USER MOD reduce.3.24.130724 H: found=0, std=0, add=1751, rem=0, adj=73 USER MOD reduce.3.24.130724 removed 1751 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 218 SER OG : rot 180:sc= 0.0372 USER MOD Set 1.2: A 219 HIS : no HD1:sc= -0.257 X(o=-0.22,f=0.029) USER MOD Set 2.1: A 215 HIS : no HE2:sc= 0.0999 K(o=-0.47,f=-1.5) USER MOD Set 2.2: A 217 ASN : amide:sc= -0.568 K(o=-0.47,f=-4.2!) USER MOD Set 3.1: A 73 THR OG1 : rot 160:sc= 0.00418 USER MOD Set 3.2: A 216 HIS : no HD1:sc= -0.0494 X(o=-0.045,f=-0.41) USER MOD Set 4.1: A 40 SER OG : rot -87:sc= -0.274 USER MOD Set 4.2: A 172 GLN : amide:sc= -0.326 X(o=-0.6,f=-1) USER MOD Set 5.1: A 18 ASN :FLIP amide:sc= -1.37 F(o=-2.3,f=-1.7) USER MOD Set 5.2: A 156 SER OG : rot 180:sc= -0.359 USER MOD Set 6.1: A 148 ASN : amide:sc= 1.95 K(o=2.5,f=-2.9) USER MOD Set 6.2: A 173 THR OG1 : rot -77:sc= 0.535 USER MOD Set 7.1: A 107 SER OG : rot -140:sc= 0.942 USER MOD Set 7.2: A 178 LYS NZ :NH3+ -115:sc= 1.27 (180deg=-0.0486) USER MOD Set 8.1: A 98 THR OG1 : rot 18:sc= 0.436 USER MOD Set 8.2: A 100 SER OG : rot -140:sc= 0 USER MOD Set 9.1: A 67 GLN :FLIP amide:sc= -2.81! C(o=-5.7!,f=-3.5!) USER MOD Set 9.2: A 94 CYS SG : rot 155:sc= -0.737! USER MOD Set 9.3: A 96 THR OG1 : rot 180:sc= 0 USER MOD Set 9.4: A 129 SER OG : rot 141:sc= 0.0487 USER MOD Set10.1: A 66 TYR OH : rot -35:sc= 0.36 USER MOD Set10.2: A 83 MET CE :methyl 179:sc= -1.35 (180deg=-1.4) USER MOD Set11.1: A 76 LYS NZ :NH3+ -153:sc= 0.807 (180deg=-1.42!) USER MOD Set11.2: A 77 SER OG : rot 180:sc= 0.962 USER MOD Set11.3: A 194 ASN : amide:sc= -2.95! C(o=-1.2!,f=-2.1!) USER MOD Set12.1: A 46 ASN : amide:sc= 0.656 K(o=1.5,f=-2!) USER MOD Set12.2: A 48 TYR OH : rot 180:sc= 0.833 USER MOD Set13.1: A 8 GLN :FLIP amide:sc= 0.539 F(o=1.6,f=2.4) USER MOD Set13.2: A 116 TYR OH : rot 77:sc= 1.54 USER MOD Set13.3: A 118 LYS NZ :NH3+ -128:sc= 0.314 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 172:sc= 1.4 (180deg=1) USER MOD Single : A 4 LYS NZ :NH3+ -119:sc= 1.05 (180deg=-0.0967) USER MOD Single : A 9 GLN : amide:sc= -0.678 X(o=-0.68,f=-0.3) USER MOD Single : A 10 THR OG1 : rot 90:sc= -3.68! USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -169:sc= -0.0236 (180deg=-0.212) USER MOD Single : A 28 LYS NZ :NH3+ -163:sc= -0.0938 (180deg=-0.456) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot -160:sc=-0.00925 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ -161:sc= -0.113 (180deg=-0.576) USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.0596 USER MOD Single : A 36 SER OG : rot 180:sc= -0.285 USER MOD Single : A 37 SER OG : rot 166:sc= -1.09 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 166:sc= -0.0592 (180deg=-0.308) USER MOD Single : A 44 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -179:sc= 2.01 (180deg=1.94) USER MOD Single : A 62 SER OG : rot -32:sc= 0.418 USER MOD Single : A 68 THR OG1 : rot -130:sc= -3.04! USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -0.336 K(o=-0.34,f=-2!) USER MOD Single : A 85 HIS : no HD1:sc= -0.239 X(o=-0.24,f=0.05) USER MOD Single : A 89 SER OG : rot -41:sc= 0.0638 USER MOD Single : A 91 THR OG1 : rot -87:sc= 0.737 USER MOD Single : A 95 HIS : no HD1:sc= -4.51! C(o=-4.5!,f=-4.8!) USER MOD Single : A 99 GLN :FLIP amide:sc= -0.0214 F(o=-1.2!,f=-0.021) USER MOD Single : A 105 SER OG : rot 160:sc= 0.0112 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0.058) USER MOD Single : A 124 MET CE :methyl -132:sc= -2.12 (180deg=-3.86!) USER MOD Single : A 125 ASN : amide:sc= -0.463 K(o=-0.46,f=-3.3!) USER MOD Single : A 128 SER OG : rot 80:sc= -0.351 USER MOD Single : A 130 LYS NZ :NH3+ -135:sc= -1.13 (180deg=-3.49!) USER MOD Single : A 131 SER OG : rot 87:sc= 0.961 USER MOD Single : A 137 TYR OH : rot -69:sc= 0.563 USER MOD Single : A 140 SER OG : rot 180:sc= 0.354 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 HIS : no HD1:sc= 1.1 K(o=1.1,f=-4.7!) USER MOD Single : A 151 CYS SG : rot 180:sc= -3.61! USER MOD Single : A 155 CYS SG : rot 43:sc= -4.74! USER MOD Single : A 158 MET CE :methyl 153:sc= -0.35 (180deg=-1.31!) USER MOD Single : A 161 ASN : amide:sc= -0.0498 K(o=-0.05,f=-2.5!) USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 165 SER OG : rot 101:sc= 0.927 USER MOD Single : A 166 LYS NZ :NH3+ 178:sc= -1.6 (180deg=-1.74) USER MOD Single : A 169 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 175 MET CE :methyl -139:sc= -0.253 (180deg=-1.05) USER MOD Single : A 180 SER OG : rot 180:sc= 0 USER MOD Single : A 182 SER OG : rot 180:sc= 0.029 USER MOD Single : A 186 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 187 THR OG1 : rot -98:sc= 0.668 USER MOD Single : A 188 MET CE :methyl -123:sc= -6.08! (180deg=-7.84!) USER MOD Single : A 190 SER OG : rot 90:sc= 0.738 USER MOD Single : A 191 ASN : amide:sc= -0.0169 X(o=-0.017,f=-0.45) USER MOD Single : A 198 ASN : amide:sc= -5.03 K(o=-5,f=-6!) USER MOD Single : A 200 LYS NZ :NH3+ 150:sc= -0.176 (180deg=-1.11!) USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 206 HIS : no HD1:sc= -0.715 K(o=-0.72,f=-1.5) USER MOD Single : A 208 THR OG1 : rot -130:sc= -1.99! USER MOD Single : A 210 SER OG : rot 160:sc= 0.0158 USER MOD Single : A 220 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.749 -5.280 -22.786 1.00 1.81 N ATOM 2 CA MET A 1 -8.317 -5.263 -21.369 1.00 1.25 C ATOM 3 C MET A 1 -9.036 -4.164 -20.606 1.00 1.04 C ATOM 4 O MET A 1 -9.172 -3.042 -21.090 1.00 1.62 O ATOM 5 CB MET A 1 -6.802 -5.065 -21.267 1.00 1.61 C ATOM 6 CG MET A 1 -5.986 -6.294 -21.650 1.00 2.19 C ATOM 7 SD MET A 1 -6.187 -6.767 -23.380 1.00 2.82 S ATOM 8 CE MET A 1 -5.165 -8.238 -23.450 1.00 3.86 C ATOM 0 H1 MET A 1 -8.153 -5.943 -23.323 1.00 1.81 H new ATOM 0 H2 MET A 1 -9.742 -5.583 -22.843 1.00 1.81 H new ATOM 0 H3 MET A 1 -8.655 -4.326 -23.189 1.00 1.81 H new ATOM 0 HA MET A 1 -8.574 -6.225 -20.926 1.00 1.25 H new ATOM 0 HB2 MET A 1 -6.511 -4.234 -21.910 1.00 1.61 H new ATOM 0 HB3 MET A 1 -6.552 -4.780 -20.245 1.00 1.61 H new ATOM 0 HG2 MET A 1 -4.932 -6.099 -21.453 1.00 2.19 H new ATOM 0 HG3 MET A 1 -6.279 -7.130 -21.015 1.00 2.19 H new ATOM 0 HE1 MET A 1 -5.187 -8.649 -24.460 1.00 3.86 H new ATOM 0 HE2 MET A 1 -4.139 -7.981 -23.185 1.00 3.86 H new ATOM 0 HE3 MET A 1 -5.546 -8.980 -22.748 1.00 3.86 H new ATOM 20 N ASP A 2 -9.475 -4.490 -19.400 1.00 0.84 N ATOM 21 CA ASP A 2 -10.258 -3.579 -18.596 1.00 0.67 C ATOM 22 C ASP A 2 -9.407 -3.048 -17.476 1.00 0.52 C ATOM 23 O ASP A 2 -9.351 -1.847 -17.240 1.00 0.53 O ATOM 24 CB ASP A 2 -11.480 -4.304 -18.031 1.00 0.98 C ATOM 25 CG ASP A 2 -12.379 -3.410 -17.197 1.00 1.50 C ATOM 26 OD1 ASP A 2 -13.234 -2.718 -17.780 1.00 1.72 O ATOM 27 OD2 ASP A 2 -12.259 -3.423 -15.953 1.00 2.25 O ATOM 0 H ASP A 2 -9.297 -5.391 -18.957 1.00 0.84 H new ATOM 0 HA ASP A 2 -10.599 -2.748 -19.213 1.00 0.67 H new ATOM 0 HB2 ASP A 2 -12.059 -4.721 -18.855 1.00 0.98 H new ATOM 0 HB3 ASP A 2 -11.145 -5.142 -17.420 1.00 0.98 H new ATOM 32 N PHE A 3 -8.675 -3.954 -16.846 1.00 0.43 N ATOM 33 CA PHE A 3 -7.875 -3.623 -15.693 1.00 0.34 C ATOM 34 C PHE A 3 -6.774 -2.678 -16.108 1.00 0.37 C ATOM 35 O PHE A 3 -6.444 -1.731 -15.406 1.00 0.40 O ATOM 36 CB PHE A 3 -7.272 -4.883 -15.084 1.00 0.30 C ATOM 37 CG PHE A 3 -8.279 -5.869 -14.564 1.00 0.29 C ATOM 38 CD1 PHE A 3 -8.900 -5.665 -13.347 1.00 0.28 C ATOM 39 CD2 PHE A 3 -8.576 -7.016 -15.277 1.00 0.30 C ATOM 40 CE1 PHE A 3 -9.793 -6.583 -12.847 1.00 0.29 C ATOM 41 CE2 PHE A 3 -9.477 -7.939 -14.786 1.00 0.31 C ATOM 42 CZ PHE A 3 -10.084 -7.722 -13.566 1.00 0.29 C ATOM 0 H PHE A 3 -8.624 -4.934 -17.124 1.00 0.43 H new ATOM 0 HA PHE A 3 -8.508 -3.146 -14.944 1.00 0.34 H new ATOM 0 HB2 PHE A 3 -6.656 -5.375 -15.836 1.00 0.30 H new ATOM 0 HB3 PHE A 3 -6.610 -4.595 -14.268 1.00 0.30 H new ATOM 0 HD1 PHE A 3 -8.681 -4.772 -12.780 1.00 0.28 H new ATOM 0 HD2 PHE A 3 -8.097 -7.192 -16.229 1.00 0.30 H new ATOM 0 HE1 PHE A 3 -10.266 -6.412 -11.891 1.00 0.29 H new ATOM 0 HE2 PHE A 3 -9.706 -8.828 -15.355 1.00 0.31 H new ATOM 0 HZ PHE A 3 -10.786 -8.444 -13.175 1.00 0.29 H new ATOM 52 N LYS A 4 -6.256 -2.911 -17.293 1.00 0.40 N ATOM 53 CA LYS A 4 -5.152 -2.146 -17.794 1.00 0.47 C ATOM 54 C LYS A 4 -5.637 -0.837 -18.379 1.00 0.54 C ATOM 55 O LYS A 4 -4.880 -0.080 -18.961 1.00 0.95 O ATOM 56 CB LYS A 4 -4.377 -2.918 -18.847 1.00 0.54 C ATOM 57 CG LYS A 4 -2.885 -2.952 -18.558 1.00 0.68 C ATOM 58 CD LYS A 4 -2.059 -3.260 -19.791 1.00 0.83 C ATOM 59 CE LYS A 4 -2.187 -4.704 -20.231 1.00 1.10 C ATOM 60 NZ LYS A 4 -1.515 -4.924 -21.536 1.00 1.51 N ATOM 0 H LYS A 4 -6.591 -3.634 -17.929 1.00 0.40 H new ATOM 0 HA LYS A 4 -4.486 -1.943 -16.955 1.00 0.47 H new ATOM 0 HB2 LYS A 4 -4.758 -3.938 -18.900 1.00 0.54 H new ATOM 0 HB3 LYS A 4 -4.545 -2.464 -19.824 1.00 0.54 H new ATOM 0 HG2 LYS A 4 -2.576 -1.990 -18.149 1.00 0.68 H new ATOM 0 HG3 LYS A 4 -2.684 -3.703 -17.794 1.00 0.68 H new ATOM 0 HD2 LYS A 4 -2.371 -2.607 -20.606 1.00 0.83 H new ATOM 0 HD3 LYS A 4 -1.012 -3.037 -19.587 1.00 0.83 H new ATOM 0 HE2 LYS A 4 -1.748 -5.358 -19.477 1.00 1.10 H new ATOM 0 HE3 LYS A 4 -3.241 -4.972 -20.311 1.00 1.10 H new ATOM 0 HZ1 LYS A 4 -2.214 -5.245 -22.237 1.00 1.51 H new ATOM 0 HZ2 LYS A 4 -1.084 -4.034 -21.859 1.00 1.51 H new ATOM 0 HZ3 LYS A 4 -0.776 -5.648 -21.428 1.00 1.51 H new ATOM 74 N ALA A 5 -6.914 -0.599 -18.282 1.00 0.45 N ATOM 75 CA ALA A 5 -7.455 0.666 -18.687 1.00 0.47 C ATOM 76 C ALA A 5 -7.517 1.599 -17.487 1.00 0.42 C ATOM 77 O ALA A 5 -7.001 2.717 -17.517 1.00 0.42 O ATOM 78 CB ALA A 5 -8.810 0.453 -19.324 1.00 0.54 C ATOM 0 H ALA A 5 -7.600 -1.265 -17.926 1.00 0.45 H new ATOM 0 HA ALA A 5 -6.813 1.136 -19.432 1.00 0.47 H new ATOM 0 HB1 ALA A 5 -9.222 1.414 -19.632 1.00 0.54 H new ATOM 0 HB2 ALA A 5 -8.705 -0.193 -20.196 1.00 0.54 H new ATOM 0 HB3 ALA A 5 -9.481 -0.015 -18.604 1.00 0.54 H new ATOM 84 N ILE A 6 -8.078 1.089 -16.400 1.00 0.42 N ATOM 85 CA ILE A 6 -8.339 1.911 -15.229 1.00 0.43 C ATOM 86 C ILE A 6 -7.095 2.008 -14.371 1.00 0.37 C ATOM 87 O ILE A 6 -6.799 3.052 -13.819 1.00 0.38 O ATOM 88 CB ILE A 6 -9.533 1.412 -14.371 1.00 0.53 C ATOM 89 CG1 ILE A 6 -10.119 0.101 -14.904 1.00 0.91 C ATOM 90 CG2 ILE A 6 -10.612 2.481 -14.307 1.00 1.07 C ATOM 91 CD1 ILE A 6 -9.401 -1.136 -14.415 1.00 0.65 C ATOM 0 H ILE A 6 -8.360 0.113 -16.305 1.00 0.42 H new ATOM 0 HA ILE A 6 -8.617 2.896 -15.605 1.00 0.43 H new ATOM 0 HB ILE A 6 -9.155 1.215 -13.368 1.00 0.53 H new ATOM 0 HG12 ILE A 6 -11.168 0.039 -14.613 1.00 0.91 H new ATOM 0 HG13 ILE A 6 -10.091 0.118 -15.993 1.00 0.91 H new ATOM 0 HG21 ILE A 6 -11.445 2.121 -13.703 1.00 1.07 H new ATOM 0 HG22 ILE A 6 -10.202 3.385 -13.858 1.00 1.07 H new ATOM 0 HG23 ILE A 6 -10.964 2.704 -15.314 1.00 1.07 H new ATOM 0 HD11 ILE A 6 -9.875 -2.022 -14.836 1.00 0.65 H new ATOM 0 HD12 ILE A 6 -8.358 -1.099 -14.729 1.00 0.65 H new ATOM 0 HD13 ILE A 6 -9.452 -1.180 -13.327 1.00 0.65 H new ATOM 103 N ALA A 7 -6.364 0.905 -14.288 1.00 0.33 N ATOM 104 CA ALA A 7 -5.141 0.825 -13.498 1.00 0.31 C ATOM 105 C ALA A 7 -4.019 1.610 -14.133 1.00 0.30 C ATOM 106 O ALA A 7 -3.261 2.295 -13.466 1.00 0.32 O ATOM 107 CB ALA A 7 -4.704 -0.603 -13.415 1.00 0.34 C ATOM 0 H ALA A 7 -6.602 0.037 -14.768 1.00 0.33 H new ATOM 0 HA ALA A 7 -5.355 1.238 -12.512 1.00 0.31 H new ATOM 0 HB1 ALA A 7 -3.790 -0.670 -12.825 1.00 0.34 H new ATOM 0 HB2 ALA A 7 -5.486 -1.196 -12.940 1.00 0.34 H new ATOM 0 HB3 ALA A 7 -4.517 -0.985 -14.419 1.00 0.34 H new ATOM 113 N GLN A 8 -3.898 1.451 -15.427 1.00 0.31 N ATOM 114 CA GLN A 8 -2.893 2.142 -16.210 1.00 0.34 C ATOM 115 C GLN A 8 -3.072 3.636 -16.100 1.00 0.35 C ATOM 116 O GLN A 8 -2.106 4.397 -16.124 1.00 0.39 O ATOM 117 CB GLN A 8 -2.981 1.714 -17.662 1.00 0.38 C ATOM 118 CG GLN A 8 -2.266 0.423 -17.938 1.00 0.96 C ATOM 119 CD GLN A 8 -1.729 0.339 -19.359 1.00 1.04 C ATOM 120 OE1 GLN A 8 -0.467 0.690 -19.534 1.00 1.59 O flip ATOM 121 NE2 GLN A 8 -2.430 -0.065 -20.284 1.00 1.50 N flip ATOM 0 H GLN A 8 -4.497 0.834 -15.975 1.00 0.31 H new ATOM 0 HA GLN A 8 -1.909 1.881 -15.821 1.00 0.34 H new ATOM 0 HB2 GLN A 8 -4.029 1.609 -17.941 1.00 0.38 H new ATOM 0 HB3 GLN A 8 -2.560 2.498 -18.292 1.00 0.38 H new ATOM 0 HG2 GLN A 8 -1.440 0.313 -17.235 1.00 0.96 H new ATOM 0 HG3 GLN A 8 -2.947 -0.409 -17.762 1.00 0.96 H new ATOM 0 HE21 GLN A 8 -3.401 -0.327 -20.112 1.00 1.50 H new ATOM 0 HE22 GLN A 8 -2.041 -0.138 -21.224 1.00 1.50 H new ATOM 130 N GLN A 9 -4.315 4.043 -15.967 1.00 0.36 N ATOM 131 CA GLN A 9 -4.616 5.451 -15.758 1.00 0.40 C ATOM 132 C GLN A 9 -4.527 5.768 -14.274 1.00 0.38 C ATOM 133 O GLN A 9 -4.130 6.859 -13.880 1.00 0.45 O ATOM 134 CB GLN A 9 -5.994 5.805 -16.317 1.00 0.48 C ATOM 135 CG GLN A 9 -6.068 5.687 -17.831 1.00 0.74 C ATOM 136 CD GLN A 9 -5.033 6.546 -18.535 1.00 1.65 C ATOM 137 OE1 GLN A 9 -5.293 7.700 -18.874 1.00 2.47 O ATOM 138 NE2 GLN A 9 -3.854 5.989 -18.765 1.00 2.31 N ATOM 0 H GLN A 9 -5.130 3.430 -15.999 1.00 0.36 H new ATOM 0 HA GLN A 9 -3.886 6.057 -16.294 1.00 0.40 H new ATOM 0 HB2 GLN A 9 -6.741 5.149 -15.870 1.00 0.48 H new ATOM 0 HB3 GLN A 9 -6.248 6.824 -16.024 1.00 0.48 H new ATOM 0 HG2 GLN A 9 -5.926 4.645 -18.118 1.00 0.74 H new ATOM 0 HG3 GLN A 9 -7.064 5.977 -18.166 1.00 0.74 H new ATOM 0 HE21 GLN A 9 -3.677 5.029 -18.468 1.00 2.31 H new ATOM 0 HE22 GLN A 9 -3.123 6.520 -19.239 1.00 2.31 H new ATOM 147 N THR A 10 -4.868 4.774 -13.470 1.00 0.34 N ATOM 148 CA THR A 10 -4.781 4.851 -12.023 1.00 0.34 C ATOM 149 C THR A 10 -3.338 5.057 -11.571 1.00 0.30 C ATOM 150 O THR A 10 -3.087 5.812 -10.630 1.00 0.30 O ATOM 151 CB THR A 10 -5.394 3.578 -11.384 1.00 0.37 C ATOM 152 OG1 THR A 10 -6.622 3.897 -10.728 1.00 0.48 O ATOM 153 CG2 THR A 10 -4.447 2.887 -10.413 1.00 0.34 C ATOM 0 H THR A 10 -5.218 3.878 -13.810 1.00 0.34 H new ATOM 0 HA THR A 10 -5.354 5.715 -11.686 1.00 0.34 H new ATOM 0 HB THR A 10 -5.581 2.877 -12.197 1.00 0.37 H new ATOM 0 HG1 THR A 10 -7.365 3.804 -11.361 1.00 0.48 H new ATOM 0 HG21 THR A 10 -4.932 2.003 -9.998 1.00 0.34 H new ATOM 0 HG22 THR A 10 -3.540 2.590 -10.939 1.00 0.34 H new ATOM 0 HG23 THR A 10 -4.190 3.572 -9.605 1.00 0.34 H new ATOM 161 N ALA A 11 -2.399 4.382 -12.237 1.00 0.29 N ATOM 162 CA ALA A 11 -0.978 4.602 -11.977 1.00 0.28 C ATOM 163 C ALA A 11 -0.639 6.087 -11.944 1.00 0.30 C ATOM 164 O ALA A 11 -0.233 6.624 -10.915 1.00 0.31 O ATOM 165 CB ALA A 11 -0.136 3.909 -13.031 1.00 0.31 C ATOM 0 H ALA A 11 -2.596 3.684 -12.954 1.00 0.29 H new ATOM 0 HA ALA A 11 -0.754 4.179 -10.998 1.00 0.28 H new ATOM 0 HB1 ALA A 11 0.920 4.082 -12.824 1.00 0.31 H new ATOM 0 HB2 ALA A 11 -0.339 2.838 -13.013 1.00 0.31 H new ATOM 0 HB3 ALA A 11 -0.383 4.308 -14.015 1.00 0.31 H new ATOM 171 N GLN A 12 -0.833 6.747 -13.071 1.00 0.35 N ATOM 172 CA GLN A 12 -0.518 8.165 -13.203 1.00 0.40 C ATOM 173 C GLN A 12 -1.505 9.042 -12.428 1.00 0.40 C ATOM 174 O GLN A 12 -1.267 10.234 -12.254 1.00 0.45 O ATOM 175 CB GLN A 12 -0.515 8.577 -14.671 1.00 0.48 C ATOM 176 CG GLN A 12 -1.883 8.473 -15.310 1.00 0.98 C ATOM 177 CD GLN A 12 -1.925 9.036 -16.715 1.00 0.97 C ATOM 178 OE1 GLN A 12 -0.934 8.999 -17.445 1.00 1.30 O ATOM 179 NE2 GLN A 12 -3.075 9.564 -17.105 1.00 1.64 N ATOM 0 H GLN A 12 -1.211 6.322 -13.918 1.00 0.35 H new ATOM 0 HA GLN A 12 0.475 8.314 -12.780 1.00 0.40 H new ATOM 0 HB2 GLN A 12 -0.156 9.603 -14.755 1.00 0.48 H new ATOM 0 HB3 GLN A 12 0.186 7.948 -15.219 1.00 0.48 H new ATOM 0 HG2 GLN A 12 -2.188 7.427 -15.335 1.00 0.98 H new ATOM 0 HG3 GLN A 12 -2.608 9.002 -14.691 1.00 0.98 H new ATOM 0 HE21 GLN A 12 -3.873 9.575 -16.469 1.00 1.64 H new ATOM 0 HE22 GLN A 12 -3.163 9.960 -18.041 1.00 1.64 H new ATOM 188 N GLU A 13 -2.617 8.463 -11.990 1.00 0.38 N ATOM 189 CA GLU A 13 -3.544 9.181 -11.115 1.00 0.39 C ATOM 190 C GLU A 13 -2.906 9.370 -9.760 1.00 0.37 C ATOM 191 O GLU A 13 -2.705 10.491 -9.288 1.00 0.42 O ATOM 192 CB GLU A 13 -4.863 8.421 -10.934 1.00 0.43 C ATOM 193 CG GLU A 13 -5.811 8.546 -12.103 1.00 1.10 C ATOM 194 CD GLU A 13 -6.314 9.961 -12.294 1.00 1.65 C ATOM 195 OE1 GLU A 13 -7.093 10.438 -11.442 1.00 1.64 O ATOM 196 OE2 GLU A 13 -5.931 10.606 -13.293 1.00 2.54 O ATOM 0 H GLU A 13 -2.899 7.510 -12.221 1.00 0.38 H new ATOM 0 HA GLU A 13 -3.762 10.142 -11.581 1.00 0.39 H new ATOM 0 HB2 GLU A 13 -4.643 7.366 -10.770 1.00 0.43 H new ATOM 0 HB3 GLU A 13 -5.360 8.787 -10.036 1.00 0.43 H new ATOM 0 HG2 GLU A 13 -5.307 8.217 -13.012 1.00 1.10 H new ATOM 0 HG3 GLU A 13 -6.660 7.880 -11.951 1.00 1.10 H new ATOM 203 N VAL A 14 -2.549 8.251 -9.159 1.00 0.34 N ATOM 204 CA VAL A 14 -1.977 8.257 -7.827 1.00 0.33 C ATOM 205 C VAL A 14 -0.599 8.901 -7.863 1.00 0.33 C ATOM 206 O VAL A 14 -0.227 9.700 -6.996 1.00 0.36 O ATOM 207 CB VAL A 14 -1.889 6.834 -7.241 1.00 0.32 C ATOM 208 CG1 VAL A 14 -0.758 6.027 -7.832 1.00 0.53 C ATOM 209 CG2 VAL A 14 -1.775 6.899 -5.748 1.00 0.49 C ATOM 0 H VAL A 14 -2.646 7.324 -9.574 1.00 0.34 H new ATOM 0 HA VAL A 14 -2.632 8.838 -7.178 1.00 0.33 H new ATOM 0 HB VAL A 14 -2.810 6.316 -7.510 1.00 0.32 H new ATOM 0 HG11 VAL A 14 -0.745 5.034 -7.382 1.00 0.53 H new ATOM 0 HG12 VAL A 14 -0.900 5.935 -8.909 1.00 0.53 H new ATOM 0 HG13 VAL A 14 0.189 6.528 -7.633 1.00 0.53 H new ATOM 0 HG21 VAL A 14 -1.713 5.889 -5.343 1.00 0.49 H new ATOM 0 HG22 VAL A 14 -0.878 7.454 -5.475 1.00 0.49 H new ATOM 0 HG23 VAL A 14 -2.651 7.401 -5.338 1.00 0.49 H new ATOM 219 N LEU A 15 0.134 8.580 -8.911 1.00 0.32 N ATOM 220 CA LEU A 15 1.427 9.156 -9.143 1.00 0.33 C ATOM 221 C LEU A 15 1.264 10.614 -9.469 1.00 0.39 C ATOM 222 O LEU A 15 2.177 11.411 -9.322 1.00 0.43 O ATOM 223 CB LEU A 15 2.071 8.488 -10.318 1.00 0.34 C ATOM 224 CG LEU A 15 3.541 8.748 -10.427 1.00 0.43 C ATOM 225 CD1 LEU A 15 4.285 7.459 -10.197 1.00 0.56 C ATOM 226 CD2 LEU A 15 3.890 9.349 -11.779 1.00 0.60 C ATOM 0 H LEU A 15 -0.159 7.910 -9.622 1.00 0.32 H new ATOM 0 HA LEU A 15 2.042 9.026 -8.252 1.00 0.33 H new ATOM 0 HB2 LEU A 15 1.905 7.413 -10.249 1.00 0.34 H new ATOM 0 HB3 LEU A 15 1.582 8.828 -11.231 1.00 0.34 H new ATOM 0 HG LEU A 15 3.836 9.473 -9.668 1.00 0.43 H new ATOM 0 HD11 LEU A 15 5.357 7.639 -10.275 1.00 0.56 H new ATOM 0 HD12 LEU A 15 4.052 7.077 -9.203 1.00 0.56 H new ATOM 0 HD13 LEU A 15 3.985 6.727 -10.947 1.00 0.56 H new ATOM 0 HD21 LEU A 15 