS A 89 4.356 -11.455 -12.060 1.00 14.23 N ATOM 0 H LYS A 89 5.445 -8.729 -7.201 1.00 72.13 H new ATOM 0 HA LYS A 89 2.961 -9.800 -7.964 1.00 31.14 H new ATOM 0 HB2 LYS A 89 5.041 -10.074 -9.255 1.00 11.52 H new ATOM 0 HB3 LYS A 89 5.741 -11.038 -7.970 1.00 11.52 H new ATOM 0 HG2 LYS A 89 3.955 -12.758 -8.309 1.00 73.32 H new ATOM 0 HG3 LYS A 89 3.296 -11.800 -9.621 1.00 73.32 H new ATOM 0 HD2 LYS A 89 6.105 -12.985 -9.535 1.00 34.32 H new ATOM 0 HD3 LYS A 89 4.757 -13.633 -10.449 1.00 34.32 H new ATOM 0 HE2 LYS A 89 5.998 -10.880 -10.854 1.00 24.13 H new ATOM 0 HE3 LYS A 89 6.294 -12.282 -11.862 1.00 24.13 H new ATOM 0 HZ1 LYS A 89 4.661 -10.962 -12.923 1.00 14.23 H new ATOM 0 HZ2 LYS A 89 3.852 -12.327 -12.319 1.00 14.23 H new ATOM 0 HZ3 LYS A 89 3.721 -10.837 -11.515 1.00 14.23 H new ATOM 1377 N ALA A 90 4.486 -11.497 -5.531 1.00 51.03 N ATOM 1378 CA ALA A 90 4.258 -12.413 -4.405 1.00 74.42 C ATOM 1379 C ALA A 90 3.329 -11.785 -3.354 1.00 24.55 C ATOM 1380 O ALA A 90 2.450 -12.452 -2.802 1.00 54.21 O ATOM 1381 CB ALA A 90 5.586 -12.811 -3.766 1.00 31.23 C ATOM 0 H ALA A 90 5.453 -11.188 -5.630 1.00 51.03 H new ATOM 0 HA ALA A 90 3.771 -13.307 -4.794 1.00 74.42 H new ATOM 0 HB1 ALA A 90 5.400 -13.490 -2.933 1.00 31.23 H new ATOM 0 HB2 ALA A 90 6.212 -13.308 -4.507 1.00 31.23 H new ATOM 0 HB3 ALA A 90 6.096 -11.919 -3.401 1.00 31.23 H new ATOM 1387 N TYR A 91 3.536 -10.495 -3.093 1.00 20.24 N ATOM 1388 CA TYR A 91 2.704 -9.735 -2.155 1.00 24.12 C ATOM 1389 C TYR A 91 1.223 -9.775 -2.562 1.00 53.22 C ATOM 1390 O TYR A 91 0.370 -10.197 -1.780 1.00 12.23 O ATOM 1391 CB TYR A 91 3.208 -8.283 -2.080 1.00 35.12 C ATOM 1392 CG TYR A 91 2.422 -7.367 -1.147 1.00 3.12 C ATOM 1393 CD1 TYR A 91 1.820 -7.852 0.012 1.00 72.41 C ATOM 1394 CD2 TYR A 91 2.299 -6.008 -1.423 1.00 24.24 C ATOM 1395 CE1 TYR A 91 1.118 -7.014 0.860 1.00 53.22 C ATOM 1396 CE2 TYR A 91 1.599 -5.164 -0.578 1.00 13.41 C ATOM 1397 CZ TYR A 91 1.010 -5.672 0.562 1.00 21.21 C ATOM 1398 OH TYR A 91 0.312 -4.836 1.407 1.00 62.02 O ATOM 0 H TYR A 91 4.281 -9.947 -3.523 1.00 20.24 H new ATOM 0 HA TYR A 91 2.783 -10.194 -1.170 1.00 24.12 H new ATOM 0 HB2 TYR A 91 4.250 -8.294 -1.759 1.00 35.12 H new ATOM 0 HB3 TYR A 91 3.188 -7.857 -3.083 1.00 35.12 H new ATOM 0 HD1 TYR A 91 1.903 -8.902 0.253 1.00 72.41 H new ATOM 0 HD2 TYR A 91 2.758 -5.605 -2.313 1.00 24.24 H new ATOM 0 HE1 TYR A 91 0.656 -7.410 1.752 1.00 53.22 H new ATOM 0 HE2 TYR A 91 1.514 -4.113 -0.810 1.00 13.41 H new ATOM 0 HH TYR A 91 0.332 -3.922 1.053 1.00 62.02 H new ATOM 1408 N ILE A 92 0.927 -9.358 -3.793 1.00 21.35 N ATOM 1409 CA ILE A 92 -0.457 -9.313 -4.277 1.00 10.33 C ATOM 1410 C ILE A 92 -1.047 -10.725 -4.433 1.00 1.21 C ATOM 1411 O ILE A 92 -2.242 -10.934 -4.229 1.00 40.24 O ATOM 1412 CB ILE A 92 -0.571 -8.546 -5.628 1.00 74.23 C ATOM 1413 CG1 ILE A 92 -2.036 -8.164 -5.912 1.00 21.44 C ATOM 1414 CG2 ILE A 92 -0.001 -9.369 -6.786 1.00 60.35 C ATOM 1415 CD1 ILE A 92 -2.633 -7.227 -4.879 1.00 14.33 C ATOM 0 H ILE A 92 1.622 -9.047 -4.472 1.00 21.35 H new ATOM 0 HA ILE A 92 -1.031 -8.775 -3.523 1.00 10.33 H new ATOM 0 HB ILE A 92 0.019 -7.633 -5.542 1.00 74.23 H new ATOM 0 HG12 ILE A 92 -2.096 -7.694 -6.894 1.00 21.44 H new ATOM 0 HG13 ILE A 92 -2.637 -9.072 -5.956 1.00 21.44 H new ATOM 0 HG21 ILE A 92 -0.096 -8.805 -7.714 1.00 60.35 H new ATOM 0 HG22 ILE A 92 1.051 -9.583 -6.597 1.00 60.35 H new ATOM 0 HG23 ILE A 92 -0.552 -10.306 -6.872 1.00 60.35 H new ATOM 0 HD11 ILE A 92 -3.666 -7.003 -5.145 1.00 14.33 H new ATOM 0 HD12 ILE A 92 -2.606 -7.702 -3.898 1.00 14.33 H new ATOM 0 HD13 ILE A 92 -2.057 -6.302 -4.850 1.00 14.33 H new ATOM 1427 N LYS A 93 -0.197 -11.691 -4.786 1.00 44.21 N ATOM 1428 CA LYS A 93 -0.629 -13.083 -4.954 1.00 63.15 C ATOM 1429 C LYS A 93 -1.082 -13.687 -3.614 1.00 44.33 C ATOM 1430 O LYS A 93 -2.201 -14.194 -3.491 1.00 43.12 O ATOM 1431 CB LYS A 93 0.513 -13.917 -5.554 1.00 14.53 C ATOM 1432 CG LYS A 93 0.098 -15.316 -6.006 1.00 1.14 C ATOM 1433 CD LYS A 93 -0.956 -15.265 -7.110 1.00 2.13 C ATOM 1434 CE LYS A 93 -1.257 -16.648 -7.675 1.00 61.44 C ATOM 1435 NZ LYS A 93 -0.083 -17.226 -8.383 1.00 75.13 N ATOM 0 H LYS A 93 0.796 -11.536 -4.962 1.00 44.21 H new ATOM 0 HA LYS A 93 -1.480 -13.098 -5.635 1.00 63.15 H new ATOM 0 HB2 LYS A 93 0.930 -13.381 -6.407 1.00 14.53 H new ATOM 0 HB3 LYS A 93 1.309 -14.008 -4.815 1.00 14.53 H new ATOM 0 HG2 LYS A 93 0.974 -15.857 -6.364 1.00 1.14 H new ATOM 0 HG3 LYS A 93 -0.294 -15.872 -5.154 1.00 1.14 H new ATOM 0 HD2 LYS A 93 -1.873 -14.827 -6.716 1.00 2.13 H new ATOM 0 HD3 LYS A 93 -0.610 -14.613 -7.912 1.00 2.13 H new ATOM 0 HE2 LYS A 93 -1.556 -17.314 -6.865 1.00 61.44 H new ATOM 0 HE3 LYS A 93 -2.100 -16.583 -8.363 1.00 61.44 H new ATOM 0 HZ1 LYS A 93 -0.387 -18.044 -8.949 1.00 75.13 H new ATOM 0 HZ2 LYS A 93 0.333 -16.507 -9.009 1.00 75.13 H new ATOM 0 HZ3 LYS A 93 0.626 -17.531 -7.687 1.00 75.13 H new ATOM 1449 N LYS A 94 -0.207 -13.623 -2.608 1.00 54.25 N ATOM 1450 CA LYS A 94 -0.532 -14.134 -1.273 1.00 42.40 C ATOM 1451 C LYS A 94 -1.691 -13.337 -0.659 1.00 43.41 C ATOM 1452 O LYS A 94 -2.577 -13.896 -0.017 1.00 70.41 O ATOM 1453 CB LYS A 94 0.687 -14.047 -0.342 1.00 44.23 C ATOM 1454 CG LYS A 94 0.597 -14.983 0.864 1.00 33.04 C ATOM 1455 CD LYS A 94 1.333 -14.439 2.087 1.00 21.24 C ATOM 1456 CE LYS A 94 0.534 -13.339 2.779 1.00 12.13 C ATOM 1457 NZ LYS A 94 -0.753 -13.853 3.328 1.00 65.32 N ATOM 0 H LYS A 94 0.728 -13.224 -2.691 1.00 54.25 H new ATOM 0 HA LYS A 94 -0.826 -15.178 -1.381 1.00 42.40 H new ATOM 0 HB2 LYS A 94 1.587 -14.284 -0.910 1.00 44.23 H new ATOM 0 HB3 LYS A 94 0.793 -13.021 0.011 1.00 44.23 H new ATOM 0 HG2 LYS A 94 -0.451 -15.143 1.117 1.00 33.04 H new ATOM 0 HG3 LYS A 94 1.013 -15.955 0.597 1.00 33.04 H new ATOM 0 HD2 LYS A 94 1.521 -15.250 2.790 1.00 21.24 H new ATOM 0 HD3 LYS A 94 2.304 -14.048 1.784 1.00 21.24 H new ATOM 0 HE2 LYS A 94 1.128 -12.911 3.586 1.00 12.13 H new ATOM 0 HE3 LYS A 94 0.332 -12.536 2.071 1.00 12.13 H new ATOM 0 HZ1 LYS A 94 -1.547 -13.404 2.829 1.00 65.32 H new ATOM 0 HZ2 LYS A 94 -0.800 -14.884 3.196 1.00 65.32 H new ATOM 0 HZ3 LYS A 94 -0.811 -13.631 4.342 1.00 65.32 H new ATOM 1471 N PHE A 95 -1.655 -12.018 -0.850 1.00 14.50 N ATOM 1472 CA PHE A 95 -2.731 -11.127 -0.402 1.00 70.25 C ATOM 1473 C PHE A 95 -4.094 -11.560 -0.960 1.00 15.02 C ATOM 1474 O PHE A 95 -5.021 -11.838 -0.201 1.00 24.01 O ATOM 1475 CB PHE A 95 -2.416 -9.679 -0.825 1.00 74.43 C ATOM 1476 CG PHE A 95 -3.621 -8.766 -0.872 1.00 45.30 C ATOM 1477 CD1 PHE A 95 -4.146 -8.212 0.284 1.00 12.35 C ATOM 1478 CD2 PHE A 95 -4.229 -8.470 -2.084 1.00 12.33 C ATOM 1479 CE1 PHE A 95 -5.251 -7.383 0.230 1.00 61.23 C ATOM 1480 CE2 PHE A 95 -5.330 -7.644 -2.143 1.00 22.42 C ATOM 1481 CZ PHE A 95 -5.843 -7.098 -0.983 1.00 4.54 C ATOM 0 H PHE A 95 -0.886 -11.537 -1.316 1.00 14.50 H new ATOM 0 HA PHE A 95 -2.789 -11.185 0.685 1.00 70.25 H new ATOM 0 HB2 PHE A 95 -1.686 -9.261 -0.132 1.00 74.43 H new ATOM 0 HB3 PHE A 95 -1.948 -9.694 -1.809 1.00 74.43 H new ATOM 0 HD1 PHE A 95 -3.687 -8.430 1.237 1.00 12.35 H new ATOM 0 HD2 PHE A 95 -3.833 -8.894 -2.995 1.00 12.33 H new ATOM 0 HE1 PHE A 95 -5.651 -6.958 1.139 1.00 61.23 H new ATOM 0 HE2 PHE A 95 -5.791 -7.424 -3.095 1.00 22.42 H new ATOM 0 HZ PHE A 95 -6.706 -6.449 -1.025 1.00 4.54 H new ATOM 1491 N MET A 96 -4.191 -11.616 -2.288 1.00 15.11 N ATOM 1492 CA MET A 96 -5.441 -11.949 -2.977 1.00 50.52 C ATOM 1493 C MET A 96 -6.073 -13.230 -2.412 1.00 52.11 C ATOM 1494 O MET A 96 -7.246 -13.236 -2.034 1.00 14.42 O ATOM 1495 CB MET A 96 -5.175 -12.098 -4.482 1.00 0.31 C ATOM 1496 CG MET A 96 -6.411 -12.430 -5.311 1.00 61.44 C ATOM 1497 SD MET A 96 -6.053 -12.519 -7.079 1.00 3.43 S ATOM 1498 CE MET A 96 -4.743 -13.742 -7.097 1.00 0.42 C ATOM 0 H MET A 96 -3.409 -11.433 -2.916 1.00 15.11 H new ATOM 0 HA MET A 96 -6.150 -11.137 -2.813 1.00 50.52 H new ATOM 0 HB2 MET A 96 -4.741 -11.171 -4.855 1.00 0.31 H new ATOM 0 HB3 MET A 96 -4.431 -12.881 -4.631 1.00 0.31 H new ATOM 0 HG2 MET A 96 -6.823 -13.383 -4.978 1.00 61.44 H new ATOM 0 HG3 MET A 96 -7.176 -11.674 -5.136 1.00 61.44 H new ATOM 0 HE1 MET A 96 -4.815 -14.339 -8.006 1.00 0.42 H new ATOM 0 HE2 MET A 96 -3.776 -13.240 -7.068 1.00 0.42 H new ATOM 0 HE3 MET A 96 -4.840 -14.392 -6.227 1.00 0.42 H new ATOM 1508 N LYS A 97 -5.286 -14.301 -2.339 1.00 12.15 N ATOM 1509 CA LYS A 97 -5.768 -15.573 -1.790 1.00 72.31 C ATOM 1510 C LYS A 97 -6.143 -15.438 -0.306 1.00 33.11 C ATOM 1511 O LYS A 97 -7.238 -15.819 0.102 1.00 21.04 O ATOM 1512 CB LYS A 97 -4.702 -16.667 -1.955 1.00 61.11 C ATOM 1513 CG LYS A 97 -5.104 -18.012 -1.347 1.00 14.11 C ATOM 1514 CD LYS A 97 -4.030 -19.078 -1.539 1.00 65.33 C ATOM 1515 CE LYS A 97 -3.794 -19.388 -3.011 1.00 41.13 C ATOM 1516 NZ LYS A 97 -2.831 -20.504 -3.195 1.00 1.03 N ATOM 0 H LYS A 97 -4.315 -14.317 -2.651 1.00 12.15 H new ATOM 0 HA LYS A 97 -6.663 -15.852 -2.346 1.00 72.31 H new ATOM 0 HB2 LYS A 97 -4.496 -16.805 -3.017 1.00 61.11 H new ATOM 0 HB3 LYS A 97 -3.774 -16.331 -1.492 1.00 61.11 H new ATOM 0 HG2 LYS A 97 -5.299 -17.883 -0.282 1.00 14.11 H new ATOM 0 HG3 LYS A 97 -6.035 -18.351 -1.803 1.00 14.11 H new ATOM 0 HD2 LYS A 97 -3.098 -18.740 -1.085 1.00 65.33 H new ATOM 0 HD3 LYS A 97 -4.326 -19.989 -1.019 1.00 65.33 H new ATOM 0 HE2 LYS A 97 -4.742 -19.645 -3.484 1.00 41.13 H new ATOM 0 HE3 LYS A 97 -3.418 -18.497 -3.514 1.00 41.13 H new ATOM 0 HZ1 LYS A 97 -2.698 -20.684 -4.211 1.00 1.03 H new ATOM 0 HZ2 LYS A 97 -1.919 -20.249 -2.766 1.00 1.03 H new ATOM 0 HZ3 LYS A 97 -3.202 -21.361 -2.737 1.00 1.03 H new ATOM 1530 N ASN A 98 -5.233 -14.877 0.485 1.00 61.32 N ATOM 1531 CA ASN A 98 -5.410 -14.775 1.940 1.00 10.33 C ATOM 1532 C ASN A 98 -6.699 -14.020 2.320 1.00 31.12 C ATOM 1533 O ASN A 98 -7.504 -14.511 3.116 1.00 24.53 O ATOM 1534 CB ASN A 98 -4.184 -14.085 2.555 1.00 25.41 C ATOM 1535 CG ASN A 98 -4.159 -14.118 4.075 1.00 31.42 C ATOM 1536 OD1 ASN A 98 -4.723 -15.151 4.672 1.00 61.21 O flip ATOM 1537 ND2 ASN A 98 -3.606 -13.227 4.710 1.00 73.01 N flip ATOM 0 H ASN A 98 -4.357 -14.481 0.144 1.00 61.32 H new ATOM 0 HA ASN A 98 -5.506 -15.785 2.339 1.00 10.33 H new ATOM 0 HB2 ASN A 98 -3.281 -14.564 2.176 1.00 25.41 H new ATOM 0 HB3 ASN A 98 -4.158 -13.047 2.223 1.00 25.41 H new ATOM 0 HD21 ASN A 98 -3.179 -12.441 4.220 1.00 73.01 H new ATOM 0 HD22 ASN A 98 -3.573 -13.272 5.728 1.00 73.01 H new ATOM 1544 N VAL A 99 -6.901 -12.836 1.740 1.00 52.11 N ATOM 1545 CA VAL A 99 -8.057 -11.997 2.087 1.00 75.23 C ATOM 1546 C VAL A 99 -9.390 -12.595 1.598 1.00 51.33 C ATOM 1547 O VAL A 99 -10.391 -12.550 2.318 1.00 65.12 O ATOM 1548 CB VAL A 99 -7.911 -10.548 1.550 1.00 5.53 C ATOM 1549 CG1 VAL A 99 -6.691 -9.870 2.170 1.00 32.25 C ATOM 1550 CG2 VAL A 99 -7.829 -10.522 0.024 1.00 73.21 C ATOM 0 H VAL A 99 -6.286 -12.435 1.032 1.00 52.11 H new ATOM 0 HA VAL A 99 -8.076 -11.966 3.176 1.00 75.23 H new ATOM 0 HB VAL A 99 -8.803 -9.992 1.840 1.00 5.53 H new ATOM 0 HG11 VAL A 99 -6.603 -8.855 1.783 1.00 32.25 H new ATOM 0 HG12 VAL A 99 -6.805 -9.837 3.254 1.00 32.25 H new ATOM 0 HG13 VAL A 99 -5.793 -10.434 1.917 1.00 32.25 H new ATOM 0 HG21 VAL A 99 -7.727 -9.492 -0.317 1.00 73.21 H new ATOM 0 HG22 VAL A 99 -6.965 -11.100 -0.304 1.00 73.21 H new ATOM 0 HG23 VAL A 99 -8.736 -10.956 -0.397 1.00 73.21 H new ATOM 1560 N ILE A 100 -9.409 -13.162 0.389 1.00 63.14 N ATOM 1561 CA ILE A 100 -10.649 -13.735 -0.154 1.00 5.14 C ATOM 1562 C ILE A 100 -10.995 -15.067 0.536 1.00 53.24 C ATOM 1563 O ILE A 100 -12.148 -15.308 0.890 1.00 71.35 O ATOM 1564 CB ILE A 100 -10.584 -13.938 -1.699 1.00 4.54 C ATOM 1565 CG1 ILE A 100 -11.987 -14.232 -2.262 1.00 62.10 C ATOM 1566 CG2 ILE A 100 -9.615 -15.060 -2.076 1.00 63.21 C ATOM 1567 CD1 ILE A 100 -12.986 -13.114 -2.031 1.00 62.42 C ATOM 0 H ILE A 100 -8.598 -13.238 -0.225 1.00 63.14 H new ATOM 0 HA ILE A 100 -11.438 -13.012 0.053 1.00 5.14 H new ATOM 0 HB ILE A 100 -10.212 -13.013 -2.140 1.00 4.54 H new ATOM 0 HG12 ILE A 100 -11.907 -14.419 -3.333 1.00 62.10 H new ATOM 0 HG13 ILE A 100 -12.367 -15.146 -1.806 1.00 62.10 H new ATOM 0 HG21 ILE A 100 -9.595 -15.174 -3.160 1.00 63.21 H new ATOM 0 HG22 ILE A 100 -8.615 -14.813 -1.718 1.00 63.21 H new ATOM 0 HG23 ILE A 100 -9.944 -15.993 -1.619 1.00 63.21 H new ATOM 0 HD11 ILE A 100 -13.950 -13.394 -2.455 1.00 62.42 H new ATOM 0 HD12 ILE A 100 -13.097 -12.941 -0.961 1.00 62.42 H new ATOM 0 HD13 ILE A 100 -12.630 -12.203 -2.511 1.00 62.42 H new ATOM 1579 N ASP A 101 -9.982 -15.908 0.758 1.00 40.11 N ATOM 1580 CA ASP A 101 -10.173 -17.196 1.434 1.00 53.34 C ATOM 1581 C ASP A 101 -10.708 -16.976 2.859 1.00 53.42 C ATOM 1582 O ASP A 101 -11.424 -17.815 3.406 1.00 51.22 O ATOM 1583 CB ASP A 101 -8.844 -17.967 1.460 1.00 33.22 C ATOM 1584 CG ASP A 101 -8.993 -19.403 1.937 1.00 62.43 C ATOM 1585 OD1 ASP A 101 -9.495 -20.245 1.157 1.00 5.12 O ATOM 1586 OD2 ASP A 101 -8.591 -19.706 3.083 1.00 21.11 O ATOM 0 H ASP A 101 -9.019 -15.721 0.479 1.00 40.11 H new ATOM 0 HA ASP A 101 -10.908 -17.786 0.886 1.00 53.34 H new ATOM 0 HB2 ASP A 101 -8.412 -17.967 0.459 1.00 33.22 H new ATOM 0 HB3 ASP A 101 -8.142 -17.446 2.111 1.00 33.22 H new ATOM 1591 N HIS A 102 -10.345 -15.835 3.446 1.00 64.30 N ATOM 1592 CA HIS A 102 -10.871 -15.409 4.747 1.00 42.14 C ATOM 1593 C HIS A 102 -12.310 -14.870 4.625 1.00 25.52 C ATOM 1594 O HIS A 102 -13.255 -15.465 5.144 1.00 24.22 O ATOM 1595 CB HIS A 102 -9.947 -14.327 5.339 1.00 24.40 C ATOM 1596 CG HIS A 102 -10.426 -13.715 6.628 1.00 14.44 C ATOM 1597 ND1 HIS A 102 -10.041 -14.173 7.868 1.00 31.01 N ATOM 1598 CD2 HIS A 102 -11.235 -12.650 6.864 1.00 24.32 C ATOM 1599 CE1 HIS A 102 -10.588 -13.423 8.806 1.00 62.31 C ATOM 1600 NE2 HIS A 102 -11.314 -12.492 8.226 1.00 25.13 N ATOM 0 H HIS A 102 -9.680 -15.180 3.035 1.00 64.30 H new ATOM 0 HA HIS A 102 -10.899 -16.275 5.409 1.00 42.14 H new ATOM 0 HB2 HIS A 102 -8.962 -14.764 5.506 1.00 24.40 H new ATOM 0 HB3 HIS A 102 -9.823 -13.534 4.602 1.00 24.40 H new ATOM 0 HD2 HIS A 102 -11.725 -12.041 6.119 1.00 24.32 H new ATOM 0 HE1 HIS A 102 -10.461 -13.552 9.871 1.00 62.31 H new ATOM 0 HE2 HIS A 102 -11.849 -11.770 8.709 1.00 25.13 H new ATOM 1609 N MET A 103 -12.468 -13.751 3.916 1.00 64.40 N ATOM 1610 CA MET A 103 -13.752 -13.030 3.861 1.00 22.24 C ATOM 1611 C MET A 103 -14.869 -13.852 3.190 1.00 41.30 C ATOM 1612 O MET A 103 -15.994 -13.912 3.692 1.00 4.33 O ATOM 1613 CB MET A 103 -13.581 -11.693 3.127 1.00 22.22 C ATOM 1614 CG MET A 103 -14.858 -10.860 3.070 1.00 75.54 C ATOM 1615 SD MET A 103 -14.624 -9.275 2.243 1.00 73.15 S ATOM 1616 CE MET A 103 -16.281 -8.594 2.335 1.00 32.20 C ATOM 0 H MET A 103 -11.724 -13.319 3.369 1.00 64.40 H new ATOM 0 HA MET A 103 -14.055 -12.851 4.893 1.00 22.24 H new ATOM 0 HB2 MET A 103 -12.801 -11.114 3.621 1.00 22.22 H new ATOM 0 HB3 MET A 103 -13.238 -11.887 2.111 1.00 22.22 H new ATOM 0 HG2 MET A 103 -15.632 -11.425 2.550 1.00 75.54 H new ATOM 0 HG3 MET A 103 -15.218 -10.686 4.084 1.00 75.54 H new ATOM 0 HE1 MET A 103 -16.297 -7.611 1.863 1.00 32.20 H new ATOM 0 HE2 MET A 103 -16.976 -9.256 1.818 1.00 32.20 H new ATOM 0 HE3 MET A 103 -16.578 -8.500 3.379 1.00 32.20 H new ATOM 1626 N GLU A 104 -14.557 -14.481 2.060 1.00 33.01 N ATOM 1627 CA GLU A 104 -15.549 -15.267 1.309 1.00 62.32 C ATOM 1628 C GLU A 104 -15.957 -16.535 2.080 1.00 72.23 C ATOM 1629 O GLU A 104 -16.940 -17.199 1.744 1.00 20.44 O ATOM 1630 CB GLU A 104 -14.992 -15.617 -0.083 1.00 12.14 C ATOM 1631 CG GLU A 104 -16.013 -16.223 -1.044 1.00 61.00 C ATOM 1632 CD GLU A 104 -15.473 -16.351 -2.463 1.00 72.32 C ATOM 1633 OE1 GLU A 104 -14.734 -17.318 -2.741 1.00 25.04 O ATOM 1634 OE2 GLU A 104 -15.777 -15.475 -3.306 1.00 62.31 O ATOM 0 H GLU A 104 -13.628 -14.466 1.639 1.00 33.01 H new ATOM 0 HA GLU A 104 -16.448 -14.664 1.184 1.00 62.32 H new ATOM 0 HB2 GLU A 104 -14.581 -14.713 -0.533 1.00 12.14 H new ATOM 0 HB3 GLU A 104 -14.165 -16.317 0.037 1.00 12.14 H new ATOM 0 HG2 GLU A 104 -16.309 -17.207 -0.681 1.00 61.00 H new ATOM 0 HG3 GLU A 104 -16.910 -15.604 -1.054 1.00 61.00 H new ATOM 1641 N LYS A 105 -15.206 -16.845 3.133 1.00 4.21 N ATOM 1642 CA LYS A 105 -15.475 -18.010 3.979 1.00 40.12 C ATOM 1643 C LYS A 105 -16.563 -17.715 5.027 1.00 73.41 C ATOM 1644 O LYS A 105 -17.445 -18.542 5.270 1.00 41.24 O ATOM 1645 CB LYS A 105 -14.172 -18.443 4.667 1.00 32.51 C ATOM 1646 CG LYS A 105 -14.316 -19.616 5.631 1.00 73.12 C ATOM 1647 CD LYS A 105 -12.955 -20.067 6.156 1.00 61.03 C ATOM 1648 CE LYS A 105 -13.082 -21.156 7.211 1.00 63.11 C ATOM 1649 NZ LYS A 105 -13.785 -20.674 8.428 1.00 35.24 N ATOM 0 H LYS A 105 -14.395 -16.299 3.426 1.00 4.21 H new ATOM 0 HA LYS A 105 -15.847 -18.817 3.348 1.00 40.12 H new ATOM 0 HB2 LYS A 105 -13.444 -18.708 3.900 1.00 32.51 H new ATOM 0 HB3 LYS A 105 -13.765 -17.591 5.212 1.00 32.51 H new ATOM 0 HG2 LYS A 105 -14.954 -19.328 6.466 1.00 73.12 H new ATOM 0 HG3 LYS A 105 -14.808 -20.447 5.126 1.00 73.12 H new ATOM 0 HD2 LYS A 105 -12.351 -20.435 5.327 1.00 61.03 H new ATOM 0 HD3 LYS A 105 -12.429 -19.212 6.580 1.00 61.03 H new ATOM 0 HE2 LYS A 105 -13.623 -22.005 6.792 1.00 63.11 H new ATOM 0 HE3 LYS A 105 -12.089 -21.514 7.484 1.00 63.11 H new ATOM 0 HZ1 LYS A 105 -13.645 -21.354 9.202 1.00 35.24 H new ATOM 0 HZ2 LYS A 105 -13.401 -19.748 8.707 1.00 35.24 H new ATOM 0 HZ3 LYS A 105 -14.801 -20.581 8.228 1.00 35.24 H new ATOM 1663 N ASN A 106 -16.499 -16.535 5.648 1.00 52.43 N ATOM 1664 CA ASN A 106 -17.477 -16.153 6.680 1.00 14.31 C ATOM 1665 C ASN A 106 -18.706 -15.435 6.091 1.00 44.33 C ATOM 1666 O ASN A 106 -19.829 -15.639 6.557 1.00 63.30 O ATOM 1667 CB ASN A 106 -16.814 -15.270 7.747 1.00 13.11 C ATOM 1668 CG ASN A 106 -16.055 -14.101 7.146 1.00 72.33 C ATOM 1669 OD1 ASN A 106 -14.868 -14.200 6.874 1.00 65.01 O ATOM 1670 ND2 ASN A 106 -16.732 -12.994 6.921 1.00 25.45 N ATOM 0 H ASN A 106 -15.787 -15.829 5.459 1.00 52.43 H new ATOM 0 HA ASN A 106 -17.829 -17.077 7.139 1.00 14.31 H new ATOM 0 HB2 ASN A 106 -17.578 -14.892 8.427 1.00 13.11 H new ATOM 0 HB3 ASN A 106 -16.130 -15.876 8.341 1.00 13.11 H new ATOM 0 HD21 ASN A 106 -16.266 -12.186 6.508 1.00 25.45 H new ATOM 0 HD22 ASN A 106 -17.722 -12.944 7.160 1.00 25.45 H new ATOM 1677 N ASN A 107 -18.500 -14.601 5.070 1.00 54.12 N ATOM 1678 CA ASN A 107 -19.613 -13.873 4.443 1.00 11.42 C ATOM 1679 C ASN A 107 -20.441 -14.789 3.528 1.00 53.13 C ATOM 1680 O ASN A 107 -21.640 -14.949 3.737 1.00 14.23 O ATOM 1681 CB ASN A 107 -19.092 -12.664 3.658 1.00 23.14 C ATOM 1682 CG ASN A 107 -20.200 -11.921 2.928 1.00 1.51 C ATOM 1683 OD1 ASN A 107 -20.502 -12.215 1.776 1.00 53.20 O ATOM 1684 ND2 ASN A 107 -20.822 -10.968 3.588 1.00 51.21 N ATOM 0 H ASN A 107 -17.585 -14.412 4.661 1.00 54.12 H new ATOM 0 HA ASN A 107 -20.266 -13.519 5.240 1.00 11.42 H new ATOM 0 HB2 ASN A 107 -18.590 -11.980 4.342 1.00 23.14 H new ATOM 0 HB3 ASN A 107 -18.346 -12.998 2.936 1.00 23.14 H new ATOM 0 HD21 ASN A 107 -21.579 -10.450 3.143 1.00 51.21 H new ATOM 0 HD22 ASN A 107 -20.547 -10.747 4.545 1.00 51.21 H new ATOM 1691 N ARG A 108 -19.798 -15.354 2.502 1.00 62.42 N ATOM 1692 CA ARG A 108 -20.421 -16.341 1.590 1.00 24.12 C ATOM 1693 C ARG A 108 -21.481 -15.738 0.630 1.00 31.03 C ATOM 1694 O ARG A 108 -21.762 -16.318 -0.421 1.00 53.14 O ATOM 1695 CB ARG A 108 -20.987 -17.550 2.392 1.00 61.54 C ATOM 1696 CG ARG A 108 -22.460 -17.908 2.129 1.00 35.54 C ATOM 1697 CD ARG A 108 -23.417 -17.102 3.006 1.00 42.42 C ATOM 1698 NE ARG A 108 -24.821 -17.368 2.694 1.00 13.21 N ATOM 1699 CZ ARG A 108 -25.711 -17.763 3.566 1.00 23.11 C ATOM 1700 NH1 ARG A 108 -25.369 -18.040 4.786 1.00 64.14 N ATOM 1701 NH2 ARG A 108 -26.947 -17.896 3.209 1.00 32.32 N ATOM 0 H ARG A 108 -18.826 -15.144 2.272 1.00 62.42 H new ATOM 0 HA ARG A 108 -19.623 -16.696 0.937 1.00 24.12 H new ATOM 0 HB2 ARG A 108 -20.376 -18.425 2.169 1.00 61.54 H new ATOM 0 HB3 ARG A 108 -20.869 -17.341 3.455 1.00 61.54 H new ATOM 0 HG2 ARG A 108 -22.694 -17.728 1.080 1.00 35.54 H new ATOM 0 HG3 ARG A 108 -22.612 -18.972 2.312 1.00 35.54 H new ATOM 0 HD2 ARG A 108 -23.230 -17.337 4.054 1.00 42.42 H new ATOM 0 HD3 ARG A 108 -23.215 -16.039 2.877 1.00 42.42 H new ATOM 0 HE ARG A 108 -25.127 -17.236 1.730 1.00 13.21 H new ATOM 0 HH11 ARG A 108 -24.395 -17.951 5.075 1.00 64.14 H new ATOM 0 HH12 ARG A 108 -26.074 -18.347 5.456 1.00 64.14 H new ATOM 0 HH21 ARG A 108 -27.225 -17.693 2.249 1.00 32.32 H new ATOM 0 HH22 ARG A 108 -27.643 -18.204 3.888 1.00 32.32 H new ATOM 1715 N ASP A 109 -22.052 -14.583 0.968 1.00 60.14 N ATOM 1716 CA ASP A 109 -23.110 -13.984 0.144 1.00 43.53 C ATOM 1717 C ASP A 109 -22.557 -13.264 -1.094 1.00 20.00 C ATOM 1718 O ASP A 109 -21.670 -12.411 -1.004 1.00 1.23 O ATOM 1719 CB ASP A 109 -23.966 -13.025 0.973 1.00 33.03 C ATOM 1720 CG ASP A 109 -24.880 -13.765 1.929 1.00 24.44 C ATOM 1721 OD1 ASP A 109 -25.678 -14.605 1.454 1.00 64.23 O ATOM 1722 OD2 ASP A 109 -24.816 -13.508 3.146 1.00 53.24 O ATOM 0 H ASP A 109 -21.805 -14.044 1.798 1.00 60.14 H new ATOM 0 HA ASP A 109 -23.732 -14.806 -0.210 1.00 43.53 H new ATOM 0 HB2 ASP A 109 -23.317 -12.355 1.537 1.00 33.03 H new ATOM 0 HB3 ASP A 109 -24.564 -12.404 0.306 1.00 33.03 H new ATOM 1727 N LYS A 110 -23.134 -13.594 -2.248 1.00 71.55 N ATOM 1728 CA LYS A 110 -22.711 -13.043 -3.542 1.00 15.41 C ATOM 1729 C LYS A 110 -22.934 -11.520 -3.635 1.00 51.43 C ATOM 1730 O LYS A 110 -22.507 -10.877 -4.594 1.00 1.10 O ATOM 1731 CB LYS A 110 -23.471 -13.764 -4.666 1.00 44.41 C ATOM 1732 CG LYS A 110 -23.282 -15.282 -4.644 1.00 53.23 C ATOM 1733 CD LYS A 110 -24.279 -16.014 -5.546 1.00 2.01 C ATOM 1734 CE LYS A 110 -24.101 -15.671 -7.022 1.00 71.34 