4.964 9.528 -11.831 1.00 0.60 H new ATOM 0 HD22 LEU A 15 3.598 8.659 -12.570 1.00 0.60 H new ATOM 0 HD23 LEU A 15 3.358 10.292 -11.906 1.00 0.60 H new ATOM 238 N GLY A 16 0.078 10.939 -9.932 1.00 0.43 N ATOM 239 CA GLY A 16 -0.249 12.313 -10.241 1.00 0.50 C ATOM 240 C GLY A 16 -0.201 13.155 -9.000 1.00 0.50 C ATOM 241 O GLY A 16 0.076 14.354 -9.046 1.00 0.57 O ATOM 0 H GLY A 16 -0.675 10.272 -10.103 1.00 0.43 H new ATOM 0 HA2 GLY A 16 0.451 12.703 -10.980 1.00 0.50 H new ATOM 0 HA3 GLY A 16 -1.243 12.366 -10.685 1.00 0.50 H new ATOM 245 N TYR A 17 -0.405 12.494 -7.876 1.00 0.45 N ATOM 246 CA TYR A 17 -0.364 13.158 -6.592 1.00 0.48 C ATOM 247 C TYR A 17 1.060 13.135 -6.079 1.00 0.50 C ATOM 248 O TYR A 17 1.396 13.807 -5.108 1.00 0.64 O ATOM 249 CB TYR A 17 -1.303 12.478 -5.601 1.00 0.49 C ATOM 250 CG TYR A 17 -2.701 12.294 -6.133 1.00 0.96 C ATOM 251 CD1 TYR A 17 -3.426 13.375 -6.611 1.00 1.59 C ATOM 252 CD2 TYR A 17 -3.298 11.044 -6.144 1.00 1.41 C ATOM 253 CE1 TYR A 17 -4.713 13.212 -7.090 1.00 2.29 C ATOM 254 CE2 TYR A 17 -4.581 10.873 -6.620 1.00 2.13 C ATOM 255 CZ TYR A 17 -5.267 11.950 -7.135 1.00 2.49 C ATOM 256 OH TYR A 17 -6.564 11.790 -7.561 1.00 3.27 O ATOM 0 H TYR A 17 -0.601 11.494 -7.829 1.00 0.45 H new ATOM 0 HA TYR A 17 -0.697 14.190 -6.705 1.00 0.48 H new ATOM 0 HB2 TYR A 17 -0.893 11.504 -5.332 1.00 0.49 H new ATOM 0 HB3 TYR A 17 -1.345 13.070 -4.686 1.00 0.49 H new ATOM 0 HD1 TYR A 17 -2.979 14.358 -6.609 1.00 1.59 H new ATOM 0 HD2 TYR A 17 -2.750 10.190 -5.774 1.00 1.41 H new ATOM 0 HE1 TYR A 17 -5.280 14.067 -7.427 1.00 2.29 H new ATOM 0 HE2 TYR A 17 -5.046 9.899 -6.589 1.00 2.13 H new ATOM 0 HH TYR A 17 -6.802 10.840 -7.535 1.00 3.27 H new ATOM 266 N ASN A 18 1.888 12.329 -6.736 1.00 0.43 N ATOM 267 CA ASN A 18 3.322 12.313 -6.471 1.00 0.51 C ATOM 268 C ASN A 18 4.015 13.426 -7.265 1.00 0.62 C ATOM 269 O ASN A 18 5.186 13.731 -7.045 1.00 0.77 O ATOM 270 CB ASN A 18 3.906 10.949 -6.867 1.00 0.60 C ATOM 271 CG ASN A 18 5.364 10.773 -6.467 1.00 1.20 C ATOM 272 OD1 ASN A 18 5.754 11.343 -5.336 1.00 2.03 O flip ATOM 273 ND2 ASN A 18 6.131 10.114 -7.166 1.00 1.65 N flip ATOM 0 H ASN A 18 1.588 11.675 -7.459 1.00 0.43 H new ATOM 0 HA ASN A 18 3.490 12.481 -5.407 1.00 0.51 H new ATOM 0 HB2 ASN A 18 3.313 10.161 -6.404 1.00 0.60 H new ATOM 0 HB3 ASN A 18 3.816 10.824 -7.946 1.00 0.60 H new ATOM 0 HD21 ASN A 18 5.796 9.690 -8.031 1.00 1.65 H new ATOM 0 HD22 ASN A 18 7.103 9.992 -6.881 1.00 1.65 H new ATOM 280 N ARG A 19 3.267 14.057 -8.167 1.00 0.61 N ATOM 281 CA ARG A 19 3.847 15.030 -9.092 1.00 0.80 C ATOM 282 C ARG A 19 3.452 16.441 -8.709 1.00 0.90 C ATOM 283 O ARG A 19 4.150 17.403 -9.034 1.00 1.10 O ATOM 284 CB ARG A 19 3.364 14.761 -10.515 1.00 0.83 C ATOM 285 CG ARG A 19 3.654 13.358 -11.001 1.00 1.26 C ATOM 286 CD ARG A 19 2.748 12.981 -12.160 1.00 1.01 C ATOM 287 NE ARG A 19 3.001 13.792 -13.354 1.00 1.65 N ATOM 288 CZ ARG A 19 2.053 14.186 -14.210 1.00 1.85 C ATOM 289 NH1 ARG A 19 0.774 13.909 -13.973 1.00 1.70 N ATOM 290 NH2 ARG A 19 2.389 14.867 -15.302 1.00 2.72 N ATOM 0 H ARG A 19 2.263 13.914 -8.278 1.00 0.61 H new ATOM 0 HA ARG A 19 4.931 14.930 -9.040 1.00 0.80 H new ATOM 0 HB2 ARG A 19 2.290 14.938 -10.564 1.00 0.83 H new ATOM 0 HB3 ARG A 19 3.836 15.475 -11.190 1.00 0.83 H new ATOM 0 HG2 ARG A 19 4.696 13.286 -11.312 1.00 1.26 H new ATOM 0 HG3 ARG A 19 3.516 12.651 -10.183 1.00 1.26 H new ATOM 0 HD2 ARG A 19 2.892 11.928 -12.402 1.00 1.01 H new ATOM 0 HD3 ARG A 19 1.708 13.099 -11.858 1.00 1.01 H new ATOM 0 HE ARG A 19 3.963 14.074 -13.544 1.00 1.65 H new ATOM 0 HH11 ARG A 19 0.511 13.393 -13.134 1.00 1.70 H new ATOM 0 HH12 ARG A 19 0.056 14.213 -14.631 1.00 1.70 H new ATOM 0 HH21 ARG A 19 3.368 15.087 -15.485 1.00 2.72 H new ATOM 0 HH22 ARG A 19 1.668 15.169 -15.957 1.00 2.72 H new ATOM 304 N ASP A 20 2.342 16.561 -8.002 1.00 0.87 N ATOM 305 CA ASP A 20 1.889 17.857 -7.528 1.00 1.08 C ATOM 306 C ASP A 20 1.104 17.707 -6.246 1.00 0.94 C ATOM 307 O ASP A 20 0.772 16.595 -5.829 1.00 1.32 O ATOM 308 CB ASP A 20 1.041 18.591 -8.573 1.00 1.59 C ATOM 309 CG ASP A 20 -0.292 17.925 -8.864 1.00 1.74 C ATOM 310 OD1 ASP A 20 -1.251 18.131 -8.089 1.00 2.16 O ATOM 311 OD2 ASP A 20 -0.402 17.228 -9.892 1.00 1.91 O ATOM 0 H ASP A 20 1.739 15.780 -7.744 1.00 0.87 H new ATOM 0 HA ASP A 20 2.780 18.457 -7.341 1.00 1.08 H new ATOM 0 HB2 ASP A 20 0.859 19.609 -8.229 1.00 1.59 H new ATOM 0 HB3 ASP A 20 1.609 18.665 -9.500 1.00 1.59 H new ATOM 316 N THR A 21 0.807 18.830 -5.627 1.00 0.91 N ATOM 317 CA THR A 21 0.146 18.844 -4.343 1.00 1.05 C ATOM 318 C THR A 21 -0.995 19.854 -4.361 1.00 1.13 C ATOM 319 O THR A 21 -0.831 20.974 -4.846 1.00 1.46 O ATOM 320 CB THR A 21 1.167 19.168 -3.238 1.00 1.45 C ATOM 321 OG1 THR A 21 1.792 20.435 -3.493 1.00 1.82 O ATOM 322 CG2 THR A 21 2.236 18.087 -3.196 1.00 1.70 C ATOM 0 H THR A 21 1.017 19.756 -6.000 1.00 0.91 H new ATOM 0 HA THR A 21 -0.278 17.861 -4.135 1.00 1.05 H new ATOM 0 HB THR A 21 0.644 19.211 -2.282 1.00 1.45 H new ATOM 0 HG1 THR A 21 2.438 20.630 -2.782 1.00 1.82 H new ATOM 0 HG21 THR A 21 2.958 18.319 -2.413 1.00 1.70 H new ATOM 0 HG22 THR A 21 1.771 17.123 -2.987 1.00 1.70 H new ATOM 0 HG23 THR A 21 2.747 18.043 -4.158 1.00 1.70 H new ATOM 330 N SER A 22 -2.155 19.458 -3.856 1.00 1.05 N ATOM 331 CA SER A 22 -3.346 20.272 -4.013 1.00 1.30 C ATOM 332 C SER A 22 -4.195 20.306 -2.744 1.00 1.31 C ATOM 333 O SER A 22 -4.830 19.313 -2.382 1.00 2.15 O ATOM 334 CB SER A 22 -4.177 19.742 -5.186 1.00 1.67 C ATOM 335 OG SER A 22 -5.214 20.641 -5.540 1.00 2.19 O ATOM 0 H SER A 22 -2.294 18.589 -3.341 1.00 1.05 H new ATOM 0 HA SER A 22 -3.025 21.294 -4.214 1.00 1.30 H new ATOM 0 HB2 SER A 22 -3.529 19.577 -6.046 1.00 1.67 H new ATOM 0 HB3 SER A 22 -4.607 18.776 -4.921 1.00 1.67 H new ATOM 0 HG SER A 22 -5.723 20.273 -6.292 1.00 2.19 H new ATOM 341 N GLY A 23 -4.172 21.453 -2.069 1.00 0.96 N ATOM 342 CA GLY A 23 -5.102 21.720 -0.983 1.00 1.10 C ATOM 343 C GLY A 23 -5.019 20.739 0.167 1.00 0.89 C ATOM 344 O GLY A 23 -6.037 20.417 0.784 1.00 1.01 O ATOM 0 H GLY A 23 -3.517 22.212 -2.258 1.00 0.96 H new ATOM 0 HA2 GLY A 23 -4.918 22.724 -0.602 1.00 1.10 H new ATOM 0 HA3 GLY A 23 -6.117 21.711 -1.380 1.00 1.10 H new ATOM 348 N TRP A 24 -3.827 20.247 0.456 1.00 0.79 N ATOM 349 CA TRP A 24 -3.636 19.382 1.607 1.00 0.66 C ATOM 350 C TRP A 24 -2.618 19.982 2.550 1.00 0.67 C ATOM 351 O TRP A 24 -2.246 21.151 2.422 1.00 0.83 O ATOM 352 CB TRP A 24 -3.261 17.951 1.188 1.00 0.71 C ATOM 353 CG TRP A 24 -1.900 17.749 0.607 1.00 0.81 C ATOM 354 CD1 TRP A 24 -0.808 18.545 0.743 1.00 1.34 C ATOM 355 CD2 TRP A 24 -1.488 16.632 -0.175 1.00 0.87 C ATOM 356 NE1 TRP A 24 0.261 17.990 0.107 1.00 1.41 N ATOM 357 CE2 TRP A 24 -0.131 16.816 -0.475 1.00 0.99 C ATOM 358 CE3 TRP A 24 -2.141 15.494 -0.649 1.00 1.36 C ATOM 359 CZ2 TRP A 24 0.589 15.899 -1.227 1.00 1.09 C ATOM 360 CZ3 TRP A 24 -1.426 14.585 -1.397 1.00 1.67 C ATOM 361 CH2 TRP A 24 -0.074 14.795 -1.679 1.00 1.37 C ATOM 0 H TRP A 24 -2.982 20.430 -0.086 1.00 0.79 H new ATOM 0 HA TRP A 24 -4.584 19.308 2.139 1.00 0.66 H new ATOM 0 HB2 TRP A 24 -3.355 17.307 2.062 1.00 0.71 H new ATOM 0 HB3 TRP A 24 -3.995 17.608 0.459 1.00 0.71 H new ATOM 0 HD1 TRP A 24 -0.790 19.483 1.278 1.00 1.34 H new ATOM 0 HE1 TRP A 24 1.201 18.385 0.071 1.00 1.41 H new ATOM 0 HE3 TRP A 24 -3.186 15.329 -0.434 1.00 1.36 H new ATOM 0 HZ2 TRP A 24 1.635 16.053 -1.447 1.00 1.09 H new ATOM 0 HZ3 TRP A 24 -1.917 13.698 -1.770 1.00 1.67 H new ATOM 0 HH2 TRP A 24 0.460 14.065 -2.270 1.00 1.37 H new ATOM 372 N LYS A 25 -2.160 19.172 3.471 1.00 0.60 N ATOM 373 CA LYS A 25 -1.267 19.600 4.512 1.00 0.70 C ATOM 374 C LYS A 25 -0.836 18.411 5.311 1.00 0.61 C ATOM 375 O LYS A 25 -1.629 17.510 5.573 1.00 0.59 O ATOM 376 CB LYS A 25 -1.948 20.590 5.440 1.00 0.89 C ATOM 377 CG LYS A 25 -1.251 21.932 5.480 1.00 1.29 C ATOM 378 CD LYS A 25 0.139 21.843 6.097 1.00 1.62 C ATOM 379 CE LYS A 25 0.100 21.368 7.545 1.00 2.23 C ATOM 380 NZ LYS A 25 -0.779 22.214 8.392 1.00 2.95 N ATOM 0 H LYS A 25 -2.402 18.182 3.517 1.00 0.60 H new ATOM 0 HA LYS A 25 -0.407 20.084 4.049 1.00 0.70 H new ATOM 0 HB2 LYS A 25 -2.980 20.731 5.119 1.00 0.89 H new ATOM 0 HB3 LYS A 25 -1.982 20.173 6.447 1.00 0.89 H new ATOM 0 HG2 LYS A 25 -1.172 22.328 4.468 1.00 1.29 H new ATOM 0 HG3 LYS A 25 -1.856 22.636 6.052 1.00 1.29 H new ATOM 0 HD2 LYS A 25 0.752 21.160 5.509 1.00 1.62 H new ATOM 0 HD3 LYS A 25 0.618 22.821 6.051 1.00 1.62 H new ATOM 0 HE2 LYS A 25 -0.251 20.337 7.577 1.00 2.23 H new ATOM 0 HE3 LYS A 25 1.110 21.374 7.954 1.00 2.23 H new ATOM 0 HZ1 LYS A 25 -0.632 21.974 9.393 1.00 2.95 H new ATOM 0 HZ2 LYS A 25 -0.548 23.216 8.239 1.00 2.95 H new ATOM 0 HZ3 LYS A 25 -1.773 22.045 8.138 1.00 2.95 H new ATOM 394 N VAL A 26 0.415 18.405 5.676 1.00 0.63 N ATOM 395 CA VAL A 26 0.927 17.384 6.556 1.00 0.58 C ATOM 396 C VAL A 26 0.204 17.415 7.867 1.00 0.66 C ATOM 397 O VAL A 26 0.246 18.400 8.604 1.00 0.80 O ATOM 398 CB VAL A 26 2.416 17.528 6.813 1.00 0.64 C ATOM 399 CG1 VAL A 26 3.174 16.774 5.769 1.00 1.22 C ATOM 400 CG2 VAL A 26 2.813 18.975 6.799 1.00 1.56 C ATOM 0 H VAL A 26 1.104 19.096 5.379 1.00 0.63 H new ATOM 0 HA VAL A 26 0.761 16.431 6.053 1.00 0.58 H new ATOM 0 HB VAL A 26 2.650 17.119 7.796 1.00 0.64 H new ATOM 0 HG11 VAL A 26 4.244 16.876 5.951 1.00 1.22 H new ATOM 0 HG12 VAL A 26 2.898 15.720 5.809 1.00 1.22 H new ATOM 0 HG13 VAL A 26 2.934 17.175 4.784 1.00 1.22 H new ATOM 0 HG21 VAL A 26 3.884 19.060 6.985 1.00 1.56 H new ATOM 0 HG22 VAL A 26 2.578 19.407 5.826 1.00 1.56 H new ATOM 0 HG23 VAL A 26 2.266 19.510 7.576 1.00 1.56 H new ATOM 410 N VAL A 27 -0.468 16.337 8.143 1.00 0.62 N ATOM 411 CA VAL A 27 -1.212 16.233 9.358 1.00 0.73 C ATOM 412 C VAL A 27 -0.342 15.603 10.425 1.00 0.76 C ATOM 413 O VAL A 27 -0.539 15.854 11.613 1.00 0.90 O ATOM 414 CB VAL A 27 -2.524 15.429 9.175 1.00 0.75 C ATOM 415 CG1 VAL A 27 -2.239 13.985 8.786 1.00 1.21 C ATOM 416 CG2 VAL A 27 -3.385 15.493 10.430 1.00 1.22 C ATOM 0 H VAL A 27 -0.515 15.516 7.540 1.00 0.62 H new ATOM 0 HA VAL A 27 -1.502 17.238 9.666 1.00 0.73 H new ATOM 0 HB VAL A 27 -3.081 15.890 8.359 1.00 0.75 H new ATOM 0 HG11 VAL A 27 -3.180 13.448 8.665 1.00 1.21 H new ATOM 0 HG12 VAL A 27 -1.686 13.964 7.847 1.00 1.21 H new ATOM 0 HG13 VAL A 27 -1.647 13.508 9.567 1.00 1.21 H new ATOM 0 HG21 VAL A 27 -4.299 14.920 10.274 1.00 1.22 H new ATOM 0 HG22 VAL A 27 -2.833 15.073 11.271 1.00 1.22 H new ATOM 0 HG23 VAL A 27 -3.639 16.531 10.644 1.00 1.22 H new ATOM 426 N LYS A 28 0.649 14.802 10.013 1.00 0.65 N ATOM 427 CA LYS A 28 1.509 14.177 10.996 1.00 0.68 C ATOM 428 C LYS A 28 2.824 13.690 10.389 1.00 0.58 C ATOM 429 O LYS A 28 2.884 13.295 9.225 1.00 0.55 O ATOM 430 CB LYS A 28 0.741 13.039 11.686 1.00 0.77 C ATOM 431 CG LYS A 28 1.593 12.127 12.547 1.00 0.87 C ATOM 432 CD LYS A 28 1.705 10.755 11.919 1.00 1.45 C ATOM 433 CE LYS A 28 0.367 10.030 11.925 1.00 2.02 C ATOM 434 NZ LYS A 28 -0.193 9.892 13.297 1.00 2.41 N ATOM 0 H LYS A 28 0.862 14.584 9.040 1.00 0.65 H new ATOM 0 HA LYS A 28 1.786 14.923 11.741 1.00 0.68 H new ATOM 0 HB2 LYS A 28 -0.043 13.473 12.306 1.00 0.77 H new ATOM 0 HB3 LYS A 28 0.247 12.438 10.923 1.00 0.77 H new ATOM 0 HG2 LYS A 28 2.586 12.558 12.671 1.00 0.87 H new ATOM 0 HG3 LYS A 28 1.155 12.043 13.542 1.00 0.87 H new ATOM 0 HD2 LYS A 28 2.064 10.851 10.894 1.00 1.45 H new ATOM 0 HD3 LYS A 28 2.443 10.164 12.462 1.00 1.45 H new ATOM 0 HE2 LYS A 28 -0.341 10.573 11.299 1.00 2.02 H new ATOM 0 HE3 LYS A 28 0.490 9.041 11.484 1.00 2.02 H new ATOM 0 HZ1 LYS A 28 -0.934 9.162 13.298 1.00 2.41 H new ATOM 0 HZ2 LYS A 28 0.564 9.617 13.955 1.00 2.41 H new ATOM 0 HZ3 LYS A 28 -0.601 10.800 13.598 1.00 2.41 H new ATOM 448 N THR A 29 3.882 13.753 11.181 1.00 0.61 N ATOM 449 CA THR A 29 5.186 13.261 10.775 1.00 0.59 C ATOM 450 C THR A 29 5.894 12.634 11.970 1.00 0.72 C ATOM 451 O THR A 29 5.625 12.992 13.120 1.00 0.88 O ATOM 452 CB THR A 29 6.072 14.393 10.209 1.00 0.75 C ATOM 453 OG1 THR A 29 6.167 15.463 11.160 1.00 1.38 O ATOM 454 CG2 THR A 29 5.525 14.930 8.893 1.00 0.82 C ATOM 0 H THR A 29 3.860 14.146 12.122 1.00 0.61 H new ATOM 0 HA THR A 29 5.029 12.519 9.992 1.00 0.59 H new ATOM 0 HB THR A 29 7.061 13.976 10.021 1.00 0.75 H new ATOM 0 HG1 THR A 29 6.732 16.176 10.795 1.00 1.38 H new ATOM 0 HG21 THR A 29 6.175 15.725 8.526 1.00 0.82 H new ATOM 0 HG22 THR A 29 5.487 14.125 8.159 1.00 0.82 H new ATOM 0 HG23 THR A 29 4.522 15.326 9.050 1.00 0.82 H new ATOM 462 N SER A 30 6.772 11.679 11.703 1.00 0.80 N ATOM 463 CA SER A 30 7.562 11.068 12.762 1.00 1.04 C ATOM 464 C SER A 30 8.989 11.628 12.763 1.00 1.45 C ATOM 465 O SER A 30 9.256 12.635 13.416 1.00 2.37 O ATOM 466 CB SER A 30 7.556 9.546 12.622 1.00 1.24 C ATOM 467 OG SER A 30 6.228 9.048 12.621 1.00 1.93 O ATOM 0 H SER A 30 6.955 11.312 10.769 1.00 0.80 H new ATOM 0 HA SER A 30 7.111 11.315 13.723 1.00 1.04 H new ATOM 0 HB2 SER A 30 8.058 9.259 11.698 1.00 1.24 H new ATOM 0 HB3 SER A 30 8.117 9.098 13.442 1.00 1.24 H new ATOM 0 HG SER A 30 6.236 8.095 12.849 1.00 1.93 H new ATOM 473 N LYS A 31 9.898 11.001 12.022 1.00 1.32 N ATOM 474 CA LYS A 31 11.254 11.533 11.886 1.00 1.71 C ATOM 475 C LYS A 31 11.892 11.046 10.586 1.00 1.47 C ATOM 476 O LYS A 31 13.105 10.873 10.500 1.00 2.02 O ATOM 477 CB LYS A 31 12.118 11.143 13.096 1.00 2.29 C ATOM 478 CG LYS A 31 13.411 11.941 13.200 1.00 2.73 C ATOM 479 CD LYS A 31 14.219 11.571 14.433 1.00 3.59 C ATOM 480 CE LYS A 31 15.465 12.433 14.536 1.00 4.18 C ATOM 481 NZ LYS A 31 16.272 12.126 15.744 1.00 4.55 N ATOM 0 H LYS A 31 9.726 10.135 11.512 1.00 1.32 H new ATOM 0 HA LYS A 31 11.193 12.621 11.852 1.00 1.71 H new ATOM 0 HB2 LYS A 31 11.538 11.285 14.008 1.00 2.29 H new ATOM 0 HB3 LYS A 31 12.359 10.082 13.034 1.00 2.29 H new ATOM 0 HG2 LYS A 31 14.014 11.770 12.308 1.00 2.73 H new ATOM 0 HG3 LYS A 31 13.177 13.005 13.227 1.00 2.73 H new ATOM 0 HD2 LYS A 31 13.608 11.698 15.326 1.00 3.59 H new ATOM 0 HD3 LYS A 31 14.501 10.519 14.387 1.00 3.59 H new ATOM 0 HE2 LYS A 31 16.078 12.287 13.647 1.00 4.18 H new ATOM 0 HE3 LYS A 31 15.175 13.484 14.554 1.00 4.18 H new ATOM 0 HZ1 LYS A 31 17.110 12.741 15.767 1.00 4.55 H new ATOM 0 HZ2 LYS A 31 15.698 12.291 16.596 1.00 4.55 H new ATOM 0 HZ3 LYS A 31 16.573 11.131 15.717 1.00 4.55 H new ATOM 495 N LYS A 32 11.050 10.850 9.576 1.00 0.87 N ATOM 496 CA LYS A 32 11.483 10.399 8.249 1.00 0.69 C ATOM 497 C LYS A 32 10.285 10.248 7.336 1.00 0.51 C ATOM 498 O LYS A 32 10.421 10.225 6.111 1.00 0.59 O ATOM 499 CB LYS A 32 12.236 9.064 8.299 1.00 0.80 C ATOM 500 CG LYS A 32 13.746 9.217 8.200 1.00 1.00 C ATOM 501 CD LYS A 32 14.144 10.047 6.988 1.00 0.93 C ATOM 502 CE LYS A 32 15.611 10.452 7.038 1.00 1.14 C ATOM 503 NZ LYS A 32 15.928 11.271 8.242 1.00 1.42 N ATOM 0 H LYS A 32 10.044 10.999 9.651 1.00 0.87 H new ATOM 0 HA LYS A 32 12.165 11.158 7.866 1.00 0.69 H new ATOM 0 HB2 LYS A 32 11.991 8.552 9.229 1.00 0.80 H new ATOM 0 HB3 LYS A 32 11.889 8.429 7.484 1.00 0.80 H new ATOM 0 HG2 LYS A 32 14.125 9.689 9.106 1.00 1.00 H new ATOM 0 HG3 LYS A 32 14.209 8.232 8.136 1.00 1.00 H new ATOM 0 HD2 LYS A 32 13.955 9.476 6.079 1.00 0.93 H new ATOM 0 HD3 LYS A 32 13.522 10.940 6.939 1.00 0.93 H new ATOM 0 HE2 LYS A 32 16.233 9.557 7.035 1.00 1.14 H new ATOM 0 HE3 LYS A 32 15.861 11.017 6.140 1.00 1.14 H new ATOM 0 HZ1 LYS A 32 16.818 11.786 8.087 1.00 1.42 H new ATOM 0 HZ2 LYS A 32 15.159 11.951 8.412 1.00 1.42 H new ATOM 0 HZ3 LYS A 32 16.028 10.648 9.069 1.00 1.42 H new ATOM 517 N ILE A 33 9.115 10.119 7.950 1.00 0.37 N ATOM 518 CA ILE A 33 7.875 9.947 7.219 1.00 0.33 C ATOM 519 C ILE A 33 6.950 11.133 7.443 1.00 0.36 C ATOM 520 O ILE A 33 7.086 11.864 8.427 1.00 0.46 O ATOM 521 CB ILE A 33 7.167 8.644 7.620 1.00 0.41 C ATOM 522 CG1 ILE A 33 6.909 8.623 9.125 1.00 0.58 C ATOM 523 CG2 ILE A 33 8.009 7.447 7.205 1.00 0.76 C ATOM 524 CD1 ILE A 33 6.170 7.389 9.590 1.00 0.75 C ATOM 0 H ILE A 33 9.004 10.131 8.964 1.00 0.37 H new ATOM 0 HA ILE A 33 8.123 9.889 6.159 1.00 0.33 H new ATOM 0 HB ILE A 33 6.207 8.590 7.107 1.00 0.41 H new ATOM 0 HG12 ILE A 33 7.862 8.686 9.650 1.00 0.58 H new ATOM 0 HG13 ILE A 33 6.334 9.507 9.400 1.00 0.58 H new ATOM 0 HG21 ILE A 33 7.500 6.527 7.493 1.00 0.76 H new ATOM 0 HG22 ILE A 33 8.152 7.460 6.124 1.00 0.76 H new ATOM 0 HG23 ILE A 33 8.979 7.495 7.700 1.00 0.76 H new ATOM 0 HD11 ILE A 33 6.020 7.439 10.668 1.00 0.75 H new ATOM 0 HD12 ILE A 33 5.202 7.335 9.091 1.00 0.75 H new ATOM 0 HD13 ILE A 33 6.754 6.502 9.346 1.00 0.75 H new ATOM 536 N THR A 34 5.993 11.279 6.547 1.00 0.33 N ATOM 537 CA THR A 34 5.254 12.522 6.393 1.00 0.36 C ATOM 538 C THR A 34 3.877 12.260 5.780 1.00 0.36 C ATOM 539 O THR A 34 3.780 11.889 4.614 1.00 0.39 O ATOM 540 CB THR A 34 6.077 13.451 5.461 1.00 0.39 C ATOM 541 OG1 THR A 34 7.322 13.810 6.078 1.00 0.58 O ATOM 542 CG2 THR A 34 5.328 14.706 5.084 1.00 0.56 C ATOM 0 H THR A 34 5.704 10.541 5.905 1.00 0.33 H new ATOM 0 HA THR A 34 5.103 12.987 7.367 1.00 0.36 H new ATOM 0 HB THR A 34 6.263 12.886 4.548 1.00 0.39 H new ATOM 0 HG1 THR A 34 7.829 14.394 5.476 1.00 0.58 H new ATOM 0 HG21 THR A 34 5.950 15.319 4.432 1.00 0.56 H new ATOM 0 HG22 THR A 34 4.409 14.438 4.563 1.00 0.56 H new ATOM 0 HG23 THR A 34 5.083 15.268 5.985 1.00 0.56 H new ATOM 550 N VAL A 35 2.813 12.424 6.567 1.00 0.39 N ATOM 551 CA VAL A 35 1.461 12.260 6.038 1.00 0.40 C ATOM 552 C VAL A 35 0.782 13.599 5.797 1.00 0.40 C ATOM 553 O VAL A 35 0.572 14.376 6.721 1.00 0.44 O ATOM 554 CB VAL A 35 0.543 11.378 6.920 1.00 0.48 C ATOM 555 CG1 VAL A 35 0.916 9.920 6.785 1.00 0.82 C ATOM 556 CG2 VAL A 35 0.585 11.782 8.374 1.00 0.86 C ATOM 0 H VAL A 35 2.860 12.666 7.557 1.00 0.39 H new ATOM 0 HA VAL A 35 1.601 11.741 5.090 1.00 0.40 H new ATOM 0 HB VAL A 35 -0.476 11.528 6.563 1.00 0.48 H new ATOM 0 HG11 VAL A 35 0.260 9.317 7.412 1.00 0.82 H new ATOM 0 HG12 VAL A 35 0.808 9.612 5.745 1.00 0.82 H new ATOM 0 HG13 VAL A 35 1.950 9.778 7.100 1.00 0.82 H new ATOM 0 HG21 VAL A 35 -0.075 11.134 8.951 1.00 0.86 H new ATOM 0 HG22 VAL A 35 1.604 11.688 8.749 1.00 0.86 H new ATOM 0 HG23 VAL A 35 0.256 12.816 8.474 1.00 0.86 H new ATOM 566 N SER A 36 0.453 13.857 4.541 1.00 0.42 N ATOM 567 CA SER A 36 -0.286 15.050 4.153 1.00 0.42 C ATOM 568 C SER A 36 -1.720 14.676 3.816 1.00 0.43 C ATOM 569 O SER A 36 -1.968 13.808 2.979 1.00 0.47 O ATOM 570 CB SER A 36 0.392 15.716 2.963 1.00 0.45 C ATOM 571 OG SER A 36 1.787 15.831 3.173 1.00 1.10 O ATOM 0 H SER A 36 0.691 13.245 3.760 1.00 0.42 H new ATOM 0 HA SER A 36 -0.296 15.757 4.982 1.00 0.42 H new ATOM 0 HB2 SER A 36 0.203 15.135 2.060 1.00 0.45 H new ATOM 0 HB3 SER A 36 -0.038 16.705 2.801 1.00 0.45 H new ATOM 0 HG SER A 36 2.201 16.260 2.395 1.00 1.10 H new ATOM 577 N SER A 37 -2.653 15.326 4.482 1.00 0.45 N ATOM 578 CA SER A 37 -4.053 14.968 4.390 1.00 0.48 C ATOM 579 C SER A 37 -4.866 16.033 3.653 1.00 0.53 C ATOM 580 O SER A 37 -4.722 17.231 3.906 1.00 0.59 O ATOM 581 CB SER A 37 -4.618 14.767 5.796 1.00 0.59 C ATOM 582 OG SER A 37 -4.416 15.925 6.592 1.00 1.27 O ATOM 0 H SER A 37 -2.463 16.115 5.100 1.00 0.45 H new ATOM 0 HA SER A 37 -4.128 14.043 3.819 1.00 0.48 H new ATOM 0 HB2 SER A 37 -5.683 14.543 5.736 1.00 0.59 H new ATOM 0 HB3 SER A 37 -4.138 13.909 6.266 1.00 0.59 H new ATOM 0 HG SER A 37 -4.971 15.869 7.398 1.00 1.27 H new ATOM 588 N LYS A 38 -5.701 15.579 2.737 1.00 0.59 N ATOM 589 CA LYS A 38 -6.684 16.429 2.061 1.00 0.76 C ATOM 590 C LYS A 38 -7.992 15.671 1.925 1.00 0.90 C ATOM 591 O LYS A 38 -7.992 14.450 1.949 1.00 1.69 O ATOM 592 CB LYS A 38 -6.207 16.851 0.665 1.00 0.99 C ATOM 593 CG LYS A 38 -5.767 15.691 -0.215 1.00 1.06 C ATOM 594 CD LYS A 38 -6.054 15.967 -1.684 1.00 1.11 C ATOM 595 CE LYS A 38 -5.708 14.770 -2.557 1.00 1.44 C ATOM 596 NZ LYS A 38 -6.172 14.945 -3.959 1.00 1.91 N ATOM 0 H LYS A 38 -5.723 14.605 2.434 1.00 0.59 H new ATOM 0 HA LYS A 38 -6.818 17.328 2.662 1.00 0.76 H new ATOM 0 HB2 LYS A 38 -7.012 17.389 0.164 1.00 0.99 H new ATOM 0 HB3 LYS A 38 -5.376 17.548 0.772 1.00 0.99 H new ATOM 0 HG2 LYS A 38 -4.700 15.513 -0.078 1.00 1.06 H new ATOM 0 HG3 LYS A 38 -6.284 14.782 0.094 1.00 1.06 H new ATOM 0 HD2 LYS A 38 -7.108 16.217 -1.809 1.00 1.11 H new ATOM 0 HD3 LYS A 38 -5.480 16.834 -2.011 1.00 1.11 H new ATOM 0 HE2 LYS A 38 -4.629 14.617 -2.550 1.00 1.44 H new ATOM 0 HE3 LYS A 38 -6.160 13.872 -2.136 1.00 1.44 H new ATOM 0 HZ1 LYS A 38 -5.915 14.106 -4.517 1.00 1.91 H new ATOM 0 HZ2 LYS A 38 -7.205 15.065 -3.970 1.00 1.91 H new ATOM 0 HZ3 LYS A 38 -5.721 15.787 -4.371 1.00 1.91 H new ATOM 610 N ALA A 39 -9.101 16.382 1.771 1.00 1.16 N ATOM 611 CA ALA A 39 -10.395 15.735 1.585 1.00 1.25 C ATOM 612 C ALA A 39 -10.374 14.864 0.329 1.00 1.19 C ATOM 613 O ALA A 39 -9.995 15.324 -0.752 1.00 1.50 O ATOM 614 CB ALA A 39 -11.497 16.779 1.503 1.00 1.68 C ATOM 0 H ALA A 39 -9.132 17.402 1.771 1.00 1.16 H new ATOM 0 HA ALA A 39 -10.597 15.093 2.442 1.00 1.25 H new ATOM 0 HB1 ALA A 39 -12.458 16.284 1.364 1.00 1.68 H new ATOM 0 HB2 ALA A 39 -11.518 17.359 2.425 1.00 1.68 H new ATOM 0 HB3 ALA A 39 -11.306 17.444 0.660 1.00 1.68 H new ATOM 620 N SER A 40 -10.771 13.600 0.494 1.00 1.11 N ATOM 621 CA SER A 40 -10.652 12.595 -0.557 1.00 1.35 C ATOM 622 C SER A 40 -11.522 12.918 -1.773 1.00 1.53 C ATOM 623 O SER A 40 -11.132 12.635 -2.907 1.00 2.09 O ATOM 624 CB SER A 40 -11.025 11.217 0.000 1.00 1.66 C ATOM 625 OG SER A 40 -10.794 10.192 -0.951 1.00 2.06 O ATOM 0 H SER A 40 -11.182 13.248 1.359 1.00 1.11 H new ATOM 0 HA SER A 40 -9.615 12.594 -0.892 1.00 1.35 H new ATOM 0 HB2 SER A 40 -10.443 11.018 0.900 1.00 1.66 H new ATOM 0 HB3 SER A 40 -12.075 11.214 0.292 1.00 1.66 H new ATOM 0 HG SER A 40 -11.585 10.091 -1.521 1.00 2.06 H new ATOM 631 N ARG A 41 -12.703 13.492 -1.521 1.00 1.87 N ATOM 632 CA ARG A 41 -13.665 13.891 -2.567 1.00 2.15 C ATOM 633 C ARG A 41 -14.341 12.681 -3.220 1.00 1.92 C ATOM 634 O ARG A 41 -15.546 12.697 -3.467 1.00 2.12 O ATOM 635 CB ARG A 41 -13.005 14.751 -3.653 1.00 3.07 C ATOM 636 CG ARG A 41 -12.224 15.939 -3.121 1.00 3.62 C ATOM 637 CD ARG A 41 -13.080 16.864 -2.275 1.00 4.44 C ATOM 638 NE ARG A 41 -12.305 18.006 -1.790 1.00 4.95 N ATOM 639 CZ ARG A 41 -12.733 18.870 -0.871 1.00 5.91 C ATOM 640 NH1 ARG A 41 -13.919 18.712 -0.298 1.00 6.46 N ATOM 641 NH2 ARG A 41 -11.960 19.888 -0.511 1.00 6.61 N ATOM 0 H ARG A 41 -13.026 13.697 -0.576 1.00 1.87 H new ATOM 0 HA ARG A 41 -14.427 14.485 -2.061 1.00 2.15 H new ATOM 0 HB2 ARG A 41 -12.334 14.123 -4.239 1.00 3.07 H new ATOM 0 HB3 ARG A 41 -13.777 15.113 -4.332 1.00 3.07 H new ATOM 0 HG2 ARG A 41 -11.384 15.581 -2.526 1.00 3.62 H new ATOM 0 HG3 ARG A 41 -11.806 16.499 -3.957 1.00 3.62 H new ATOM 0 HD2 ARG A 41 -13.927 17.219 -2.863 1.00 4.44 H new ATOM 0 HD3 ARG A 41 -13.489 16.312 -1.428 1.00 4.44 H new ATOM 0 HE ARG A 41 -11.374 18.150 -2.182 1.00 4.95 H new ATOM 0 HH11 ARG A 41 -14.511 17.924 -0.560 1.00 6.46 H new ATOM 0 HH12 ARG A 41 -14.239 19.379 0.405 1.00 6.46 H new ATOM 0 HH21 ARG A 41 -11.041 20.007 -0.938 1.00 6.61 H new ATOM 0 HH22 ARG A 41 -12.285 20.551 0.192 1.00 6.61 H new ATOM 655 N LYS A 42 -13.567 11.633 -3.488 1.00 1.99 N ATOM 656 CA LYS A 42 -14.097 10.412 -4.094 1.00 2.62 C ATOM 657 C LYS A 42 -14.744 9.542 -3.028 1.00 2.59 C ATOM 658 O LYS A 42 -15.292 8.478 -3.315 1.00 3.13 O ATOM 659 CB LYS A 42 -12.976 9.625 -4.776 1.00 3.24 C ATOM 660 CG LYS A 42 -12.168 10.432 -5.778 1.00 3.85 C ATOM 661 CD LYS A 42 -12.983 10.805 -7.003 1.00 4.70 C ATOM 662 CE LYS A 42 -12.148 11.605 -7.989 1.00 5.56 C ATOM 663 NZ LYS A 42 -10.951 10.850 -8.455 1.00 6.46 N ATOM 0 H LYS A 42 -12.566 11.604 -3.295 1.00 1.99 H new ATOM 0 HA LYS A 42 -14.842 10.692 -4.839 1.00 2.62 H new ATOM 0 HB2 LYS A 42 -12.303 9.237 -4.012 1.00 3.24 H new ATOM 0 HB3 LYS A 42 -13.410 8.764 -5.285 1.00 3.24 H new ATOM 0 HG2 LYS A 42 -11.799 11.339 -5.299 1.00 3.85 H new ATOM 0 HG3 LYS A 42 -11.295 9.857 -6.086 1.00 3.85 H new ATOM 0 HD2 LYS A 42 -13.355 9.901 -7.485 1.00 4.70 H new ATOM 0 HD3 LYS A 42 -13.854 11.387 -6.702 1.00 4.70 H new ATOM 0 HE2 LYS A 42 -12.762 11.875 -8.848 1.00 5.56 H new ATOM 0 HE3 LYS A 42 -11.829 12.536 -7.521 1.00 5.56 H new ATOM 0 HZ1 LYS A 42 -10.546 11.322 -9.288 1.00 6.46 H new ATOM 0 HZ2 LYS A 42 -10.242 10.820 -7.695 1.00 6.46 H new ATOM 0 HZ3 LYS A 42 -11.229 9.880 -8.707 1.00 6.46 H new ATOM 677 N PHE A 43 -14.663 10.016 -1.800 1.00 2.24 N ATOM 678 CA PHE A 43 -15.171 9.322 -0.645 1.00 2.56 C ATOM 679 C PHE A 43 -15.454 10.362 0.414 1.00 2.44 C ATOM 680 O PHE A 43 -14.760 11.381 0.472 1.00 3.00 O ATOM 681 CB PHE A 43 -14.144 8.293 -0.143 1.00 3.06 C ATOM 682 CG PHE A 43 -14.449 7.738 1.222 1.00 3.83 C ATOM 683 CD1 PHE A 43 -15.514 6.874 1.415 1.00 4.52 C ATOM 684 CD2 PHE A 43 -13.675 8.096 2.315 1.00 4.19 C ATOM 685 CE1 PHE A 43 -15.802 6.378 2.672 1.00 5.45 C ATOM 686 CE2 PHE A 43 -13.958 7.605 3.574 1.00 5.06 C ATOM 687 CZ PHE A 43 -15.024 6.744 3.753 1.00 5.65 C ATOM 0 H PHE A 43 -14.232 10.914 -1.579 1.00 2.24 H new ATOM 0 HA PHE A 43 -16.081 8.775 -0.891 1.00 2.56 H new ATOM 0 HB2 PHE A 43 -14.092 7.470 -0.855 1.00 3.06 H new ATOM 0 HB3 PHE A 43 -13.159 8.759 -0.122 1.00 3.06 H new ATOM 0 HD1 PHE A 43 -16.126 6.585 0.574 1.00 4.52 H new ATOM 0 HD2 PHE A 43 -12.840 8.768 2.180 1.00 4.19 H new ATOM 0 HE1 PHE A 43 -16.635 5.704 2.809 1.00 5.45 H new ATOM 0 HE2 PHE A 43 -13.348 7.893 4.417 1.00 5.06 H new ATOM 0 HZ PHE A 43 -15.248 6.358 4.736 1.00 5.65 H new ATOM 697 N HIS A 44 -16.472 10.138 1.223 1.00 2.18 N ATOM 698 CA HIS A 44 -16.834 11.099 2.253 1.00 2.43 C ATOM 699 C HIS A 44 -15.857 11.018 3.423 1.00 1.88 C ATOM 700 O HIS A 44 -16.220 10.646 4.542 1.00 2.06 O ATOM 701 CB HIS A 44 -18.274 10.885 2.728 1.00 3.27 C ATOM 702 CG HIS A 44 -19.296 11.047 1.642 1.00 4.01 C ATOM 703 ND1 HIS A 44 -19.641 12.268 1.103 1.00 4.55 N ATOM 704 CD2 HIS A 44 -20.036 10.127 0.981 1.00 4.75 C ATOM 705 CE1 HIS A 44 -20.546 12.090 0.159 1.00 5.43 C ATOM 706 NE2 HIS A 44 -20.802 10.800 0.066 1.00 5.56 N ATOM 0 H HIS A 44 -17.061 9.306 1.190 1.00 2.18 H new ATOM 0 HA HIS A 44 -16.774 12.098 1.822 1.00 2.43 H new ATOM 0 HB2 HIS A 44 -18.363 9.885 3.152 1.00 3.27 H new ATOM 0 HB3 HIS A 44 -18.492 11.592 3.529 1.00 3.27 H new ATOM 0 HD2 HIS A 44 -20.025 9.060 1.145 1.00 4.75 H new ATOM 0 HE1 HIS A 44 -21.000 12.869 -0.436 1.00 5.43 H new ATOM 0 HE2 HIS A 44 -21.463 10.372 -0.582 1.00 5.56 H new ATOM 715 N GLY A 45 -14.610 11.356 3.134 1.00 1.56 N ATOM 716 CA GLY A 45 -13.555 11.340 4.123 1.00 1.46 C ATOM 717 C GLY A 45 -12.368 12.138 3.646 1.00 1.27 C ATOM 718 O GLY A 45 -12.523 13.065 2.851 1.00 1.42 O ATOM 0 H GLY A 45 -14.305 11.649 2.206 1.00 1.56 H new ATOM 0 HA2 GLY A 45 -13.923 11.752 5.062 1.00 1.46 H new ATOM 0 HA3 GLY A 45 -13.252 10.312 4.323 1.00 1.46 H new ATOM 722 N ASN A 46 -11.182 11.784 4.097 1.00 1.06 N ATOM 723 CA ASN A 46 -9.987 12.483 3.664 1.00 0.90 C ATOM 724 C ASN A 46 -8.897 11.503 3.241 1.00 0.81 C ATOM 725 O ASN A 46 -8.788 10.397 3.766 1.00 0.95 O ATOM 726 CB ASN A 46 -9.480 13.447 4.747 1.00 0.91 C ATOM 727 CG ASN A 46 -9.135 12.780 6.065 1.00 1.32 C ATOM 728 OD1 ASN A 46 -9.723 11.766 6.451 1.00 2.05 O ATOM 729 ND2 ASN A 46 -8.188 13.364 6.778 1.00 1.87 N ATOM 0 H ASN A 46 -11.019 11.024 4.757 1.00 1.06 H new ATOM 0 HA ASN A 46 -10.252 13.080 2.791 1.00 0.90 H new ATOM 0 HB2 ASN A 46 -8.596 13.963 4.372 1.00 0.91 H new ATOM 0 HB3 ASN A 46 -10.241 14.207 4.926 1.00 0.91 H new ATOM 0 HD21 ASN A 46 -7.919 12.977 7.683 1.00 1.87 H new ATOM 0 HD22 ASN A 46 -7.726 14.201 6.423 1.00 1.87 H new ATOM 736 N LEU A 47 -8.118 11.931 2.261 1.00 0.70 N ATOM 737 CA LEU A 47 -7.070 11.122 1.670 1.00 0.62 C ATOM 738 C LEU A 47 -5.731 11.540 2.273 1.00 0.54 C ATOM 739 O LEU A 47 -5.527 12.716 2.580 1.00 0.58 O ATOM 740 CB LEU A 47 -7.069 11.341 0.148 1.00 0.66 C ATOM 741 CG LEU A 47 -6.524 10.194 -0.717 1.00 0.70 C ATOM 742 CD1 LEU A 47 -6.854 10.440 -2.174 1.00 0.77 C ATOM 743 CD2 LEU A 47 -5.020 10.035 -0.563 1.00 0.87 C ATOM 0 H LEU A 47 -8.198 12.861 1.850 1.00 0.70 H new ATOM 0 HA LEU A 47 -7.238 10.064 1.873 1.00 0.62 H new ATOM 0 HB2 LEU A 47 -8.092 11.547 -0.166 1.00 0.66 H new ATOM 0 HB3 LEU A 47 -6.484 12.235 -0.066 1.00 0.66 H new ATOM 0 HG LEU A 47 -7.000 9.275 -0.376 1.00 0.70 H new ATOM 0 HD11 LEU A 47 -6.463 9.622 -2.779 1.00 0.77 H new ATOM 0 HD12 LEU A 47 -7.935 10.498 -2.297 1.00 0.77 H new ATOM 0 HD13 LEU A 47 -6.401 11.378 -2.496 1.00 0.77 H new ATOM 0 HD21 LEU A 47 -4.675 9.214 -1.191 1.00 0.87 H new ATOM 0 HD22 LEU A 47 -4.524 10.957 -0.866 1.00 0.87 H new ATOM 0 HD23 LEU A 47 -4.782 9.820 0.479 1.00 0.87 H new ATOM 755 N TYR A 48 -4.822 10.595 2.435 1.00 0.48 N ATOM 756 CA TYR A 48 -3.542 10.880 3.056 1.00 0.45 C ATOM 757 C TYR A 48 -2.399 10.459 2.145 1.00 0.46 C ATOM 758 O TYR A 48 -2.457 9.400 1.521 1.00 0.54 O ATOM 759 CB TYR A 48 -3.396 10.120 4.372 1.00 0.48 C ATOM 760 CG TYR A 48 -4.358 10.502 5.474 1.00 0.53 C ATOM 761 CD1 TYR A 48 -5.674 10.061 5.447 1.00 0.63 C ATOM 762 CD2 TYR A 48 -3.966 11.333 6.515 1.00 0.64 C ATOM 763 CE1 TYR A 48 -6.570 10.431 6.429 1.00 0.76 C ATOM 764 CE2 TYR A 48 -4.859 11.712 7.498 1.00 0.78 C ATOM 765 CZ TYR A 48 -6.090 11.149 7.548 1.00 0.82 C ATOM 766 OH TYR A 48 -7.054 11.636 8.427 1.00 0.99 O ATOM 0 H TYR A 48 -4.947 9.625 2.145 1.00 0.48 H new ATOM 0 HA TYR A 48 -3.503 11.954 3.238 1.00 0.45 H new ATOM 0 HB2 TYR A 48 -3.514 9.056 4.168 1.00 0.48 H new ATOM 0 HB3 TYR A 48 -2.380 10.263 4.739 1.00 0.48 H new ATOM 0 HD1 TYR A 48 -6.002 9.418 4.644 1.00 0.63 H new ATOM 0 HD2 TYR A 48 -2.947 11.688 6.557 1.00 0.64 H new ATOM 0 HE1 TYR A 48 -7.616 10.177 6.344 1.00 0.76 H new ATOM 0 HE2 TYR A 48 -4.576 12.457 8.227 1.00 0.78 H new ATOM 0 HH TYR A 48 -6.615 12.114 9.161 1.00 0.99 H new ATOM 776 N ARG A 49 -1.372 11.287 2.067 1.00 0.45 N ATOM 777 CA ARG A 49 -0.118 10.869 1.456 1.00 0.48 C ATOM 778 C ARG A 49 0.902 10.609 2.546 1.00 0.40 C ATOM 779 O ARG A 49 1.225 11.520 3.300 1.00 0.48 O ATOM 780 CB ARG A 49 0.466 11.931 0.516 1.00 0.59 C ATOM 781 CG ARG A 49 1.878 11.571 0.037 1.00 0.71 C ATOM 782 CD ARG A 49 2.748 12.797 -0.222 1.00 1.32 C ATOM 783 NE ARG A 49 2.598 13.316 -1.581 1.00 1.69 N ATOM 784 CZ ARG A 49 3.549 13.989 -2.237 1.00 2.18 C ATOM 785 NH1 ARG A 49 4.729 14.226 -1.675 1.00 2.54 N ATOM 786 NH2 ARG A 49 3.325 14.434 -3.462 1.00 2.92 N ATOM 0 H ARG A 49 -1.379 12.246 2.415 1.00 0.45 H new ATOM 0 HA ARG A 49 -0.332 9.973 0.873 1.00 0.48 H new ATOM 0 HB2 ARG A 49 -0.189 12.049 -0.347 1.00 0.59 H new ATOM 0 HB3 ARG A 49 0.493 12.892 1.029 1.00 0.59 H new ATOM 0 HG2 ARG A 49 2.360 10.941 0.785 1.00 0.71 H new ATOM 0 HG3 ARG A 49 1.807 10.983 -0.878 1.00 0.71 H new ATOM 0 HD2 ARG A 49 2.489 13.579 0.492 1.00 1.32 H new ATOM 0 HD3 ARG A 49 3.793 12.540 -0.049 1.00 1.32 H new ATOM 0 HE ARG A 49 1.711 13.154 -2.059 1.00 1.69 H new ATOM 0 HH11 ARG A 49 4.920 13.893 -0.730 1.00 2.54 H new ATOM 0 HH12 ARG A 49 5.444 14.741 -2.189 1.00 2.54 H new ATOM 0 HH21 ARG A 49 2.424 14.264 -3.910 1.00 2.92 H new ATOM 0 HH22 ARG A 49 4.053 14.947 -3.959 1.00 2.92 H new ATOM 800 N VAL A 50 1.413 9.397 2.632 1.00 0.37 N ATOM 801 CA VAL A 50 2.500 9.128 3.548 1.00 0.42 C ATOM 802 C VAL A 50 3.782 9.052 2.744 1.00 0.46 C ATOM 803 O VAL A 50 3.824 8.441 1.678 1.00 0.62 O ATOM 804 CB VAL A 50 2.286 7.852 4.392 1.00 0.63 C ATOM 805 CG1 VAL A 50 2.350 6.588 3.549 1.00 1.29 C ATOM 806 CG2 VAL A 50 3.289 7.794 5.533 1.00 1.33 C ATOM 0 H VAL A 50 1.098 8.594 2.087 1.00 0.37 H new ATOM 0 HA VAL A 50 2.551 9.939 4.274 1.00 0.42 H new ATOM 0 HB VAL A 50 1.281 7.904 4.811 1.00 0.63 H new ATOM 0 HG11 VAL A 50 2.194 5.717 4.186 1.00 1.29 H new ATOM 0 HG12 VAL A 50 1.574 6.621 2.784 1.00 1.29 H new ATOM 0 HG13 VAL A 50 3.328 6.518 3.072 1.00 1.29 H new ATOM 0 HG21 VAL A 50 3.124 6.889 6.117 1.00 1.33 H new ATOM 0 HG22 VAL A 50 4.301 7.785 5.128 1.00 1.33 H new ATOM 0 HG23 VAL A 50 3.163 8.667 6.173 1.00 1.33 H new ATOM 816 N GLU A 51 4.810 9.696 3.238 1.00 0.37 N ATOM 817 CA GLU A 51 5.982 9.958 2.440 1.00 0.37 C ATOM 818 C GLU A 51 7.226 9.963 3.306 1.00 0.38 C ATOM 819 O GLU A 51 7.425 10.859 4.124 1.00 0.56 O ATOM 820 CB GLU A 51 5.820 11.309 1.755 1.00 0.40 C ATOM 821 CG GLU A 51 6.841 11.580 0.673 1.00 0.47 C ATOM 822 CD GLU A 51 7.301 13.017 0.688 1.00 0.52 C ATOM 823 OE1 GLU A 51 6.558 13.886 0.182 1.00 1.07 O ATOM 824 OE2 GLU A 51 8.400 13.286 1.198 1.00 1.02 O ATOM 0 H GLU A 51 4.859 10.050 4.193 1.00 0.37 H new ATOM 0 HA GLU A 51 6.091 9.173 1.692 1.00 0.37 H new ATOM 0 HB2 GLU A 51 4.822 11.366 1.320 1.00 0.40 H new ATOM 0 HB3 GLU A 51 5.886 12.096 2.507 1.00 0.40 H new ATOM 0 HG2 GLU A 51 7.699 10.922 0.809 1.00 0.47 H new ATOM 0 HG3 GLU A 51 6.411 11.346 -0.301 1.00 0.47 H new ATOM 831 N GLY A 52 8.053 8.962 3.125 1.00 0.27 N ATOM 832 CA GLY A 52 9.278 8.872 3.877 1.00 0.29 C ATOM 833 C GLY A 52 10.394 8.333 3.030 1.00 0.25 C ATOM 834 O GLY A 52 10.143 7.637 2.050 1.00 0.29 O ATOM 0 H GLY A 52 7.899 8.200 2.464 1.00 0.27 H new ATOM 0 HA2 GLY A 52 9.549 9.857 4.256 1.00 0.29 H new ATOM 0 HA3 GLY A 52 9.130 8.227 4.743 1.00 0.29 H new ATOM 838 N ILE A 53 11.624 8.660 3.364 1.00 0.24 N ATOM 839 CA ILE A 53 12.734 8.092 2.624 1.00 0.23 C ATOM 840 C ILE A 53 13.283 6.878 3.345 1.00 0.23 C ATOM 841 O ILE A 53 13.607 6.928 4.534 1.00 0.30 O ATOM 842 CB ILE A 53 13.883 9.087 2.336 1.00 0.29 C ATOM 843 CG1 ILE A 53 13.492 10.085 1.246 1.00 0.37 C ATOM 844 CG2 ILE A 53 15.123 8.331 1.888 1.00 0.27 C ATOM 845 CD1 ILE A 53 12.561 11.184 1.687 1.00 0.58 C ATOM 0 H ILE A 53 11.878 9.296 4.119 1.00 0.24 H new ATOM 0 HA ILE A 53 12.323 7.809 1.655 1.00 0.23 H new ATOM 0 HB ILE A 53 14.088 9.634 3.257 1.00 0.29 H new ATOM 0 HG12 ILE A 53 14.400 10.538 0.848 1.00 0.37 H new ATOM 0 HG13 ILE A 53 13.022 9.539 0.428 1.00 0.37 H new ATOM 0 HG21 ILE A 53 15.928 9.038 1.687 1.00 0.27 H new ATOM 0 HG22 ILE A 53 15.433 7.642 2.674 1.00 0.27 H new ATOM 0 HG23 ILE A 53 14.899 7.769 0.981 1.00 0.27 H new ATOM 0 HD11 ILE A 53 12.344 11.838 0.842 1.00 0.58 H new ATOM 0 HD12 ILE A 53 11.633 10.748 2.056 1.00 0.58 H new ATOM 0 HD13 ILE A 53 13.031 11.762 2.482 1.00 0.58 H new ATOM 857 N ILE A 54 13.368 5.789 2.612 1.00 0.24 N ATOM 858 CA ILE A 54 13.923 4.561 3.119 1.00 0.26 C ATOM 859 C ILE A 54 15.319 4.363 2.543 1.00 0.29 C ATOM 860 O ILE A 54 15.481 4.215 1.331 1.00 0.31 O ATOM 861 CB ILE A 54 13.011 3.369 2.768 1.00 0.26 C ATOM 862 CG1 ILE A 54 11.623 3.614 3.354 1.00 0.32 C ATOM 863 CG2 ILE A 54 13.601 2.061 3.286 1.00 0.32 C ATOM 864 CD1 ILE A 54 10.627 2.534 3.033 1.00 0.35 C ATOM 0 H ILE A 54 13.052 5.734 1.644 1.00 0.24 H new ATOM 0 HA ILE A 54 13.992 4.618 4.205 1.00 0.26 H new ATOM 0 HB ILE A 54 12.932 3.282 1.684 1.00 0.26 H new ATOM 0 HG12 ILE A 54 11.708 3.707 4.437 1.00 0.32 H new ATOM 0 HG13 ILE A 54 11.245 4.566 2.981 1.00 0.32 H new ATOM 0 HG21 ILE A 54 12.939 1.235 3.026 1.00 0.32 H new ATOM 0 HG22 ILE A 54 14.579 1.899 2.833 1.00 0.32 H new ATOM 0 HG23 ILE A 54 13.707 2.114 4.370 1.00 0.32 H new ATOM 0 HD11 ILE A 54 9.666 2.780 3.484 1.00 0.35 H new ATOM 0 HD12 ILE A 54 10.511 2.455 1.952 1.00 0.35 H new ATOM 0 HD13 ILE A 54 10.981 1.583 3.430 1.00 0.35 H new ATOM 876 N PRO A 55 16.341 4.436 3.410 1.00 0.36 N ATOM 877 CA PRO A 55 17.756 4.270 3.039 1.00 0.44 C ATOM 878 C PRO A 55 18.081 2.867 2.524 1.00 0.47 C ATOM 879 O PRO A 55 18.897 2.145 3.102 1.00 0.62 O ATOM 880 CB PRO A 55 18.510 4.545 4.348 1.00 0.54 C ATOM 881 CG PRO A 55 17.540 5.276 5.208 1.00 0.53 C ATOM 882 CD PRO A 55 16.189 4.743 4.834 1.00 0.42 C ATOM 0 HA PRO A 55 18.030 4.936 2.221 1.00 0.44 H new ATOM 0 HB2 PRO A 55 18.833 3.617 4.819 1.00 0.54 H new ATOM 0 HB3 PRO A 55 19.405 5.140 4.170 1.00 0.54 H new ATOM 0 HG2 PRO A 55 17.749 5.108 6.265 1.00 0.53 H new ATOM 0 HG3 PRO A 55 17.598 6.351 5.038 1.00 0.53 H new ATOM 0 HD2 PRO A 55 15.930 3.857 5.413 1.00 0.42 H new ATOM 0 HD3 PRO A 55 15.403 5.478 5.007 1.00 0.42 H new ATOM 890 N GLU A 56 17.416 2.493 1.455 1.00 0.43 N ATOM 891 CA GLU A 56 17.677 1.257 0.755 1.00 0.49 C ATOM 892 C GLU A 56 17.716 1.584 -0.724 1.00 0.46 C ATOM 893 O GLU A 56 17.829 2.749 -1.098 1.00 0.60 O ATOM 894 CB GLU A 56 16.550 0.257 1.028 1.00 0.66 C ATOM 895 CG GLU A 56 16.998 -1.180 1.275 1.00 0.77 C ATOM 896 CD GLU A 56 17.981 -1.710 0.254 1.00 1.18 C ATOM 897 OE1 GLU A 56 17.556 -2.028 -0.866 1.00 1.68 O ATOM 898 OE2 GLU A 56 19.183 -1.807 0.566 1.00 1.38 O ATOM 0 H GLU A 56 16.667 3.048 