C ATOM 1735 NZ LYS A 110 -25.041 -16.442 -7.882 1.00 2.21 N ATOM 0 H LYS A 110 -23.910 -14.252 -2.316 1.00 71.55 H new ATOM 0 HA LYS A 110 -21.639 -13.209 -3.645 1.00 15.41 H new ATOM 0 HB2 LYS A 110 -24.533 -13.535 -4.582 1.00 44.41 H new ATOM 0 HB3 LYS A 110 -23.137 -13.377 -5.628 1.00 44.41 H new ATOM 0 HG2 LYS A 110 -22.267 -15.522 -4.961 1.00 53.23 H new ATOM 0 HG3 LYS A 110 -23.391 -15.643 -3.621 1.00 53.23 H new ATOM 0 HD2 LYS A 110 -24.163 -17.089 -5.411 1.00 2.01 H new ATOM 0 HD3 LYS A 110 -25.294 -15.762 -5.239 1.00 2.01 H new ATOM 0 HE2 LYS A 110 -24.264 -14.603 -7.170 1.00 71.34 H new ATOM 0 HE3 LYS A 110 -23.075 -15.882 -7.324 1.00 71.34 H new ATOM 0 HZ1 LYS A 110 -24.892 -16.183 -8.878 1.00 2.21 H new ATOM 0 HZ2 LYS A 110 -24.868 -17.460 -7.759 1.00 2.21 H new ATOM 0 HZ3 LYS A 110 -26.020 -16.222 -7.610 1.00 2.21 H new ATOM 1749 N ALA A 111 -23.610 -10.948 -2.641 1.00 75.40 N ATOM 1750 CA ALA A 111 -23.829 -9.500 -2.589 1.00 61.42 C ATOM 1751 C ALA A 111 -22.561 -8.743 -2.150 1.00 4.34 C ATOM 1752 O ALA A 111 -22.236 -7.687 -2.698 1.00 3.14 O ATOM 1753 CB ALA A 111 -24.987 -9.181 -1.650 1.00 12.11 C ATOM 0 H ALA A 111 -24.016 -11.463 -1.860 1.00 75.40 H new ATOM 0 HA ALA A 111 -24.077 -9.165 -3.596 1.00 61.42 H new ATOM 0 HB1 ALA A 111 -25.143 -8.103 -1.617 1.00 12.11 H new ATOM 0 HB2 ALA A 111 -25.893 -9.668 -2.011 1.00 12.11 H new ATOM 0 HB3 ALA A 111 -24.754 -9.544 -0.649 1.00 12.11 H new ATOM 1759 N ASP A 112 -21.851 -9.281 -1.156 1.00 3.14 N ATOM 1760 CA ASP A 112 -20.652 -8.623 -0.618 1.00 4.03 C ATOM 1761 C ASP A 112 -19.351 -9.144 -1.259 1.00 30.25 C ATOM 1762 O ASP A 112 -18.624 -8.387 -1.906 1.00 70.22 O ATOM 1763 CB ASP A 112 -20.584 -8.793 0.904 1.00 33.52 C ATOM 1764 CG ASP A 112 -21.790 -8.199 1.609 1.00 34.32 C ATOM 1765 OD1 ASP A 112 -21.930 -6.955 1.613 1.00 30.34 O ATOM 1766 OD2 ASP A 112 -22.610 -8.965 2.154 1.00 3.25 O ATOM 0 H ASP A 112 -22.082 -10.167 -0.707 1.00 3.14 H new ATOM 0 HA ASP A 112 -20.738 -7.565 -0.867 1.00 4.03 H new ATOM 0 HB2 ASP A 112 -20.512 -9.854 1.145 1.00 33.52 H new ATOM 0 HB3 ASP A 112 -19.677 -8.318 1.279 1.00 33.52 H new ATOM 1771 N VAL A 113 -19.065 -10.438 -1.082 1.00 52.12 N ATOM 1772 CA VAL A 113 -17.778 -11.015 -1.514 1.00 43.33 C ATOM 1773 C VAL A 113 -17.507 -10.827 -3.013 1.00 71.41 C ATOM 1774 O VAL A 113 -16.366 -10.602 -3.414 1.00 1.22 O ATOM 1775 CB VAL A 113 -17.668 -12.516 -1.157 1.00 71.20 C ATOM 1776 CG1 VAL A 113 -17.682 -12.697 0.354 1.00 11.23 C ATOM 1777 CG2 VAL A 113 -18.782 -13.328 -1.816 1.00 35.31 C ATOM 0 H VAL A 113 -19.700 -11.106 -0.646 1.00 52.12 H new ATOM 0 HA VAL A 113 -17.019 -10.460 -0.963 1.00 43.33 H new ATOM 0 HB VAL A 113 -16.720 -12.891 -1.544 1.00 71.20 H new ATOM 0 HG11 VAL A 113 -17.604 -13.757 0.594 1.00 11.23 H new ATOM 0 HG12 VAL A 113 -16.839 -12.163 0.792 1.00 11.23 H new ATOM 0 HG13 VAL A 113 -18.613 -12.301 0.759 1.00 11.23 H new ATOM 0 HG21 VAL A 113 -18.676 -14.378 -1.545 1.00 35.31 H new ATOM 0 HG22 VAL A 113 -19.750 -12.961 -1.475 1.00 35.31 H new ATOM 0 HG23 VAL A 113 -18.716 -13.224 -2.899 1.00 35.31 H new ATOM 1787 N ASP A 114 -18.548 -10.915 -3.838 1.00 74.14 N ATOM 1788 CA ASP A 114 -18.398 -10.685 -5.275 1.00 72.04 C ATOM 1789 C ASP A 114 -17.970 -9.234 -5.546 1.00 11.31 C ATOM 1790 O ASP A 114 -17.048 -8.983 -6.320 1.00 72.21 O ATOM 1791 CB ASP A 114 -19.704 -11.010 -6.006 1.00 53.10 C ATOM 1792 CG ASP A 114 -19.595 -10.807 -7.508 1.00 11.44 C ATOM 1793 OD1 ASP A 114 -19.135 -11.732 -8.213 1.00 15.14 O ATOM 1794 OD2 ASP A 114 -19.970 -9.721 -7.997 1.00 11.13 O ATOM 0 H ASP A 114 -19.497 -11.142 -3.541 1.00 74.14 H new ATOM 0 HA ASP A 114 -17.619 -11.347 -5.653 1.00 72.04 H new ATOM 0 HB2 ASP A 114 -19.984 -12.043 -5.801 1.00 53.10 H new ATOM 0 HB3 ASP A 114 -20.503 -10.380 -5.614 1.00 53.10 H new ATOM 1799 N ALA A 115 -18.632 -8.287 -4.879 1.00 64.23 N ATOM 1800 CA ALA A 115 -18.298 -6.863 -5.011 1.00 1.24 C ATOM 1801 C ALA A 115 -16.863 -6.576 -4.541 1.00 41.10 C ATOM 1802 O ALA A 115 -16.138 -5.797 -5.164 1.00 74.33 O ATOM 1803 CB ALA A 115 -19.295 -6.014 -4.230 1.00 55.31 C ATOM 0 H ALA A 115 -19.404 -8.478 -4.240 1.00 64.23 H new ATOM 0 HA ALA A 115 -18.359 -6.600 -6.067 1.00 1.24 H new ATOM 0 HB1 ALA A 115 -19.037 -4.960 -4.336 1.00 55.31 H new ATOM 0 HB2 ALA A 115 -20.299 -6.182 -4.619 1.00 55.31 H new ATOM 0 HB3 ALA A 115 -19.263 -6.292 -3.176 1.00 55.31 H new ATOM 1809 N PHE A 116 -16.465 -7.209 -3.437 1.00 11.41 N ATOM 1810 CA PHE A 116 -15.099 -7.084 -2.908 1.00 55.45 C ATOM 1811 C PHE A 116 -14.062 -7.641 -3.897 1.00 43.42 C ATOM 1812 O PHE A 116 -13.145 -6.930 -4.318 1.00 34.45 O ATOM 1813 CB PHE A 116 -14.988 -7.811 -1.556 1.00 43.11 C ATOM 1814 CG PHE A 116 -13.572 -7.936 -1.042 1.00 73.20 C ATOM 1815 CD1 PHE A 116 -12.851 -6.811 -0.668 1.00 34.23 C ATOM 1816 CD2 PHE A 116 -12.960 -9.181 -0.944 1.00 23.55 C ATOM 1817 CE1 PHE A 116 -11.553 -6.924 -0.207 1.00 51.15 C ATOM 1818 CE2 PHE A 116 -11.662 -9.297 -0.482 1.00 10.33 C ATOM 1819 CZ PHE A 116 -10.958 -8.166 -0.113 1.00 22.42 C ATOM 0 H PHE A 116 -17.070 -7.818 -2.886 1.00 11.41 H new ATOM 0 HA PHE A 116 -14.889 -6.024 -2.764 1.00 55.45 H new ATOM 0 HB2 PHE A 116 -15.586 -7.277 -0.818 1.00 43.11 H new ATOM 0 HB3 PHE A 116 -15.418 -8.808 -1.654 1.00 43.11 H new ATOM 0 HD1 PHE A 116 -13.309 -5.836 -0.738 1.00 34.23 H new ATOM 0 HD2 PHE A 116 -13.505 -10.068 -1.232 1.00 23.55 H new ATOM 0 HE1 PHE A 116 -11.004 -6.040 0.080 1.00 51.15 H new ATOM 0 HE2 PHE A 116 -11.199 -10.270 -0.410 1.00 10.33 H new ATOM 0 HZ PHE A 116 -9.944 -8.254 0.248 1.00 22.42 H new ATOM 1829 N LYS A 117 -14.217 -8.915 -4.257 1.00 45.03 N ATOM 1830 CA LYS A 117 -13.333 -9.574 -5.232 1.00 41.23 C ATOM 1831 C LYS A 117 -13.240 -8.758 -6.534 1.00 31.45 C ATOM 1832 O LYS A 117 -12.156 -8.523 -7.068 1.00 31.31 O ATOM 1833 CB LYS A 117 -13.871 -10.981 -5.531 1.00 50.12 C ATOM 1834 CG LYS A 117 -12.983 -11.821 -6.447 1.00 70.14 C ATOM 1835 CD LYS A 117 -13.623 -13.175 -6.763 1.00 40.35 C ATOM 1836 CE LYS A 117 -13.945 -13.965 -5.497 1.00 62.34 C ATOM 1837 NZ LYS A 117 -14.609 -15.259 -5.796 1.00 62.34 N ATOM 0 H LYS A 117 -14.951 -9.519 -3.887 1.00 45.03 H new ATOM 0 HA LYS A 117 -12.332 -9.643 -4.807 1.00 41.23 H new ATOM 0 HB2 LYS A 117 -14.004 -11.513 -4.589 1.00 50.12 H new ATOM 0 HB3 LYS A 117 -14.857 -10.889 -5.987 1.00 50.12 H new ATOM 0 HG2 LYS A 117 -12.800 -11.279 -7.375 1.00 70.14 H new ATOM 0 HG3 LYS A 117 -12.014 -11.977 -5.973 1.00 70.14 H new ATOM 0 HD2 LYS A 117 -14.537 -13.019 -7.335 1.00 40.35 H new ATOM 0 HD3 LYS A 117 -12.949 -13.757 -7.392 1.00 40.35 H new ATOM 0 HE2 LYS A 117 -13.025 -14.150 -4.943 1.00 62.34 H new ATOM 0 HE3 LYS A 117 -14.590 -13.368 -4.853 1.00 62.34 H new ATOM 0 HZ1 LYS A 117 -15.133 -15.582 -4.958 1.00 62.34 H new ATOM 0 HZ2 LYS A 117 -15.268 -15.135 -6.591 1.00 62.34 H new ATOM 0 HZ3 LYS A 117 -13.891 -15.967 -6.049 1.00 62.34 H new ATOM 1851 N LYS A 118 -14.395 -8.320 -7.015 1.00 73.01 N ATOM 1852 CA LYS A 118 -14.498 -7.506 -8.230 1.00 33.40 C ATOM 1853 C LYS A 118 -13.774 -6.154 -8.081 1.00 52.00 C ATOM 1854 O LYS A 118 -13.107 -5.687 -9.009 1.00 54.51 O ATOM 1855 CB LYS A 118 -15.984 -7.285 -8.534 1.00 25.41 C ATOM 1856 CG LYS A 118 -16.282 -6.438 -9.763 1.00 21.35 C ATOM 1857 CD LYS A 118 -17.786 -6.314 -9.965 1.00 73.42 C ATOM 1858 CE LYS A 118 -18.147 -5.442 -11.153 1.00 71.34 C ATOM 1859 NZ LYS A 118 -19.618 -5.356 -11.329 1.00 15.42 N ATOM 0 H LYS A 118 -15.294 -8.517 -6.575 1.00 73.01 H new ATOM 0 HA LYS A 118 -14.013 -8.033 -9.052 1.00 33.40 H new ATOM 0 HB2 LYS A 118 -16.460 -8.258 -8.660 1.00 25.41 H new ATOM 0 HB3 LYS A 118 -16.448 -6.813 -7.668 1.00 25.41 H new ATOM 0 HG2 LYS A 118 -15.841 -5.448 -9.647 1.00 21.35 H new ATOM 0 HG3 LYS A 118 -15.826 -6.889 -10.644 1.00 21.35 H new ATOM 0 HD2 LYS A 118 -18.213 -7.307 -10.105 1.00 73.42 H new ATOM 0 HD3 LYS A 118 -18.236 -5.898 -9.064 1.00 73.42 H new ATOM 0 HE2 LYS A 118 -17.736 -4.442 -11.012 1.00 71.34 H new ATOM 0 HE3 LYS A 118 -17.693 -5.848 -12.057 1.00 71.34 H new ATOM 0 HZ1 LYS A 118 -19.835 -4.754 -12.148 1.00 15.42 H new ATOM 0 HZ2 LYS A 118 -20.005 -6.308 -11.487 1.00 15.42 H new ATOM 0 HZ3 LYS A 118 -20.046 -4.946 -10.475 1.00 15.42 H new ATOM 1873 N LYS A 119 -13.900 -5.534 -6.906 1.00 64.22 N ATOM 1874 CA LYS A 119 -13.292 -4.225 -6.652 1.00 74.14 C ATOM 1875 C LYS A 119 -11.760 -4.332 -6.603 1.00 64.24 C ATOM 1876 O LYS A 119 -11.051 -3.582 -7.278 1.00 13.13 O ATOM 1877 CB LYS A 119 -13.813 -3.636 -5.332 1.00 40.05 C ATOM 1878 CG LYS A 119 -13.555 -2.138 -5.180 1.00 32.42 C ATOM 1879 CD LYS A 119 -14.427 -1.323 -6.137 1.00 14.20 C ATOM 1880 CE LYS A 119 -14.129 0.171 -6.061 1.00 30.41 C ATOM 1881 NZ LYS A 119 -14.173 0.688 -4.665 1.00 52.44 N ATOM 0 H LYS A 119 -14.418 -5.917 -6.115 1.00 64.22 H new ATOM 0 HA LYS A 119 -13.570 -3.563 -7.472 1.00 74.14 H new ATOM 0 HB2 LYS A 119 -14.885 -3.819 -5.261 1.00 40.05 H new ATOM 0 HB3 LYS A 119 -13.344 -4.162 -4.500 1.00 40.05 H new ATOM 0 HG2 LYS A 119 -13.757 -1.835 -4.153 1.00 32.42 H new ATOM 0 HG3 LYS A 119 -12.503 -1.927 -5.374 1.00 32.42 H new ATOM 0 HD2 LYS A 119 -14.267 -1.672 -7.157 1.00 14.20 H new ATOM 0 HD3 LYS A 119 -15.478 -1.494 -5.903 1.00 14.20 H new ATOM 0 HE2 LYS A 119 -13.144 0.364 -6.486 1.00 30.41 H new ATOM 0 HE3 LYS A 119 -14.852 0.714 -6.670 1.00 30.41 H new ATOM 0 HZ1 LYS A 119 -14.504 1.674 -4.670 1.00 52.44 H new ATOM 0 HZ2 LYS A 119 -14.825 0.107 -4.100 1.00 52.44 H new ATOM 0 HZ3 LYS A 119 -13.221 0.644 -4.248 1.00 52.44 H new ATOM 1895 N ILE A 120 -11.255 -5.276 -5.807 1.00 63.55 N ATOM 1896 CA ILE A 120 -9.809 -5.477 -5.670 1.00 72.31 C ATOM 1897 C ILE A 120 -9.184 -5.945 -6.996 1.00 73.31 C ATOM 1898 O ILE A 120 -8.047 -5.595 -7.317 1.00 64.05 O ATOM 1899 CB ILE A 120 -9.479 -6.488 -4.535 1.00 23.21 C ATOM 1900 CG1 ILE A 120 -7.967 -6.515 -4.251 1.00 53.43 C ATOM 1901 CG2 ILE A 120 -9.989 -7.887 -4.875 1.00 51.12 C ATOM 1902 CD1 ILE A 120 -7.421 -5.207 -3.707 1.00 63.10 C ATOM 0 H ILE A 120 -11.823 -5.913 -5.248 1.00 63.55 H new ATOM 0 HA ILE A 120 -9.375 -4.513 -5.404 1.00 72.31 H new ATOM 0 HB ILE A 120 -9.992 -6.155 -3.633 1.00 23.21 H new ATOM 0 HG12 ILE A 120 -7.755 -7.311 -3.537 1.00 53.43 H new ATOM 0 HG13 ILE A 120 -7.439 -6.763 -5.171 1.00 53.43 H new ATOM 0 HG21 ILE A 120 -9.743 -8.571 -4.063 1.00 51.12 H new ATOM 0 HG22 ILE A 120 -11.070 -7.857 -5.010 1.00 51.12 H new ATOM 0 HG23 ILE A 120 -9.518 -8.232 -5.795 1.00 51.12 H new ATOM 0 HD11 ILE A 120 -6.350 -5.305 -3.532 1.00 63.10 H new ATOM 0 HD12 ILE A 120 -7.600 -4.410 -4.429 1.00 63.10 H new ATOM 0 HD13 ILE A 120 -7.921 -4.966 -2.769 1.00 63.10 H new ATOM 1914 N GLN A 121 -9.936 -6.724 -7.773 1.00 72.54 N ATOM 1915 CA GLN A 121 -9.487 -7.139 -9.105 1.00 22.51 C ATOM 1916 C GLN A 121 -9.366 -5.923 -10.036 