1.041 1.00 0.43 H new ATOM 0 HA GLU A 56 18.617 0.815 1.085 1.00 0.49 H new ATOM 0 HB2 GLU A 56 15.986 0.598 1.896 1.00 0.66 H new ATOM 0 HB3 GLU A 56 15.866 0.266 0.180 1.00 0.66 H new ATOM 0 HG2 GLU A 56 17.451 -1.242 2.264 1.00 0.77 H new ATOM 0 HG3 GLU A 56 16.120 -1.825 1.286 1.00 0.77 H new ATOM 905 N SER A 57 17.624 0.572 -1.552 1.00 0.45 N ATOM 906 CA SER A 57 17.419 0.758 -2.946 1.00 0.45 C ATOM 907 C SER A 57 15.960 0.496 -3.265 1.00 0.43 C ATOM 908 O SER A 57 15.292 -0.307 -2.608 1.00 0.43 O ATOM 909 CB SER A 57 18.330 -0.180 -3.735 1.00 0.53 C ATOM 910 OG SER A 57 19.685 -0.020 -3.346 1.00 1.18 O ATOM 0 H SER A 57 17.691 -0.404 -1.265 1.00 0.45 H new ATOM 0 HA SER A 57 17.666 1.781 -3.229 1.00 0.45 H new ATOM 0 HB2 SER A 57 18.021 -1.213 -3.574 1.00 0.53 H new ATOM 0 HB3 SER A 57 18.228 0.020 -4.802 1.00 0.53 H new ATOM 0 HG SER A 57 20.248 -0.632 -3.864 1.00 1.18 H new ATOM 916 N PRO A 58 15.464 1.170 -4.297 1.00 0.44 N ATOM 917 CA PRO A 58 14.077 1.075 -4.730 1.00 0.43 C ATOM 918 C PRO A 58 13.789 -0.319 -5.269 1.00 0.46 C ATOM 919 O PRO A 58 12.650 -0.675 -5.554 1.00 0.46 O ATOM 920 CB PRO A 58 13.952 2.164 -5.814 1.00 0.44 C ATOM 921 CG PRO A 58 15.194 2.993 -5.679 1.00 0.49 C ATOM 922 CD PRO A 58 16.242 2.077 -5.130 1.00 0.52 C ATOM 0 HA PRO A 58 13.356 1.227 -3.927 1.00 0.43 H new ATOM 0 HB2 PRO A 58 13.878 1.724 -6.808 1.00 0.44 H new ATOM 0 HB3 PRO A 58 13.057 2.768 -5.665 1.00 0.44 H new ATOM 0 HG2 PRO A 58 15.498 3.401 -6.643 1.00 0.49 H new ATOM 0 HG3 PRO A 58 15.028 3.840 -5.013 1.00 0.49 H new ATOM 0 HD2 PRO A 58 16.772 1.547 -5.921 1.00 0.52 H new ATOM 0 HD3 PRO A 58 16.991 2.618 -4.551 1.00 0.52 H new ATOM 930 N ALA A 59 14.857 -1.101 -5.392 1.00 0.50 N ATOM 931 CA ALA A 59 14.766 -2.489 -5.799 1.00 0.54 C ATOM 932 C ALA A 59 14.146 -3.345 -4.712 1.00 0.50 C ATOM 933 O ALA A 59 13.179 -4.044 -4.968 1.00 0.51 O ATOM 934 CB ALA A 59 16.133 -3.026 -6.164 1.00 0.64 C ATOM 0 H ALA A 59 15.809 -0.784 -5.211 1.00 0.50 H new ATOM 0 HA ALA A 59 14.120 -2.533 -6.676 1.00 0.54 H new ATOM 0 HB1 ALA A 59 16.045 -4.069 -6.467 1.00 0.64 H new ATOM 0 HB2 ALA A 59 16.545 -2.443 -6.987 1.00 0.64 H new ATOM 0 HB3 ALA A 59 16.795 -2.953 -5.301 1.00 0.64 H new ATOM 940 N LYS A 60 14.682 -3.286 -3.493 1.00 0.49 N ATOM 941 CA LYS A 60 14.115 -4.070 -2.403 1.00 0.49 C ATOM 942 C LYS A 60 12.763 -3.491 -2.057 1.00 0.42 C ATOM 943 O LYS A 60 11.863 -4.189 -1.599 1.00 0.43 O ATOM 944 CB LYS A 60 15.018 -4.067 -1.168 1.00 0.58 C ATOM 945 CG LYS A 60 14.459 -4.829 0.014 1.00 0.65 C ATOM 946 CD LYS A 60 14.060 -6.247 -0.333 1.00 1.35 C ATOM 947 CE LYS A 60 12.873 -6.640 0.510 1.00 2.45 C ATOM 948 NZ LYS A 60 12.369 -8.010 0.204 1.00 3.30 N ATOM 0 H LYS A 60 15.490 -2.716 -3.241 1.00 0.49 H new ATOM 0 HA LYS A 60 14.020 -5.106 -2.727 1.00 0.49 H new ATOM 0 HB2 LYS A 60 15.984 -4.495 -1.437 1.00 0.58 H new ATOM 0 HB3 LYS A 60 15.199 -3.035 -0.867 1.00 0.58 H new ATOM 0 HG2 LYS A 60 15.203 -4.851 0.810 1.00 0.65 H new ATOM 0 HG3 LYS A 60 13.591 -4.298 0.404 1.00 0.65 H new ATOM 0 HD2 LYS A 60 13.811 -6.320 -1.392 1.00 1.35 H new ATOM 0 HD3 LYS A 60 14.892 -6.928 -0.153 1.00 1.35 H new ATOM 0 HE2 LYS A 60 13.149 -6.587 1.563 1.00 2.45 H new ATOM 0 HE3 LYS A 60 12.070 -5.920 0.354 1.00 2.45 H new ATOM 0 HZ1 LYS A 60 11.544 -8.218 0.802 1.00 3.30 H new ATOM 0 HZ2 LYS A 60 12.094 -8.063 -0.797 1.00 3.30 H new ATOM 0 HZ3 LYS A 60 13.118 -8.706 0.394 1.00 3.30 H new ATOM 962 N LEU A 61 12.633 -2.202 -2.304 1.00 0.37 N ATOM 963 CA LEU A 61 11.371 -1.519 -2.134 1.00 0.35 C ATOM 964 C LEU A 61 10.330 -2.102 -3.084 1.00 0.38 C ATOM 965 O LEU A 61 9.259 -2.517 -2.660 1.00 0.41 O ATOM 966 CB LEU A 61 11.554 -0.024 -2.365 1.00 0.34 C ATOM 967 CG LEU A 61 12.372 0.692 -1.282 1.00 0.31 C ATOM 968 CD1 LEU A 61 12.480 2.171 -1.578 1.00 0.34 C ATOM 969 CD2 LEU A 61 11.722 0.488 0.065 1.00 0.30 C ATOM 0 H LEU A 61 13.395 -1.605 -2.626 1.00 0.37 H new ATOM 0 HA LEU A 61 11.015 -1.663 -1.114 1.00 0.35 H new ATOM 0 HB2 LEU A 61 12.041 0.125 -3.328 1.00 0.34 H new ATOM 0 HB3 LEU A 61 10.572 0.444 -2.429 1.00 0.34 H new ATOM 0 HG LEU A 61 13.376 0.268 -1.272 1.00 0.31 H new ATOM 0 HD11 LEU A 61 13.064 2.657 -0.796 1.00 0.34 H new ATOM 0 HD12 LEU A 61 12.971 2.315 -2.540 1.00 0.34 H new ATOM 0 HD13 LEU A 61 11.483 2.609 -1.611 1.00 0.34 H new ATOM 0 HD21 LEU A 61 12.306 0.998 0.832 1.00 0.30 H new ATOM 0 HD22 LEU A 61 10.711 0.896 0.047 1.00 0.30 H new ATOM 0 HD23 LEU A 61 11.679 -0.578 0.291 1.00 0.30 H new ATOM 981 N SER A 62 10.673 -2.183 -4.362 1.00 0.41 N ATOM 982 CA SER A 62 9.793 -2.789 -5.355 1.00 0.46 C ATOM 983 C SER A 62 9.808 -4.309 -5.228 1.00 0.46 C ATOM 984 O SER A 62 9.062 -5.006 -5.918 1.00 0.50 O ATOM 985 CB SER A 62 10.222 -2.363 -6.764 1.00 0.53 C ATOM 986 OG SER A 62 9.369 -2.901 -7.760 1.00 1.29 O ATOM 0 H SER A 62 11.556 -1.836 -4.737 1.00 0.41 H new ATOM 0 HA SER A 62 8.775 -2.443 -5.178 1.00 0.46 H new ATOM 0 HB2 SER A 62 10.218 -1.275 -6.832 1.00 0.53 H new ATOM 0 HB3 SER A 62 11.246 -2.690 -6.947 1.00 0.53 H new ATOM 0 HG SER A 62 9.035 -3.775 -7.468 1.00 1.29 H new ATOM 992 N ASP A 63 10.658 -4.816 -4.349 1.00 0.44 N ATOM 993 CA ASP A 63 10.734 -6.254 -4.120 1.00 0.48 C ATOM 994 C ASP A 63 9.785 -6.676 -3.005 1.00 0.49 C ATOM 995 O ASP A 63 9.079 -7.679 -3.124 1.00 0.60 O ATOM 996 CB ASP A 63 12.168 -6.676 -3.783 1.00 0.53 C ATOM 997 CG ASP A 63 12.297 -8.161 -3.504 1.00 0.87 C ATOM 998 OD1 ASP A 63 12.244 -8.951 -4.465 1.00 1.10 O ATOM 999 OD2 ASP A 63 12.425 -8.546 -2.324 1.00 1.32 O ATOM 0 H ASP A 63 11.301 -4.260 -3.785 1.00 0.44 H new ATOM 0 HA ASP A 63 10.432 -6.756 -5.039 1.00 0.48 H new ATOM 0 HB2 ASP A 63 12.824 -6.409 -4.612 1.00 0.53 H new ATOM 0 HB3 ASP A 63 12.511 -6.117 -2.912 1.00 0.53 H new ATOM 1004 N PHE A 64 9.750 -5.899 -1.931 1.00 0.44 N ATOM 1005 CA PHE A 64 8.952 -6.263 -0.772 1.00 0.48 C ATOM 1006 C PHE A 64 7.462 -5.993 -1.019 1.00 0.51 C ATOM 1007 O PHE A 64 6.631 -6.859 -0.764 1.00 0.61 O ATOM 1008 CB PHE A 64 9.436 -5.527 0.504 1.00 0.51 C ATOM 1009 CG PHE A 64 8.915 -4.126 0.641 1.00 0.46 C ATOM 1010 CD1 PHE A 64 7.692 -3.898 1.221 1.00 0.59 C ATOM 1011 CD2 PHE A 64 9.667 -3.037 0.222 1.00 0.50 C ATOM 1012 CE1 PHE A 64 7.221 -2.618 1.386 1.00 0.59 C ATOM 1013 CE2 PHE A 64 9.205 -1.756 0.397 1.00 0.50 C ATOM 1014 CZ PHE A 64 7.936 -1.548 0.807 1.00 0.47 C ATOM 0 H PHE A 64 10.260 -5.021 -1.840 1.00 0.44 H new ATOM 0 HA PHE A 64 9.083 -7.333 -0.611 1.00 0.48 H new ATOM 0 HB2 PHE A 64 9.133 -6.102 1.379 1.00 0.51 H new ATOM 0 HB3 PHE A 64 10.526 -5.499 0.502 1.00 0.51 H new ATOM 0 HD1 PHE A 64 7.093 -4.734 1.551 1.00 0.59 H new ATOM 0 HD2 PHE A 64 10.626 -3.199 -0.247 1.00 0.50 H new ATOM 0 HE1 PHE A 64 6.318 -2.434 1.950 1.00 0.59 H new ATOM 0 HE2 PHE A 64 9.856 -0.916 0.207 1.00 0.50 H new ATOM 0 HZ PHE A 64 7.475 -0.578 0.694 1.00 0.47 H new ATOM 1024 N LEU A 65 7.127 -4.822 -1.585 1.00 0.49 N ATOM 1025 CA LEU A 65 5.754 -4.317 -1.558 1.00 0.58 C ATOM 1026 C LEU A 65 4.893 -5.020 -2.579 1.00 0.64 C ATOM 1027 O LEU A 65 3.748 -4.638 -2.798 1.00 0.81 O ATOM 1028 CB LEU A 65 5.725 -2.819 -1.845 1.00 0.66 C ATOM 1029 CG LEU A 65 5.598 -2.448 -3.328 1.00 0.78 C ATOM 1030 CD1 LEU A 65 5.443 -0.966 -3.483 1.00 1.25 C ATOM 1031 CD2 LEU A 65 6.790 -2.922 -4.127 1.00 1.50 C ATOM 0 H LEU A 65 7.790 -4.212 -2.064 1.00 0.49 H new ATOM 0 HA LEU A 65 5.360 -4.510 -0.560 1.00 0.58 H new ATOM 0 HB2 LEU A 65 4.890 -2.376 -1.302 1.00 0.66 H new ATOM 0 HB3 LEU A 65 6.636 -2.370 -1.450 1.00 0.66 H new ATOM 0 HG LEU A 65 4.711 -2.949 -3.715 1.00 0.78 H new ATOM 0 HD11 LEU A 65 5.354 -0.718 -4.541 1.00 1.25 H new ATOM 0 HD12 LEU A 65 4.547 -0.637 -2.957 1.00 1.25 H new ATOM 0 HD13 LEU A 65 6.315 -0.463 -3.065 1.00 1.25 H new ATOM 0 HD21 LEU A 65 6.663 -2.640 -5.172 1.00 1.50 H new ATOM 0 HD22 LEU A 65 7.697 -2.462 -3.735 1.00 1.50 H new ATOM 0 HD23 LEU A 65 6.871 -4.006 -4.051 1.00 1.50 H new ATOM 1043 N TYR A 66 5.476 -6.027 -3.207 1.00 0.58 N ATOM 1044 CA TYR A 66 4.827 -6.808 -4.252 1.00 0.64 C ATOM 1045 C TYR A 66 3.388 -7.246 -3.878 1.00 0.72 C ATOM 1046 O TYR A 66 2.641 -7.736 -4.724 1.00 0.89 O ATOM 1047 CB TYR A 66 5.692 -8.029 -4.575 1.00 0.73 C ATOM 1048 CG TYR A 66 5.358 -8.706 -5.886 1.00 0.88 C ATOM 1049 CD1 TYR A 66 5.380 -8.000 -7.081 1.00 0.82 C ATOM 1050 CD2 TYR A 66 5.011 -10.052 -5.926 1.00 1.27 C ATOM 1051 CE1 TYR A 66 5.065 -8.613 -8.277 1.00 1.01 C ATOM 1052 CE2 TYR A 66 4.697 -10.673 -7.120 1.00 1.47 C ATOM 1053 CZ TYR A 66 4.764 -9.957 -8.298 1.00 1.29 C ATOM 1054 OH TYR A 66 4.409 -10.559 -9.486 1.00 1.52 O ATOM 0 H TYR A 66 6.428 -6.331 -3.004 1.00 0.58 H new ATOM 0 HA TYR A 66 4.731 -6.169 -5.130 1.00 0.64 H new ATOM 0 HB2 TYR A 66 6.738 -7.722 -4.595 1.00 0.73 H new ATOM 0 HB3 TYR A 66 5.588 -8.755 -3.769 1.00 0.73 H new ATOM 0 HD1 TYR A 66 5.648 -6.954 -7.075 1.00 0.82 H new ATOM 0 HD2 TYR A 66 4.986 -10.622 -5.009 1.00 1.27 H new ATOM 0 HE1 TYR A 66 5.055 -8.041 -9.193 1.00 1.01 H new ATOM 0 HE2 TYR A 66 4.401 -11.712 -7.131 1.00 1.47 H new ATOM 0 HH TYR A 66 3.892 -9.929 -10.030 1.00 1.52 H new ATOM 1064 N GLN A 67 3.052 -7.128 -2.585 1.00 0.89 N ATOM 1065 CA GLN A 67 1.685 -7.250 -2.061 1.00 1.13 C ATOM 1066 C GLN A 67 1.366 -8.687 -1.750 1.00 1.10 C ATOM 1067 O GLN A 67 0.729 -8.989 -0.746 1.00 1.76 O ATOM 1068 CB GLN A 67 0.609 -6.663 -2.986 1.00 1.54 C ATOM 1069 CG GLN A 67 0.779 -5.178 -3.282 1.00 2.13 C ATOM 1070 CD GLN A 67 -0.534 -4.407 -3.272 1.00 2.94 C ATOM 1071 OE1 GLN A 67 -1.460 -4.806 -2.410 1.00 3.50 O flip ATOM 1072 NE2 GLN A 67 -0.706 -3.442 -4.014 1.00 3.60 N flip ATOM 0 H GLN A 67 3.741 -6.940 -1.857 1.00 0.89 H new ATOM 0 HA GLN A 67 1.663 -6.655 -1.148 1.00 1.13 H new ATOM 0 HB2 GLN A 67 0.617 -7.212 -3.927 1.00 1.54 H new ATOM 0 HB3 GLN A 67 -0.369 -6.821 -2.532 1.00 1.54 H new ATOM 0 HG2 GLN A 67 1.453 -4.743 -2.545 1.00 2.13 H new ATOM 0 HG3 GLN A 67 1.254 -5.061 -4.256 1.00 2.13 H new ATOM 0 HE21 GLN A 67 0.028 -3.162 -4.665 1.00 3.60 H new ATOM 0 HE22 GLN A 67 -1.582 -2.921 -3.978 1.00 3.60 H new ATOM 1081 N THR A 68 1.839 -9.574 -2.589 1.00 0.83 N ATOM 1082 CA THR A 68 1.551 -10.970 -2.405 1.00 0.93 C ATOM 1083 C THR A 68 2.786 -11.815 -2.667 1.00 1.09 C ATOM 1084 O THR A 68 2.705 -13.005 -2.971 1.00 1.39 O ATOM 1085 CB THR A 68 0.389 -11.400 -3.334 1.00 1.18 C ATOM 1086 OG1 THR A 68 -0.050 -12.730 -3.040 1.00 1.48 O ATOM 1087 CG2 THR A 68 0.822 -11.317 -4.790 1.00 1.29 C ATOM 0 H THR A 68 2.420 -9.355 -3.398 1.00 0.83 H new ATOM 0 HA THR A 68 1.249 -11.128 -1.370 1.00 0.93 H new ATOM 0 HB THR A 68 -0.443 -10.718 -3.161 1.00 1.18 H new ATOM 0 HG1 THR A 68 -0.092 -13.251 -3.869 1.00 1.48 H new ATOM 0 HG21 THR A 68 -0.004 -11.622 -5.433 1.00 1.29 H new ATOM 0 HG22 THR A 68 1.107 -10.292 -5.027 1.00 1.29 H new ATOM 0 HG23 THR A 68 1.673 -11.978 -4.955 1.00 1.29 H new ATOM 1095 N GLY A 69 3.940 -11.199 -2.524 1.00 1.06 N ATOM 1096 CA GLY A 69 5.160 -11.903 -2.805 1.00 1.39 C ATOM 1097 C GLY A 69 5.939 -12.238 -1.568 1.00 1.17 C ATOM 1098 O GLY A 69 6.141 -13.403 -1.233 1.00 1.46 O ATOM 0 H GLY A 69 4.053 -10.232 -2.221 1.00 1.06 H new ATOM 0 HA2 GLY A 69 4.927 -12.823 -3.342 1.00 1.39 H new ATOM 0 HA3 GLY A 69 5.780 -11.296 -3.465 1.00 1.39 H new ATOM 1102 N ASP A 70 6.327 -11.200 -0.873 1.00 0.84 N ATOM 1103 CA ASP A 70 7.281 -11.306 0.220 1.00 0.83 C ATOM 1104 C ASP A 70 6.786 -10.518 1.420 1.00 0.65 C ATOM 1105 O ASP A 70 7.035 -10.864 2.569 1.00 0.61 O ATOM 1106 CB ASP A 70 8.615 -10.746 -0.277 1.00 1.12 C ATOM 1107 CG ASP A 70 9.688 -10.619 0.784 1.00 1.45 C ATOM 1108 OD1 ASP A 70 10.030 -11.652 1.404 1.00 2.19 O ATOM 1109 OD2 ASP A 70 10.178 -9.495 1.013 1.00 1.68 O ATOM 0 H ASP A 70 5.994 -10.251 -1.043 1.00 0.84 H new ATOM 0 HA ASP A 70 7.400 -12.344 0.530 1.00 0.83 H new ATOM 0 HB2 ASP A 70 8.988 -11.389 -1.075 1.00 1.12 H new ATOM 0 HB3 ASP A 70 8.439 -9.763 -0.715 1.00 1.12 H new ATOM 1114 N ARG A 71 5.963 -9.528 1.129 1.00 0.60 N ATOM 1115 CA ARG A 71 5.673 -8.468 2.072 1.00 0.51 C ATOM 1116 C ARG A 71 4.867 -9.017 3.219 1.00 0.43 C ATOM 1117 O ARG A 71 5.074 -8.656 4.362 1.00 0.49 O ATOM 1118 CB ARG A 71 4.896 -7.331 1.402 1.00 0.59 C ATOM 1119 CG ARG A 71 3.577 -7.785 0.833 1.00 0.83 C ATOM 1120 CD ARG A 71 2.477 -6.798 1.136 1.00 0.87 C ATOM 1121 NE ARG A 71 2.739 -6.036 2.359 1.00 1.77 N ATOM 1122 CZ ARG A 71 2.411 -4.759 2.547 1.00 2.46 C ATOM 1123 NH1 ARG A 71 1.899 -4.040 1.554 1.00 2.69 N ATOM 1124 NH2 ARG A 71 2.597 -4.212 3.737 1.00 3.38 N ATOM 0 H ARG A 71 5.479 -9.437 0.236 1.00 0.60 H new ATOM 0 HA ARG A 71 6.619 -8.070 2.439 1.00 0.51 H new ATOM 0 HB2 ARG A 71 4.720 -6.539 2.130 1.00 0.59 H new ATOM 0 HB3 ARG A 71 5.503 -6.902 0.605 1.00 0.59 H new ATOM 0 HG2 ARG A 71 3.668 -7.910 -0.246 1.00 0.83 H new ATOM 0 HG3 ARG A 71 3.317 -8.760 1.246 1.00 0.83 H new ATOM 0 HD2 ARG A 71 2.367 -6.110 0.298 1.00 0.87 H new ATOM 0 HD3 ARG A 71 1.531 -7.330 1.237 1.00 0.87 H new ATOM 0 HE ARG A 71 3.208 -6.520 3.125 1.00 1.77 H new ATOM 0 HH11 ARG A 71 1.754 -4.465 0.638 1.00 2.69 H new ATOM 0 HH12 ARG A 71 1.651 -3.063 1.707 1.00 2.69 H new ATOM 0 HH21 ARG A 71 2.988 -4.767 4.498 1.00 3.38 H new ATOM 0 HH22 ARG A 71 2.350 -3.235 3.893 1.00 3.38 H new ATOM 1138 N ILE A 72 3.975 -9.936 2.893 1.00 0.44 N ATOM 1139 CA ILE A 72 3.074 -10.495 3.874 1.00 0.44 C ATOM 1140 C ILE A 72 3.809 -11.490 4.747 1.00 0.54 C ATOM 1141 O ILE A 72 3.387 -11.778 5.862 1.00 0.64 O ATOM 1142 CB ILE A 72 1.874 -11.223 3.228 1.00 0.45 C ATOM 1143 CG1 ILE A 72 2.349 -12.442 2.457 1.00 0.62 C ATOM 1144 CG2 ILE A 72 1.091 -10.308 2.314 1.00 0.47 C ATOM 1145 CD1 ILE A 72 2.697 -12.189 1.008 1.00 0.71 C ATOM 0 H ILE A 72 3.859 -10.309 1.951 1.00 0.44 H new ATOM 0 HA ILE A 72 2.698 -9.658 4.462 1.00 0.44 H new ATOM 0 HB ILE A 72 1.211 -11.540 4.033 1.00 0.45 H new ATOM 0 HG12 ILE A 72 3.226 -12.851 2.959 1.00 0.62 H new ATOM 0 HG13 ILE A 72 1.572 -13.205 2.500 1.00 0.62 H new ATOM 0 HG21 ILE A 72 0.256 -10.856 1.879 1.00 0.47 H new ATOM 0 HG22 ILE A 72 0.711 -9.461 2.885 1.00 0.47 H new ATOM 0 HG23 ILE A 72 1.741 -9.946 1.518 1.00 0.47 H new ATOM 0 HD11 ILE A 72 3.025 -13.120 0.545 1.00 0.71 H new ATOM 0 HD12 ILE A 72 1.819 -11.812 0.483 1.00 0.71 H new ATOM 0 HD13 ILE A 72 3.498 -11.453 0.950 1.00 0.71 H new ATOM 1157 N THR A 73 4.925 -12.008 4.241 1.00 0.59 N ATOM 1158 CA THR A 73 5.597 -13.082 4.929 1.00 0.72 C ATOM 1159 C THR A 73 6.447 -12.524 6.058 1.00 0.74 C ATOM 1160 O THR A 73 6.719 -13.214 7.040 1.00 0.88 O ATOM 1161 CB THR A 73 6.467 -13.946 3.984 1.00 0.81 C ATOM 1162 OG1 THR A 73 6.581 -15.272 4.516 1.00 0.97 O ATOM 1163 CG2 THR A 73 7.865 -13.363 3.805 1.00 0.80 C ATOM 0 H THR A 73 5.368 -11.703 3.374 1.00 0.59 H new ATOM 0 HA THR A 73 4.825 -13.735 5.335 1.00 0.72 H new ATOM 0 HB THR A 73 5.978 -13.963 3.010 1.00 0.81 H new ATOM 0 HG1 THR A 73 6.840 -15.890 3.801 1.00 0.97 H new ATOM 0 HG21 THR A 73 8.442 -14.000 3.135 1.00 0.80 H new ATOM 0 HG22 THR A 73 7.790 -12.362 3.379 1.00 0.80 H new ATOM 0 HG23 THR A 73 8.363 -13.309 4.773 1.00 0.80 H new ATOM 1171 N TRP A 74 6.869 -11.276 5.909 1.00 0.64 N ATOM 1172 CA TRP A 74 7.644 -10.625 6.962 1.00 0.66 C ATOM 1173 C TRP A 74 6.843 -9.522 7.639 1.00 0.63 C ATOM 1174 O TRP A 74 7.333 -8.863 8.562 1.00 0.75 O ATOM 1175 CB TRP A 74 8.950 -10.055 6.398 1.00 0.66 C ATOM 1176 CG TRP A 74 8.764 -9.193 5.183 1.00 0.59 C ATOM 1177 CD1 TRP A 74 9.074 -9.523 3.900 1.00 0.66 C ATOM 1178 CD2 TRP A 74 8.220 -7.868 5.126 1.00 0.53 C ATOM 1179 NE1 TRP A 74 8.781 -8.489 3.062 1.00 0.65 N ATOM 1180 CE2 TRP A 74 8.254 -7.466 3.782 1.00 0.58 C ATOM 1181 CE3 TRP A 74 7.712 -6.980 6.073 1.00 0.52 C ATOM 1182 CZ2 TRP A 74 7.802 -6.231 3.360 1.00 0.62 C ATOM 1183 CZ3 TRP A 74 7.258 -5.753 5.650 1.00 0.56 C ATOM 1184 CH2 TRP A 74 7.306 -5.386 4.299 1.00 0.61 C ATOM 0 H TRP A 74 6.693 -10.700 5.085 1.00 0.64 H new ATOM 0 HA TRP A 74 7.882 -11.381 7.710 1.00 0.66 H new ATOM 0 HB2 TRP A 74 9.444 -9.470 7.174 1.00 0.66 H new ATOM 0 HB3 TRP A 74 9.617 -10.880 6.147 1.00 0.66 H new ATOM 0 HD1 TRP A 74 9.492 -10.469 3.590 1.00 0.66 H new ATOM 0 HE1 TRP A 74 8.934 -8.485 2.053 1.00 0.65 H new ATOM 0 HE3 TRP A 74 7.676 -7.250 7.118 1.00 0.52 H new ATOM 0 HZ2 TRP A 74 7.842 -5.948 2.319 1.00 0.62 H new ATOM 0 HZ3 TRP A 74 6.857 -5.059 6.373 1.00 0.56 H new ATOM 0 HH2 TRP A 74 6.942 -4.414 4.000 1.00 0.61 H new ATOM 1195 N ASP A 75 5.612 -9.335 7.181 1.00 0.55 N ATOM 1196 CA ASP A 75 4.797 -8.191 7.585 1.00 0.58 C ATOM 1197 C ASP A 75 4.412 -8.240 9.057 1.00 0.58 C ATOM 1198 O ASP A 75 4.694 -9.205 9.771 1.00 0.73 O ATOM 1199 CB ASP A 75 3.532 -8.114 6.737 1.00 0.83 C ATOM 1200 CG ASP A 75 3.060 -6.686 6.547 1.00 1.44 C ATOM 1201 OD1 ASP A 75 2.473 -6.115 7.498 1.00 1.44 O ATOM 1202 OD2 ASP A 75 3.286 -6.127 5.452 1.00 2.19 O ATOM 0 H ASP A 75 5.151 -9.965 6.524 1.00 0.55 H new ATOM 0 HA ASP A 75 5.408 -7.302 7.429 1.00 0.58 H new ATOM 0 HB2 ASP A 75 3.721 -8.566 5.763 1.00 0.83 H new ATOM 0 HB3 ASP A 75 2.742 -8.697 7.211 1.00 0.83 H new ATOM 1207 N LYS A 76 3.742 -7.184 9.485 1.00 0.58 N ATOM 1208 CA LYS A 76 3.386 -6.991 10.874 1.00 0.65 C ATOM 1209 C LYS A 76 1.904 -6.674 11.032 1.00 0.62 C ATOM 1210 O LYS A 76 1.356 -6.765 12.130 1.00 0.75 O ATOM 1211 CB LYS A 76 4.223 -5.866 11.469 1.00 0.88 C ATOM 1212 CG LYS A 76 4.528 -4.724 10.501 1.00 0.78 C ATOM 1213 CD LYS A 76 3.355 -3.788 10.337 1.00 1.63 C ATOM 1214 CE LYS A 76 3.240 -2.848 11.520 1.00 1.97 C ATOM 1215 NZ LYS A 76 2.275 -3.333 12.540 1.00 3.19 N ATOM 0 H LYS A 76 3.429 -6.432 8.871 1.00 0.58 H new ATOM 0 HA LYS A 76 3.588 -7.920 11.406 1.00 0.65 H new ATOM 0 HB2 LYS A 76 3.701 -5.461 12.336 1.00 0.88 H new ATOM 0 HB3 LYS A 76 5.164 -6.282 11.829 1.00 0.88 H new ATOM 0 HG2 LYS A 76 5.390 -4.164 10.863 1.00 0.78 H new ATOM 0 HG3 LYS A 76 4.801 -5.136 9.529 1.00 0.78 H new ATOM 0 HD2 LYS A 76 3.471 -3.211 9.420 1.00 1.63 H new ATOM 0 HD3 LYS A 76 2.436 -4.365 10.236 1.00 1.63 H new ATOM 0 HE2 LYS A 76 4.220 -2.727 11.981 1.00 1.97 H new ATOM 0 HE3 LYS A 76 2.929 -1.864 11.169 1.00 1.97 H new ATOM 0 HZ1 LYS A 76 1.885 -2.522 13.062 1.00 3.19 H new ATOM 0 HZ2 LYS A 76 1.502 -3.847 12.070 1.00 3.19 H new ATOM 0 HZ3 LYS A 76 2.761 -3.970 13.203 1.00 3.19 H new ATOM 1229 N SER A 77 1.267 -6.277 9.943 1.00 0.61 N ATOM 1230 CA SER A 77 -0.153 -5.981 9.953 1.00 0.72 C ATOM 1231 C SER A 77 -0.825 -6.706 8.807 1.00 0.61 C ATOM 1232 O SER A 77 -1.876 -6.300 8.314 1.00 0.65 O ATOM 1233 CB SER A 77 -0.396 -4.472 9.859 1.00 0.91 C ATOM 1234 OG SER A 77 0.058 -3.809 11.032 1.00 1.58 O ATOM 0 H SER A 77 1.716 -6.152 9.036 1.00 0.61 H new ATOM 0 HA SER A 77 -0.582 -6.326 10.894 1.00 0.72 H new ATOM 0 HB2 SER A 77 0.120 -4.070 8.987 1.00 0.91 H new ATOM 0 HB3 SER A 77 -1.459 -4.279 9.717 1.00 0.91 H new ATOM 0 HG SER A 77 -0.106 -2.847 10.948 1.00 1.58 H new ATOM 1240 N LEU A 78 -0.199 -7.785 8.378 1.00 0.54 N ATOM 1241 CA LEU A 78 -0.766 -8.602 7.306 1.00 0.50 C ATOM 1242 C LEU A 78 -1.121 -10.002 7.775 1.00 0.53 C ATOM 1243 O LEU A 78 -1.150 -10.275 8.975 1.00 0.71 O ATOM 1244 CB LEU A 78 0.171 -8.673 6.113 1.00 0.45 C ATOM 1245 CG LEU A 78 0.172 -7.427 5.238 1.00 0.45 C ATOM 1246 CD1 LEU A 78 1.014 -7.667 4.008 1.00 0.49 C ATOM 1247 CD2 LEU A 78 -1.247 -7.047 4.845 1.00 0.51 C ATOM 0 H LEU A 78 0.692 -8.119 8.746 1.00 0.54 H new ATOM 0 HA LEU A 78 -1.689 -8.111 6.999 1.00 0.50 H new ATOM 0 HB2 LEU A 78 1.185 -8.850 6.473 1.00 0.45 H new ATOM 0 HB3 LEU A 78 -0.105 -9.532 5.501 1.00 0.45 H new ATOM 0 HG LEU A 78 0.600 -6.600 5.805 1.00 0.45 H new ATOM 0 HD11 LEU A 78 1.011 -6.772 3.385 1.00 0.49 H new ATOM 0 HD12 LEU A 78 2.036 -7.898 4.306 1.00 0.49 H new ATOM 0 HD13 LEU A 78 0.603 -8.504 3.443 1.00 0.49 H new ATOM 0 HD21 LEU A 78 -1.225 -6.154 4.220 1.00 0.51 H new ATOM 0 HD22 LEU A 78 -1.703 -7.867 4.290 1.00 0.51 H new ATOM 0 HD23 LEU A 78 -1.832 -6.847 5.743 1.00 0.51 H new ATOM 1259 N GLN A 79 -1.391 -10.883 6.810 1.00 0.46 N ATOM 1260 CA GLN A 79 -1.990 -12.172 7.102 1.00 0.50 C ATOM 1261 C GLN A 79 -1.800 -13.169 5.960 1.00 0.48 C ATOM 1262 O GLN A 79 -0.971 -14.070 6.046 1.00 0.55 O ATOM 1263 CB GLN A 79 -3.485 -11.990 7.372 1.00 0.56 C ATOM 1264 CG GLN A 79 -3.870 -12.051 8.835 1.00 0.55 C ATOM 1265 CD GLN A 79 -3.799 -13.460 9.390 1.00 1.03 C ATOM 1266 OE1 GLN A 79 -2.764 -13.893 9.894 1.00 1.66 O ATOM 1267 NE2 GLN A 79 -4.901 -14.186 9.301 1.00 1.73 N ATOM 0 H GLN A 79 -1.202 -10.721 5.821 1.00 0.46 H new ATOM 0 HA GLN A 79 -1.489 -12.576 7.982 1.00 0.50 H new ATOM 0 HB2 GLN A 79 -3.800 -11.029 6.966 1.00 0.56 H new ATOM 0 HB3 GLN A 79 -4.035 -12.760 6.832 1.00 0.56 H new ATOM 0 HG2 GLN A 79 -3.209 -11.403 9.410 1.00 0.55 H new ATOM 0 HG3 GLN A 79 -4.882 -11.665 8.959 1.00 0.55 H new ATOM 0 HE21 GLN A 79 -5.739 -13.790 8.876 1.00 1.73 H new ATOM 0 HE22 GLN A 79 -4.912 -15.142 9.658 1.00 1.73 H new ATOM 1276 N VAL A 80 -2.557 -12.993 4.876 1.00 0.41 N ATOM 1277 CA VAL A 80 -2.658 -14.031 3.849 1.00 0.43 C ATOM 1278 C VAL A 80 -2.645 -13.438 2.441 1.00 0.39 C ATOM 1279 O VAL A 80 -3.479 -12.605 2.100 1.00 0.45 O ATOM 1280 CB VAL A 80 -3.953 -14.863 4.017 1.00 0.48 C ATOM 1281 CG1 VAL A 80 -3.961 -16.046 3.061 1.00 0.78 C ATOM 1282 CG2 VAL A 80 -4.130 -15.330 5.459 1.00 0.74 C ATOM 0 H VAL A 80 -3.103 -12.152 4.687 1.00 0.41 H new ATOM 0 HA VAL A 80 -1.787 -14.674 3.977 1.00 0.43 H new ATOM 0 HB VAL A 80 -4.797 -14.218 3.772 1.00 0.48 H new ATOM 0 HG11 VAL A 80 -4.880 -16.617 3.196 1.00 0.78 H new ATOM 0 HG12 VAL A 80 -3.906 -15.684 2.034 1.00 0.78 H new ATOM 0 HG13 VAL A 80 -3.103 -16.686 3.267 1.00 0.78 H new ATOM 0 HG21 VAL A 80 -5.048 -15.911 5.543 1.00 0.74 H new ATOM 0 HG22 VAL A 80 -3.281 -15.949 5.748 1.00 0.74 H new ATOM 0 HG23 VAL A 80 -4.188 -14.463 6.118 1.00 0.74 H new ATOM 1292 N TYR A 81 -1.685 -13.868 1.638 1.00 0.42 N ATOM 1293 CA TYR A 81 -1.578 -13.458 0.248 1.00 0.46 C ATOM 1294 C TYR A 81 -2.212 -14.476 -0.700 1.00 0.51 C ATOM 1295 O TYR A 81 -2.329 -15.655 -0.370 1.00 0.78 O ATOM 1296 CB TYR A 81 -0.107 -13.322 -0.103 1.00 0.74 C ATOM 1297 CG TYR A 81 0.639 -14.649 -0.107 1.00 1.91 C ATOM 1298 CD1 TYR A 81 0.987 -15.281 1.083 1.00 3.05 C ATOM 1299 CD2 TYR A 81 0.990 -15.269 -1.300 1.00 2.02 C ATOM 1300 CE1 TYR A 81 1.660 -16.487 1.083 1.00 4.21 C ATOM 1301 CE2 TYR A 81 1.662 -16.476 -1.308 1.00 3.15 C ATOM 1302 CZ TYR A 81 1.995 -17.081 -0.115 1.00 4.24 C ATOM 1303 OH TYR A 81 2.665 -18.283 -0.121 1.00 5.40 O ATOM 0 H TYR A 81 -0.954 -14.515 1.934 1.00 0.42 H new ATOM 0 HA TYR A 81 -2.107 -12.512 0.132 1.00 0.46 H new ATOM 0 HB2 TYR A 81 -0.017 -12.860 -1.086 1.00 0.74 H new ATOM 0 HB3 TYR A 81 0.368 -12.649 0.610 1.00 0.74 H new ATOM 0 HD1 TYR A 81 0.726 -14.820 2.024 1.00 3.05 H new ATOM 0 HD2 TYR A 81 0.733 -14.799 -2.238 1.00 2.02 H new ATOM 0 HE1 TYR A 81 1.922 -16.962 2.017 1.00 4.21 H new ATOM 0 HE2 TYR A 81 1.925 -16.944 -2.245 1.00 3.15 H new ATOM 0 HH TYR A 81 2.824 -18.564 -1.046 1.00 5.40 H new ATOM 1313 N ASN A 82 -2.641 -13.988 -1.857 1.00 0.42 N ATOM 1314 CA ASN A 82 -3.039 -14.836 -2.979 1.00 0.46 C ATOM 1315 C ASN A 82 -3.048 -14.013 -4.262 1.00 0.44 C ATOM 1316 O ASN A 82 -3.869 -13.109 -4.416 1.00 0.45 O ATOM 1317 CB ASN A 82 -4.427 -15.461 -2.777 1.00 0.50 C ATOM 1318 CG ASN A 82 -4.378 -16.868 -2.208 1.00 0.93 C ATOM 1319 OD1 ASN A 82 -3.391 -17.590 -2.367 1.00 1.69 O ATOM 1320 ND2 ASN A 82 -5.465 -17.283 -1.578 1.00 1.40 N ATOM 0 H ASN A 82 -2.724 -12.989 -2.047 1.00 0.42 H new ATOM 0 HA ASN A 82 -2.314 -15.647 -3.044 1.00 0.46 H new ATOM 0 HB2 ASN A 82 -5.009 -14.827 -2.108 1.00 0.50 H new ATOM 0 HB3 ASN A 82 -4.951 -15.482 -3.733 1.00 0.50 H new ATOM 0 HD21 ASN A 82 -5.507 -18.231 -1.203 1.00 1.40 H new ATOM 0 HD22 ASN A 82 -6.261 -16.655 -1.467 1.00 1.40 H new ATOM 1327 N MET A 83 -2.120 -14.296 -5.167 1.00 0.47 N ATOM 1328 CA MET A 83 -2.124 -13.654 -6.475 1.00 0.48 C ATOM 1329 C MET A 83 -3.279 -14.232 -7.284 1.00 0.47 C ATOM 1330 O MET A 83 -3.243 -15.398 -7.677 1.00 0.57 O ATOM 1331 CB MET A 83 -0.786 -13.885 -7.192 1.00 0.58 C ATOM 1332 CG MET A 83 -0.466 -12.842 -8.259 1.00 0.63 C ATOM 1333 SD MET A 83 1.142 -13.100 -9.031 1.00 1.66 S ATOM 1334 CE MET A 83 2.227 -13.052 -7.607 1.00 2.05 C ATOM 0 H MET A 83 -1.360 -14.961 -5.021 1.00 0.47 H new ATOM 0 HA MET A 83 -2.253 -12.577 -6.364 1.00 0.48 H new ATOM 0 HB2 MET A 83 0.015 -13.891 -6.452 1.00 0.58 H new ATOM 0 HB3 MET A 83 -0.799 -14.872 -7.655 1.00 0.58 H new ATOM 0 HG2 MET A 83 -1.240 -12.865 -9.026 1.00 0.63 H new ATOM 0 HG3 MET A 83 -0.493 -11.849 -7.809 1.00 0.63 H new ATOM 0 HE1 MET A 83 3.256 -13.215 -7.928 1.00 2.05 H new ATOM 0 HE2 MET A 83 2.148 -12.079 -7.122 1.00 2.05 H new ATOM 0 HE3 MET A 83 1.938 -13.832 -6.903 1.00 2.05 H new ATOM 1344 N VAL A 84 -4.304 -13.419 -7.515 1.00 0.38 N ATOM 1345 CA VAL A 84 -5.550 -13.909 -8.101 1.00 0.39 C ATOM 1346 C VAL A 84 -5.495 -13.882 -9.623 1.00 0.42 C ATOM 1347 O VAL A 84 -5.082 -14.851 -10.257 1.00 0.64 O ATOM 1348 CB VAL A 84 -6.790 -13.108 -7.616 1.00 0.38 C ATOM 1349 CG1 VAL A 84 -7.476 -13.787 -6.441 1.00 0.55 C ATOM 1350 CG2 VAL A 84 -6.407 -11.695 -7.224 1.00 0.42 C ATOM 0 H VAL A 84 -4.299 -12.420 -7.307 1.00 0.38 H new ATOM 0 HA VAL A 84 -5.658 -14.939 -7.762 1.00 0.39 H new ATOM 0 HB VAL A 84 -7.488 -13.073 -8.453 1.00 0.38 H new ATOM 0 HG11 VAL A 84 -8.338 -13.196 -6.132 1.00 0.55 H new ATOM 0 HG12 VAL A 84 -7.806 -14.782 -6.738 1.00 0.55 H new ATOM 0 HG13 VAL A 84 -6.776 -13.870 -5.610 1.00 0.55 H new ATOM 0 HG21 VAL A 84 -7.294 -11.157 -6.889 1.00 0.42 H new ATOM 0 HG22 VAL A 84 -5.675 -11.727 -6.417 1.00 0.42 H new ATOM 0 HG23 VAL A 84 -5.976 -11.183 -8.084 1.00 0.42 H new ATOM 1360 N HIS A 85 -5.884 -12.762 -10.205 1.00 0.30 N ATOM 1361 CA HIS A 85 -5.928 -12.638 -11.644 1.00 0.31 C ATOM 1362 C HIS A 85 -4.896 -11.637 -12.112 1.00 0.32 C ATOM 1363 O HIS A 85 -4.863 -10.496 -11.655 1.00 0.38 O ATOM 1364 CB HIS A 85 -7.328 -12.226 -12.109 1.00 0.37 C ATOM 1365 CG HIS A 85 -7.453 -12.061 -13.595 1.00 0.80 C ATOM 1366 ND1 HIS A 85 -7.063 -13.024 -14.499 1.00 1.36 N ATOM 1367 CD2 HIS A 85 -7.920 -11.027 -14.332 1.00 1.71 C ATOM 1368 CE1 HIS A 85 -7.288 -12.593 -15.724 1.00 1.75 C ATOM 1369 NE2 HIS A 85 -7.806 -11.383 -15.651 1.00 1.96 N ATOM 0 H HIS A 85 -6.174 -11.925 -9.699 1.00 0.30 H new ATOM 0 HA HIS A 85 -5.697 -13.608 -12.083 1.00 0.31 H new ATOM 0 HB2 HIS A 85 -8.046 -12.975 -11.775 1.00 0.37 H new ATOM 0 HB3 HIS A 85 -7.599 -11.287 -11.625 1.00 0.37 H new ATOM 0 HD2 HIS A 85 -8.310 -10.094 -13.952 1.00 1.71 H new ATOM 0 HE1 HIS A 85 -7.083 -13.139 -16.633 1.00 1.75 H new ATOM 0 HE2 HIS A 85 -8.078 -10.805 -16.447 1.00 1.96 H new ATOM 1378 N ARG A 86 -4.046 -12.077 -13.008 1.00 0.34 N ATOM 1379 CA ARG A 86 -3.023 -11.221 -13.575 1.00 0.36 C ATOM 1380 C ARG A 86 -3.432 -10.832 -14.989 1.00 0.38 C ATOM 1381 O ARG A 86 -3.882 -11.672 -15.770 1.00 0.52 O ATOM 1382 CB ARG A 86 -1.677 -11.935 -13.587 1.00 0.40 C ATOM 1383 CG ARG A 86 -1.497 -12.933 -12.450 1.00 0.45 C ATOM 1384 CD ARG A 86 -0.087 -13.488 -12.463 1.00 0.69 C ATOM 1385 NE ARG A 86 0.068 -14.645 -11.587 1.00 1.15 N ATOM 1386 CZ ARG A 86 1.189 -15.362 -11.502 1.00 1.68 C ATOM 1387 NH1 ARG A 86 2.233 -15.058 -12.270 1.00 1.98 N ATOM 1388 NH2 ARG A 86 1.259 -16.385 -10.660 1.00 2.44 N ATOM 0 H ARG A 86 -4.040 -13.032 -13.365 1.00 0.34 H new ATOM 0 HA ARG A 86 -2.921 -10.323 -12.966 1.00 0.36 H new ATOM 0 HB2 ARG A 86 -1.562 -12.457 -14.537 1.00 0.40 H new ATOM 0 HB3 ARG A 86 -0.882 -11.191 -13.534 1.00 0.40 H new ATOM 0 HG2 ARG A 86 -1.696 -12.448 -11.495 1.00 0.45 H new ATOM 0 HG3 ARG A 86 -2.217 -13.745 -12.551 1.00 0.45 H new ATOM 0 HD2 ARG A 86 0.179 -13.770 -13.482 1.00 0.69 H new ATOM 0 HD3 ARG A 86 0.610 -12.708 -12.156 1.00 0.69 H new ATOM 0 HE ARG A 86 -0.725 -14.920 -11.008 1.00 1.15 H new ATOM 0 HH11 ARG A 86 2.175 -14.277 -12.923 1.00 1.98 H new ATOM 0 HH12 ARG A 86 3.091 -15.606 -12.205 1.00 1.98 H new ATOM 0 HH21 ARG A 86 0.456 -16.623 -10.078 1.00 2.44 H new ATOM 0 HH22 ARG A 86 2.116 -16.934 -10.595 1.00 2.44 H new ATOM 1402 N ILE A 87 -3.303 -9.555 -15.302 1.00 0.35 N ATOM 1403 CA ILE A 87 -3.742 -9.034 -16.589 1.00 0.36 C ATOM 1404 C ILE A 87 -2.569 -9.022 -17.547 1.00 0.39 C ATOM 1405 O ILE A 87 -2.699 -9.328 -18.732 1.00 0.47 O ATOM 1406 CB ILE A 87 -4.309 -7.595 -16.488 1.00 0.38 C ATOM 1407 CG1 ILE A 87 -4.468 -7.133 -15.028 1.00 0.32 C ATOM 1408 CG2 ILE A 87 -5.633 -7.497 -17.223 1.00 0.44 C ATOM 1409 CD1 ILE A 87 -5.447 -7.937 -14.197 1.00 0.27 C ATOM 0 H ILE A 87 -2.896 -8.855 -14.681 1.00 0.35 H new ATOM 0 HA ILE A 87 -4.541 -9.685 -16.945 1.00 0.36 H new ATOM 0 HB ILE A 87 -3.587 -6.928 -16.960 1.00 0.38 H new ATOM 0 HG12 ILE A 87 -3.492 -7.169 -14.545 1.00 0.32 H new ATOM 0 HG13 ILE A 87 -4.786 -6.091 -15.027 1.00 0.32 H new ATOM 0 HG21 ILE A 87 -6.019 -6.481 -17.143 1.00 0.44 H new ATOM 0 HG22 ILE A 87 -5.485 -7.748 -18.273 1.00 0.44 H new ATOM 0 HG23 ILE A 87 -6.347 -8.192 -16.781 1.00 0.44 H new ATOM 0 HD11 ILE A 87 -5.485 -7.531 -13.186 1.00 0.27 H new ATOM 0 HD12 ILE A 87 -6.438 -7.882 -14.648 1.00 0.27 H new ATOM 0 HD13 ILE A 87 -5.123 -8.977 -14.158 1.00 0.27 H new ATOM 1421 N ASP A 88 -1.424 -8.662 -17.007 1.00 0.42 N ATOM 1422 CA ASP A 88 -0.184 -8.657 -17.755 1.00 0.56 C ATOM 1423 C ASP A 88 0.956 -8.915 -16.783 1.00 0.67 C ATOM 1424 O ASP A 88 0.713 -9.238 -15.621 1.00 1.18 O ATOM 1425 CB ASP A 88 0.019 -7.319 -18.477 1.00 0.65 C ATOM 1426 CG ASP A 88 0.821 -7.458 -19.760 1.00 1.16 C ATOM 1427 OD1 ASP A 88 1.879 -8.119 -19.747 1.00 1.86 O ATOM 1428 OD2 ASP A 88 0.383 -6.922 -20.798 1.00 1.35 O ATOM 0 H ASP A 88 -1.326 -8.364 -16.036 1.00 0.42 H new ATOM 0 HA ASP A 88 -0.213 -9.435 -18.518 1.00 0.56 H new ATOM 0 HB2 ASP A 88 -0.954 -6.884 -18.707 1.00 0.65 H new ATOM 0 HB3 ASP A 88 0.528 -6.624 -17.809 1.00 0.65 H new ATOM 1433 N SER A 89 2.183 -8.746 -17.229 1.00 0.65 N ATOM 1434 CA SER A 89 3.331 -8.994 -16.383 1.00 0.70 C ATOM 1435 C SER A 89 3.580 -7.809 -15.448 1.00 0.53 C ATOM 1436 O SER A 89 4.470 -7.855 -14.595 1.00 0.59 O ATOM 1437 CB SER A 89 4.566 -9.261 -17.241 1.00 0.94 C ATOM 1438 OG SER A 89 5.580 -9.913 -16.492 1.00 1.44 O ATOM 0 H SER A 89 2.411 -8.437 -18.174 1.00 0.65 H new ATOM 0 HA SER A 89 3.128 -9.874 -15.773 1.00 0.70 H new ATOM 0 HB2 SER A 89 4.291 -9.876 -18.098 1.00 0.94 H new ATOM 0 HB3 SER A 89 4.949 -8.319 -17.634 1.00 0.94 H new ATOM 0 HG SER A 89 5.630 -9.518 -15.596 1.00 1.44 H new ATOM 1444 N ASP A 90 2.792 -6.750 -15.597 1.00 0.47 N ATOM 1445 CA ASP A 90 2.942 -5.576 -14.756 1.00 0.48 C ATOM 1446 C ASP A 90 1.575 -5.085 -14.311 1.00 0.39 C ATOM 1447 O ASP A 90 1.418 -3.954 -13.854 1.00 0.41 O ATOM 1448 CB ASP A 90 3.718 -4.466 -15.488 1.00 0.73 C ATOM 1449 CG ASP A 90 3.012 -3.934 -16.725 1.00 1.21 C ATOM 1450 OD1 ASP A 90 2.381 -4.731 -17.454 1.00 1.87 O ATOM 1451 OD2 ASP A 90 3.115 -2.718 -16.995 1.00 1.70 O ATOM 0 H ASP A 90 2.047 -6.684 -16.290 1.00 0.47 H new ATOM 0 HA ASP A 90 3.520 -5.849 -13.873 1.00 0.48 H new ATOM 0 HB2 ASP A 90 3.891 -3.641 -14.797 1.00 0.73 H new ATOM 0 HB3 ASP A 90 4.696 -4.850 -15.777 1.00 0.73 H new ATOM 1456 N THR A 91 0.579 -5.959 -14.432 1.00 0.35 N ATOM 1457 CA THR A 91 -0.764 -5.630 -14.039 1.00 0.32 C ATOM 1458 C THR A 91 -1.367 -6.825 -13.322 1.00 0.28 C ATOM 1459 O THR A 91 -1.645 -7.852 -13.941 1.00 0.30 O ATOM 1460 CB THR A 91 -1.623 -5.271 -15.265 1.00 0.36 C ATOM 1461 OG1 THR A 91 -0.803 -4.711 -16.298 1.00 0.46 O ATOM 1462 CG2 THR A 91 -2.695 -4.271 -14.893 1.00 0.35 C ATOM 0 H THR A 91 0.691 -6.903 -14.803 1.00 0.35 H new ATOM 0 HA THR A 91 -0.741 -4.764 -13.378 1.00 0.32 H new ATOM 0 HB THR A 91 -2.094 -6.186 -15.624 1.00 0.36 H new ATOM 0 HG1 THR A 91 -0.713 -3.745 -16.157 1.00 0.46 H new ATOM 0 HG21 THR A 91 -3.290 -4.031 -15.774 1.00 0.35 H new ATOM 0 HG22 THR A 91 -3.340 -4.698 -14.125 1.00 0.35 H new ATOM 0 HG23 THR A 91 -2.229 -3.362 -14.512 1.00 0.35 H new ATOM 1470 N PHE A 92 -1.536 -6.708 -12.020 1.00 0.25 N ATOM 1471 CA PHE A 92 -1.974 -7.833 -11.213 1.00 0.25 C ATOM 1472 C PHE A 92 -3.184 -7.470 -10.395 1.00 0.22 C ATOM 1473 O PHE A 92 -3.651 -6.339 -10.414 1.00 0.21 O ATOM 1474 CB PHE A 92 -0.882 -8.266 -10.238 1.00 0.30 C ATOM 1475 CG PHE A 92 0.455 -8.465 -10.862 1.00 0.32 C ATOM 1476 CD1 PHE A 92 1.321 -7.402 -11.031 1.00 0.33 C ATOM 1477 CD2 PHE A 92 0.841 -9.720 -11.282 1.00 0.39 C ATOM 1478 CE1 PHE A 92 2.555 -7.589 -11.611 1.00 0.38 C ATOM 1479 CE2 PHE A 92 2.069 -9.923 -11.861 1.00 0.43 C ATOM 1480 CZ PHE A 92 2.947 -8.813 -12.016 1.00 0.41 C ATOM 0 H PHE A 92 -1.377 -5.847 -11.497 1.00 0.25 H new ATOM 0 HA PHE A 92 -2.209 -8.642 -11.905 1.00 0.25 H new ATOM 0 HB2 PHE A 92 -0.795 -7.516 -9.452 1.00 0.30 H new ATOM 0 HB3 PHE A 92 -1.188 -9.196 -9.758 1.00 0.30 H new ATOM 0 HD1 PHE A 92 1.027 -6.415 -10.705 1.00 0.33 H new ATOM 0 HD2 PHE A 92 0.168 -10.555 -11.154 1.00 0.39 H new ATOM 0 HE1 PHE A 92 3.216 -6.746 -11.743 1.00 0.38 H new ATOM 0 HE2 PHE A 92 2.364 -10.907 -12.193 1.00 0.43 H new ATOM 0 HZ PHE A 92 3.923 -8.951 -12.456 1.00 0.41 H new ATOM 1490 N ILE A 93 -3.676 -8.453 -9.680 1.00 0.23 N ATOM 1491 CA ILE A 93 -4.654 -8.245 -8.642 1.00 0.23 C ATOM 1492 C ILE A 93 -4.227 -9.090 -7.452 1.00 0.28 C ATOM 1493 O ILE A 93 -3.850 -10.255 -7.623 1.00 0.33 O ATOM 1494 CB ILE A 93 -6.073 -8.647 -9.088 1.00 0.23 C ATOM 1495 CG1 ILE A 93 -6.404 -8.051 -10.452 1.00 0.24 C ATOM 1496 CG2 ILE A 93 -7.098 -8.182 -8.069 1.00 0.26 C ATOM 1497 CD1 ILE A 93 -7.737 -8.505 -10.987 1.00 0.41 C ATOM 0 H ILE A 93 -3.406 -9.429 -9.804 1.00 0.23 H new ATOM 0 HA ILE A 93 -4.696 -7.185 -8.391 1.00 0.23 H new ATOM 0 HB ILE A 93 -6.106 -9.734 -9.163 1.00 0.23 H new ATOM 0 HG12 ILE A 93 -6.400 -6.964 -10.377 1.00 0.24 H new ATOM 0 HG13 ILE A 93 -5.622 -8.324 -11.161 1.00 0.24 H new ATOM 0 HG21 ILE A 93 -8.096 -8.473 -8.398 1.00 0.26 H new ATOM 0 HG22 ILE A 93 -6.886 -8.641 -7.104 1.00 0.26 H new ATOM 0 HG23 ILE A 93 -7.050 -7.097 -7.973 1.00 0.26 H new ATOM 0 HD11 ILE A 93 -7.914 -8.046 -11.960 1.00 0.41 H new ATOM 0 HD12 ILE A 93 -7.736 -9.590 -11.092 1.00 0.41 H new ATOM 0 HD13 ILE A 93 -8.526 -8.208 -10.297 1.00 0.41 H new ATOM 1509 N CYS A 94 -4.232 -8.516 -6.269 1.00 0.36 N ATOM 1510 CA CYS A 94 -3.747 -9.227 -5.102 1.00 0.48 C ATOM 1511 C CYS A 94 -4.852 -9.474 -4.088 1.00 0.39 C ATOM 1512 O CYS A 94 -5.569 -8.559 -3.694 1.00 0.47 O ATOM 1513 CB CYS A 94 -2.609 -8.447 -4.453 1.00 0.74 C ATOM 1514 SG CYS A 94 -2.997 -6.708 -4.165 1.00 2.01 S ATOM 0 H CYS A 94 -4.563 -7.568 -6.088 1.00 0.36 H new ATOM 0 HA CYS A 94 -3.382 -10.199 -5.435 1.00 0.48 H new ATOM 0 HB2 CYS A 94 -2.354 -8.916 -3.503 1.00 0.74 H new ATOM 0 HB3 CYS A 94 -1.726 -8.513 -5.088 1.00 0.74 H new ATOM 0 HG CYS A 94 -2.273 -6.259 -3.183 1.00 2.01 H new ATOM 1520 N HIS A 95 -4.997 -10.727 -3.691 1.00 0.37 N ATOM 1521 CA HIS A 95 -5.848 -11.082 -2.575 1.00 0.36 C ATOM 1522 C HIS A 95 -5.031 -11.037 -1.287 1.00 0.39 C ATOM 1523 O HIS A 95 -4.395 -12.015 -0.899 1.00 0.56 O ATOM 1524 CB HIS A 95 -6.467 -12.470 -2.782 1.00 0.41 C ATOM 1525 CG HIS A 95 -7.240 -12.972 -1.596 1.00 0.50 C ATOM 1526 ND1 HIS A 95 -6.733 -13.877 -0.692 1.00 1.20 N ATOM 1527 CD2 HIS A 95 -8.482 -12.669 -1.162 1.00 1.23 C ATOM 1528 CE1 HIS A 95 -7.634 -14.106 0.246 1.00 0.99 C ATOM 1529 NE2 HIS A 95 -8.706 -13.381 -0.015 1.00 0.95 N ATOM 0 H HIS A 95 -4.530 -11.520 -4.132 1.00 0.37 H new ATOM 0 HA HIS A 95 -6.666 -10.365 -2.505 1.00 0.36 H new ATOM 0 HB2 HIS A 95 -7.129 -12.437 -3.648 1.00 0.41 H new ATOM 0 HB3 HIS A 95 -5.674 -13.180 -3.014 1.00 0.41 H new ATOM 0 HD2 HIS A 95 -9.174 -11.988 -1.635 1.00 1.23 H new ATOM 0 HE1 HIS A 95 -7.514 -14.774 1.086 1.00 0.99 H new ATOM 0 HE2 HIS A 95 -9.558 -13.356 0.545 1.00 0.95 H new ATOM 1538 N THR A 96 -5.040 -9.886 -0.654 1.00 0.35 N ATOM 1539 CA THR A 96 -4.233 -9.638 0.520 1.00 0.38 C ATOM 1540 C THR A 96 -5.092 -9.516 1.777 1.00 0.36 C ATOM 1541 O THR A 96 -5.813 -8.542 1.952 1.00 0.41 O ATOM 1542 CB THR A 96 -3.430 -8.337 0.336 1.00 0.43 C ATOM 1543 OG1 THR A 96 -2.594 -8.442 -0.824 1.00 0.50 O ATOM 1544 CG2 THR A 96 -2.577 -8.046 1.561 1.00 0.47 C ATOM 0 H THR A 96 -5.611 -9.091 -0.941 1.00 0.35 H new ATOM 0 HA THR A 96 -3.559 -10.486 0.642 1.00 0.38 H new ATOM 0 HB THR A 96 -4.134 -7.515 0.205 1.00 0.43 H new ATOM 0 HG1 THR A 96 -2.086 -7.611 -0.938 1.00 0.50 H new ATOM 0 HG21 THR A 96 -2.020 -7.122 1.405 1.00 0.47 H new ATOM 0 HG22 THR A 96 -3.220 -7.939 2.435 1.00 0.47 H new ATOM 0 HG23 THR A 96 -1.879 -8.868 1.722 1.00 0.47 H