1.00 33.11 C ATOM 1917 O GLN A 121 -8.404 -5.796 -10.795 1.00 22.25 O ATOM 1918 CB GLN A 121 -10.449 -8.175 -9.700 1.00 50.25 C ATOM 1919 CG GLN A 121 -9.992 -8.735 -11.046 1.00 43.42 C ATOM 1920 CD GLN A 121 -8.678 -9.500 -10.964 1.00 14.40 C ATOM 1921 OE1 GLN A 121 -8.354 -10.113 -9.949 1.00 71.40 O ATOM 1922 NE2 GLN A 121 -7.914 -9.474 -12.036 1.00 72.55 N ATOM 0 H GLN A 121 -10.854 -7.080 -7.507 1.00 72.54 H new ATOM 0 HA GLN A 121 -8.503 -7.598 -9.007 1.00 22.51 H new ATOM 0 HB2 GLN A 121 -10.565 -8.998 -8.994 1.00 50.25 H new ATOM 0 HB3 GLN A 121 -11.431 -7.718 -9.821 1.00 50.25 H new ATOM 0 HG2 GLN A 121 -10.765 -9.395 -11.439 1.00 43.42 H new ATOM 0 HG3 GLN A 121 -9.883 -7.915 -11.755 1.00 43.42 H new ATOM 0 HE21 GLN A 121 -8.212 -8.956 -12.862 1.00 72.55 H new ATOM 0 HE22 GLN A 121 -7.024 -9.972 -12.040 1.00 72.55 H new ATOM 1931 N GLY A 122 -10.347 -5.024 -9.964 1.00 53.11 N ATOM 1932 CA GLY A 122 -10.276 -3.776 -10.716 1.00 62.41 C ATOM 1933 C GLY A 122 -9.088 -2.916 -10.288 1.00 2.43 C ATOM 1934 O GLY A 122 -8.416 -2.294 -11.118 1.00 52.21 O ATOM 0 H GLY A 122 -11.189 -5.136 -9.400 1.00 53.11 H new ATOM 0 HA2 GLY A 122 -10.198 -3.998 -11.780 1.00 62.41 H new ATOM 0 HA3 GLY A 122 -11.200 -3.215 -10.575 1.00 62.41 H new ATOM 1938 N TRP A 123 -8.829 -2.897 -8.981 1.00 23.44 N ATOM 1939 CA TRP A 123 -7.684 -2.179 -8.415 1.00 50.52 C ATOM 1940 C TRP A 123 -6.360 -2.689 -9.006 1.00 1.15 C ATOM 1941 O TRP A 123 -5.572 -1.911 -9.547 1.00 44.15 O ATOM 1942 CB TRP A 123 -7.684 -2.339 -6.884 1.00 1.02 C ATOM 1943 CG TRP A 123 -6.599 -1.573 -6.171 1.00 32.01 C ATOM 1944 CD1 TRP A 123 -6.520 -0.220 -6.009 1.00 32.14 C ATOM 1945 CD2 TRP A 123 -5.454 -2.120 -5.503 1.00 42.23 C ATOM 1946 NE1 TRP A 123 -5.395 0.104 -5.289 1.00 22.32 N ATOM 1947 CE2 TRP A 123 -4.728 -1.042 -4.965 1.00 3.02 C ATOM 1948 CE3 TRP A 123 -4.974 -3.418 -5.306 1.00 2.33 C ATOM 1949 CZ2 TRP A 123 -3.550 -1.222 -4.246 1.00 34.53 C ATOM 1950 CZ3 TRP A 123 -3.804 -3.597 -4.593 1.00 14.25 C ATOM 1951 CH2 TRP A 123 -3.103 -2.503 -4.069 1.00 42.03 C ATOM 0 H TRP A 123 -9.403 -3.376 -8.287 1.00 23.44 H new ATOM 0 HA TRP A 123 -7.775 -1.123 -8.670 1.00 50.52 H new ATOM 0 HB2 TRP A 123 -8.651 -2.016 -6.499 1.00 1.02 H new ATOM 0 HB3 TRP A 123 -7.582 -3.397 -6.643 1.00 1.02 H new ATOM 0 HD1 TRP A 123 -7.237 0.492 -6.391 1.00 32.14 H new ATOM 0 HE1 TRP A 123 -5.105 1.049 -5.037 1.00 22.32 H new ATOM 0 HE3 TRP A 123 -5.509 -4.267 -5.705 1.00 2.33 H new ATOM 0 HZ2 TRP A 123 -3.008 -0.380 -3.842 1.00 34.53 H new ATOM 0 HZ3 TRP A 123 -3.424 -4.596 -4.437 1.00 14.25 H new ATOM 0 HH2 TRP A 123 -2.192 -2.674 -3.515 1.00 42.03 H new ATOM 1962 N VAL A 124 -6.134 -4.005 -8.928 1.00 35.02 N ATOM 1963 CA VAL A 124 -4.875 -4.601 -9.397 1.00 52.31 C ATOM 1964 C VAL A 124 -4.670 -4.437 -10.916 1.00 72.33 C ATOM 1965 O VAL A 124 -3.590 -4.043 -11.353 1.00 3.03 O ATOM 1966 CB VAL A 124 -4.757 -6.102 -9.011 1.00 34.34 C ATOM 1967 CG1 VAL A 124 -4.803 -6.270 -7.496 1.00 0.51 C ATOM 1968 CG2 VAL A 124 -5.842 -6.944 -9.676 1.00 33.43 C ATOM 0 H VAL A 124 -6.801 -4.676 -8.547 1.00 35.02 H new ATOM 0 HA VAL A 124 -4.086 -4.048 -8.888 1.00 52.31 H new ATOM 0 HB VAL A 124 -3.794 -6.460 -9.375 1.00 34.34 H new ATOM 0 HG11 VAL A 124 -4.719 -7.327 -7.244 1.00 0.51 H new ATOM 0 HG12 VAL A 124 -3.976 -5.723 -7.044 1.00 0.51 H new ATOM 0 HG13 VAL A 124 -5.747 -5.880 -7.115 1.00 0.51 H new ATOM 0 HG21 VAL A 124 -5.725 -7.987 -9.381 1.00 33.43 H new ATOM 0 HG22 VAL A 124 -6.823 -6.586 -9.363 1.00 33.43 H new ATOM 0 HG23 VAL A 124 -5.754 -6.861 -10.759 1.00 33.43 H new ATOM 1978 N VAL A 125 -5.699 -4.716 -11.723 1.00 62.21 N ATOM 1979 CA VAL A 125 -5.565 -4.606 -13.186 1.00 43.43 C ATOM 1980 C VAL A 125 -5.217 -3.172 -13.618 1.00 53.45 C ATOM 1981 O VAL A 125 -4.530 -2.963 -14.618 1.00 72.13 O ATOM 1982 CB VAL A 125 -6.837 -5.078 -13.933 1.00 34.11 C ATOM 1983 CG1 VAL A 125 -7.130 -6.546 -13.625 1.00 70.21 C ATOM 1984 CG2 VAL A 125 -8.039 -4.199 -13.595 1.00 71.55 C ATOM 0 H VAL A 125 -6.619 -5.015 -11.400 1.00 62.21 H new ATOM 0 HA VAL A 125 -4.744 -5.268 -13.461 1.00 43.43 H new ATOM 0 HB VAL A 125 -6.651 -4.983 -15.003 1.00 34.11 H new ATOM 0 HG11 VAL A 125 -8.027 -6.858 -14.159 1.00 70.21 H new ATOM 0 HG12 VAL A 125 -6.287 -7.160 -13.942 1.00 70.21 H new ATOM 0 HG13 VAL A 125 -7.285 -6.669 -12.553 1.00 70.21 H new ATOM 0 HG21 VAL A 125 -8.915 -4.557 -14.136 1.00 71.55 H new ATOM 0 HG22 VAL A 125 -8.231 -4.242 -12.523 1.00 71.55 H new ATOM 0 HG23 VAL A 125 -7.830 -3.169 -13.885 1.00 71.55 H new ATOM 1994 N SER A 126 -5.697 -2.184 -12.859 1.00 12.12 N ATOM 1995 CA SER A 126 -5.329 -0.780 -13.096 1.00 5.21 C ATOM 1996 C SER A 126 -3.931 -0.475 -12.539 1.00 45.12 C ATOM 1997 O SER A 126 -3.116 0.176 -13.187 1.00 13.34 O ATOM 1998 CB SER A 126 -6.355 0.163 -12.448 1.00 22.45 C ATOM 1999 OG SER A 126 -6.004 1.527 -12.642 1.00 64.14 O ATOM 0 H SER A 126 -6.338 -2.326 -12.078 1.00 12.12 H new ATOM 0 HA SER A 126 -5.321 -0.618 -14.174 1.00 5.21 H new ATOM 0 HB2 SER A 126 -7.341 -0.024 -12.872 1.00 22.45 H new ATOM 0 HB3 SER A 126 -6.422 -0.048 -11.381 1.00 22.45 H new ATOM 0 HG SER A 126 -6.676 2.101 -12.219 1.00 64.14 H new ATOM 2005 N LEU A 127 -3.658 -0.979 -11.339 1.00 32.34 N ATOM 2006 CA LEU A 127 -2.409 -0.695 -10.618 1.00 32.43 C ATOM 2007 C LEU A 127 -1.178 -1.286 -11.327 1.00 70.05 C ATOM 2008 O LEU A 127 -0.080 -0.741 -11.246 1.00 65.30 O ATOM 2009 CB LEU A 127 -2.499 -1.261 -9.193 1.00 72.21 C ATOM 2010 CG LEU A 127 -1.312 -0.937 -8.271 1.00 10.12 C ATOM 2011 CD1 LEU A 127 -1.268 0.553 -7.943 1.00 63.31 C ATOM 2012 CD2 LEU A 127 -1.377 -1.773 -6.997 1.00 73.33 C ATOM 0 H LEU A 127 -4.293 -1.597 -10.834 1.00 32.34 H new ATOM 0 HA LEU A 127 -2.285 0.388 -10.591 1.00 32.43 H new ATOM 0 HB2 LEU A 127 -3.410 -0.883 -8.729 1.00 72.21 H new ATOM 0 HB3 LEU A 127 -2.600 -2.344 -9.258 1.00 72.21 H new ATOM 0 HG LEU A 127 -0.393 -1.191 -8.798 1.00 10.12 H new ATOM 0 HD11 LEU A 127 -0.420 0.757 -7.290 1.00 63.31 H new ATOM 0 HD12 LEU A 127 -1.162 1.125 -8.865 1.00 63.31 H new ATOM 0 HD13 LEU A 127 -2.191 0.842 -7.440 1.00 63.31 H new ATOM 0 HD21 LEU A 127 -0.528 -1.529 -6.358 1.00 73.33 H new ATOM 0 HD22 LEU A 127 -2.304 -1.557 -6.467 1.00 73.33 H new ATOM 0 HD23 LEU A 127 -1.345 -2.832 -7.254 1.00 73.33 H new ATOM 2024 N LEU A 128 -1.366 -2.406 -12.016 1.00 34.20 N ATOM 2025 CA LEU A 128 -0.262 -3.092 -12.698 1.00 23.01 C ATOM 2026 C LEU A 128 -0.034 -2.547 -14.121 1.00 75.51 C ATOM 2027 O LEU A 128 0.808 -3.064 -14.862 1.00 30.23 O ATOM 2028 CB LEU A 128 -0.524 -4.606 -12.734 1.00 23.45 C ATOM 2029 CG LEU A 128 -0.753 -5.263 -11.357 1.00 4.13 C ATOM 2030 CD1 LEU A 128 -0.952 -6.769 -11.497 1.00 52.03 C ATOM 2031 CD2 LEU A 128 0.399 -4.956 -10.398 1.00 41.31 C ATOM 0 H LEU A 128 -2.272 -2.863 -12.120 1.00 34.20 H new ATOM 0 HA LEU A 128 0.649 -2.899 -12.131 1.00 23.01 H new ATOM 0 HB2 LEU A 128 -1.398 -4.793 -13.358 1.00 23.45 H new ATOM 0 HB3 LEU A 128 0.323 -5.094 -13.216 1.00 23.45 H new ATOM 0 HG LEU A 128 -1.663 -4.837 -10.935 1.00 4.13 H new ATOM 0 HD11 LEU A 128 -1.111 -7.208 -10.512 1.00 52.03 H new ATOM 0 HD12 LEU A 128 -1.820 -6.964 -12.126 1.00 52.03 H new ATOM 0 HD13 LEU A 128 -0.067 -7.212 -11.953 1.00 52.03 H new ATOM 0 HD21 LEU A 128 0.209 -5.433 -9.436 1.00 41.31 H new ATOM 0 HD22 LEU A 128 1.331 -5.339 -10.814 1.00 41.31 H new ATOM 0 HD23 LEU A 128 0.479 -3.878 -10.259 1.00 41.31 H new ATOM 2043 N ALA A 129 -0.796 -1.517 -14.504 1.00 12.12 N ATOM 2044 CA ALA A 129 -0.652 -0.891 -15.829 1.00 25.12 C ATOM 2045 C ALA A 129 0.778 -0.363 -16.073 1.00 61.54 C ATOM 2046 O ALA A 129 1.164 0.693 -15.560 1.00 32.21 O ATOM 2047 CB ALA A 129 -1.673 0.230 -15.997 1.00 22.42 C ATOM 0 H ALA A 129 -1.518 -1.098 -13.919 1.00 12.12 H new ATOM 0 HA ALA A 129 -0.840 -1.662 -16.576 1.00 25.12 H new ATOM 0 HB1 ALA A 129 -1.556 0.684 -16.981 1.00 22.42 H new ATOM 0 HB2 ALA A 129 -2.680 -0.178 -15.903 1.00 22.42 H new ATOM 0 HB3 ALA A 129 -1.514 0.985 -15.227 1.00 22.42 H new ATOM 2053 N LYS A 130 1.549 -1.099 -16.879 1.00 41.44 N ATOM 2054 CA LYS A 130 2.970 -0.791 -17.123 1.00 35.34 C ATOM 2055 C LYS A 130 3.180 0.583 -17.787 1.00 52.41 C ATOM 2056 O LYS A 130 4.246 1.187 -17.664 1.00 52.51 O ATOM 2057 CB LYS A 130 3.594 -1.878 -18.011 1.00 61.32 C ATOM 2058 CG LYS A 130 2.981 -1.957 -19.410 1.00 22.15 C ATOM 2059 CD LYS A 130 3.687 -2.974 -20.313 1.00 73.20 C ATOM 2060 CE LYS A 130 3.382 -4.423 -19.930 1.00 63.34 C ATOM 2061 NZ LYS A 130 3.985 -4.824 -18.628 1.00 3.34 N ATOM 0 H LYS A 130 1.213 -1.921 -17.380 1.00 41.44 H new ATOM 0 HA LYS A 130 3.457 -0.763 -16.148 1.00 35.34 H new ATOM 0 HB2 LYS A 130 4.664 -1.690 -18.103 1.00 61.32 H new ATOM 0 HB3 LYS A 130 3.482 -2.845 -17.520 1.00 61.32 H new ATOM 0 HG2 LYS A 130 1.928 -2.224 -19.325 1.00 22.15 H new ATOM 0 HG3 LYS A 130 3.024 -0.973 -19.876 1.00 22.15 H new ATOM 0 HD2 LYS A 130 3.385 -2.806 -21.347 1.00 73.20 H new ATOM 0 HD3 LYS A 130 4.763 -2.810 -20.265 1.00 73.20 H new ATOM 0 HE2 LYS A 130 2.302 -4.559 -19.880 1.00 63.34 H new ATOM 0 HE3 LYS A 130 3.751 -5.085 -20.713 1.00 63.34 H new ATOM 0 HZ1 LYS A 130 4.354 -5.794 -18.700 1.00 3.34 H new ATOM 0 HZ2 LYS A 130 4.762 -4.175 -18.391 1.00 3.34 H new ATOM 0 HZ3 LYS A 130 3.261 -4.784 -17.883 1.00 3.34 H new ATOM 2075 N ASP A 131 2.167 1.069 -18.492 1.00 62.21 N ATOM 2076 CA ASP A 131 2.279 2.320 -19.245 1.00 72.33 C ATOM 2077 C ASP A 131 2.111 3.564 -18.345 1.00 1.12 C ATOM 2078 O ASP A 131 2.821 4.558 -18.512 1.00 12.11 O ATOM 2079 CB ASP A 131 1.269 2.324 -20.406 1.00 1.31 C ATOM 2080 CG ASP A 131 -0.172 2.076 -19.978 1.00 55.41 C ATOM 2081 OD1 ASP A 131 -0.405 1.573 -18.856 1.00 73.31 O ATOM 2082 OD2 ASP A 131 -1.086 2.376 -20.771 1.00 0.52 O ATOM 0 H ASP A 131 1.255 0.618 -18.561 1.00 62.21 H new ATOM 0 HA ASP A 131 3.287 2.375 -19.655 1.00 72.33 H new ATOM 0 HB2 ASP A 131 1.324 3.285 -20.918 1.00 1.31 H new ATOM 0 HB3 ASP A 131 1.559 1.561 -21.128 1.00 1.31 H new ATOM 2087 N ARG A 132 1.175 3.506 -17.395 1.00 42.31 N ATOM 2088 CA ARG A 132 0.962 4.617 -16.444 1.00 74.53 C ATOM 2089 C ARG A 132 1.620 4.348 -15.075 1.00 53.04 C ATOM 2090 O ARG A 132 2.501 5.087 -14.634 1.00 63.21 O ATOM 2091 CB ARG A 132 -0.544 4.884 -16.225 1.00 54.23 C ATOM 2092 CG ARG A 132 -1.226 5.710 -17.318 1.00 55.30 C ATOM 2093 CD ARG A 132 -1.456 4.924 -18.603 1.00 13.12 C ATOM 2094 NE ARG A 132 -2.248 3.710 -18.376 1.00 33.43 N ATOM 2095 CZ ARG A 132 -3.555 3.670 -18.359 1.00 51.31 C ATOM 2096 NH1 ARG A 132 -4.252 4.748 -18.532 1.00 62.11 N ATOM 2097 NH2 ARG A 132 -4.161 2.538 -18.176 1.00 12.11 N ATOM 0 H ARG A 132 0.552 2.710 -17.258 1.00 42.31 H new ATOM 0 HA ARG A 132 1.432 5.493 -16.892 1.00 74.53 H new ATOM 0 HB2 ARG A 132 -1.058 3.926 -16.142 1.00 54.23 H new ATOM 0 HB3 ARG A 132 -0.671 5.397 -15.272 