new ATOM 1552 N ILE A 97 -5.019 -10.506 2.651 1.00 0.38 N ATOM 1553 CA ILE A 97 -5.656 -10.395 3.952 1.00 0.40 C ATOM 1554 C ILE A 97 -4.790 -9.527 4.845 1.00 0.41 C ATOM 1555 O ILE A 97 -3.624 -9.842 5.082 1.00 0.42 O ATOM 1556 CB ILE A 97 -5.864 -11.760 4.644 1.00 0.47 C ATOM 1557 CG1 ILE A 97 -6.654 -12.713 3.746 1.00 0.56 C ATOM 1558 CG2 ILE A 97 -6.583 -11.570 5.979 1.00 0.51 C ATOM 1559 CD1 ILE A 97 -8.093 -12.305 3.544 1.00 1.03 C ATOM 0 H ILE A 97 -4.531 -11.386 2.486 1.00 0.38 H new ATOM 0 HA ILE A 97 -6.642 -9.958 3.793 1.00 0.40 H new ATOM 0 HB ILE A 97 -4.885 -12.202 4.830 1.00 0.47 H new ATOM 0 HG12 ILE A 97 -6.163 -12.773 2.775 1.00 0.56 H new ATOM 0 HG13 ILE A 97 -6.627 -13.713 4.179 1.00 0.56 H new ATOM 0 HG21 ILE A 97 -6.724 -12.539 6.457 1.00 0.51 H new ATOM 0 HG22 ILE A 97 -5.985 -10.929 6.627 1.00 0.51 H new ATOM 0 HG23 ILE A 97 -7.554 -11.106 5.806 1.00 0.51 H new ATOM 0 HD11 ILE A 97 -8.589 -13.028 2.897 1.00 1.03 H new ATOM 0 HD12 ILE A 97 -8.601 -12.273 4.508 1.00 1.03 H new ATOM 0 HD13 ILE A 97 -8.130 -11.319 3.081 1.00 1.03 H new ATOM 1571 N THR A 98 -5.347 -8.432 5.312 1.00 0.49 N ATOM 1572 CA THR A 98 -4.615 -7.521 6.164 1.00 0.56 C ATOM 1573 C THR A 98 -5.176 -7.566 7.572 1.00 0.63 C ATOM 1574 O THR A 98 -6.341 -7.891 7.781 1.00 0.77 O ATOM 1575 CB THR A 98 -4.668 -6.072 5.630 1.00 0.71 C ATOM 1576 OG1 THR A 98 -3.808 -5.220 6.396 1.00 1.38 O ATOM 1577 CG2 THR A 98 -6.082 -5.527 5.688 1.00 0.86 C ATOM 0 H THR A 98 -6.307 -8.150 5.116 1.00 0.49 H new ATOM 0 HA THR A 98 -3.573 -7.840 6.171 1.00 0.56 H new ATOM 0 HB THR A 98 -4.332 -6.090 4.593 1.00 0.71 H new ATOM 0 HG1 THR A 98 -3.165 -5.767 6.894 1.00 1.38 H new ATOM 0 HG21 THR A 98 -6.094 -4.506 5.307 1.00 0.86 H new ATOM 0 HG22 THR A 98 -6.737 -6.150 5.079 1.00 0.86 H new ATOM 0 HG23 THR A 98 -6.432 -5.533 6.720 1.00 0.86 H new ATOM 1585 N GLN A 99 -4.344 -7.241 8.527 1.00 0.59 N ATOM 1586 CA GLN A 99 -4.753 -7.150 9.903 1.00 0.72 C ATOM 1587 C GLN A 99 -4.606 -5.711 10.380 1.00 0.99 C ATOM 1588 O GLN A 99 -3.676 -5.383 11.117 1.00 1.32 O ATOM 1589 CB GLN A 99 -3.933 -8.088 10.785 1.00 0.61 C ATOM 1590 CG GLN A 99 -4.685 -9.348 11.170 1.00 0.80 C ATOM 1591 CD GLN A 99 -3.919 -10.227 12.139 1.00 1.04 C ATOM 1592 OE1 GLN A 99 -3.078 -9.620 12.963 1.00 1.62 O flip ATOM 1593 NE2 GLN A 99 -4.089 -11.445 12.148 1.00 1.82 N flip ATOM 0 H GLN A 99 -3.358 -7.031 8.370 1.00 0.59 H new ATOM 0 HA GLN A 99 -5.797 -7.454 9.978 1.00 0.72 H new ATOM 0 HB2 GLN A 99 -3.018 -8.364 10.261 1.00 0.61 H new ATOM 0 HB3 GLN A 99 -3.635 -7.559 11.690 1.00 0.61 H new ATOM 0 HG2 GLN A 99 -5.640 -9.071 11.617 1.00 0.80 H new ATOM 0 HG3 GLN A 99 -4.908 -9.920 10.269 1.00 0.80 H new ATOM 0 HE21 GLN A 99 -4.747 -11.873 11.496 1.00 1.82 H new ATOM 0 HE22 GLN A 99 -3.572 -12.027 12.807 1.00 1.82 H new ATOM 1602 N SER A 100 -5.528 -4.850 9.951 1.00 1.67 N ATOM 1603 CA SER A 100 -5.507 -3.434 10.323 1.00 2.03 C ATOM 1604 C SER A 100 -5.974 -3.241 11.769 1.00 1.60 C ATOM 1605 O SER A 100 -6.431 -2.169 12.155 1.00 2.41 O ATOM 1606 CB SER A 100 -6.398 -2.638 9.366 1.00 3.23 C ATOM 1607 OG SER A 100 -6.054 -2.897 8.013 1.00 3.91 O ATOM 0 H SER A 100 -6.304 -5.110 9.342 1.00 1.67 H new ATOM 0 HA SER A 100 -4.483 -3.069 10.249 1.00 2.03 H new ATOM 0 HB2 SER A 100 -7.443 -2.899 9.535 1.00 3.23 H new ATOM 0 HB3 SER A 100 -6.298 -1.572 9.572 1.00 3.23 H new ATOM 0 HG SER A 100 -6.096 -2.063 7.499 1.00 3.91 H new ATOM 1613 N PHE A 101 -5.872 -4.319 12.531 1.00 0.91 N ATOM 1614 CA PHE A 101 -6.188 -4.368 13.950 1.00 1.37 C ATOM 1615 C PHE A 101 -5.534 -3.211 14.700 1.00 1.09 C ATOM 1616 O PHE A 101 -4.339 -3.242 14.996 1.00 1.69 O ATOM 1617 CB PHE A 101 -5.680 -5.711 14.490 1.00 2.29 C ATOM 1618 CG PHE A 101 -6.147 -6.080 15.868 1.00 2.99 C ATOM 1619 CD1 PHE A 101 -5.451 -5.657 16.988 1.00 3.67 C ATOM 1620 CD2 PHE A 101 -7.268 -6.876 16.040 1.00 3.48 C ATOM 1621 CE1 PHE A 101 -5.866 -6.018 18.253 1.00 4.71 C ATOM 1622 CE2 PHE A 101 -7.688 -7.238 17.304 1.00 4.58 C ATOM 1623 CZ PHE A 101 -6.985 -6.809 18.412 1.00 5.16 C ATOM 0 H PHE A 101 -5.555 -5.217 12.165 1.00 0.91 H new ATOM 0 HA PHE A 101 -7.264 -4.276 14.095 1.00 1.37 H new ATOM 0 HB2 PHE A 101 -5.986 -6.498 13.800 1.00 2.29 H new ATOM 0 HB3 PHE A 101 -4.590 -5.693 14.489 1.00 2.29 H new ATOM 0 HD1 PHE A 101 -4.574 -5.038 16.870 1.00 3.67 H new ATOM 0 HD2 PHE A 101 -7.819 -7.217 15.176 1.00 3.48 H new ATOM 0 HE1 PHE A 101 -5.315 -5.681 19.119 1.00 4.71 H new ATOM 0 HE2 PHE A 101 -8.565 -7.856 17.426 1.00 4.58 H new ATOM 0 HZ PHE A 101 -7.311 -7.092 19.402 1.00 5.16 H new ATOM 1633 N ALA A 102 -6.326 -2.179 14.960 1.00 1.17 N ATOM 1634 CA ALA A 102 -5.877 -1.036 15.754 1.00 1.07 C ATOM 1635 C ALA A 102 -5.617 -1.442 17.192 1.00 1.42 C ATOM 1636 O ALA A 102 -4.476 -1.506 17.646 1.00 1.98 O ATOM 1637 CB ALA A 102 -6.893 0.103 15.702 1.00 0.98 C ATOM 0 H ALA A 102 -7.289 -2.107 14.632 1.00 1.17 H new ATOM 0 HA ALA A 102 -4.942 -0.682 15.321 1.00 1.07 H new ATOM 0 HB1 ALA A 102 -6.533 0.939 16.301 1.00 0.98 H new ATOM 0 HB2 ALA A 102 -7.024 0.426 14.669 1.00 0.98 H new ATOM 0 HB3 ALA A 102 -7.848 -0.243 16.098 1.00 0.98 H new ATOM 1643 N VAL A 103 -6.693 -1.716 17.897 1.00 1.54 N ATOM 1644 CA VAL A 103 -6.624 -2.133 19.284 1.00 2.05 C ATOM 1645 C VAL A 103 -7.752 -3.128 19.543 1.00 1.79 C ATOM 1646 O VAL A 103 -8.117 -3.430 20.675 1.00 2.21 O ATOM 1647 CB VAL A 103 -6.724 -0.907 20.228 1.00 2.56 C ATOM 1648 CG1 VAL A 103 -8.068 -0.214 20.078 1.00 3.03 C ATOM 1649 CG2 VAL A 103 -6.460 -1.294 21.676 1.00 3.17 C ATOM 0 H VAL A 103 -7.641 -1.657 17.526 1.00 1.54 H new ATOM 0 HA VAL A 103 -5.666 -2.613 19.484 1.00 2.05 H new ATOM 0 HB VAL A 103 -5.948 -0.200 19.935 1.00 2.56 H new ATOM 0 HG11 VAL A 103 -8.113 0.642 20.751 1.00 3.03 H new ATOM 0 HG12 VAL A 103 -8.189 0.126 19.049 1.00 3.03 H new ATOM 0 HG13 VAL A 103 -8.867 -0.912 20.326 1.00 3.03 H new ATOM 0 HG21 VAL A 103 -6.538 -0.410 22.309 1.00 3.17 H new ATOM 0 HG22 VAL A 103 -7.194 -2.034 21.994 1.00 3.17 H new ATOM 0 HG23 VAL A 103 -5.458 -1.715 21.763 1.00 3.17 H new ATOM 1659 N GLY A 104 -8.289 -3.652 18.450 1.00 1.47 N ATOM 1660 CA GLY A 104 -9.416 -4.554 18.539 1.00 1.84 C ATOM 1661 C GLY A 104 -10.644 -3.969 17.891 1.00 1.67 C ATOM 1662 O GLY A 104 -11.669 -4.638 17.758 1.00 1.96 O ATOM 0 H GLY A 104 -7.962 -3.467 17.502 1.00 1.47 H new ATOM 0 HA2 GLY A 104 -9.165 -5.500 18.058 1.00 1.84 H new ATOM 0 HA3 GLY A 104 -9.625 -4.774 19.586 1.00 1.84 H new ATOM 1666 N SER A 105 -10.530 -2.721 17.464 1.00 1.38 N ATOM 1667 CA SER A 105 -11.653 -2.021 16.862 1.00 1.39 C ATOM 1668 C SER A 105 -11.822 -2.454 15.417 1.00 1.19 C ATOM 1669 O SER A 105 -12.875 -2.279 14.811 1.00 1.34 O ATOM 1670 CB SER A 105 -11.401 -0.522 16.917 1.00 1.59 C ATOM 1671 OG SER A 105 -10.656 -0.185 18.073 1.00 1.88 O ATOM 0 H SER A 105 -9.672 -2.173 17.523 1.00 1.38 H new ATOM 0 HA SER A 105 -12.562 -2.261 17.414 1.00 1.39 H new ATOM 0 HB2 SER A 105 -10.861 -0.205 16.025 1.00 1.59 H new ATOM 0 HB3 SER A 105 -12.351 0.012 16.921 1.00 1.59 H new ATOM 0 HG SER A 105 -10.232 0.689 17.945 1.00 1.88 H new ATOM 1677 N ILE A 106 -10.767 -3.039 14.882 1.00 1.05 N ATOM 1678 CA ILE A 106 -10.707 -3.374 13.478 1.00 0.96 C ATOM 1679 C ILE A 106 -10.361 -4.841 13.305 1.00 0.94 C ATOM 1680 O ILE A 106 -9.351 -5.311 13.829 1.00 1.12 O ATOM 1681 CB ILE A 106 -9.644 -2.516 12.763 1.00 0.93 C ATOM 1682 CG1 ILE A 106 -9.847 -1.035 13.098 1.00 1.01 C ATOM 1683 CG2 ILE A 106 -9.716 -2.739 11.260 1.00 0.98 C ATOM 1684 CD1 ILE A 106 -8.652 -0.164 12.781 1.00 0.94 C ATOM 0 H ILE A 106 -9.932 -3.293 15.409 1.00 1.05 H new ATOM 0 HA ILE A 106 -11.684 -3.175 13.038 1.00 0.96 H new ATOM 0 HB ILE A 106 -8.655 -2.816 13.111 1.00 0.93 H new ATOM 0 HG12 ILE A 106 -10.711 -0.663 12.547 1.00 1.01 H new ATOM 0 HG13 ILE A 106 -10.081 -0.942 14.159 1.00 1.01 H new ATOM 0 HG21 ILE A 106 -8.961 -2.128 10.765 1.00 0.98 H new ATOM 0 HG22 ILE A 106 -9.534 -3.791 11.039 1.00 0.98 H new ATOM 0 HG23 ILE A 106 -10.705 -2.458 10.897 1.00 0.98 H new ATOM 0 HD11 ILE A 106 -8.874 0.870 13.046 1.00 0.94 H new ATOM 0 HD12 ILE A 106 -7.790 -0.508 13.352 1.00 0.94 H new ATOM 0 HD13 ILE A 106 -8.430 -0.225 11.716 1.00 0.94 H new ATOM 1696 N SER A 107 -11.207 -5.558 12.591 1.00 0.84 N ATOM 1697 CA SER A 107 -10.951 -6.951 12.287 1.00 0.86 C ATOM 1698 C SER A 107 -10.091 -7.038 11.029 1.00 0.79 C ATOM 1699 O SER A 107 -9.962 -6.047 10.303 1.00 0.77 O ATOM 1700 CB SER A 107 -12.281 -7.678 12.082 1.00 0.97 C ATOM 1701 OG SER A 107 -13.172 -7.414 13.156 1.00 1.35 O ATOM 0 H SER A 107 -12.081 -5.196 12.210 1.00 0.84 H new ATOM 0 HA SER A 107 -10.419 -7.424 13.112 1.00 0.86 H new ATOM 0 HB2 SER A 107 -12.733 -7.360 11.142 1.00 0.97 H new ATOM 0 HB3 SER A 107 -12.106 -8.751 12.005 1.00 0.97 H new ATOM 0 HG SER A 107 -13.655 -8.234 13.389 1.00 1.35 H new ATOM 1707 N PRO A 108 -9.465 -8.196 10.768 1.00 0.82 N ATOM 1708 CA PRO A 108 -8.713 -8.414 9.537 1.00 0.82 C ATOM 1709 C PRO A 108 -9.561 -8.103 8.309 1.00 0.73 C ATOM 1710 O PRO A 108 -10.703 -8.552 8.201 1.00 0.81 O ATOM 1711 CB PRO A 108 -8.350 -9.907 9.576 1.00 0.91 C ATOM 1712 CG PRO A 108 -9.180 -10.492 10.670 1.00 1.07 C ATOM 1713 CD PRO A 108 -9.431 -9.378 11.641 1.00 0.92 C ATOM 0 HA PRO A 108 -7.838 -7.767 9.470 1.00 0.82 H new ATOM 0 HB2 PRO A 108 -8.564 -10.388 8.621 1.00 0.91 H new ATOM 0 HB3 PRO A 108 -7.287 -10.047 9.772 1.00 0.91 H new ATOM 0 HG2 PRO A 108 -10.118 -10.887 10.279 1.00 1.07 H new ATOM 0 HG3 PRO A 108 -8.661 -11.320 11.153 1.00 1.07 H new ATOM 0 HD2 PRO A 108 -10.370 -9.512 12.179 1.00 0.92 H new ATOM 0 HD3 PRO A 108 -8.642 -9.307 12.390 1.00 0.92 H new ATOM 1721 N ARG A 109 -9.007 -7.332 7.389 1.00 0.61 N ATOM 1722 CA ARG A 109 -9.754 -6.952 6.198 1.00 0.56 C ATOM 1723 C ARG A 109 -9.221 -7.722 5.014 1.00 0.52 C ATOM 1724 O ARG A 109 -8.078 -8.178 5.027 1.00 0.66 O ATOM 1725 CB ARG A 109 -9.669 -5.445 5.910 1.00 0.64 C ATOM 1726 CG ARG A 109 -10.293 -4.558 6.975 1.00 1.05 C ATOM 1727 CD ARG A 109 -10.286 -3.092 6.541 1.00 0.88 C ATOM 1728 NE ARG A 109 -10.357 -2.171 7.682 1.00 1.89 N ATOM 1729 CZ ARG A 109 -9.492 -1.167 7.890 1.00 2.34 C ATOM 1730 NH1 ARG A 109 -8.467 -0.987 7.065 1.00 2.06 N ATOM 1731 NH2 ARG A 109 -9.646 -0.353 8.933 1.00 3.45 N ATOM 0 H ARG A 109 -8.058 -6.961 7.439 1.00 0.61 H new ATOM 0 HA ARG A 109 -10.803 -7.191 6.373 1.00 0.56 H new ATOM 0 HB2 ARG A 109 -8.621 -5.169 5.796 1.00 0.64 H new ATOM 0 HB3 ARG A 109 -10.157 -5.243 4.957 1.00 0.64 H new ATOM 0 HG2 ARG A 109 -11.317 -4.879 7.167 1.00 1.05 H new ATOM 0 HG3 ARG A 109 -9.745 -4.666 7.911 1.00 1.05 H new ATOM 0 HD2 ARG A 109 -9.380 -2.889 5.970 1.00 0.88 H new ATOM 0 HD3 ARG A 109 -11.130 -2.909 5.876 1.00 0.88 H new ATOM 0 HE ARG A 109 -11.110 -2.302 8.358 1.00 1.89 H new ATOM 0 HH11 ARG A 109 -8.336 -1.613 6.271 1.00 2.06 H new ATOM 0 HH12 ARG A 109 -7.811 -0.223 7.226 1.00 2.06 H new ATOM 0 HH21 ARG A 109 -10.424 -0.492 9.578 1.00 3.45 H new ATOM 0 HH22 ARG A 109 -8.986 0.409 9.087 1.00 3.45 H new ATOM 1745 N ASP A 110 -10.037 -7.865 3.994 1.00 0.46 N ATOM 1746 CA ASP A 110 -9.611 -8.579 2.810 1.00 0.47 C ATOM 1747 C ASP A 110 -9.362 -7.577 1.693 1.00 0.44 C ATOM 1748 O ASP A 110 -10.278 -6.884 1.263 1.00 0.64 O ATOM 1749 CB ASP A 110 -10.658 -9.614 2.386 1.00 0.62 C ATOM 1750 CG ASP A 110 -10.123 -10.619 1.377 1.00 0.83 C ATOM 1751 OD1 ASP A 110 -9.503 -10.204 0.375 1.00 1.32 O ATOM 1752 OD2 ASP A 110 -10.333 -11.838 1.578 1.00 1.37 O ATOM 0 H ASP A 110 -10.989 -7.501 3.959 1.00 0.46 H new ATOM 0 HA ASP A 110 -8.689 -9.119 3.028 1.00 0.47 H new ATOM 0 HB2 ASP A 110 -11.013 -10.147 3.268 1.00 0.62 H new ATOM 0 HB3 ASP A 110 -11.518 -9.099 1.957 1.00 0.62 H new ATOM 1757 N PHE A 111 -8.128 -7.478 1.242 1.00 0.39 N ATOM 1758 CA PHE A 111 -7.783 -6.515 0.214 1.00 0.43 C ATOM 1759 C PHE A 111 -7.717 -7.186 -1.139 1.00 0.41 C ATOM 1760 O PHE A 111 -7.060 -8.213 -1.306 1.00 0.54 O ATOM 1761 CB PHE A 111 -6.442 -5.832 0.502 1.00 0.61 C ATOM 1762 CG PHE A 111 -6.519 -4.682 1.467 1.00 0.94 C ATOM 1763 CD1 PHE A 111 -7.687 -3.946 1.591 1.00 1.36 C ATOM 1764 CD2 PHE A 111 -5.433 -4.343 2.260 1.00 1.60 C ATOM 1765 CE1 PHE A 111 -7.772 -2.897 2.486 1.00 2.01 C ATOM 1766 CE2 PHE A 111 -5.511 -3.292 3.154 1.00 2.30 C ATOM 1767 CZ PHE A 111 -6.641 -2.540 3.236 1.00 2.41 C ATOM 0 H PHE A 111 -7.349 -8.050 1.569 1.00 0.39 H new ATOM 0 HA PHE A 111 -8.564 -5.755 0.212 1.00 0.43 H new ATOM 0 HB2 PHE A 111 -5.749 -6.575 0.897 1.00 0.61 H new ATOM 0 HB3 PHE A 111 -6.023 -5.473 -0.438 1.00 0.61 H new ATOM 0 HD1 PHE A 111 -8.542 -4.196 0.980 1.00 1.36 H new ATOM 0 HD2 PHE A 111 -4.516 -4.907 2.178 1.00 1.60 H new ATOM 0 HE1 PHE A 111 -8.700 -2.357 2.607 1.00 2.01 H new ATOM 0 HE2 PHE A 111 -4.669 -3.066 3.792 1.00 2.30 H new ATOM 0 HZ PHE A 111 -6.668 -1.671 3.876 1.00 2.41 H new ATOM 1777 N ILE A 112 -8.420 -6.611 -2.089 1.00 0.34 N ATOM 1778 CA ILE A 112 -8.354 -7.058 -3.463 1.00 0.33 C ATOM 1779 C ILE A 112 -7.957 -5.891 -4.335 1.00 0.35 C ATOM 1780 O ILE A 112 -8.786 -5.288 -5.025 1.00 0.43 O ATOM 1781 CB ILE A 112 -9.677 -7.652 -3.979 1.00 0.34 C ATOM 1782 CG1 ILE A 112 -10.168 -8.763 -3.060 1.00 0.40 C ATOM 1783 CG2 ILE A 112 -9.462 -8.200 -5.363 1.00 0.36 C ATOM 1784 CD1 ILE A 112 -9.284 -9.986 -3.079 1.00 0.42 C ATOM 0 H ILE A 112 -9.050 -5.825 -1.933 1.00 0.34 H new ATOM 0 HA ILE A 112 -7.615 -7.858 -3.506 1.00 0.33 H new ATOM 0 HB ILE A 112 -10.432 -6.866 -3.999 1.00 0.34 H new ATOM 0 HG12 ILE A 112 -10.228 -8.382 -2.040 1.00 0.40 H new ATOM 0 HG13 ILE A 112 -11.178 -9.048 -3.354 1.00 0.40 H new ATOM 0 HG21 ILE A 112 -10.395 -8.623 -5.736 1.00 0.36 H new ATOM 0 HG22 ILE A 112 -9.137 -7.398 -6.025 1.00 0.36 H new ATOM 0 HG23 ILE A 112 -8.698 -8.977 -5.332 1.00 0.36 H new ATOM 0 HD11 ILE A 112 -9.690 -10.739 -2.403 1.00 0.42 H new ATOM 0 HD12 ILE A 112 -9.244 -10.390 -4.090 1.00 0.42 H new ATOM 0 HD13 ILE A 112 -8.279 -9.714 -2.757 1.00 0.42 H new ATOM 1796 N ASP A 113 -6.692 -5.554 -4.273 1.00 0.36 N ATOM 1797 CA ASP A 113 -6.191 -4.425 -5.008 1.00 0.42 C ATOM 1798 C ASP A 113 -5.737 -4.868 -6.379 1.00 0.33 C ATOM 1799 O ASP A 113 -4.862 -5.722 -6.507 1.00 0.35 O ATOM 1800 CB ASP A 113 -5.030 -3.757 -4.268 1.00 0.58 C ATOM 1801 CG ASP A 113 -5.427 -3.206 -2.913 1.00 1.23 C ATOM 1802 OD1 ASP A 113 -6.008 -2.100 -2.861 1.00 1.86 O ATOM 1803 OD2 ASP A 113 -5.147 -3.874 -1.896 1.00 1.32 O ATOM 0 H ASP A 113 -5.992 -6.048 -3.720 1.00 0.36 H new ATOM 0 HA ASP A 113 -6.996 -3.697 -5.107 1.00 0.42 H new ATOM 0 HB2 ASP A 113 -4.226 -4.481 -4.138 1.00 0.58 H new ATOM 0 HB3 ASP A 113 -4.634 -2.947 -4.881 1.00 0.58 H new ATOM 1808 N LEU A 114 -6.372 -4.337 -7.403 1.00 0.28 N ATOM 1809 CA LEU A 114 -5.840 -4.452 -8.737 1.00 0.23 C ATOM 1810 C LEU A 114 -4.687 -3.505 -8.855 1.00 0.22 C ATOM 1811 O LEU A 114 -4.848 -2.291 -8.800 1.00 0.24 O ATOM 1812 CB LEU A 114 -6.868 -4.142 -9.800 1.00 0.23 C ATOM 1813 CG LEU A 114 -6.275 -3.702 -11.138 1.00 0.22 C ATOM 1814 CD1 LEU A 114 -5.846 -4.908 -11.958 1.00 0.21 C ATOM 1815 CD2 LEU A 114 -7.262 -2.831 -11.899 1.00 0.26 C ATOM 0 H LEU A 114 -7.252 -3.825 -7.334 1.00 0.28 H new ATOM 0 HA LEU A 114 -5.526 -5.483 -8.898 1.00 0.23 H new ATOM 0 HB2 LEU A 114 -7.484 -5.026 -9.962 1.00 0.23 H new ATOM 0 HB3 LEU A 114 -7.528 -3.356 -9.432 1.00 0.23 H new ATOM 0 HG LEU A 114 -5.385 -3.103 -10.944 1.00 0.22 H new ATOM 0 HD11 LEU A 114 -5.427 -4.573 -12.907 1.00 0.21 H new ATOM 0 HD12 LEU A 114 -5.093 -5.473 -11.408 1.00 0.21 H new ATOM 0 HD13 LEU A 114 -6.710 -5.545 -12.148 1.00 0.21 H new ATOM 0 HD21 LEU A 114 -6.822 -2.527 -12.849 1.00 0.26 H new ATOM 0 HD22 LEU A 114 -8.176 -3.395 -12.086 1.00 0.26 H new ATOM 0 HD23 LEU A 114 -7.496 -1.945 -11.308 1.00 0.26 H new ATOM 1827 N VAL A 115 -3.545 -4.074 -9.030 1.00 0.23 N ATOM 1828 CA VAL A 115 -2.320 -3.372 -8.841 1.00 0.23 C ATOM 1829 C VAL A 115 -1.525 -3.323 -10.109 1.00 0.23 C ATOM 1830 O VAL A 115 -1.201 -4.347 -10.714 1.00 0.24 O ATOM 1831 CB VAL A 115 -1.533 -4.044 -7.719 1.00 0.24 C ATOM 1832 CG1 VAL A 115 -1.947 -5.509 -7.635 1.00 0.25 C ATOM 1833 CG2 VAL A 115 -0.029 -3.888 -7.897 1.00 0.26 C ATOM 0 H VAL A 115 -3.432 -5.048 -9.311 1.00 0.23 H new ATOM 0 HA VAL A 115 -2.534 -2.340 -8.561 1.00 0.23 H new ATOM 0 HB VAL A 115 -1.770 -3.550 -6.777 1.00 0.24 H new ATOM 0 HG11 VAL A 115 -1.391 -5.999 -6.836 1.00 0.25 H new ATOM 0 HG12 VAL A 115 -3.015 -5.574 -7.426 1.00 0.25 H new ATOM 0 HG13 VAL A 115 -1.732 -6.003 -8.583 1.00 0.25 H new ATOM 0 HG21 VAL A 115 0.488 -4.382 -7.075 1.00 0.26 H new ATOM 0 HG22 VAL A 115 0.275 -4.341 -8.841 1.00 0.26 H new ATOM 0 HG23 VAL A 115 0.229 -2.829 -7.903 1.00 0.26 H new ATOM 1843 N TYR A 116 -1.238 -2.123 -10.524 1.00 0.25 N ATOM 1844 CA TYR A 116 -0.421 -1.941 -11.675 1.00 0.25 C ATOM 1845 C TYR A 116 0.950 -1.472 -11.244 1.00 0.26 C ATOM 1846 O TYR A 116 1.109 -0.350 -10.761 1.00 0.28 O ATOM 1847 CB TYR A 116 -1.061 -0.948 -12.647 1.00 0.31 C ATOM 1848 CG TYR A 116 -0.357 -0.864 -13.980 1.00 0.83 C ATOM 1849 CD1 TYR A 116 0.815 -0.136 -14.127 1.00 1.10 C ATOM 1850 CD2 TYR A 116 -0.863 -1.518 -15.092 1.00 1.31 C ATOM 1851 CE1 TYR A 116 1.459 -0.065 -15.342 1.00 1.65 C ATOM 1852 CE2 TYR A 116 -0.223 -1.450 -16.311 1.00 1.87 C ATOM 1853 CZ TYR A 116 0.936 -0.724 -16.430 1.00 1.99 C ATOM 1854 OH TYR A 116 1.575 -0.652 -17.645 1.00 2.57 O ATOM 0 H TYR A 116 -1.559 -1.262 -10.080 1.00 0.25 H new ATOM 0 HA TYR A 116 -0.323 -2.892 -12.199 1.00 0.25 H new ATOM 0 HB2 TYR A 116 -2.100 -1.233 -12.812 1.00 0.31 H new ATOM 0 HB3 TYR A 116 -1.071 0.041 -12.188 1.00 0.31 H new ATOM 0 HD1 TYR A 116 1.229 0.383 -13.275 1.00 1.10 H new ATOM 0 HD2 TYR A 116 -1.774 -2.091 -15.002 1.00 1.31 H new ATOM 0 HE1 TYR A 116 2.371 0.506 -15.440 1.00 1.65 H new ATOM 0 HE2 TYR A 116 -0.631 -1.965 -17.168 1.00 1.87 H new ATOM 0 HH TYR A 116 2.358 -1.242 -17.638 1.00 2.57 H new ATOM 1864 N ILE A 117 1.935 -2.330 -11.414 1.00 0.30 N ATOM 1865 CA ILE A 117 3.282 -1.991 -11.022 1.00 0.33 C ATOM 1866 C ILE A 117 3.975 -1.287 -12.171 1.00 0.38 C ATOM 1867 O ILE A 117 4.458 -1.907 -13.119 1.00 0.46 O ATOM 1868 CB ILE A 117 4.076 -3.234 -10.571 1.00 0.42 C ATOM 1869 CG1 ILE A 117 3.444 -3.809 -9.303 1.00 0.45 C ATOM 1870 CG2 ILE A 117 5.540 -2.882 -10.322 1.00 0.52 C ATOM 1871 CD1 ILE A 117 3.895 -5.212 -8.978 1.00 0.89 C ATOM 0 H ILE A 117 1.827 -3.260 -11.818 1.00 0.30 H new ATOM 0 HA ILE A 117 3.237 -1.320 -10.164 1.00 0.33 H new ATOM 0 HB ILE A 117 4.041 -3.982 -11.363 1.00 0.42 H new ATOM 0 HG12 ILE A 117 3.682 -3.157 -8.462 1.00 0.45 H new ATOM 0 HG13 ILE A 117 2.360 -3.803 -9.414 1.00 0.45 H new ATOM 0 HG21 ILE A 117 6.080 -3.774 -10.005 1.00 0.52 H new ATOM 0 HG22 ILE A 117 5.983 -2.497 -11.241 1.00 0.52 H new ATOM 0 HG23 ILE A 117 5.604 -2.123 -9.542 1.00 0.52 H new ATOM 0 HD11 ILE A 117 3.403 -5.550 -8.066 1.00 0.89 H new ATOM 0 HD12 ILE A 117 3.633 -5.878 -9.800 1.00 0.89 H new ATOM 0 HD13 ILE A 117 4.975 -5.223 -8.833 1.00 0.89 H new ATOM 1883 N LYS A 118 3.978 0.023 -12.074 1.00 0.42 N ATOM 1884 CA LYS A 118 4.571 0.871 -13.076 1.00 0.52 C ATOM 1885 C LYS A 118 5.942 1.299 -12.607 1.00 0.39 C ATOM 1886 O LYS A 118 6.069 2.027 -11.627 1.00 0.34 O ATOM 1887 CB LYS A 118 3.687 2.102 -13.319 1.00 0.70 C ATOM 1888 CG LYS A 118 4.306 3.147 -14.240 1.00 0.93 C ATOM 1889 CD LYS A 118 4.374 2.673 -15.681 1.00 0.94 C ATOM 1890 CE LYS A 118 2.995 2.639 -16.319 1.00 0.72 C ATOM 1891 NZ LYS A 118 3.041 2.116 -17.712 1.00 1.20 N ATOM 0 H LYS A 118 3.566 0.531 -11.291 1.00 0.42 H new ATOM 0 HA LYS A 118 4.660 0.322 -14.013 1.00 0.52 H new ATOM 0 HB2 LYS A 118 2.739 1.775 -13.745 1.00 0.70 H new ATOM 0 HB3 LYS A 118 3.462 2.568 -12.360 1.00 0.70 H new ATOM 0 HG2 LYS A 118 3.722 4.066 -14.189 1.00 0.93 H new ATOM 0 HG3 LYS A 118 5.310 3.388 -13.891 1.00 0.93 H new ATOM 0 HD2 LYS A 118 5.025 3.334 -16.253 1.00 0.94 H new ATOM 0 HD3 LYS A 118 4.818 1.678 -15.718 1.00 0.94 H new ATOM 0 HE2 LYS A 118 2.332 2.015 -15.719 1.00 0.72 H new ATOM 0 HE3 LYS A 118 2.571 3.643 -16.322 1.00 0.72 H new ATOM 0 HZ1 LYS A 118 2.560 2.782 -18.349 1.00 1.20 H new ATOM 0 HZ2 LYS A 118 4.032 2.007 -18.009 1.00 1.20 H new ATOM 0 HZ3 LYS A 118 2.564 1.193 -17.752 1.00 1.20 H new ATOM 1905 N ARG A 119 6.974 0.839 -13.274 1.00 0.52 N ATOM 1906 CA ARG A 119 8.292 1.261 -12.915 1.00 0.52 C ATOM 1907 C ARG A 119 8.788 2.230 -13.963 1.00 0.49 C ATOM 1908 O ARG A 119 8.995 1.886 -15.126 1.00 0.58 O ATOM 1909 CB ARG A 119 9.242 0.062 -12.711 1.00 0.79 C ATOM 1910 CG ARG A 119 9.536 -0.751 -13.961 1.00 1.00 C ATOM 1911 CD ARG A 119 10.774 -0.238 -14.680 1.00 1.25 C ATOM 1912 NE ARG A 119 12.009 -0.600 -13.987 1.00 1.68 N ATOM 1913 CZ ARG A 119 13.144 -0.913 -14.608 1.00 2.18 C ATOM 1914 NH1 ARG A 119 13.180 -0.979 -15.934 1.00 2.57 N ATOM 1915 NH2 ARG A 119 14.232 -1.184 -13.899 1.00 2.80 N ATOM 0 H ARG A 119 6.922 0.184 -14.054 1.00 0.52 H new ATOM 0 HA ARG A 119 8.266 1.771 -11.952 1.00 0.52 H new ATOM 0 HB2 ARG A 119 10.185 0.431 -12.307 1.00 0.79 H new ATOM 0 HB3 ARG A 119 8.810 -0.600 -11.960 1.00 0.79 H new ATOM 0 HG2 ARG A 119 9.678 -1.797 -13.691 1.00 1.00 H new ATOM 0 HG3 ARG A 119 8.679 -0.709 -14.634 1.00 1.00 H new ATOM 0 HD2 ARG A 119 10.797 -0.641 -15.692 1.00 1.25 H new ATOM 0 HD3 ARG A 119 10.715 0.847 -14.770 1.00 1.25 H new ATOM 0 HE ARG A 119 12.001 -0.614 -12.967 1.00 1.68 H new ATOM 0 HH11 ARG A 119 12.338 -0.790 -16.477 1.00 2.57 H new ATOM 0 HH12 ARG A 119 14.050 -1.219 -16.409 1.00 2.57 H new ATOM 0 HH21 ARG A 119 14.198 -1.152 -12.880 1.00 2.80 H new ATOM 0 HH22 ARG A 119 15.103 -1.424 -14.373 1.00 2.80 H new ATOM 1929 N TYR A 120 8.867 3.471 -13.573 1.00 0.43 N ATOM 1930 CA TYR A 120 9.556 4.437 -14.368 1.00 0.46 C ATOM 1931 C TYR A 120 11.027 4.188 -14.140 1.00 0.50 C ATOM 1932 O TYR A 120 11.512 4.369 -13.030 1.00 0.48 O ATOM 1933 CB TYR A 120 9.141 5.858 -13.992 1.00 0.46 C ATOM 1934 CG TYR A 120 7.692 6.155 -14.303 1.00 0.51 C ATOM 1935 CD1 TYR A 120 7.277 6.421 -15.601 1.00 0.76 C ATOM 1936 CD2 TYR A 120 6.740 6.179 -13.292 1.00 0.58 C ATOM 1937 CE1 TYR A 120 5.954 6.702 -15.882 1.00 0.83 C ATOM 1938 CE2 TYR A 120 5.415 6.455 -13.565 1.00 0.66 C ATOM 1939 CZ TYR A 120 5.027 6.684 -14.892 1.00 0.70 C ATOM 1940 OH TYR A 120 3.709 7.000 -15.135 1.00 0.81 O ATOM 0 H TYR A 120 8.462 3.833 -12.710 1.00 0.43 H new ATOM 0 HA TYR A 120 9.311 4.338 -15.426 1.00 0.46 H new ATOM 0 HB2 TYR A 120 9.317 6.012 -12.927 1.00 0.46 H new ATOM 0 HB3 TYR A 120 9.774 6.568 -14.525 1.00 0.46 H new ATOM 0 HD1 TYR A 120 8.000 6.408 -16.403 1.00 0.76 H new ATOM 0 HD2 TYR A 120 7.041 5.978 -12.275 1.00 0.58 H new ATOM 0 HE1 TYR A 120 5.657 6.937 -16.893 1.00 0.83 H new ATOM 0 HE2 TYR A 120 4.688 6.494 -12.767 1.00 0.66 H new ATOM 0 HH TYR A 120 3.197 6.930 -14.302 1.00 0.81 H new ATOM 1950 N GLU A 121 11.667 3.650 -15.168 1.00 0.61 N ATOM 1951 CA GLU A 121 13.067 3.224 -15.133 1.00 0.73 C ATOM 1952 C GLU A 121 13.960 4.191 -14.368 1.00 0.70 C ATOM 1953 O GLU A 121 14.467 5.167 -14.916 1.00 0.79 O ATOM 1954 CB GLU A 121 13.584 3.038 -16.559 1.00 0.96 C ATOM 1955 CG GLU A 121 12.823 1.968 -17.324 1.00 1.06 C ATOM 1956 CD GLU A 121 13.312 1.790 -18.745 1.00 1.69 C ATOM 1957 OE1 GLU A 121 14.406 1.218 -18.932 1.00 2.28 O ATOM 1958 OE2 GLU A 121 12.608 2.224 -19.680 1.00 2.27 O ATOM 0 H GLU A 121 11.221 3.492 -16.072 1.00 0.61 H new ATOM 0 HA GLU A 121 13.104 2.276 -14.597 1.00 0.73 H new ATOM 0 HB2 GLU A 121 13.509 3.984 -17.095 1.00 0.96 H new ATOM 0 HB3 GLU A 121 14.641 2.773 -16.526 1.00 0.96 H new ATOM 0 HG2 GLU A 121 12.912 1.019 -16.795 1.00 1.06 H new ATOM 0 HG3 GLU A 121 11.764 2.226 -17.341 1.00 1.06 H new ATOM 1965 N GLY A 122 14.129 3.892 -13.088 1.00 0.67 N ATOM 1966 CA GLY A 122 14.958 4.694 -12.209 1.00 0.71 C ATOM 1967 C GLY A 122 14.338 6.032 -11.893 1.00 0.66 C ATOM 1968 O GLY A 122 15.029 7.039 -11.739 1.00 0.76 O ATOM 0 H GLY A 122 13.695 3.088 -12.634 1.00 0.67 H new ATOM 0 HA2 GLY A 122 15.131 4.149 -11.281 1.00 0.71 H new ATOM 0 HA3 GLY A 122 15.931 4.849 -12.674 1.00 0.71 H new ATOM 1972 N ASN A 123 13.028 6.022 -11.784 1.00 0.57 N ATOM 1973 CA ASN A 123 12.257 7.212 -11.496 1.00 0.54 C ATOM 1974 C ASN A 123 11.240 6.922 -10.403 1.00 0.45 C ATOM 1975 O ASN A 123 11.227 7.586 -9.369 1.00 0.45 O ATOM 1976 CB ASN A 123 11.543 7.689 -12.761 1.00 0.60 C ATOM 1977 CG ASN A 123 12.464 8.421 -13.722 1.00 1.01 C ATOM 1978 OD1 ASN A 123 13.048 7.821 -14.620 1.00 1.65 O ATOM 1979 ND2 ASN A 123 12.601 9.724 -13.536 1.00 1.61 N ATOM 0 H ASN A 123 12.462 5.180 -11.894 1.00 0.57 H new ATOM 0 HA ASN A 123 12.931 7.996 -11.152 1.00 0.54 H new ATOM 0 HB2 ASN A 123 11.104 6.831 -13.270 1.00 0.60 H new ATOM 0 HB3 ASN A 123 10.721 8.348 -12.481 1.00 0.60 H new ATOM 0 HD21 ASN A 123 13.209 10.266 -14.150 1.00 1.61 H new ATOM 0 HD22 ASN A 123 12.099 10.187 -12.778 1.00 1.61 H new ATOM 1986 N MET A 124 10.422 5.893 -10.620 1.00 0.39 N ATOM 1987 CA MET A 124 9.331 5.553 -9.695 1.00 0.34 C ATOM 1988 C MET A 124 8.887 4.115 -9.896 1.00 0.33 C ATOM 1989 O MET A 124 8.469 3.739 -10.984 1.00 0.40 O ATOM 1990 CB MET A 124 8.101 6.469 -9.867 1.00 0.34 C ATOM 1991 CG MET A 124 8.168 7.790 -9.113 1.00 0.56 C ATOM 1992 SD MET A 124 8.804 9.156 -10.113 1.00 1.09 S ATOM 1993 CE MET A 124 7.569 9.248 -11.406 1.00 1.12 C ATOM 0 H MET A 124 10.491 5.276 -11.429 1.00 0.39 H new ATOM 0 HA MET A 124 9.731 5.694 -8.691 1.00 0.34 H new ATOM 0 HB2 MET A 124 7.971 6.681 -10.928 1.00 0.34 H new ATOM 0 HB3 MET A 124 7.215 5.926 -9.539 1.00 0.34 H new ATOM 0 HG2 MET A 124 7.171 8.046 -8.754 1.00 0.56 H new ATOM 0 HG3 MET A 124 8.801 7.667 -8.235 1.00 0.56 H new ATOM 0 HE1 MET A 124 8.062 9.294 -12.377 1.00 1.12 H new ATOM 0 HE2 MET A 124 6.932 8.365 -11.364 1.00 1.12 H new ATOM 0 HE3 MET A 124 6.960 10.141 -11.265 1.00 1.12 H new ATOM 2003 N ASN A 125 8.963 3.325 -8.841 1.00 0.34 N ATOM 2004 CA ASN A 125 8.510 1.947 -8.879 1.00 0.37 C ATOM 2005 C ASN A 125 7.223 1.842 -8.075 1.00 0.32 C ATOM 2006 O ASN A 125 7.231 1.478 -6.901 1.00 0.37 O ATOM 2007 CB ASN A 125 9.583 1.001 -8.322 1.00 0.50 C ATOM 2008 CG ASN A 125 10.843 0.957 -9.175 1.00 0.95 C ATOM 2009 OD1 ASN A 125 11.233 1.944 -9.801 1.00 1.58 O ATOM 2010 ND2 ASN A 125 11.491 -0.195 -9.205 1.00 1.62 N ATOM 0 H ASN A 125 9.338 3.618 -7.939 1.00 0.34 H new ATOM 0 HA ASN A 125 8.324 1.650 -9.911 1.00 0.37 H new ATOM 0 HB2 ASN A 125 9.846 1.315 -7.312 1.00 0.50 H new ATOM 0 HB3 ASN A 125 9.168 -0.004 -8.246 1.00 0.50 H new ATOM 0 HD21 ASN A 125 12.343 -0.287 -9.759 1.00 1.62 H new ATOM 0 HD22 ASN A 125 11.139 -0.992 -8.674 1.00 1.62 H new ATOM 2017 N ILE A 126 6.127 2.203 -8.717 1.00 0.26 N ATOM 2018 CA ILE A 126 4.844 2.354 -8.047 1.00 0.23 C ATOM 2019 C ILE A 126 3.928 1.147 -8.235 1.00 0.27 C ATOM 2020 O ILE A 126 3.829 0.594 -9.330 1.00 0.30 O ATOM 2021 CB ILE A 126 4.110 3.616 -8.567 1.00 0.22 C ATOM 2022 CG1 ILE A 126 2.609 3.516 -8.292 1.00 0.24 C ATOM 2023 CG2 ILE A 126 4.376 3.836 -10.048 1.00 0.24 C ATOM 2024 CD1 ILE A 126 1.778 4.553 -9.011 1.00 0.26 C ATOM 0 H ILE A 126 6.099 2.400 -9.717 1.00 0.26 H new ATOM 0 HA ILE A 126 5.066 2.447 -6.984 1.00 0.23 H new ATOM 0 HB ILE A 126 4.501 4.479 -8.028 1.00 0.22 H new ATOM 0 HG12 ILE A 126 2.263 2.524 -8.582 1.00 0.24 H new ATOM 0 HG13 ILE A 126 2.440 3.611 -7.219 1.00 0.24 H new ATOM 0 HG21 ILE A 126 3.848 4.728 -10.384 1.00 0.24 H new ATOM 0 HG22 ILE A 126 5.446 3.965 -10.210 1.00 0.24 H new ATOM 0 HG23 ILE A 126 4.025 2.972 -10.613 1.00 0.24 H new ATOM 0 HD11 ILE A 126 0.726 4.413 -8.762 1.00 0.26 H new ATOM 0 HD12 ILE A 126 2.094 5.550 -8.703 1.00 0.26 H new ATOM 0 HD13 ILE A 126 1.914 4.446 -10.087 1.00 0.26 H new ATOM 2036 N ILE A 127 3.258 0.746 -7.158 1.00 0.30 N ATOM 2037 CA ILE A 127 2.144 -0.182 -7.269 1.00 0.34 C ATOM 2038 C ILE A 127 0.827 0.601 -7.228 1.00 0.38 C ATOM 2039 O ILE A 127 0.419 1.130 -6.196 1.00 0.45 O ATOM 2040 CB ILE A 127 2.156 -1.281 -6.174 1.00 0.41 C ATOM 2041 CG1 ILE A 127 2.086 -0.675 -4.771 1.00 0.42 C ATOM 2042 CG2 ILE A 127 3.400 -2.145 -6.310 1.00 0.50 C ATOM 2043 CD1 ILE A 127 1.979 -1.701 -3.663 1.00 0.59 C ATOM 0 H ILE A 127 3.467 1.048 -6.207 1.00 0.30 H new ATOM 0 HA ILE A 127 2.245 -0.701 -8.222 1.00 0.34 H new ATOM 0 HB ILE A 127 1.271 -1.902 -6.315 1.00 0.41 H new ATOM 0 HG12 ILE A 127 2.975 -0.066 -4.604 1.00 0.42 H new ATOM 0 HG13 ILE A 127 1.227 -0.006 -4.717 1.00 0.42 H new ATOM 0 HG21 ILE A 127 3.396 -2.912 -5.536 1.00 0.50 H new ATOM 0 HG22 ILE A 127 3.408 -2.620 -7.291 1.00 0.50 H new ATOM 0 HG23 ILE A 127 4.289 -1.523 -6.201 1.00 0.50 H new ATOM 0 HD11 ILE A 127 1.934 -1.193 -2.700 1.00 0.59 H new ATOM 0 HD12 ILE A 127 1.075 -2.294 -3.803 1.00 0.59 H new ATOM 0 HD13 ILE A 127 2.850 -2.355 -3.688 1.00 0.59 H new ATOM 2055 N SER A 128 0.217 0.743 -8.387 1.00 0.39 N ATOM 2056 CA SER A 128 -1.050 1.444 -8.521 1.00 0.50 C ATOM 2057 C SER A 128 -2.200 0.481 -8.277 1.00 0.55 C ATOM 2058 O SER A 128 -2.488 -0.365 -9.113 1.00 1.00 O ATOM 2059 CB SER A 128 -1.144 2.010 -9.929 1.00 0.68 C ATOM 2060 OG SER A 128 0.152 2.285 -10.442 1.00 1.18 O ATOM 0 H SER A 128 0.584 0.376 -9.265 1.00 0.39 H new ATOM 0 HA SER A 128 -1.107 2.251 -7.790 1.00 0.50 H new ATOM 0 HB2 SER A 128 -1.656 1.301 -10.579 1.00 0.68 H new ATOM 0 HB3 SER A 128 -1.740 2.923 -9.921 1.00 0.68 H new ATOM 0 HG SER A 128 0.563 1.453 -10.756 1.00 1.18 H new ATOM 2066 N SER A 129 -2.879 0.637 -7.165 1.00 0.30 N ATOM 2067 CA SER A 129 -3.801 -0.391 -6.708 1.00 0.31 C ATOM 2068 C SER A 129 -5.240 0.119 -6.631 1.00 0.31 C ATOM 2069 O SER A 129 -5.494 1.237 -6.180 1.00 0.43 O ATOM 2070 CB SER A 129 -3.336 -0.912 -5.349 1.00 0.40 C ATOM 2071 OG SER A 129 -1.960 -1.262 -5.390 1.00 1.24 O ATOM 0 H SER A 129 -2.816 1.456 -6.560 1.00 0.30 H new ATOM 0 HA SER A 129 -3.797 -1.203 -7.435 1.00 0.31 H new ATOM 0 HB2 SER A 129 -3.500 -0.151 -4.586 1.00 0.40 H new ATOM 0 HB3 SER A 129 -3.929 -1.781 -5.065 1.00 0.40 H new ATOM 0 HG SER A 129 -1.529 -0.995 -4.551 1.00 1.24 H new ATOM 2077 N LYS A 130 -6.182 -0.708 -7.079 1.00 0.27 N ATOM 2078 CA LYS A 130 -7.588 -0.365 -7.033 1.00 0.32 C ATOM 2079 C LYS A 130 -8.326 -1.539 -6.463 1.00 0.37 C ATOM 2080 O LYS A 130 -8.213 -2.633 -6.995 1.00 0.41 O ATOM 2081 CB LYS A 130 -8.168 -0.114 -8.429 1.00 0.40 C ATOM 2082 CG LYS A 130 -7.303 0.713 -9.352 1.00 0.90 C ATOM 2083 CD LYS A 130 -7.931 0.829 -10.736 1.00 0.80 C ATOM 2084 CE LYS A 130 -9.121 1.787 -10.755 1.00 1.42 C ATOM 2085 NZ LYS A 130 -10.363 1.182 -10.189 1.00 2.26 N ATOM 0 H LYS A 130 -5.987 -1.626 -7.480 1.00 0.27 H new ATOM 0 HA LYS A 130 -7.694 0.542 -6.437 1.00 0.32 H new ATOM 0 HB2 LYS A 130 -8.358 -1.077 -8.903 1.00 0.40 H new ATOM 0 HB3 LYS A 130 -9.132 0.383 -8.319 1.00 0.40 H new ATOM 0 HG2 LYS A 130 -7.162 1.708 -8.929 1.00 0.90 H new ATOM 0 HG3 LYS A 130 -6.316 0.259 -9.434 1.00 0.90 H new ATOM 0 HD2 LYS A 130 -7.179 1.173 -11.446 1.00 0.80 H new ATOM 0 HD3 LYS A 130 -8.256 -0.157 -11.069 1.00 0.80 H new ATOM 0 HE2 LYS A 130 -8.869 2.683 -10.188 1.00 1.42 H new ATOM 0 HE3 LYS A 130 -9.311 2.102 -11.781 1.00 1.42 H new ATOM 0 HZ1 LYS A 130 -11.169 1.402 -10.808 1.00 2.26 H new ATOM 0 HZ2 LYS A 130 -10.248 0.150 -10.123 1.00 2.26 H new ATOM 0 HZ3 LYS A 130 -10.538 1.572 -9.241 1.00 2.26 H new ATOM 2099 N SER A 131 -9.079 -1.343 -5.413 1.00 0.41 N ATOM 2100 CA SER A 131 -9.906 -2.410 -4.922 1.00 0.44 C ATOM 2101 C SER A 131 -10.922 -2.711 -6.000 1.00 0.41 C ATOM 2102 O SER A 131 -11.904 -1.987 -6.167 1.00 0.47 O ATOM 2103 CB SER A 131 -10.573 -2.012 -3.621 1.00 0.56 C ATOM 2104 OG SER A 131 -11.175 -0.741 -3.751 1.00 1.39 O ATOM 0 H SER A 131 -9.136 -0.469 -4.890 1.00 0.41 H new ATOM 0 HA SER A 131 -9.314 -3.299 -4.705 1.00 0.44 H new ATOM 0 HB2 SER A 131 -11.325 -2.752 -3.348 1.00 0.56 H new ATOM 0 HB3 SER A 131 -9.837 -1.994 -2.817 1.00 0.56 H new ATOM 0 HG SER A 131 -12.080 -0.843 -4.112 1.00 1.39 H new ATOM 2110 N VAL A 132 -10.658 -3.748 -6.759 1.00 0.35 N ATOM 2111 CA VAL A 132 -11.346 -3.946 -7.991 1.00 0.36 C ATOM 2112 C VAL A 132 -12.317 -5.088 -7.843 1.00 0.37 C ATOM 2113 O VAL A 132 -12.005 -6.126 -7.260 1.00 0.46 O ATOM 2114 CB VAL A 132 -10.361 -4.186 -9.164 1.00 0.40 C ATOM 2115 CG1 VAL A 132 -10.242 -5.642 -9.558 1.00 0.88 C ATOM 2116 CG2 VAL A 132 -10.734 -3.326 -10.355 1.00 1.05 C ATOM 0 H VAL A 132 -9.967 -4.464 -6.535 1.00 0.35 H new ATOM 0 HA VAL A 132 -11.901 -3.039 -8.233 1.00 0.36 H new ATOM 0 HB VAL A 132 -9.374 -3.891 -8.808 1.00 0.40 H new ATOM 0 HG11 VAL A 132 -9.537 -5.739 -10.384 1.00 0.88 H new ATOM 0 HG12 VAL A 132 -9.885 -6.221 -8.707 1.00 0.88 H new ATOM 0 HG13 VAL A 132 -11.218 -6.016 -9.868 1.00 0.88 H new ATOM 0 HG21 VAL A 132 -10.032 -3.507 -11.169 1.00 1.05 H new ATOM 0 HG22 VAL A 132 -11.743 -3.577 -10.683 1.00 1.05 H new ATOM 0 HG23 VAL A 132 -10.696 -2.274 -10.071 1.00 1.05 H new ATOM 2126 N ASP A 133 -13.495 -4.873 -8.351 1.00 0.39 N ATOM 2127 CA ASP A 133 -14.591 -5.778 -8.131 1.00 0.43 C ATOM 2128 C ASP A 133 -14.570 -6.866 -9.184 1.00 0.43 C ATOM 2129 O ASP A 133 -15.253 -6.787 -10.208 1.00 0.59 O ATOM 2130 CB ASP A 133 -15.869 -4.967 -8.159 1.00 0.54 C ATOM 2131 CG ASP A 133 -17.069 -5.694 -7.574 1.00 1.27 C ATOM 2132 OD1 ASP A 133 -17.475 -6.726 -8.148 1.00 1.39 O ATOM 2133 OD2 ASP A 133 -17.603 -5.246 -6.536 1.00 2.17 O ATOM 0 H ASP A 133 -13.726 -4.066 -8.930 1.00 0.39 H new ATOM 0 HA ASP A 133 -14.515 -6.276 -7.164 1.00 0.43 H new ATOM 0 HB2 ASP A 133 -15.713 -4.040 -7.607 1.00 0.54 H new ATOM 0 HB3 ASP A 133 -16.090 -4.690 -9.190 1.00 0.54 H new ATOM 2138 N PHE A 134 -13.730 -7.856 -8.949 1.00 0.35 N ATOM 2139 CA PHE A 134 -13.539 -8.934 -9.895 1.00 0.40 C ATOM 2140 C PHE A 134 -13.870 -10.275 -9.186 1.00 0.46 C ATOM 2141 O PHE A 134 -14.152 -10.259 -7.995 1.00 0.50 O ATOM 2142 CB PHE A 134 -12.080 -8.868 -10.388 1.00 0.39 C ATOM 2143 CG PHE A 134 -11.182 -9.693 -9.545 1.00 0.38 C ATOM 2144 CD1 PHE A 134 -11.013 -9.420 -8.202 1.00 0.36 C ATOM 2145 CD2 PHE A 134 -10.449 -10.703 -10.122 1.00 0.51 C ATOM 2146 CE1 PHE A 134 -10.119 -10.149 -7.458 1.00 0.42 C ATOM 2147 CE2 PHE A 134 -9.569 -11.431 -9.382 1.00 0.53 C ATOM 2148 CZ PHE A 134 -9.647 -11.279 -7.915 1.00 0.45 C ATOM 0 H PHE A 134 -13.166 -7.934 -8.103 1.00 0.35 H new ATOM 0 HA PHE A 134 -14.197 -8.851 -10.760 1.00 0.40 H new ATOM 0 HB2 PHE A 134 -12.028 -9.212 -11.421 1.00 0.39 H new ATOM 0 HB3 PHE A 134 -11.739 -7.833 -10.379 1.00 0.39 H new ATOM 0 HD1 PHE A 134 -11.585 -8.631 -7.736 1.00 0.36 H new ATOM 0 HD2 PHE A 134 -10.573 -10.921 -11.173 1.00 0.51 H new ATOM 0 HE1 PHE A 134 -9.804 -9.787 -6.490 1.00 0.42 H new ATOM 0 HE2 PHE A 134 -8.848 -12.088 -9.845 1.00 0.53 H new ATOM 0 HZ PHE A 134 -9.328 -12.067 -7.249 1.00 0.45 H new ATOM 2158 N PRO A 135 -13.838 -11.433 -9.896 1.00 0.61 N ATOM 2159 CA PRO A 135 -14.141 -12.776 -9.360 1.00 0.75 C ATOM 2160 C PRO A 135 -13.958 -12.992 -7.835 1.00 0.92 C ATOM 2161 O PRO A 135 -14.930 -13.277 -7.137 1.00 1.13 O ATOM 2162 CB PRO A 135 -13.157 -13.636 -10.142 1.00 1.28 C ATOM 2163 CG PRO A 135 -13.044 -12.974 -11.484 1.00 1.19 C ATOM 2164 CD PRO A 135 -13.528 -11.546 -11.330 1.00 0.76 C ATOM 0 HA PRO A 135 -15.201 -13.000 -9.477 1.00 0.75 H new ATOM 0 HB2 PRO A 135 -12.189 -13.682 -9.642 1.00 1.28 H new ATOM 0 HB3 PRO A 135 -13.517 -14.661 -10.236 1.00 1.28 H new ATOM 0 HG2 PRO A 135 -12.012 -12.993 -11.835 1.00 1.19 H new ATOM 0 HG3 PRO A 135 -13.643 -13.504 -12.225 1.00 1.19 H new ATOM 0 HD2 PRO A 135 -12.764 -10.830 -11.632 1.00 0.76 H new ATOM 0 HD3 PRO A 135 -14.407 -11.353 -11.946 1.00 0.76 H new ATOM 2172 N GLU A 136 -12.726 -12.890 -7.325 1.00 1.10 N ATOM 2173 CA GLU A 136 -12.434 -13.186 -5.916 1.00 1.59 C ATOM 2174 C GLU A 136 -12.962 -12.101 -4.967 1.00 1.68 C ATOM 2175 O GLU A 136 -13.348 -12.385 -3.834 1.00 2.17 O ATOM 2176 CB GLU A 136 -10.921 -13.340 -5.763 1.00 1.78 C ATOM 2177 CG GLU A 136 -10.399 -13.228 -4.344 1.00 2.38 C ATOM 2178 CD GLU A 136 -10.729 -14.423 -3.467 1.00 3.03 C ATOM 2179 OE1 GLU A 136 -10.191 -15.521 -3.724 1.00 3.50 O ATOM 2180 OE2 GLU A 136 -11.560 -14.276 -2.546 1.00 3.30 O ATOM 0 H GLU A 136 -11.912 -12.604 -7.868 1.00 1.10 H new ATOM 0 HA GLU A 136 -12.945 -14.109 -5.641 1.00 1.59 H new ATOM 0 HB2 GLU A 136 -10.629 -14.310 -6.165 1.00 1.78 H new ATOM 0 HB3 GLU A 136 -10.431 -12.581 -6.374 1.00 1.78 H new ATOM 0 HG2 GLU A 136 -9.317 -13.101 -4.375 1.00 2.38 H new ATOM 0 HG3 GLU A 136 -10.812 -12.329 -3.886 1.00 2.38 H new ATOM 2187 N TYR A 137 -12.997 -10.874 -5.462 1.00 1.38 N ATOM 