1.00 54.23 H new ATOM 0 HG2 ARG A 132 -2.183 6.075 -16.946 1.00 55.30 H new ATOM 0 HG3 ARG A 132 -0.615 6.585 -17.539 1.00 55.30 H new ATOM 0 HD2 ARG A 132 -1.966 5.558 -19.328 1.00 13.12 H new ATOM 0 HD3 ARG A 132 -0.494 4.652 -19.038 1.00 13.12 H new ATOM 0 HE ARG A 132 -1.744 2.837 -18.221 1.00 33.43 H new ATOM 0 HH11 ARG A 132 -3.782 5.640 -18.684 1.00 62.11 H new ATOM 0 HH12 ARG A 132 -5.271 4.704 -18.517 1.00 62.11 H new ATOM 0 HH21 ARG A 132 -3.618 1.684 -18.046 1.00 12.11 H new ATOM 0 HH22 ARG A 132 -5.180 2.502 -18.162 1.00 12.11 H new ATOM 2111 N PHE A 133 1.191 3.275 -14.419 1.00 23.05 N ATOM 2112 CA PHE A 133 1.535 3.023 -13.011 1.00 25.55 C ATOM 2113 C PHE A 133 2.989 2.563 -12.803 1.00 44.33 C ATOM 2114 O PHE A 133 3.440 2.427 -11.668 1.00 42.23 O ATOM 2115 CB PHE A 133 0.554 2.007 -12.418 1.00 74.41 C ATOM 2116 CG PHE A 133 -0.856 2.540 -12.284 1.00 42.23 C ATOM 2117 CD1 PHE A 133 -1.621 2.822 -13.409 1.00 22.43 C ATOM 2118 CD2 PHE A 133 -1.415 2.767 -11.033 1.00 71.24 C ATOM 2119 CE1 PHE A 133 -2.907 3.315 -13.288 1.00 72.00 C ATOM 2120 CE2 PHE A 133 -2.702 3.258 -10.909 1.00 54.00 C ATOM 2121 CZ PHE A 133 -3.447 3.532 -12.037 1.00 54.52 C ATOM 0 H PHE A 133 0.600 2.557 -14.838 1.00 23.05 H new ATOM 0 HA PHE A 133 1.450 3.975 -12.487 1.00 25.55 H new ATOM 0 HB2 PHE A 133 0.540 1.117 -13.047 1.00 74.41 H new ATOM 0 HB3 PHE A 133 0.912 1.698 -11.436 1.00 74.41 H new ATOM 0 HD1 PHE A 133 -1.205 2.654 -14.392 1.00 22.43 H new ATOM 0 HD2 PHE A 133 -0.837 2.557 -10.145 1.00 71.24 H new ATOM 0 HE1 PHE A 133 -3.489 3.530 -14.172 1.00 72.00 H new ATOM 0 HE2 PHE A 133 -3.124 3.427 -9.929 1.00 54.00 H new ATOM 0 HZ PHE A 133 -4.452 3.916 -11.941 1.00 54.52 H new ATOM 2131 N LYS A 134 3.726 2.326 -13.885 1.00 73.22 N ATOM 2132 CA LYS A 134 5.148 1.964 -13.773 1.00 70.33 C ATOM 2133 C LYS A 134 5.951 3.052 -13.024 1.00 42.10 C ATOM 2134 O LYS A 134 7.050 2.801 -12.531 1.00 54.13 O ATOM 2135 CB LYS A 134 5.750 1.740 -15.166 1.00 71.11 C ATOM 2136 CG LYS A 134 7.159 1.147 -15.145 1.00 55.53 C ATOM 2137 CD LYS A 134 7.745 0.959 -16.550 1.00 10.01 C ATOM 2138 CE LYS A 134 8.225 2.272 -17.172 1.00 64.43 C ATOM 2139 NZ LYS A 134 7.109 3.169 -17.578 1.00 21.52 N ATOM 0 H LYS A 134 3.374 2.375 -14.841 1.00 73.22 H new ATOM 0 HA LYS A 134 5.211 1.040 -13.198 1.00 70.33 H new ATOM 0 HB2 LYS A 134 5.096 1.076 -15.731 1.00 71.11 H new ATOM 0 HB3 LYS A 134 5.775 2.691 -15.697 1.00 71.11 H new ATOM 0 HG2 LYS A 134 7.814 1.799 -14.567 1.00 55.53 H new ATOM 0 HG3 LYS A 134 7.136 0.184 -14.634 1.00 55.53 H new ATOM 0 HD2 LYS A 134 8.579 0.259 -16.500 1.00 10.01 H new ATOM 0 HD3 LYS A 134 6.991 0.510 -17.196 1.00 10.01 H new ATOM 0 HE2 LYS A 134 8.861 2.794 -16.457 1.00 64.43 H new ATOM 0 HE3 LYS A 134 8.840 2.050 -18.044 1.00 64.43 H new ATOM 0 HZ1 LYS A 134 7.352 3.644 -18.471 1.00 21.52 H new ATOM 0 HZ2 LYS A 134 6.243 2.608 -17.709 1.00 21.52 H new ATOM 0 HZ3 LYS A 134 6.951 3.883 -16.838 1.00 21.52 H new ATOM 2153 N ASN A 135 5.385 4.260 -12.945 1.00 45.30 N ATOM 2154 CA ASN A 135 6.040 5.398 -12.281 1.00 24.41 C ATOM 2155 C ASN A 135 5.781 5.424 -10.760 1.00 45.22 C ATOM 2156 O ASN A 135 6.005 6.441 -10.103 1.00 25.00 O ATOM 2157 CB ASN A 135 5.550 6.706 -12.917 1.00 11.03 C ATOM 2158 CG ASN A 135 5.807 6.755 -14.411 1.00 55.04 C ATOM 2159 OD1 ASN A 135 6.903 6.170 -14.847 1.00 3.14 O flip ATOM 2160 ND2 ASN A 135 5.030 7.321 -15.171 1.00 65.23 N flip ATOM 0 H ASN A 135 4.468 4.479 -13.335 1.00 45.30 H new ATOM 0 HA ASN A 135 7.116 5.288 -12.419 1.00 24.41 H new ATOM 0 HB2 ASN A 135 4.482 6.819 -12.731 1.00 11.03 H new ATOM 0 HB3 ASN A 135 6.048 7.549 -12.438 1.00 11.03 H new ATOM 0 HD21 ASN A 135 4.189 7.765 -14.803 1.00 65.23 H new ATOM 0 HD22 ASN A 135 5.224 7.348 -16.172 1.00 65.23 H new ATOM 2167 N LEU A 136 5.311 4.310 -10.204 1.00 53.34 N ATOM 2168 CA LEU A 136 5.069 4.211 -8.760 1.00 30.24 C ATOM 2169 C LEU A 136 6.315 3.709 -8.014 1.00 13.53 C ATOM 2170 O LEU A 136 7.043 2.838 -8.498 1.00 32.12 O ATOM 2171 CB LEU A 136 3.889 3.273 -8.467 1.00 24.12 C ATOM 2172 CG LEU A 136 2.536 3.699 -9.059 1.00 10.32 C ATOM 2173 CD1 LEU A 136 1.441 2.716 -8.659 1.00 41.43 C ATOM 2174 CD2 LEU A 136 2.173 5.116 -8.625 1.00 4.52 C ATOM 0 H LEU A 136 5.089 3.463 -10.727 1.00 53.34 H new ATOM 0 HA LEU A 136 4.830 5.214 -8.405 1.00 30.24 H new ATOM 0 HB2 LEU A 136 4.134 2.281 -8.846 1.00 24.12 H new ATOM 0 HB3 LEU A 136 3.780 3.183 -7.386 1.00 24.12 H new ATOM 0 HG LEU A 136 2.624 3.691 -10.145 1.00 10.32 H new ATOM 0 HD11 LEU A 136 0.491 3.035 -9.088 1.00 41.43 H new ATOM 0 HD12 LEU A 136 1.691 1.722 -9.030 1.00 41.43 H new ATOM 0 HD13 LEU A 136 1.357 2.687 -7.573 1.00 41.43 H new ATOM 0 HD21 LEU A 136 1.212 5.394 -9.057 1.00 4.52 H new ATOM 0 HD22 LEU A 136 2.108 5.158 -7.538 1.00 4.52 H new ATOM 0 HD23 LEU A 136 2.940 5.810 -8.970 1.00 4.52 H new ATOM 2186 N ALA A 137 6.550 4.256 -6.827 1.00 22.21 N ATOM 2187 CA ALA A 137 7.687 3.847 -5.997 1.00 60.03 C ATOM 2188 C ALA A 137 7.217 2.997 -4.808 1.00 12.12 C ATOM 2189 O ALA A 137 6.077 3.122 -4.361 1.00 22.54 O ATOM 2190 CB ALA A 137 8.449 5.071 -5.508 1.00 54.42 C ATOM 0 H ALA A 137 5.970 4.986 -6.413 1.00 22.21 H new ATOM 0 HA ALA A 137 8.355 3.238 -6.606 1.00 60.03 H new ATOM 0 HB1 ALA A 137 9.291 4.754 -4.893 1.00 54.42 H new ATOM 0 HB2 ALA A 137 8.818 5.636 -6.364 1.00 54.42 H new ATOM 0 HB3 ALA A 137 7.785 5.701 -4.917 1.00 54.42 H new ATOM 2196 N PHE A 138 8.088 2.132 -4.302 1.00 22.24 N ATOM 2197 CA PHE A 138 7.748 1.274 -3.171 1.00 23.22 C ATOM 2198 C PHE A 138 8.689 1.546 -1.991 1.00 41.14 C ATOM 2199 O PHE A 138 9.888 1.758 -2.172 1.00 22.04 O ATOM 2200 CB PHE A 138 7.821 -0.196 -3.598 1.00 31.04 C ATOM 2201 CG PHE A 138 6.946 -0.516 -4.790 1.00 3.41 C ATOM 2202 CD1 PHE A 138 5.621 -0.896 -4.618 1.00 55.31 C ATOM 2203 CD2 PHE A 138 7.452 -0.433 -6.082 1.00 34.41 C ATOM 2204 CE1 PHE A 138 4.822 -1.187 -5.707 1.00 50.31 C ATOM 2205 CE2 PHE A 138 6.655 -0.724 -7.173 1.00 51.41 C ATOM 2206 CZ PHE A 138 5.338 -1.102 -6.986 1.00 43.51 C ATOM 0 H PHE A 138 9.036 2.005 -4.657 1.00 22.24 H new ATOM 0 HA PHE A 138 6.731 1.495 -2.848 1.00 23.22 H new ATOM 0 HB2 PHE A 138 8.854 -0.447 -3.837 1.00 31.04 H new ATOM 0 HB3 PHE A 138 7.525 -0.826 -2.759 1.00 31.04 H new ATOM 0 HD1 PHE A 138 5.211 -0.965 -3.621 1.00 55.31 H new ATOM 0 HD2 PHE A 138 8.480 -0.138 -6.235 1.00 34.41 H new ATOM 0 HE1 PHE A 138 3.793 -1.481 -5.558 1.00 50.31 H new ATOM 0 HE2 PHE A 138 7.061 -0.656 -8.172 1.00 51.41 H new ATOM 0 HZ PHE A 138 4.714 -1.330 -7.838 1.00 43.51 H new ATOM 2216 N PHE A 139 8.139 1.581 -0.784 1.00 43.11 N ATOM 2217 CA PHE A 139 8.944 1.815 0.418 1.00 52.02 C ATOM 2218 C PHE A 139 8.581 0.833 1.535 1.00 23.32 C ATOM 2219 O PHE A 139 7.404 0.565 1.791 1.00 3.32 O ATOM 2220 CB PHE A 139 8.783 3.264 0.904 1.00 2.43 C ATOM 2221 CG PHE A 139 9.580 4.265 0.100 1.00 33.31 C ATOM 2222 CD1 PHE A 139 9.097 4.760 -1.103 1.00 33.13 C ATOM 2223 CD2 PHE A 139 10.816 4.705 0.549 1.00 22.51 C ATOM 2224 CE1 PHE A 139 9.831 5.672 -1.839 1.00 71.32 C ATOM 2225 CE2 PHE A 139 11.554 5.616 -0.182 1.00 50.01 C ATOM 2226 CZ PHE A 139 11.062 6.100 -1.377 1.00 21.52 C ATOM 0 H PHE A 139 7.143 1.451 -0.607 1.00 43.11 H new ATOM 0 HA PHE A 139 9.988 1.649 0.154 1.00 52.02 H new ATOM 0 HB2 PHE A 139 7.728 3.536 0.864 1.00 2.43 H new ATOM 0 HB3 PHE A 139 9.089 3.324 1.949 1.00 2.43 H new ATOM 0 HD1 PHE A 139 8.136 4.429 -1.469 1.00 33.13 H new ATOM 0 HD2 PHE A 139 11.207 4.330 1.483 1.00 22.51 H new ATOM 0 HE1 PHE A 139 9.443 6.050 -2.774 1.00 71.32 H new ATOM 0 HE2 PHE A 139 12.515 5.949 0.181 1.00 50.01 H new ATOM 0 HZ PHE A 139 11.637 6.812 -1.950 1.00 21.52 H new ATOM 2236 N ILE A 140 9.605 0.301 2.197 1.00 73.44 N ATOM 2237 CA ILE A 140 9.411 -0.661 3.289 1.00 54.13 C ATOM 2238 C ILE A 140 10.105 -0.178 4.576 1.00 13.00 C ATOM 2239 O ILE A 140 11.121 0.515 4.522 1.00 2.14 O ATOM 2240 CB ILE A 140 9.937 -2.071 2.896 1.00 15.10 C ATOM 2241 CG1 ILE A 140 9.704 -3.088 4.028 1.00 21.40 C ATOM 2242 CG2 ILE A 140 11.414 -2.014 2.521 1.00 51.12 C ATOM 2243 CD1 ILE A 140 10.249 -4.474 3.734 1.00 75.40 C ATOM 0 H ILE A 140 10.582 0.518 1.999 1.00 73.44 H new ATOM 0 HA ILE A 140 8.340 -0.734 3.476 1.00 54.13 H new ATOM 0 HB ILE A 140 9.374 -2.404 2.024 1.00 15.10 H new ATOM 0 HG12 ILE A 140 10.167 -2.713 4.941 1.00 21.40 H new ATOM 0 HG13 ILE A 140 8.634 -3.163 4.221 1.00 21.40 H new ATOM 0 HG21 ILE A 140 11.759 -3.012 2.250 1.00 51.12 H new ATOM 0 HG22 ILE A 140 11.549 -1.341 1.674 1.00 51.12 H new ATOM 0 HG23 ILE A 140 11.991 -1.649 3.370 1.00 51.12 H new ATOM 0 HD11 ILE A 140 10.045 -5.132 4.579 1.00 75.40 H new ATOM 0 HD12 ILE A 140 9.768 -4.872 2.840 1.00 75.40 H new ATOM 0 HD13 ILE A 140 11.325 -4.415 3.571 1.00 75.40 H new ATOM 2255 N GLY A 141 9.541 -0.538 5.728 1.00 45.24 N ATOM 2256 CA GLY A 141 10.101 -0.119 7.009 1.00 54.32 C ATOM 2257 C GLY A 141 11.562 -0.530 7.202 1.00 60.43 C ATOM 2258 O GLY A 141 11.910 -1.700 7.017 1.00 63.14 O ATOM 0 H GLY A 141 8.703 -1.115 5.799 1.00 45.24 H new ATOM 0 HA2 GLY A 141 10.023 0.965 7.093 1.00 54.32 H new ATOM 0 HA3 GLY A 141 9.503 -0.545 7.814 1.00 54.32 H new ATOM 2262 N GLU A 142 12.408 0.430 7.589 1.00 2.20 N ATOM 2263 CA GLU A 142 13.843 0.183 7.809 1.00 71.55 C ATOM 2264 C GLU A 142 14.085 -1.083 8.652 1.00 21.42 C ATOM 2265 O GLU A 142 14.944 -1.900 8.326 1.00 24.24 O ATOM 2266 CB GLU A 142 14.480 1.405 8.492 1.00 14.15 C ATOM 2267 CG GLU A 142 15.971 1.257 8.802 1.00 52.33 C ATOM 2268 CD GLU A 142 16.824 1.055 7.555 1.00 34.34 C ATOM 2269 OE1 GLU A 142 17.072 2.045 6.831 1.00 44.30 O ATOM 2270 OE2 GLU A 142 17.264 -0.087 7.305 1.00 22.25 O ATOM 0 H GLU A 142 12.124 1.395 7.759 1.00 2.20 H new ATOM 0 HA GLU A 142 14.308 0.021 6.837 1.00 71.55 H new ATOM 0 HB2 GLU A 142 14.340 2.276 7.852 1.00 14.15 H new ATOM 0 HB3 GLU A 142 13.947 1.604 9.422 1.00 14.15 H new ATOM 0 HG2 GLU A 142 16.316 2.146 9.331 1.00 52.33 H new ATOM 0 HG3 GLU A 142 16.114 0.411 9.474 1.00 52.33 H new ATOM 2277 N ARG A 143 13.301 -1.248 9.718 1.00 64.32 N ATOM 2278 CA ARG A 143 13.407 -2.420 10.605 1.00 53.35 C ATOM 2279 C ARG A 143 13.417 -3.765 9.841 1.00 43.12 C ATOM 2280 O ARG A 143 14.085 -4.715 10.256 1.00 21.41 O ATOM 2281 CB ARG A 143 12.268 -2.401 11.644 1.00 41.45 C ATOM 2282 CG ARG A 143 10.915 -1.954 11.090 1.00 73.41 C ATOM 2283 CD ARG A 143 9.830 -1.946 12.169 1.00 71.04 C ATOM 2284 NE ARG A 143 8.688 -1.109 11.798 1.00 31.12 N ATOM 2285 CZ ARG A 143 7.486 -1.231 12.294 1.00 2.30 C ATOM 2286 NH1 ARG A 143 7.195 -2.199 13.102 1.00 71.01 N ATOM 2287 NH2 ARG A 143 6.566 -0.380 11.976 1.00 45.43 N ATOM 0 H ARG A 143 12.579 -0.583 9.994 1.00 64.32 H new ATOM 0 HA ARG A 143 14.370 -2.346 11.110 1.00 53.35 H new ATOM 0 HB2 ARG A 143 12.162 -3.400 12.067 1.00 41.45 H new ATOM 0 HB3 ARG A 143 12.549 -1.737 12.461 1.00 41.45 H new ATOM 0 HG2 ARG A 143 11.010 -0.956 10.663 1.00 73.41 H new ATOM 0 HG3 ARG A 143 10.617 -2.620 10.280 1.00 73.41 H new ATOM 0 HD2 ARG A 143 9.489 -2.966 12.346 1.00 71.04 H new ATOM 0 HD3 ARG A 143 10.254 -1.585 13.106 1.00 71.04 H new ATOM 0 HE ARG A 143 8.842 -0.379 11.103 1.00 31.12 H new ATOM 0 HH11 ARG A 143 7.909 -2.880 13.360 1.00 71.01 H new ATOM 0 HH12 ARG A 143 6.252 -2.281 13.481 1.00 71.01 H new ATOM 0 HH21 ARG A 143 6.779 0.387 11.338 1.00 45.43 H new ATOM 0 HH22 ARG A 143 5.627 -0.475 12.363 1.00 45.43 H new ATOM 2301 N ALA A 144 12.684 -3.848 8.733 1.00 24.02 N ATOM 2302 CA ALA A 144 12.635 -5.079 7.925 1.00 71.14 C ATOM 2303 C ALA A 144 13.648 -5.044 6.764 1.00 11.41 C ATOM 2304 O ALA A 144 14.109 -6.087 6.294 1.00 4.11 O ATOM 2305 CB ALA A 144 11.224 -5.291 7.388 1.00 41.20 C ATOM 0 H ALA A 144 12.115 -3.084 8.369 1.00 24.02 H new ATOM 0 HA ALA A 144 12.908 -5.913 8.571 1.00 71.14 H new ATOM 0 HB1 ALA A 144 11.195 -6.203 6.792 1.00 41.20 H new ATOM 0 HB2 ALA A 144 10.527 -5.380 8.221 1.00 41.20 H new ATOM 0 HB3 ALA A 144 10.940 -4.442 6.767 1.00 41.20 H new ATOM 2311 N ALA A 145 14.002 -3.832 6.338 1.00 54.12 N ATOM 2312 CA ALA A 145 14.849 -3.597 5.154 1.00 45.43 C ATOM 2313 C ALA A 145 16.141 -4.434 5.124 1.00 62.33 C ATOM 2314 O ALA A 145 16.640 -4.769 4.050 1.00 34.23 O ATOM 2315 CB ALA A 145 15.203 -2.119 5.076 1.00 53.14 C ATOM 0 H ALA A 145 13.710 -2.973 6.805 1.00 54.12 H new ATOM 0 HA ALA A 145 14.263 -3.913 4.291 1.00 45.43 H new ATOM 0 HB1 ALA A 145 15.829 -1.941 4.202 1.00 53.14 H new ATOM 0 HB2 ALA A 145 14.290 -1.530 4.994 1.00 53.14 H new ATOM 0 HB3 ALA A 145 15.744 -1.826 5.976 1.00 53.14 H new ATOM 2321 N GLU A 146 16.680 -4.760 6.294 1.00 44.13 N ATOM 2322 CA GLU A 146 17.967 -5.467 6.388 1.00 11.41 C ATOM 2323 C GLU A 146 17.939 -6.851 5.702 1.00 31.45 C ATOM 2324 O GLU A 146 18.972 -7.341 5.239 1.00 14.33 O ATOM 2325 CB GLU A 146 18.370 -5.616 7.858 1.00 74.34 C ATOM 2326 CG GLU A 146 19.783 -6.147 8.065 1.00 31.42 C ATOM 2327 CD GLU A 146 20.131 -6.299 9.535 1.00 15.12 C ATOM 2328 OE1 GLU A 146 20.536 -5.300 10.165 1.00 43.35 O ATOM 2329 OE2 GLU A 146 19.992 -7.419 10.074 1.00 31.23 O ATOM 0 H GLU A 146 16.251 -4.549 7.195 1.00 44.13 H new ATOM 0 HA GLU A 146 18.706 -4.866 5.858 1.00 11.41 H new ATOM 0 HB2 GLU A 146 18.283 -4.646 8.348 1.00 74.34 H new ATOM 0 HB3 GLU A 146 17.666 -6.286 8.351 1.00 74.34 H new ATOM 0 HG2 GLU A 146 19.883 -7.112 7.569 1.00 31.42 H new ATOM 0 HG3 GLU A 146 20.496 -5.471 7.593 1.00 31.42 H new ATOM 2336 N GLY A 147 16.759 -7.465 5.622 1.00 34.13 N ATOM 2337 CA GLY A 147 16.652 -8.797 5.028 1.00 30.40 C ATOM 2338 C GLY A 147 15.290 -9.457 5.232 1.00 64.15 C ATOM 2339 O GLY A 147 14.906 -10.347 4.470 1.00 33.51 O ATOM 0 H GLY A 147 15.879 -7.071 5.954 1.00 34.13 H new ATOM 0 HA2 GLY A 147 16.854 -8.725 3.959 1.00 30.40 H new ATOM 0 HA3 GLY A 147 17.423 -9.438 5.455 1.00 30.40 H new ATOM 2343 N ALA A 148 14.556 -9.022 6.257 1.00 51.35 N ATOM 2344 CA ALA A 148 13.243 -9.595 6.572 1.00 53.20 C ATOM 2345 C ALA A 148 12.211 -9.299 5.470 1.00 54.31 C ATOM 2346 O ALA A 148 11.614 -8.222 5.433 1.00 53.51 O ATOM 2347 CB ALA A 148 12.753 -9.076 7.922 1.00 11.11 C ATOM 0 H ALA A 148 14.848 -8.273 6.885 1.00 51.35 H new ATOM 0 HA ALA A 148 13.356 -10.678 6.627 1.00 53.20 H new ATOM 0 HB1 ALA A 148 11.778 -9.508 8.146 1.00 11.11 H new ATOM 0 HB2 ALA A 148 13.462 -9.359 8.700 1.00 11.11 H new ATOM 0 HB3 ALA A 148 12.669 -7.990 7.886 1.00 11.11 H new ATOM 2353 N GLU A 149 12.005 -10.268 4.575 1.00 24.11 N ATOM 2354 CA GLU A 149 11.062 -10.112 3.455 1.00 62.23 C ATOM 2355 C GLU A 149 9.599 -10.087 3.934 1.00 3.11 C ATOM 2356 O GLU A 149 8.678 -9.879 3.143 1.00 23.22 O ATOM 2357 CB GLU A 149 11.256 -11.238 2.417 1.00 44.03 C ATOM 2358 CG GLU A 149 10.766 -12.618 2.866 1.00 53.14 C ATOM 2359 CD GLU A 149 11.549 -13.188 4.039 1.00 33.21 C ATOM 2360 OE1 GLU A 149 12.617 -13.790 3.809 1.00 55.15 O ATOM 2361 OE2 GLU A 149 11.104 -13.031 5.196 1.00 23.32 O ATOM 0 H GLU A 149 12.477 -11.172 4.601 1.00 24.11 H new ATOM 0 HA GLU A 149 11.278 -9.152 2.987 1.00 62.23 H new ATOM 0 HB2 GLU A 149 10.733 -10.963 1.501 1.00 44.03 H new ATOM 0 HB3 GLU A 149 12.316 -11.307 2.170 1.00 44.03 H new ATOM 0 HG2 GLU A 149 9.714 -12.549 3.141 1.00 53.14 H new ATOM 0 HG3 GLU A 149 10.831 -13.309 2.026 1.00 53.14 H new ATOM 2368 N ASN A 150 9.392 -10.306 5.231 1.00 14.44 N ATOM 2369 CA ASN A 150 8.054 -10.253 5.829 1.00 65.24 C ATOM 2370 C ASN A 150 7.656 -8.812 6.208 1.00 63.15 C ATOM 2371 O ASN A 150 6.783 -8.601 7.050 1.00 10.11 O ATOM 2372 CB ASN A 150 8.001 -11.156 7.069 1.00 43.13 C ATOM 2373 CG ASN A 150 8.941 -10.688 8.162 1.00 23.02 C ATOM 2374 OD1 ASN A 150 10.100 -11.078 8.206 1.00 63.23 O ATOM 2375 ND2 ASN A 150 8.453 -9.846 9.048 1.00 25.04 N ATOM 0 H ASN A 150 10.137 -10.523 5.893 1.00 14.44 H new ATOM 0 HA ASN A 150 7.341 -10.610 5.086 1.00 65.24 H new ATOM 0 HB2 ASN A 150 6.982 -11.180 7.455 1.00 43.13 H new ATOM 0 HB3 ASN A 150 8.258 -12.176 6.784 1.00 43.13 H new ATOM 0 HD21 ASN A 150 9.046 -9.498 9.801 1.00 25.04 H new ATOM 0 HD22 ASN A 150 7.482 -9.542 8.981 1.00 25.04 H new ATOM 2382 N GLY A 151 8.311 -7.830 5.592 1.00 33.02 N ATOM 2383 CA GLY A 151 7.967 -6.432 5.822 1.00 1.51 C ATOM 2384 C GLY A 151 6.958 -5.901 4.808 1.00 23.12 C ATOM 2385 O GLY A 151 7.087 -6.146 3.609 1.00 23.12 O ATOM 0 H GLY A 151 9.077 -7.976 4.935 1.00 33.02 H new ATOM 0 HA2 GLY A 151 7.559 -6.323 6.827 1.00 1.51 H new ATOM 0 HA3 GLY A 151 8.873 -5.827 5.779 1.00 1.51 H new ATOM 2389 N GLN A 152 5.959 -5.170 5.289 1.00 24.01 N ATOM 2390 CA GLN A 152 4.901 -4.636 4.426 1.00 3.33 C ATOM 2391 C GLN A 152 5.420 -3.535 3.479 1.00 30.14 C ATOM 2392 O GLN A 152 5.913 -2.495 3.927 1.00 23.21 O ATOM 2393 CB GLN A 152 3.761 -4.072 5.288 1.00 4.34 C ATOM 2394 CG GLN A 152 2.545 -3.625 4.485 1.00 52.11 C ATOM 2395 CD GLN A 152 1.545 -2.834 5.311 1.00 35.23 C ATOM 2396 OE1 GLN A 152 1.430 -3.007 6.518 1.00 15.25 O ATOM 2397 NE2 GLN A 152 0.813 -1.952 4.662 1.00 33.52 N ATOM 0 H GLN A 152 5.856 -4.930 6.275 1.00 24.01 H new ATOM 0 HA GLN A 152 4.538 -5.459 3.811 1.00 3.33 H new ATOM 0 HB2 GLN A 152 3.451 -4.831 6.006 1.00 4.34 H new ATOM 0 HB3 GLN A 152 4.137 -3.225 5.862 1.00 4.34 H new ATOM 0 HG2 GLN A 152 2.876 -3.015 3.644 1.00 52.11 H new ATOM 0 HG3 GLN A 152 2.050 -4.502 4.068 1.00 52.11 H new ATOM 0 HE21 GLN A 152 0.932 -1.831 3.656 1.00 33.52 H new ATOM 0 HE22 GLN A 152 0.127 -1.390 5.165 1.00 33.52 H new ATOM 2406 N VAL A 153 5.313 -3.770 2.172 1.00 31.55 N ATOM 2407 CA VAL A 153 5.615 -2.737 1.174 1.00 54.10 C ATOM 2408 C VAL A 153 4.438 -1.765 1.014 1.00 4.05 C ATOM 2409 O VAL A 153 3.307 -2.174 0.749 1.00 14.22 O ATOM 2410 CB VAL A 153 5.958 -3.352 -0.213 1.00 2.03 C ATOM 2411 CG1 VAL A 153 5.922 -2.287 -1.311 1.00 75.02 C ATOM 2412 CG2 VAL A 153 7.327 -4.026 -0.180 1.00 64.43 C ATOM 0 H VAL A 153 5.020 -4.664 1.777 1.00 31.55 H new ATOM 0 HA VAL A 153 6.488 -2.196 1.541 1.00 54.10 H new ATOM 0 HB VAL A 153 5.202 -4.104 -0.439 1.00 2.03 H new ATOM 0 HG11 VAL A 153 6.166 -2.745 -2.270 1.00 75.02 H new ATOM 0 HG12 VAL A 153 4.925 -1.849 -1.361 1.00 75.02 H new ATOM 0 HG13 VAL A 153 6.650 -1.507 -1.086 1.00 75.02 H new ATOM 0 HG21 VAL A 153 7.548 -4.450 -1.160 1.00 64.43 H new ATOM 0 HG22 VAL A 153 8.089 -3.290 0.077 1.00 64.43 H new ATOM 0 HG23 VAL A 153 7.324 -4.820 0.566 1.00 64.43 H new ATOM 2422 N ALA A 154 4.716 -0.480 1.185 1.00 11.22 N ATOM 2423 CA ALA A 154 3.710 0.566 1.004 1.00 42.14 C ATOM 2424 C ALA A 154 3.898 1.268 -0.349 1.00 31.32 C ATOM 2425 O ALA A 154 5.026 1.599 -0.731 1.00 51.54 O ATOM 2426 CB ALA A 154 3.800 1.555 2.157 1.00 44.33 C ATOM 0 H ALA A 154 5.637 -0.131 1.451 1.00 11.22 H new ATOM 0 HA ALA A 154 2.716 0.118 1.003 1.00 42.14 H new ATOM 0 HB1 ALA A 154 3.051 2.336 2.025 1.00 44.33 H new ATOM 0 HB2 ALA A 154 3.620 1.035 3.098 1.00 44.33 H new ATOM 0 HB3 ALA A 154 4.793 2.004 2.175 1.00 44.33 H new ATOM 2432 N ILE A 155 2.800 1.495 -1.075 1.00 53.03 N ATOM 2433 CA ILE A 155 2.890 2.014 -2.454 1.00 32.53 C ATOM 2434 C ILE A 155 2.865 3.554 -2.503 1.00 43.42 C ATOM 2435 O ILE A 155 2.080 4.196 -1.813 1.00 20.42 O ATOM 2436 CB ILE A 155 1.748 1.447 -3.342 1.00 22.22 C ATOM 2437 CG1 ILE A 155 1.797 -0.092 -3.349 1.00 44.35 C ATOM 2438 CG2 ILE A 155 1.840 1.999 -4.768 1.00 42.53 C ATOM 2439 CD1 ILE A 155 0.706 -0.743 -4.174 1.00 32.32 C ATOM 0 H ILE A 155 1.849 1.333 -0.743 1.00 53.03 H new ATOM 0 HA ILE A 155 3.851 1.679 -2.845 1.00 32.53 H new ATOM 0 HB ILE A 155 0.793 1.764 -2.922 1.00 22.22 H new ATOM 0 HG12 ILE A 155 2.766 -0.412 -3.731 1.00 44.35 H new ATOM 0 HG13 ILE A 155 1.725 -0.452 -2.323 1.00 44.35 H new ATOM 0 HG21 ILE A 155 1.030 1.588 -5.370 1.00 42.53 H new ATOM 0 HG22 ILE A 155 1.758 3.086 -4.744 1.00 42.53 H new ATOM 0 HG23 ILE A 155 2.797 1.717 -5.206 1.00 42.53 H new ATOM 0 HD11 ILE A 155 0.812 -1.827 -4.126 1.00 32.32 H new ATOM 0 HD12 ILE A 155 -0.269 -0.456 -3.780 1.00 32.32 H new ATOM 0 HD13 ILE A 155 0.789 -0.416 -5.210 1.00 32.32 H new ATOM 2451 N ILE A 156 3.733 4.136 -3.336 1.00 23.22 N ATOM 2452 CA ILE A 156 3.829 5.596 -3.486 1.00 52.03 C ATOM 2453 C ILE A 156 3.273 6.065 -4.839 1.00 3.31 C ATOM 2454 O ILE A 156 3.810 5.713 -5.898 1.00 33.23 O ATOM 2455 CB ILE A 156 5.301 6.080 -3.366 1.00 50.40 C ATOM 2456 CG1 ILE A 156 5.852 5.810 -1.956 1.00 54.41 C ATOM 2457 CG2 ILE A 156 5.416 7.563 -3.720 1.00 44.53 C ATOM 2458 CD1 ILE A 156 5.136 6.575 -0.862 1.00 75.54 C ATOM 0 H ILE A 156 4.385 3.615 -3.922 1.00 23.22 H new ATOM 0 HA ILE A 156 3.233 6.027 -2.682 1.00 52.03 H new ATOM 0 HB ILE A 156 5.902 5.515 -4.078 1.00 50.40 H new ATOM 0 HG12 ILE A 156 5.780 4.743 -1.746 1.00 54.41 H new ATOM 0 HG13 ILE A 156 6.911 6.069 -1.934 1.00 54.41 H new ATOM 0 HG21 ILE A 156 6.455 7.879 -3.629 1.00 44.53 H new ATOM 0 HG22 ILE A 156 5.077 7.720 -4.744 1.00 44.53 H new ATOM 0 HG23 ILE A 156 4.798 8.148 -3.040 1.00 44.53 H new ATOM 0 HD11 ILE A 156 5.581 6.332 0.103 1.00 75.54 H new ATOM 0 HD12 ILE A 156 5.229 7.645 -1.046 1.00 75.54 H new ATOM 0 HD13 ILE A 156 4.082 6.299 -0.855 1.00 75.54 H new ATOM 2470 N GLU A 157 2.216 6.875 -4.796 1.00 24.45 N ATOM 2471 CA GLU A 157 1.620 7.450 -6.007 1.00 14.50 C ATOM 2472 C GLU A 157 1.866 8.960 -6.088 1.00 15.41 C ATOM 2473 O GLU A 157 1.748 9.672 -5.093 1.00 62.42 O ATOM 2474 CB GLU A 157 0.101 7.194 -6.038 1.00 62.20 C ATOM 2475 CG GLU A 157 -0.615 7.874 -7.214 1.00 54.50 C ATOM 2476 CD GLU A 157 -2.133 7.769 -7.143 1.00 14.55 C ATOM 2477 OE1 GLU A 157 -2.735 8.359 -6.220 1.00 62.34 O ATOM 2478 OE2 GLU A 157 -2.737 7.114 -8.026 1.00 50.12 O ATOM 0 H GLU A 157 1.751 7.151 -3.931 1.00 24.45 H new ATOM 0 HA GLU A 157 2.095 6.965 -6.860 1.00 14.50 H new ATOM 0 HB2 GLU A 157 -0.077 6.120 -6.088 1.00 62.20 H new ATOM 0 HB3 GLU A 157 -0.337 7.546 -5.104 1.00 62.20 H new ATOM 0 HG2 GLU A 157 -0.332 8.926 -7.242 1.00 54.50 H new ATOM 0 HG3 GLU A 157 -0.271 7.427 -8.146 1.00 54.50 H new ATOM 2485 N TYR A 158 2.216 9.447 -7.275 1.00 31.31 N ATOM 2486 CA TYR A 158 2.246 10.889 -7.518 1.00 55.14 C ATOM 2487 C TYR A 158 0.810 11.422 -7.618 1.00 61.21 C ATOM 2488 O TYR A 158 0.223 11.472 -8.700 1.00 3.11 O ATOM 2489 CB TYR A 158 3.035 11.213 -8.797 1.00 65.23 C ATOM 2490 CG TYR A 158 4.522 10.922 -8.689 1.00 20.51 C ATOM 2491 CD1 TYR A 158 5.037 9.673 -9.025 1.00 22.15 C ATOM 2492 CD2 TYR A 158 5.410 11.901 -8.252 1.00 21.54 C ATOM 2493 CE1 TYR A 158 6.391 9.410 -8.927 1.00 75.33 C ATOM 2494 CE2 TYR A 158 6.764 11.645 -8.154 1.00 33.12 C ATOM 2495 CZ TYR A 158 7.250 10.399 -8.492 1.00 43.24 C ATOM 2496 OH TYR A 158 8.601 10.141 -8.395 1.00 54.32 O ATOM 0 H TYR A 158 2.480 8.874 -8.076 1.00 31.31 H new ATOM 0 HA TYR A 158 2.751 11.377 -6.684 1.00 55.14 H new ATOM 0 HB2 TYR A 158 2.621 10.637 -9.624 1.00 65.23 H new ATOM 0 HB3 TYR A 158 2.897 12.266 -9.041 1.00 65.23 H new ATOM 0 HD1 TYR A 158 4.368 8.897 -9.368 1.00 22.15 H new ATOM 0 HD2 TYR A 158 5.034 12.878 -7.985 1.00 21.54 H new ATOM 0 HE1 TYR A 158 6.775 8.435 -9.190 1.00 75.33 H new ATOM 0 HE2 TYR A 158 7.439 12.417 -7.814 1.00 33.12 H new ATOM 0 HH TYR A 158 9.065 10.943 -8.075 1.00 54.32 H new ATOM 2506 N ARG A 159 0.240 11.788 -6.474 1.00 5.34 N ATOM 2507 CA ARG A 159 -1.160 12.201 -6.403 1.00 75.54 C ATOM 2508 C ARG A 159 -1.336 13.613 -6.975 1.00 71.14 C ATOM 2509 O ARG A 159 -0.725 14.576 -6.500 1.00 22.15 O ATOM 2510 CB ARG A 159 -1.650 12.139 -4.945 1.00 62.20 C ATOM 2511 CG ARG A 159 -3.125 11.765 -4.782 1.00 21.51 C ATOM 2512 CD ARG A 159 -4.068 12.790 -5.405 1.00 33.41 C ATOM 2513 NE ARG A 159 -5.469 12.416 -5.235 1.00 63.01 N ATOM 2514 CZ ARG A 159 -6.467 13.012 -5.829 1.00 4.41 C ATOM 2515 NH1 ARG A 159 -6.258 14.004 -6.641 1.00 3.22 N ATOM 2516 NH2 ARG A 159 -7.675 12.606 -5.618 1.00 62.44 N ATOM 0 H ARG A 159 0.728 11.807 -5.579 1.00 5.34 H new ATOM 0 HA ARG A 159 -1.760 11.518 -7.004 1.00 75.54 H new ATOM 0 HB2 ARG A 159 -1.043 11.414 -4.403 1.00 62.20 H new ATOM 0 HB3 ARG A 159 -1.481 13.109 -4.478 1.00 62.20 H new ATOM 0 HG2 ARG A 159 -3.301 10.791 -5.239 1.00 21.51 H new ATOM 0 HG3 ARG A 159 -3.354 11.665 -3.721 1.00 21.51 H new ATOM 0 HD2 ARG A 159 -3.895 13.765 -4.950 1.00 33.41 H new ATOM 0 HD3 ARG A 159 -3.845 12.889 -6.467 1.00 33.41 H new ATOM 0 HE ARG A 159 -5.682 11.638 -4.611 1.00 63.01 H new ATOM 0 HH11 ARG A 159 -5.306 14.325 -6.820 1.00 3.22 H new ATOM 0 HH12 ARG A 159 -7.045 14.462 -7.100 1.00 3.22 H new ATOM 0 HH21 ARG A 159 -7.847 11.822 -4.989 1.00 62.44 H new ATOM 0 HH22 ARG A 159 -8.457 13.070 -6.081 1.00 62.44 H new ATOM 2530 N ASP A 160 -2.180 13.726 -7.994 1.00 22.34 N ATOM 2531 CA ASP A 160 -2.407 14.996 -8.675 1.00 22.40 C ATOM 2532 C ASP A 160 -3.154 16.002 -7.785 1.00 13.31 C ATOM 2533 O ASP A 160 -4.070 15.643 -7.036 1.00 54.02 O ATOM 2534 CB ASP A 160 -3.204 14.761 -9.965 1.00 53.31 C ATOM 2535 CG ASP A 160 -4.615 14.269 -9.686 1.00 63.22 C ATOM 2536 OD1 ASP A 160 -4.787 13.065 -9.398 1.00 43.34 O ATOM 2537 OD2 ASP A 160 -5.558 15.089 -9.735 1.00 64.32 O ATOM 0 H ASP A 160 -2.722 12.948 -8.369 1.00 22.34 H new ATOM 0 HA ASP A 160 -1.431 15.420 -8.911 1.00 22.40 H new ATOM 0 HB2 ASP A 160 -3.251 15.689 -10.535 1.00 53.31 H new ATOM 0 HB3 ASP A 160 -2.682 14.032 -10.585 1.00 53.31 H new ATOM 2542 N VAL A 161 -2.732 17.257 -7.859 1.00 50.13 N ATOM 2543 CA VAL A 161 -3.473 18.375 -7.298 1.00 65.33 C ATOM 2544 C VAL A 161 -3.582 19.429 -8.393 1.00 33.10 C ATOM 2545 O VAL A 161 -2.709 19.495 -9.252 1.00 62.32 O ATOM 2546 CB VAL A 161 -2.772 18.975 -6.044 1.00 55.22 C ATOM 2547 CG1 VAL A 161 -3.550 20.173 -5.497 1.00 4.40 C ATOM 2548 CG2 VAL A 161 -2.592 17.911 -4.961 1.00 51.21 C ATOM 0 H VAL A 161 -1.860 17.528 -8.313 1.00 50.13 H new ATOM 0 HA VAL A 161 -4.454 18.035 -6.968 1.00 65.33 H new ATOM 0 HB VAL A 161 -1.786 19.325 -6.349 1.00 55.22 H new ATOM 0 HG11 VAL A 161 -3.037 20.571 -4.622 1.00 4.40 H new ATOM 0 HG12 VAL A 161 -3.614 20.946 -6.263 1.00 4.40 H new ATOM 0 HG13 VAL A 161 -4.555 19.857 -5.216 1.00 4.40 H new ATOM 0 HG21 VAL A 161 -2.100 18.353 -4.095 1.00 51.21 H new ATOM 0 HG22 VAL A 161 -3.567 17.523 -4.666 1.00 51.21 H new ATOM 0 HG23 VAL A 161 -1.980 17.097 -5.349 1.00 51.21 H new ATOM 2558 N ASP A 162 -4.642 20.225 -8.391 1.00 40.11 N ATOM 2559 CA ASP A 162 -4.841 21.233 -9.431 1.00 25.14 C ATOM 2560 C ASP A 162 -3.762 22.329 -9.353 1.00 21.41 C ATOM 2561 O ASP A 162 -4.025 23.462 -8.941 1.00 73.10 O ATOM 2562 CB ASP A 162 -6.250 21.830 -9.324 1.00 64.11 C ATOM 2563 CG ASP A 162 -6.587 22.733 -10.496 1.00 32.31 C ATOM 2564 OD1 ASP A 162 -6.668 22.226 -11.633 1.00 53.13 O ATOM 2565 OD2 ASP A 162 -6.786 23.947 -10.287 1.00 31.14 O ATOM 0 H ASP A 162 -5.377 20.195 -7.685 1.00 40.11 H new ATOM 0 HA ASP A 162 -4.745 20.752 -10.404 1.00 25.14 H new ATOM 0 HB2 ASP A 162 -6.980 21.023 -9.269 1.00 64.11 H new ATOM 0 HB3 ASP A 162 -6.332 22.397 -8.397 1.00 64.11 H new ATOM 2570 N GLY A 163 -2.536 21.961 -9.717 1.00 15.03 N ATOM 2571 CA GLY A 163 -1.423 22.908 -9.723 1.00 63.43 C ATOM 2572 C GLY A 163 -0.146 22.366 -9.079 1.00 23.42 C ATOM 2573 O GLY A 163 0.926 22.958 -9.217 1.00 1.24 O ATOM 0 H GLY A 163 -2.288 21.016 -10.011 1.00 15.03 H new ATOM 0 HA2 GLY A 163 -1.207 23.193 -10.753 1.00 63.43 H new ATOM 0 HA3 GLY A 163 -1.727 23.814 -9.199 1.00 63.43 H new ATOM 2577 N THR A 164 -0.247 21.239 -8.374 1.00 20.25 N ATOM 2578 CA THR A 164 0.903 20.669 -7.653 1.00 14.24 C ATOM 2579 C THR A 164 0.893 19.134 -7.700 1.00 1.24 C ATOM 2580 O THR A 164 -0.169 18.513 -7.739 1.00 73.22 O ATOM 2581 CB THR A 164 0.916 21.127 -6.168 1.00 72.52 C ATOM 2582 OG1 THR A 164 0.840 22.560 -6.092 1.00 73.02 O ATOM 2583 CG2 THR A 164 2.176 20.655 -5.444 1.00 72.30 C ATOM 0 H THR A 164 -1.108 20.700 -8.284 1.00 20.25 H new ATOM 0 HA THR A 164 1.800 21.034 -8.154 1.00 14.24 H new ATOM 0 HB THR A 164 0.049 20.680 -5.681 1.00 72.52 H new ATOM 0 HG1 THR A 164 0.847 22.839 -5.152 1.00 73.02 H new ATOM 0 HG21 THR A 164 2.149 20.994 -4.408 1.00 72.30 H new ATOM 0 HG22 THR A 164 2.223 19.566 -5.468 1.00 72.30 H new ATOM 0 HG23 THR A 164 3.056 21.067 -5.938 1.00 72.30 H new ATOM 2591 N GLU A 165 2.078 18.527 -7.694 1.00 41.22 N ATOM 2592 CA GLU A 165 2.203 17.061 -7.678 1.00 44.51 C ATOM 2593 C GLU A 165 2.763 16.569 -6.329 1.00 64.40 C ATOM 2594 O GLU A 165 3.939 16.770 -6.008 1.00 3.01 O ATOM 2595 CB GLU A 165 3.069 16.562 -8.860 1.00 61.21 C ATOM 2596 CG GLU A 165 4.516 17.073 -8.892 1.00 33.52 C ATOM 2597 CD GLU A 165 4.628 18.585 -9.043 1.00 10.22 C ATOM 2598 OE1 GLU A 165 4.235 19.114 -10.103 1.00 52.24 O ATOM 2599 OE2 GLU A 165 5.098 19.252 -8.095 1.00 33.54 O ATOM 0 H GLU A 165 2.969 19.023 -7.700 1.00 41.22 H new ATOM 0 HA GLU A 165 1.205 16.639 -7.798 1.00 44.51 H new ATOM 0 HB2 GLU A 165 3.089 15.472 -8.836 1.00 61.21 H new ATOM 0 HB3 GLU A 165 2.581 16.852 -9.791 1.00 61.21 H new ATOM 0 HG2 GLU A 165 5.019 16.770 -7.974 1.00 33.52 H new ATOM 0 HG3 GLU A 165 5.043 16.594 -9.717 1.00 33.52 H new ATOM 2606 N VAL A 166 1.904 15.932 -5.531 1.00 23.31 N ATOM 2607 CA VAL A 166 2.283 15.464 -4.192 1.00 71.52 C ATOM 2608 C VAL A 166 2.225 13.927 -4.089 1.00 15.10 C ATOM 2609 O VAL A 166 1.237 13.307 -4.472 1.00 14.41 O ATOM 2610 CB VAL A 166 1.377 16.090 -3.096 1.00 62.33 C ATOM 2611 CG1 VAL A 166 1.558 17.607 -3.045 1.00 75.42 C ATOM 2612 CG2 VAL A 166 -0.092 15.729 -3.324 1.00 32.22 C ATOM 0 H VAL A 166 0.938 15.727 -5.788 1.00 23.31 H new ATOM 0 HA VAL A 166 3.311 15.786 -4.028 1.00 71.52 H new ATOM 0 HB VAL A 166 1.680 15.676 -2.134 1.00 62.33 H new ATOM 0 HG11 VAL A 166 0.914 18.024 -2.271 1.00 75.42 H new ATOM 0 HG12 VAL A 166 2.598 17.842 -2.818 1.00 75.42 H new ATOM 0 HG13 VAL A 166 1.291 18.038 -4.010 1.00 75.42 H new ATOM 0 HG21 VAL A 166 -0.703 16.180 -2.542 1.00 32.22 H new ATOM 0 HG22 VAL A 166 -0.412 16.103 -4.296 1.00 32.22 H new ATOM 0 HG23 VAL A 166 -0.209 14.646 -3.296 1.00 32.22 H new ATOM 2622 N PRO A 167 3.293 13.287 -3.581 1.00 13.32 N ATOM 2623 CA PRO A 167 3.350 11.824 -3.445 1.00 62.44 C ATOM 2624 C PRO A 167 2.589 11.300 -2.208 1.00 61.34 C ATOM 2625 O PRO A 167 2.964 11.581 -1.066 1.00 73.50 O ATOM 2626 CB PRO A 167 4.861 11.534 -3.326 1.00 33.12 C ATOM 2627 CG PRO A 167 5.555 12.861 -3.463 1.00 4.11 C ATOM 2628 CD PRO A 167 4.534 13.908 -3.116 1.00 20.34 C ATOM 0 HA PRO A 167 2.871 11.323 -4.286 1.00 62.44 H new ATOM 0 HB2 PRO A 167 5.094 11.070 -2.368 1.00 33.12 H new ATOM 0 HB3 PRO A 167 5.187 10.842 -4.103 1.00 33.12 H new ATOM 0 HG2 PRO A 167 6.415 12.921 -2.796 1.00 4.11 H new ATOM 0 HG3 PRO A 167 5.928 13.002 -4.478 1.00 4.11 H new ATOM 0 HD2 PRO A 167 4.510 14.116 -2.046 1.00 20.34 H new ATOM 0 HD3 PRO A 167 4.731 14.854 -3.621 1.00 20.34 H new ATOM 2636 N THR A 168 1.524 10.536 -2.448 1.00 25.44 N ATOM 2637 CA THR A 168 0.720 9.940 -1.369 1.00 2.03 C ATOM 2638 C THR A 168 1.000 8.441 -1.211 1.00 41.34 C ATOM 2639 O THR A 168 1.601 7.809 -2.082 1.00 72.23 O ATOM 2640 CB THR A 168 -0.795 10.138 -1.606 1.00 74.42 C ATOM 2641 OG1 THR A 168 -1.157 9.656 -2.907 1.00 4.44 O ATOM 2642 CG2 THR A 168 -1.184 11.608 -1.468 1.00 64.54 C ATOM 0 H THR A 168 1.192 10.311 -3.386 1.00 25.44 H new ATOM 0 HA THR A 168 1.012 10.458 -0.456 1.00 2.03 H new ATOM 0 HB THR A 168 -1.334 9.569 -0.849 1.00 74.42 H new ATOM 0 HG1 THR A 168 -2.118 9.784 -3.047 1.00 4.44 H new ATOM 0 HG21 THR A 168 -2.255 11.719 -1.640 1.00 64.54 H new ATOM 0 HG22 THR A 168 -0.939 11.956 -0.465 1.00 64.54 H new ATOM 0 HG23 THR A 168 -0.636 12.200 -2.201 1.00 64.54 H new ATOM 2650 N LEU A 169 0.557 7.877 -0.088 1.00 74.31 N ATOM 2651 CA LEU A 169 0.816 6.466 0.234 1.00 53.32 C ATOM 2652 C LEU A 169 -0.450 5.600 0.086 1.00 31.25 C ATOM 2653 O LEU A 169 -1.541 6.010 0.477 1.00 42.41 O ATOM 2654 CB LEU A 169 1.341 6.358 1.671 1.00 13.33 C ATOM 2655 CG LEU A 169 1.945 5.000 2.056 1.00 20.40 C ATOM 2656 CD1 LEU A 169 3.239 4.764 1.286 1.00 52.14 C ATOM 2657 CD2 LEU A 169 2.185 4.917 3.564 1.00 2.24 C ATOM 0 H LEU A 169 0.015 8.374 0.619 1.00 74.31 H new ATOM 0 HA LEU A 169 1.559 6.095 -0.471 1.00 53.32 H new ATOM 0 HB2 LEU A 169 2.098 7.128 1.821 1.00 13.33 H new ATOM 0 HB3 LEU A 169 0.522 6.578 2.356 1.00 13.33 H new ATOM 0 HG LEU A 169 1.235 4.217 1.789 1.00 20.40 H new ATOM 0 HD11 LEU A 169 3.659 3.798 1.567 1.00 52.14 H new ATOM 0 HD12 LEU A 169 3.032 4.772 0.216 1.00 52.14 H new ATOM 0 HD13 LEU A 169 3.953 5.553 1.524 1.00 52.14 H new ATOM 0 HD21 LEU A 169 2.613 3.946 3.811 1.00 2.24 H new ATOM 0 HD22 LEU A 169 2.874 5.705 3.867 1.00 2.24 H new ATOM 0 HD23 LEU A 169 1.239 5.041 4.090 1.00 2.24 H new ATOM 2669 N MET A 170 -0.286 4.393 -0.465 1.00 1.41 N ATOM 2670 CA MET A 170 -1.391 3.433 -0.615 1.00 62.01 C ATOM 2671 C MET A 170 -1.242 2.242 0.347 1.00 54.32 C ATOM 2672 O MET A 170 -0.202 1.565 0.358 1.00 33.20 O ATOM 2673 CB MET A 170 -1.457 2.897 -2.050 1.00 44.14 C ATOM 2674 CG MET A 170 -1.817 3.933 -3.102 1.00 64.51 C ATOM 2675 SD MET A 170 -1.924 3.206 -4.751 1.00 74.41 S ATOM 2676 CE MET A 170 -2.508 4.599 -5.712 1.00 4.11 C ATOM 0 H MET A 170 0.609 4.053 -0.818 1.00 1.41 H new ATOM 0 HA MET A 170 -2.309 3.971 -0.377 1.00 62.01 H new ATOM 0 HB2 MET A 170 -0.491 2.462 -2.305 1.00 44.14 H new ATOM 0 HB3 MET A 170 -2.190 2.091 -2.088 1.00 44.14 H new ATOM 0 HG2 MET A 170 -2.771 4.395 -2.846 1.00 64.51 H new ATOM 0 HG3 MET A 170 -1.069 4.726 -3.102 1.00 64.51 H new ATOM 0 HE1 MET A 170 -2.108 4.536 -6.724 1.00 4.11 H new ATOM 0 HE2 MET A 170 -3.597 4.583 -5.751 1.00 4.11 H new ATOM 0 HE3 MET A 170 -2.175 5.527 -5.247 1.00 4.11 H new ATOM 2686 N LEU A 171 -2.297 1.986 1.135 1.00 71.41 N ATOM 2687 CA LEU A 171 -2.341 0.843 2.067 1.00 33.41 C ATOM 2688 C LEU A 171 -3.716 0.142 2.010 1.00 52.20 C ATOM 2689 O LEU A 171 -4.737 0.759 2.291 1.00 23.15 O ATOM 2690 CB LEU A 171 -2.079 1.321 3.509 1.00 2.14 C ATOM 2691 CG LEU A 171 -0.730 2.021 3.751 1.00 51.41 C ATOM 2692 CD1 LEU A 171 -0.655 2.577 5.173 1.00 52.45 C ATOM 2693 CD2 LEU A 171 0.435 1.068 3.486 1.00 1.21 C ATOM 0 H LEU A 171 -3.140 2.560 1.147 1.00 71.41 H new ATOM 0 HA LEU A 171 -1.567 0.136 1.768 1.00 33.41 H new ATOM 0 HB2 LEU A 171 -2.878 2.005 3.795 1.00 2.14 H new ATOM 0 HB3 LEU A 171 -2.144 0.460 4.174 1.00 2.14 H new ATOM 0 HG LEU A 171 -0.654 2.854 3.052 1.00 51.41 H new ATOM 0 HD11 LEU A 171 0.307 3.067 5.322 1.00 52.45 H new ATOM 0 HD12 LEU A 171 -1.458 3.299 5.324 1.00 52.45 H new ATOM 0 HD13 LEU A 171 -0.761 1.762 5.889 1.00 52.45 H new ATOM 0 HD21 LEU A 171 1.377 1.587 3.664 1.00 1.21 H new ATOM 0 HD22 LEU A 171 0.362 0.209 4.153 1.00 1.21 H new ATOM 0 HD23 LEU A 171 0.398 0.727 2.451 1.00 1.21 H new ATOM 2705 N VAL A 172 -3.750 -1.146 1.662 1.00 3.13 N ATOM 2706 CA VAL A 172 -5.029 -1.876 1.553 1.00 51.43 C ATOM 2707 C VAL A 172 -5.628 -2.199 2.938 1.00 64.45 C ATOM 2708 O VAL A 172 -5.011 -2.895 3.745 1.00 12.22 O ATOM 2709 CB VAL A 172 -4.871 -3.190 0.748 1.00 4.22 C ATOM 2710 CG1 VAL A 172 -6.222 -3.882 0.575 1.00 44.13 C ATOM 2711 CG2 VAL A 172 -4.218 -2.919 -0.607 1.00 45.15 C ATOM 0 H VAL A 172 -2.923 -1.705 1.452 1.00 3.13 H new ATOM 0 HA VAL A 172 -5.712 -1.213 1.021 1.00 51.43 H new ATOM 0 HB VAL A 172 -4.218 -3.859 1.309 1.00 4.22 H new ATOM 0 HG11 VAL A 172 -6.089 -4.803 0.007 1.00 44.13 H new ATOM 0 HG12 VAL A 172 -6.639 -4.117 1.554 1.00 44.13 H new ATOM 0 HG13 VAL A 172 -6.904 -3.221 0.040 1.00 44.13 H new ATOM 0 HG21 VAL A 172 -4.117 -3.855 -1.156 1.00 45.15 H new ATOM 0 HG22 VAL A 172 -4.839 -2.229 -1.178 1.00 45.15 H new ATOM 0 HG23 VAL A 172 -3.232 -2.479 -0.454 1.00 45.15 H new ATOM 2721 N LYS A 173 -6.848 -1.715 3.195 1.00 73.53 N ATOM 2722 CA LYS A 173 -7.477 -1.865 4.519 1.00 54.13 C ATOM 2723 C LYS A 173 -7.881 -3.320 4.821 1.00 63.35 C ATOM 2724 O LYS A 173 -7.884 -3.741 5.974 1.00 5.54 O ATOM 2725 CB LYS A 173 -8.714 -0.961 4.641 1.00 43.45 C ATOM 2726 CG LYS A 173 -9.921 -1.439 3.839 1.00 43.10 C ATOM 2727 CD LYS A 173 -11.155 -0.574 4.083 1.00 33.42 C ATOM 2728 CE LYS A 173 -11.553 -0.529 5.559 1.00 31.10 C ATOM 2729 NZ LYS A 173 -11.843 -1.880 6.112 1.00 4.14 N ATOM 0 H LYS A 173 -7.419 -1.219 2.511 1.00 73.53 H new ATOM 0 HA LYS A 173 -6.726 -1.566 5.250 1.00 54.13 H new ATOM 0 HB2 LYS A 173 -8.995 -0.890 5.692 1.00 43.45 H new ATOM 0 HB3 LYS A 173 -8.449 0.044 4.313 1.00 43.45 H new ATOM 0 HG2 LYS A 173 -9.676 -1.429 2.777 1.00 43.10 H new ATOM 0 HG3 LYS A 173 -10.145 -2.472 4.104 1.00 43.10 H new ATOM 0 HD2 LYS A 173 -10.961 0.439 3.731 1.00 33.42 H new ATOM 0 HD3 LYS A 173 -11.988 -0.961 3.496 1.00 33.42 H new ATOM 0 HE2 LYS A 173 -10.750 -0.069 6.135 1.00 31.10 H new ATOM 0 HE3 LYS A 173 -12.432 0.104 5.676 1.00 31.10 H new ATOM 0 HZ1 LYS A 173 -12.725 -1.848 6.663 1.00 4.14 H new ATOM 0 HZ2 LYS A 173 -11.947 -2.560 5.332 1.00 4.14 H new ATOM 0 HZ3 LYS A 173 -11.060 -2.178 6.729 1.00 4.14 H new ATOM 2743 N GLU A 174 -8.235 -4.079 3.783 1.00 32.44 N ATOM 2744 CA GLU A 174 -8.667 -5.474 3.963 1.00 53.21 C ATOM 2745 C GLU A 174 -7.468 -6.427 4.084 1.00 11.53 C ATOM 2746 O GLU A 174 -7.634 -7.633 4.274 1.00 63.12 O ATOM 2747 CB GLU A 174 -9.577 -5.905 2.802 1.00 12.10 C ATOM 2748 CG GLU A 174 -10.832 -5.046 2.644 1.00 3.04 C ATOM 2749 CD GLU A 174 -11.735 -5.063 3.872 1.00 24.42 C ATOM 2750 OE1 GLU A 174 -12.458 -6.059 4.077 1.00 41.54 O ATOM 2751 OE2 GLU A 174 -11.745 -4.068 4.625 1.00 65.24 O ATOM 0 H GLU A 174 -8.233 -3.759 2.815 1.00 32.44 H new ATOM 0 HA GLU A 174 -9.229 -5.529 4.895 1.00 53.21 H new ATOM 0 HB2 GLU A 174 -9.006 -5.870 1.874 1.00 12.10 H new ATOM 0 HB3 GLU A 174 -9.876 -6.942 2.954 1.00 12.10 H new ATOM 0 HG2 GLU A 174 -10.536 -4.018 2.434 1.00 3.04 H new ATOM 0 HG3 GLU A 174 -11.398 -5.397 1.781 1.00 3.04 H new ATOM 2758 N ALA A 175 -6.261 -5.874 3.984 1.00 21.22 N ATOM 2759 CA ALA A 175 -5.031 -6.652 4.156 1.00 54.00 C ATOM 2760 C ALA A 175 -4.509 -6.517 5.586 1.00 71.12 C ATOM 2761 O ALA A 175 -4.300 -7.506 6.285 1.00 12.04 O ATOM 2762 CB ALA A 175 -3.969 -6.185 3.166 1.00 75.54 C ATOM 0 H ALA A 175 -6.106 -4.886 3.784 1.00 21.22 H new ATOM 0 HA ALA A 175 -5.256 -7.701 3.964 1.00 54.00 H new ATOM 0 HB1 ALA A 175 -3.060 -6.771 3.304 1.00 75.54 H new ATOM 0 HB2 ALA A 175 -4.336 -6.319 2.148 1.00 75.54 H new ATOM 0 HB3 ALA A 175 -3.751 -5.131 3.337 1.00 75.54 H new ATOM 2768 N ILE A 176 -4.312 -5.276 6.014 1.00 45.23 N ATOM 2769 CA ILE A 176 -3.831 -4.992 7.362 1.00 51.04 C ATOM 2770 C ILE A 176 -5.000 -4.695 8.310 1.00 65.30 C ATOM 2771 O ILE A 176 -5.993 -4.085 7.917 1.00 42.01 O ATOM 2772 CB ILE A 176 -2.845 -3.793 7.369 1.00 54.01 C ATOM 2773 CG1 ILE A 176 -3.528 -2.522 6.831 1.00 61.20 C ATOM 2774 CG2 ILE A 176 -1.600 -4.126 6.546 1.00 44.41 C ATOM 2775 CD1 ILE A 176 -2.630 -1.299 6.811 1.00 74.11 C ATOM 0 H ILE A 176 -4.479 -4.446 5.445 1.00 45.23 H new ATOM 0 HA ILE A 176 -3.305 -5.881 7.709 1.00 51.04 H new ATOM 0 HB ILE A 176 -2.540 -3.603 8.398 1.00 54.01 H new ATOM 0 HG12 ILE A 176 -3.885 -2.714 5.819 1.00 61.20 H new ATOM 0 HG13 ILE A 176 -4.404 -2.306 7.442 1.00 61.20 H new ATOM 0 HG21 ILE A 176 -0.917 -3.277 6.559 1.00 44.41 H new ATOM 0 HG22 ILE A 176 -1.104 -4.997 6.973 1.00 44.41 H new ATOM 0 HG23 ILE A 176 -1.891 -4.342 5.518 1.00 44.41 H new ATOM 0 HD11 ILE A 176 -3.185 -0.447 6.419 1.00 74.11 H new ATOM 0 HD12 ILE A 176 -2.293 -1.078 7.824 1.00 74.11 H new ATOM 0 HD13 ILE A 176 -1.766 -1.492 6.176 1.00 74.11 H new ATOM 2787 N ILE A 177 -4.877 -5.116 9.563 1.00 44.22 N ATOM 2788 CA ILE A 177 -5.927 -4.880 10.554 1.00 24.32 C ATOM 2789 C ILE A 177 -5.655 -3.571 11.295 1.00 75.22 C ATOM 2790 O ILE A 177 -4.692 -3.453 12.057 1.00 64.13 O ATOM 2791 CB ILE A 177 -6.042 -6.053 11.573 1.00 40.01 C ATOM 2792 CG1 ILE A 177 -6.618 -7.319 10.903 1.00 44.42 C ATOM 2793 CG2 ILE A 177 -6.909 -5.652 12.770 1.00 4.03 C ATOM 2794 CD1 ILE A 177 -5.767 -7.882 9.783 1.00 30.42 C ATOM 0 H ILE A 177 -4.065 -5.621 9.919 1.00 44.22 H new ATOM 0 HA ILE A 177 -6.876 -4.813 10.021 1.00 24.32 H new ATOM 0 HB ILE A 177 -5.037 -6.279 11.929 1.00 40.01 H new ATOM 0 HG12 ILE A 177 -6.750 -8.089 11.663 1.00 44.42 H new ATOM 0 HG13 ILE A 177 -7.607 -7.087 10.509 1.00 44.42 H new ATOM 0 HG21 ILE A 177 -6.975 -6.487 13.468 1.00 4.03 H new ATOM 0 HG22 ILE A 177 -6.462 -4.794 13.272 1.00 4.03 H new ATOM 0 HG23 ILE A 177 -7.909 -5.389 12.424 1.00 4.03 H new ATOM 0 HD11 ILE A 177 -6.248 -8.769 9.371 1.00 30.42 H new ATOM 0 HD12 ILE A 177 -5.655 -7.133 8.999 1.00 30.42 H new ATOM 0 HD13 ILE A 177 -4.785 -8.150 10.172 1.00 30.42 H new ATOM 2806 N GLU A 178 -6.504 -2.588 11.032 1.00 60.14 N ATOM 2807 CA GLU A 178 -6.374 -1.252 11.614 1.00 43.41 C ATOM 2808 C GLU A 178 -7.431 -1.031 12.701 1.00 13.32 C ATOM 2809 O GLU A 178 -8.620 -1.284 12.491 1.00 12.22 O ATOM 2810 CB GLU A 178 -6.489 -0.192 10.500 1.00 3.11 C ATOM 2811 CG GLU A 178 -6.396 1.264 10.973 1.00 51.23 C ATOM 2812 CD GLU A 178 -7.756 1.916 11.203 1.00 32.33 C ATOM 2813 OE1 GLU A 178 -8.416 2.279 10.205 1.00 0.23 O ATOM 2814 OE2 GLU A 178 -8.169 2.076 12.372 1.00 42.40 O ATOM 0 H GLU A 178 -7.305 -2.690 10.409 1.00 60.14 H new ATOM 0 HA GLU A 178 -5.396 -1.159 12.085 1.00 43.41 H new ATOM 0 HB2 GLU A 178 -5.702 -0.371 9.768 1.00 3.11 H new ATOM 0 HB3 GLU A 178 -7.440 -0.330 9.986 1.00 3.11 H new ATOM 0 HG2 GLU A 178 -5.823 1.301 11.899 1.00 51.23 H new ATOM 0 HG3 GLU A 178 -5.844 1.844 10.233 1.00 51.23 H new ATOM 2821 N GLU A 179 -6.987 -0.579 13.868 1.00 64.34 N ATOM 2822 CA GLU A 179 -7.892 -0.306 14.989 1.00 70.30 C ATOM 2823 C GLU A 179 -7.623 1.079 15.580 1.00 54.02 C ATOM 2824 O GLU A 179 -6.684 1.270 16.358 1.00 5.13 O ATOM 2825 CB GLU A 179 -7.765 -1.385 16.080 1.00 62.40 C ATOM 2826 CG GLU A 179 -8.342 -2.742 15.679 1.00 71.51 C ATOM 2827 CD GLU A 179 -8.337 -3.750 16.818 1.00 24.52 C ATOM 2828 OE1 GLU A 179 -8.966 -3.475 17.863 1.00 51.43 O ATOM 2829 OE2 GLU A 179 -7.721 -4.825 16.677 1.00 73.13 O ATOM 0 H GLU A 179 -6.004 -0.392 14.067 1.00 64.34 H new ATOM 0 HA GLU A 179 -8.912 -0.328 14.604 1.00 70.30 H new ATOM 0 HB2 GLU A 179 -6.712 -1.509 16.333 1.00 62.40 H new ATOM 0 HB3 GLU A 179 -8.271 -1.038 16.981 1.00 62.40 H new ATOM 0 HG2 GLU A 179 -9.364 -2.606 15.326 1.00 71.51 H new ATOM 0 HG3 GLU A 179 -7.767 -3.143 14.844 1.00 71.51 H new ATOM 2836 N LYS A 180 -8.438 2.049 15.184 1.00 52.31 N ATOM 2837 CA LYS A 180 -8.318 3.416 15.686 1.00 4.15 C ATOM 2838 C LYS A 180 -8.955 3.575 17.074 1.00 1.43 C ATOM 2839 O LYS A 180 -10.171 3.465 17.226 1.00 73.13 O ATOM 2840 CB LYS A 180 -8.978 4.405 14.714 1.00 21.53 C ATOM 2841 CG LYS A 180 -8.807 5.865 15.133 1.00 75.10 C ATOM 2842 CD LYS A 180 -9.690 6.815 14.328 1.00 3.24 C ATOM 2843 CE LYS A 180 -11.174 6.531 14.538 1.00 43.45 C ATOM 2844 NZ LYS A 180 -12.020 7.661 14.073 1.00 14.00 N ATOM 0 H LYS A 180 -9.194 1.915 14.513 1.00 52.31 H new ATOM 0 HA LYS A 180 -7.253 3.632 15.769 1.00 4.15 H new ATOM 0 HB2 LYS A 180 -8.552 4.267 13.720 1.00 21.53 H new ATOM 0 HB3 LYS A 180 -10.041 4.177 14.640 1.00 21.53 H new ATOM 0 HG2 LYS A 180 -9.044 5.965 16.192 1.00 75.10 H new ATOM 0 HG3 LYS A 180 -7.763 6.154 15.011 1.00 75.10 H new ATOM 0 HD2 LYS A 180 -9.473 7.844 14.616 1.00 3.24 H new ATOM 0 HD3 LYS A 180 -9.450 6.724 13.269 1.00 3.24 H new ATOM 0 HE2 LYS A 180 -11.451 5.624 14.001 1.00 43.45 H new ATOM 0 HE3 LYS A 180 -11.363 6.346 15.595 1.00 43.45 H new ATOM 0 HZ1 LYS A 180 -13.022 7.433 14.231 1.00 14.00 H new ATOM 0 HZ2 LYS A 180 -11.773 8.521 14.603 1.00 14.00 H new ATOM 0 HZ3 LYS A 180 -11.858 7.822 13.058 1.00 14.00 H new