2188 CA TYR A 137 -13.287 -9.686 -4.649 1.00 1.79 C ATOM 2189 C TYR A 137 -14.569 -9.765 -3.777 1.00 1.42 C ATOM 2190 O TYR A 137 -14.538 -9.280 -2.649 1.00 1.58 O ATOM 2191 CB TYR A 137 -13.324 -8.457 -5.561 1.00 2.49 C ATOM 2192 CG TYR A 137 -13.816 -7.184 -4.897 1.00 3.43 C ATOM 2193 CD1 TYR A 137 -15.174 -6.905 -4.821 1.00 3.49 C ATOM 2194 CD2 TYR A 137 -12.928 -6.268 -4.343 1.00 4.47 C ATOM 2195 CE1 TYR A 137 -15.634 -5.753 -4.214 1.00 4.37 C ATOM 2196 CE2 TYR A 137 -13.381 -5.115 -3.735 1.00 5.35 C ATOM 2197 CZ TYR A 137 -14.704 -4.843 -3.688 1.00 5.22 C ATOM 2198 OH TYR A 137 -15.186 -3.714 -3.067 1.00 6.12 O ATOM 0 H TYR A 137 -12.825 -10.665 -6.445 1.00 1.38 H new ATOM 0 HA TYR A 137 -12.479 -9.615 -3.921 1.00 1.79 H new ATOM 0 HB2 TYR A 137 -12.322 -8.282 -5.951 1.00 2.49 H new ATOM 0 HB3 TYR A 137 -13.965 -8.675 -6.415 1.00 2.49 H new ATOM 0 HD1 TYR A 137 -15.883 -7.601 -5.244 1.00 3.49 H new ATOM 0 HD2 TYR A 137 -11.867 -6.462 -4.389 1.00 4.47 H new ATOM 0 HE1 TYR A 137 -16.694 -5.555 -4.145 1.00 4.37 H new ATOM 0 HE2 TYR A 137 -12.675 -4.427 -3.295 1.00 5.35 H new ATOM 0 HH TYR A 137 -15.595 -3.124 -3.733 1.00 6.12 H new ATOM 2208 N PRO A 138 -15.718 -10.302 -4.268 1.00 1.33 N ATOM 2209 CA PRO A 138 -16.946 -10.436 -3.452 1.00 1.10 C ATOM 2210 C PRO A 138 -16.696 -11.006 -2.046 1.00 0.99 C ATOM 2211 O PRO A 138 -16.389 -12.189 -1.888 1.00 0.99 O ATOM 2212 CB PRO A 138 -17.791 -11.403 -4.275 1.00 0.97 C ATOM 2213 CG PRO A 138 -17.413 -11.103 -5.680 1.00 1.56 C ATOM 2214 CD PRO A 138 -15.944 -10.776 -5.649 1.00 1.77 C ATOM 0 HA PRO A 138 -17.410 -9.468 -3.265 1.00 1.10 H new ATOM 0 HB2 PRO A 138 -17.577 -12.440 -4.017 1.00 0.97 H new ATOM 0 HB3 PRO A 138 -18.856 -11.246 -4.106 1.00 0.97 H new ATOM 0 HG2 PRO A 138 -17.610 -11.957 -6.329 1.00 1.56 H new ATOM 0 HG3 PRO A 138 -17.992 -10.266 -6.070 1.00 1.56 H new ATOM 0 HD2 PRO A 138 -15.335 -11.651 -5.877 1.00 1.77 H new ATOM 0 HD3 PRO A 138 -15.689 -10.010 -6.382 1.00 1.77 H new ATOM 2222 N PRO A 139 -16.817 -10.150 -1.009 1.00 0.96 N ATOM 2223 CA PRO A 139 -16.559 -10.510 0.381 1.00 0.91 C ATOM 2224 C PRO A 139 -17.818 -10.805 1.191 1.00 1.00 C ATOM 2225 O PRO A 139 -18.886 -11.089 0.651 1.00 1.25 O ATOM 2226 CB PRO A 139 -15.921 -9.230 0.904 1.00 0.82 C ATOM 2227 CG PRO A 139 -16.575 -8.121 0.130 1.00 0.89 C ATOM 2228 CD PRO A 139 -17.185 -8.734 -1.114 1.00 1.06 C ATOM 0 HA PRO A 139 -15.965 -11.421 0.461 1.00 0.91 H new ATOM 0 HB2 PRO A 139 -16.089 -9.115 1.975 1.00 0.82 H new ATOM 0 HB3 PRO A 139 -14.842 -9.236 0.749 1.00 0.82 H new ATOM 0 HG2 PRO A 139 -17.341 -7.633 0.732 1.00 0.89 H new ATOM 0 HG3 PRO A 139 -15.845 -7.357 -0.137 1.00 0.89 H new ATOM 0 HD2 PRO A 139 -18.266 -8.600 -1.139 1.00 1.06 H new ATOM 0 HD3 PRO A 139 -16.787 -8.281 -2.022 1.00 1.06 H new ATOM 2236 N SER A 140 -17.670 -10.687 2.505 1.00 0.90 N ATOM 2237 CA SER A 140 -18.755 -10.883 3.438 1.00 1.01 C ATOM 2238 C SER A 140 -18.684 -9.757 4.467 1.00 1.01 C ATOM 2239 O SER A 140 -18.144 -8.694 4.165 1.00 1.13 O ATOM 2240 CB SER A 140 -18.637 -12.264 4.098 1.00 1.09 C ATOM 2241 OG SER A 140 -19.778 -12.562 4.887 1.00 1.60 O ATOM 0 H SER A 140 -16.783 -10.450 2.949 1.00 0.90 H new ATOM 0 HA SER A 140 -19.720 -10.854 2.933 1.00 1.01 H new ATOM 0 HB2 SER A 140 -18.516 -13.027 3.329 1.00 1.09 H new ATOM 0 HB3 SER A 140 -17.744 -12.295 4.722 1.00 1.09 H new ATOM 0 HG SER A 140 -19.673 -13.448 5.292 1.00 1.60 H new ATOM 2247 N SER A 141 -19.209 -9.966 5.659 1.00 1.07 N ATOM 2248 CA SER A 141 -19.166 -8.927 6.674 1.00 1.19 C ATOM 2249 C SER A 141 -17.906 -9.037 7.534 1.00 1.07 C ATOM 2250 O SER A 141 -17.283 -8.027 7.865 1.00 1.22 O ATOM 2251 CB SER A 141 -20.416 -8.995 7.549 1.00 1.47 C ATOM 2252 OG SER A 141 -21.594 -8.932 6.758 1.00 1.97 O ATOM 0 H SER A 141 -19.664 -10.832 5.947 1.00 1.07 H new ATOM 0 HA SER A 141 -19.138 -7.962 6.167 1.00 1.19 H new ATOM 0 HB2 SER A 141 -20.410 -9.919 8.127 1.00 1.47 H new ATOM 0 HB3 SER A 141 -20.409 -8.172 8.264 1.00 1.47 H new ATOM 0 HG SER A 141 -22.381 -8.979 7.340 1.00 1.97 H new ATOM 2258 N ASN A 142 -17.534 -10.264 7.893 1.00 0.97 N ATOM 2259 CA ASN A 142 -16.348 -10.488 8.717 1.00 0.95 C ATOM 2260 C ASN A 142 -15.091 -10.056 7.973 1.00 0.86 C ATOM 2261 O ASN A 142 -14.302 -9.258 8.480 1.00 1.07 O ATOM 2262 CB ASN A 142 -16.237 -11.960 9.124 1.00 1.01 C ATOM 2263 CG ASN A 142 -15.121 -12.197 10.126 1.00 1.37 C ATOM 2264 OD1 ASN A 142 -13.993 -12.521 9.758 1.00 2.18 O ATOM 2265 ND2 ASN A 142 -15.428 -12.021 11.402 1.00 1.73 N ATOM 0 H ASN A 142 -18.033 -11.113 7.628 1.00 0.97 H new ATOM 0 HA ASN A 142 -16.447 -9.886 9.620 1.00 0.95 H new ATOM 0 HB2 ASN A 142 -17.184 -12.289 9.553 1.00 1.01 H new ATOM 0 HB3 ASN A 142 -16.061 -12.568 8.237 1.00 1.01 H new ATOM 0 HD21 ASN A 142 -14.717 -12.154 12.121 1.00 1.73 H new ATOM 0 HD22 ASN A 142 -16.376 -11.752 11.666 1.00 1.73 H new ATOM 2272 N TYR A 143 -14.918 -10.577 6.767 1.00 0.71 N ATOM 2273 CA TYR A 143 -13.806 -10.177 5.926 1.00 0.67 C ATOM 2274 C TYR A 143 -14.267 -9.100 4.990 1.00 0.61 C ATOM 2275 O TYR A 143 -15.037 -9.350 4.057 1.00 0.67 O ATOM 2276 CB TYR A 143 -13.241 -11.370 5.158 1.00 0.76 C ATOM 2277 CG TYR A 143 -12.787 -12.487 6.068 1.00 0.84 C ATOM 2278 CD1 TYR A 143 -11.656 -12.347 6.861 1.00 0.91 C ATOM 2279 CD2 TYR A 143 -13.474 -13.696 6.110 1.00 0.97 C ATOM 2280 CE1 TYR A 143 -11.222 -13.377 7.671 1.00 1.02 C ATOM 2281 CE2 TYR A 143 -13.049 -14.728 6.923 1.00 1.09 C ATOM 2282 CZ TYR A 143 -11.984 -14.523 7.781 1.00 1.09 C ATOM 2283 OH TYR A 143 -11.482 -15.596 8.495 1.00 1.23 O ATOM 0 H TYR A 143 -15.534 -11.276 6.352 1.00 0.71 H new ATOM 0 HA TYR A 143 -13.001 -9.790 6.551 1.00 0.67 H new ATOM 0 HB2 TYR A 143 -14.001 -11.750 4.475 1.00 0.76 H new ATOM 0 HB3 TYR A 143 -12.400 -11.039 4.548 1.00 0.76 H new ATOM 0 HD1 TYR A 143 -11.107 -11.417 6.844 1.00 0.91 H new ATOM 0 HD2 TYR A 143 -14.353 -13.829 5.497 1.00 0.97 H new ATOM 0 HE1 TYR A 143 -10.293 -13.287 8.215 1.00 1.02 H new ATOM 0 HE2 TYR A 143 -13.544 -15.687 6.889 1.00 1.09 H new ATOM 0 HH TYR A 143 -12.132 -16.329 8.484 1.00 1.23 H new ATOM 2293 N ILE A 144 -13.793 -7.900 5.245 1.00 0.56 N ATOM 2294 CA ILE A 144 -14.266 -6.756 4.524 1.00 0.53 C ATOM 2295 C ILE A 144 -13.250 -6.310 3.507 1.00 0.46 C ATOM 2296 O ILE A 144 -12.109 -5.979 3.836 1.00 0.47 O ATOM 2297 CB ILE A 144 -14.661 -5.571 5.434 1.00 0.61 C ATOM 2298 CG1 ILE A 144 -14.662 -4.277 4.616 1.00 0.62 C ATOM 2299 CG2 ILE A 144 -13.748 -5.458 6.646 1.00 0.68 C ATOM 2300 CD1 ILE A 144 -15.086 -3.066 5.393 1.00 0.82 C ATOM 0 H ILE A 144 -13.081 -7.699 5.947 1.00 0.56 H new ATOM 0 HA ILE A 144 -15.176 -7.077 4.018 1.00 0.53 H new ATOM 0 HB ILE A 144 -15.665 -5.750 5.818 1.00 0.61 H new ATOM 0 HG12 ILE A 144 -13.661 -4.109 4.219 1.00 0.62 H new ATOM 0 HG13 ILE A 144 -15.328 -4.400 3.762 1.00 0.62 H new ATOM 0 HG21 ILE A 144 -14.060 -4.613 7.259 1.00 0.68 H new ATOM 0 HG22 ILE A 144 -13.808 -6.374 7.233 1.00 0.68 H new ATOM 0 HG23 ILE A 144 -12.721 -5.306 6.315 1.00 0.68 H new ATOM 0 HD11 ILE A 144 -15.061 -2.190 4.744 1.00 0.82 H new ATOM 0 HD12 ILE A 144 -16.099 -3.211 5.768 1.00 0.82 H new ATOM 0 HD13 ILE A 144 -14.407 -2.916 6.232 1.00 0.82 H new ATOM 2312 N ARG A 145 -13.676 -6.348 2.267 1.00 0.43 N ATOM 2313 CA ARG A 145 -12.884 -5.822 1.175 1.00 0.41 C ATOM 2314 C ARG A 145 -12.693 -4.332 1.354 1.00 0.45 C ATOM 2315 O ARG A 145 -13.596 -3.540 1.073 1.00 0.48 O ATOM 2316 CB ARG A 145 -13.526 -6.116 -0.187 1.00 0.44 C ATOM 2317 CG ARG A 145 -12.828 -7.233 -0.952 1.00 0.81 C ATOM 2318 CD ARG A 145 -12.853 -8.535 -0.158 1.00 2.08 C ATOM 2319 NE ARG A 145 -11.999 -9.572 -0.729 1.00 2.70 N ATOM 2320 CZ ARG A 145 -12.395 -10.824 -0.993 1.00 3.63 C ATOM 2321 NH1 ARG A 145 -13.650 -11.191 -0.809 1.00 4.14 N ATOM 2322 NH2 ARG A 145 -11.517 -11.706 -1.444 1.00 4.42 N ATOM 0 H ARG A 145 -14.574 -6.741 1.985 1.00 0.43 H new ATOM 0 HA ARG A 145 -11.914 -6.319 1.193 1.00 0.41 H new ATOM 0 HB2 ARG A 145 -14.572 -6.385 -0.038 1.00 0.44 H new ATOM 0 HB3 ARG A 145 -13.514 -5.208 -0.791 1.00 0.44 H new ATOM 0 HG2 ARG A 145 -13.317 -7.380 -1.915 1.00 0.81 H new ATOM 0 HG3 ARG A 145 -11.796 -6.948 -1.159 1.00 0.81 H new ATOM 0 HD2 ARG A 145 -12.536 -8.335 0.866 1.00 2.08 H new ATOM 0 HD3 ARG A 145 -13.878 -8.903 -0.108 1.00 2.08 H new ATOM 0 HE ARG A 145 -11.032 -9.326 -0.942 1.00 2.70 H new ATOM 0 HH11 ARG A 145 -14.333 -10.517 -0.461 1.00 4.14 H new ATOM 0 HH12 ARG A 145 -13.937 -12.148 -1.014 1.00 4.14 H new ATOM 0 HH21 ARG A 145 -10.546 -11.431 -1.588 1.00 4.42 H new ATOM 0 HH22 ARG A 145 -11.812 -12.661 -1.647 1.00 4.42 H new ATOM 2336 N GLY A 146 -11.533 -3.963 1.876 1.00 0.62 N ATOM 2337 CA GLY A 146 -11.200 -2.569 2.019 1.00 0.79 C ATOM 2338 C GLY A 146 -11.167 -1.906 0.673 1.00 0.57 C ATOM 2339 O GLY A 146 -10.301 -2.205 -0.146 1.00 0.62 O ATOM 0 H GLY A 146 -10.816 -4.611 2.203 1.00 0.62 H new ATOM 0 HA2 GLY A 146 -11.932 -2.076 2.658 1.00 0.79 H new ATOM 0 HA3 GLY A 146 -10.231 -2.467 2.507 1.00 0.79 H new ATOM 2343 N TYR A 147 -12.111 -1.019 0.424 1.00 0.58 N ATOM 2344 CA TYR A 147 -12.243 -0.458 -0.897 1.00 0.56 C ATOM 2345 C TYR A 147 -11.297 0.718 -1.071 1.00 0.54 C ATOM 2346 O TYR A 147 -11.653 1.875 -0.852 1.00 0.67 O ATOM 2347 CB TYR A 147 -13.687 -0.052 -1.187 1.00 0.86 C ATOM 2348 CG TYR A 147 -13.930 0.212 -2.654 1.00 1.69 C ATOM 2349 CD1 TYR A 147 -14.102 -0.842 -3.545 1.00 2.19 C ATOM 2350 CD2 TYR A 147 -13.959 1.506 -3.153 1.00 2.23 C ATOM 2351 CE1 TYR A 147 -14.293 -0.606 -4.893 1.00 3.07 C ATOM 2352 CE2 TYR A 147 -14.156 1.748 -4.497 1.00 3.13 C ATOM 2353 CZ TYR A 147 -14.319 0.690 -5.364 1.00 3.51 C ATOM 2354 OH TYR A 147 -14.492 0.933 -6.707 1.00 4.44 O ATOM 0 H TYR A 147 -12.785 -0.679 1.110 1.00 0.58 H new ATOM 0 HA TYR A 147 -11.970 -1.227 -1.620 1.00 0.56 H new ATOM 0 HB2 TYR A 147 -14.358 -0.841 -0.847 1.00 0.86 H new ATOM 0 HB3 TYR A 147 -13.931 0.843 -0.615 1.00 0.86 H new ATOM 0 HD1 TYR A 147 -14.086 -1.858 -3.179 1.00 2.19 H new ATOM 0 HD2 TYR A 147 -13.825 2.338 -2.478 1.00 2.23 H new ATOM 0 HE1 TYR A 147 -14.421 -1.433 -5.575 1.00 3.07 H new ATOM 0 HE2 TYR A 147 -14.182 2.762 -4.868 1.00 3.13 H new ATOM 0 HH TYR A 147 -14.487 1.900 -6.868 1.00 4.44 H new ATOM 2364 N ASN A 148 -10.073 0.386 -1.428 1.00 0.46 N ATOM 2365 CA ASN A 148 -9.063 1.371 -1.750 1.00 0.47 C ATOM 2366 C ASN A 148 -9.370 2.003 -3.098 1.00 0.45 C ATOM 2367 O ASN A 148 -9.111 1.409 -4.150 1.00 0.58 O ATOM 2368 CB ASN A 148 -7.679 0.712 -1.788 1.00 0.49 C ATOM 2369 CG ASN A 148 -7.253 0.146 -0.445 1.00 1.08 C ATOM 2370 OD1 ASN A 148 -7.590 0.688 0.611 1.00 1.45 O ATOM 2371 ND2 ASN A 148 -6.519 -0.956 -0.476 1.00 1.62 N ATOM 0 H ASN A 148 -9.750 -0.579 -1.503 1.00 0.46 H new ATOM 0 HA ASN A 148 -9.066 2.145 -0.982 1.00 0.47 H new ATOM 0 HB2 ASN A 148 -7.684 -0.088 -2.528 1.00 0.49 H new ATOM 0 HB3 ASN A 148 -6.943 1.445 -2.117 1.00 0.49 H new ATOM 0 HD21 ASN A 148 -6.211 -1.388 0.395 1.00 1.62 H new ATOM 0 HD22 ASN A 148 -6.262 -1.373 -1.371 1.00 1.62 H new ATOM 2378 N HIS A 149 -9.965 3.189 -3.064 1.00 0.43 N ATOM 2379 CA HIS A 149 -10.175 3.969 -4.276 1.00 0.45 C ATOM 2380 C HIS A 149 -8.823 4.270 -4.877 1.00 0.40 C ATOM 2381 O HIS A 149 -7.930 4.646 -4.134 1.00 0.69 O ATOM 2382 CB HIS A 149 -10.865 5.292 -3.967 1.00 0.60 C ATOM 2383 CG HIS A 149 -12.297 5.170 -3.548 1.00 1.08 C ATOM 2384 ND1 HIS A 149 -13.344 5.514 -4.372 1.00 1.67 N ATOM 2385 CD2 HIS A 149 -12.855 4.761 -2.384 1.00 1.88 C ATOM 2386 CE1 HIS A 149 -14.482 5.325 -3.735 1.00 2.14 C ATOM 2387 NE2 HIS A 149 -14.217 4.866 -2.527 1.00 2.32 N ATOM 0 H HIS A 149 -10.310 3.631 -2.212 1.00 0.43 H new ATOM 0 HA HIS A 149 -10.804 3.398 -4.959 1.00 0.45 H new ATOM 0 HB2 HIS A 149 -10.312 5.798 -3.176 1.00 0.60 H new ATOM 0 HB3 HIS A 149 -10.812 5.928 -4.851 1.00 0.60 H new ATOM 0 HD2 HIS A 149 -12.328 4.416 -1.507 1.00 1.88 H new ATOM 0 HE1 HIS A 149 -15.467 5.514 -4.135 1.00 2.14 H new ATOM 0 HE2 HIS A 149 -14.909 4.628 -1.817 1.00 2.32 H new ATOM 2396 N PRO A 150 -8.705 4.142 -6.226 1.00 0.32 N ATOM 2397 CA PRO A 150 -7.456 4.182 -7.012 1.00 0.32 C ATOM 2398 C PRO A 150 -6.278 4.883 -6.349 1.00 0.36 C ATOM 2399 O PRO A 150 -5.819 5.932 -6.803 1.00 0.47 O ATOM 2400 CB PRO A 150 -7.891 4.955 -8.258 1.00 0.41 C ATOM 2401 CG PRO A 150 -9.388 4.821 -8.331 1.00 0.53 C ATOM 2402 CD PRO A 150 -9.828 3.995 -7.148 1.00 0.46 C ATOM 0 HA PRO A 150 -7.073 3.175 -7.176 1.00 0.32 H new ATOM 0 HB2 PRO A 150 -7.596 6.002 -8.190 1.00 0.41 H new ATOM 0 HB3 PRO A 150 -7.419 4.549 -9.153 1.00 0.41 H new ATOM 0 HG2 PRO A 150 -9.862 5.802 -8.311 1.00 0.53 H new ATOM 0 HG3 PRO A 150 -9.685 4.343 -9.264 1.00 0.53 H new ATOM 0 HD2 PRO A 150 -10.758 4.366 -6.717 1.00 0.46 H new ATOM 0 HD3 PRO A 150 -9.996 2.953 -7.420 1.00 0.46 H new ATOM 2410 N CYS A 151 -5.794 4.279 -5.289 1.00 0.38 N ATOM 2411 CA CYS A 151 -4.643 4.768 -4.585 1.00 0.48 C ATOM 2412 C CYS A 151 -3.405 4.043 -5.071 1.00 0.43 C ATOM 2413 O CYS A 151 -3.467 3.252 -6.013 1.00 0.77 O ATOM 2414 CB CYS A 151 -4.834 4.575 -3.082 1.00 0.84 C ATOM 2415 SG CYS A 151 -5.184 2.872 -2.589 1.00 1.58 S ATOM 0 H CYS A 151 -6.194 3.429 -4.892 1.00 0.38 H new ATOM 0 HA CYS A 151 -4.519 5.833 -4.780 1.00 0.48 H new ATOM 0 HB2 CYS A 151 -3.934 4.912 -2.567 1.00 0.84 H new ATOM 0 HB3 CYS A 151 -5.651 5.213 -2.747 1.00 0.84 H new ATOM 0 HG CYS A 151 -5.327 2.815 -1.298 1.00 1.58 H new ATOM 2421 N GLY A 152 -2.283 4.313 -4.448 1.00 0.34 N ATOM 2422 CA GLY A 152 -1.063 3.712 -4.896 1.00 0.39 C ATOM 2423 C GLY A 152 0.095 4.081 -4.024 1.00 0.36 C ATOM 2424 O GLY A 152 0.026 5.014 -3.228 1.00 0.43 O ATOM 0 H GLY A 152 -2.195 4.934 -3.644 1.00 0.34 H new ATOM 0 HA2 GLY A 152 -1.176 2.628 -4.909 1.00 0.39 H new ATOM 0 HA3 GLY A 152 -0.860 4.024 -5.920 1.00 0.39 H new ATOM 2428 N PHE A 153 1.180 3.422 -4.286 1.00 0.32 N ATOM 2429 CA PHE A 153 2.269 3.269 -3.351 1.00 0.31 C ATOM 2430 C PHE A 153 3.550 3.393 -4.141 1.00 0.30 C ATOM 2431 O PHE A 153 4.111 2.399 -4.603 1.00 0.38 O ATOM 2432 CB PHE A 153 2.141 1.878 -2.706 1.00 0.36 C ATOM 2433 CG PHE A 153 3.022 1.592 -1.514 1.00 0.38 C ATOM 2434 CD1 PHE A 153 4.402 1.610 -1.648 1.00 0.49 C ATOM 2435 CD2 PHE A 153 2.482 1.342 -0.264 1.00 0.54 C ATOM 2436 CE1 PHE A 153 5.223 1.380 -0.561 1.00 0.55 C ATOM 2437 CE2 PHE A 153 3.298 1.111 0.826 1.00 0.60 C ATOM 2438 CZ PHE A 153 4.621 1.001 0.683 1.00 0.52 C ATOM 0 H PHE A 153 1.345 2.959 -5.180 1.00 0.32 H new ATOM 0 HA PHE A 153 2.258 4.021 -2.562 1.00 0.31 H new ATOM 0 HB2 PHE A 153 1.104 1.740 -2.401 1.00 0.36 H new ATOM 0 HB3 PHE A 153 2.351 1.130 -3.470 1.00 0.36 H new ATOM 0 HD1 PHE A 153 4.841 1.806 -2.615 1.00 0.49 H new ATOM 0 HD2 PHE A 153 1.409 1.327 -0.140 1.00 0.54 H new ATOM 0 HE1 PHE A 153 6.295 1.484 -0.647 1.00 0.55 H new ATOM 0 HE2 PHE A 153 2.860 1.018 1.809 1.00 0.60 H new ATOM 0 HZ PHE A 153 5.230 0.631 1.495 1.00 0.52 H new ATOM 2448 N VAL A 154 3.978 4.617 -4.351 1.00 0.25 N ATOM 2449 CA VAL A 154 5.069 4.859 -5.254 1.00 0.25 C ATOM 2450 C VAL A 154 6.393 4.891 -4.515 1.00 0.24 C ATOM 2451 O VAL A 154 6.493 5.346 -3.373 1.00 0.31 O ATOM 2452 CB VAL A 154 4.891 6.157 -6.076 1.00 0.25 C ATOM 2453 CG1 VAL A 154 3.478 6.298 -6.608 1.00 0.27 C ATOM 2454 CG2 VAL A 154 5.287 7.393 -5.296 1.00 0.26 C ATOM 0 H VAL A 154 3.589 5.451 -3.911 1.00 0.25 H new ATOM 0 HA VAL A 154 5.071 4.026 -5.957 1.00 0.25 H new ATOM 0 HB VAL A 154 5.569 6.072 -6.925 1.00 0.25 H new ATOM 0 HG11 VAL A 154 3.395 7.222 -7.180 1.00 0.27 H new ATOM 0 HG12 VAL A 154 3.246 5.451 -7.253 1.00 0.27 H new ATOM 0 HG13 VAL A 154 2.776 6.323 -5.774 1.00 0.27 H new ATOM 0 HG21 VAL A 154 5.143 8.277 -5.917 1.00 0.26 H new ATOM 0 HG22 VAL A 154 4.668 7.473 -4.402 1.00 0.26 H new ATOM 0 HG23 VAL A 154 6.335 7.320 -5.006 1.00 0.26 H new ATOM 2464 N CYS A 155 7.393 4.369 -5.171 1.00 0.21 N ATOM 2465 CA CYS A 155 8.741 4.388 -4.663 1.00 0.23 C ATOM 2466 C CYS A 155 9.623 5.140 -5.636 1.00 0.27 C ATOM 2467 O CYS A 155 9.646 4.818 -6.818 1.00 0.42 O ATOM 2468 CB CYS A 155 9.238 2.962 -4.489 1.00 0.27 C ATOM 2469 SG CYS A 155 11.026 2.823 -4.324 1.00 1.55 S ATOM 0 H CYS A 155 7.297 3.915 -6.079 1.00 0.21 H new ATOM 0 HA CYS A 155 8.769 4.887 -3.695 1.00 0.23 H new ATOM 0 HB2 CYS A 155 8.767 2.530 -3.606 1.00 0.27 H new ATOM 0 HB3 CYS A 155 8.915 2.369 -5.345 1.00 0.27 H new ATOM 0 HG CYS A 155 11.464 3.762 -3.538 1.00 1.55 H new ATOM 2475 N SER A 156 10.347 6.137 -5.168 1.00 0.25 N ATOM 2476 CA SER A 156 11.099 6.962 -6.094 1.00 0.29 C ATOM 2477 C SER A 156 12.591 6.896 -5.811 1.00 0.30 C ATOM 2478 O SER A 156 13.049 7.335 -4.760 1.00 0.29 O ATOM 2479 CB SER A 156 10.614 8.413 -6.031 1.00 0.32 C ATOM 2480 OG SER A 156 9.197 8.480 -6.047 1.00 1.06 O ATOM 0 H SER A 156 10.431 6.391 -4.184 1.00 0.25 H new ATOM 0 HA SER A 156 10.929 6.573 -7.098 1.00 0.29 H new ATOM 0 HB2 SER A 156 10.993 8.887 -5.126 1.00 0.32 H new ATOM 0 HB3 SER A 156 11.017 8.971 -6.876 1.00 0.32 H new ATOM 0 HG SER A 156 8.913 9.417 -6.004 1.00 1.06 H new ATOM 2486 N PRO A 157 13.363 6.296 -6.724 1.00 0.36 N ATOM 2487 CA PRO A 157 14.817 6.406 -6.692 1.00 0.39 C ATOM 2488 C PRO A 157 15.223 7.870 -6.594 1.00 0.40 C ATOM 2489 O PRO A 157 15.106 8.619 -7.566 1.00 0.49 O ATOM 2490 CB PRO A 157 15.246 5.810 -8.035 1.00 0.51 C ATOM 2491 CG PRO A 157 14.147 4.876 -8.411 1.00 0.56 C ATOM 2492 CD PRO A 157 12.885 5.455 -7.836 1.00 0.45 C ATOM 0 HA PRO A 157 15.275 5.900 -5.842 1.00 0.39 H new ATOM 0 HB2 PRO A 157 15.378 6.587 -8.788 1.00 0.51 H new ATOM 0 HB3 PRO A 157 16.197 5.285 -7.948 1.00 0.51 H new ATOM 0 HG2 PRO A 157 14.072 4.780 -9.494 1.00 0.56 H new ATOM 0 HG3 PRO A 157 14.333 3.878 -8.014 1.00 0.56 H new ATOM 0 HD2 PRO A 157 12.340 6.041 -8.576 1.00 0.45 H new ATOM 0 HD3 PRO A 157 12.209 4.675 -7.486 1.00 0.45 H new ATOM 2500 N MET A 158 15.669 8.289 -5.413 1.00 0.37 N ATOM 2501 CA MET A 158 15.893 9.708 -5.156 1.00 0.43 C ATOM 2502 C MET A 158 17.107 10.244 -5.882 1.00 0.48 C ATOM 2503 O MET A 158 17.712 9.567 -6.709 1.00 0.49 O ATOM 2504 CB MET A 158 16.063 10.003 -3.668 1.00 0.43 C ATOM 2505 CG MET A 158 14.786 10.402 -2.968 1.00 0.50 C ATOM 2506 SD MET A 158 15.094 11.079 -1.329 1.00 0.95 S ATOM 2507 CE MET A 158 16.100 12.507 -1.725 1.00 1.16 C ATOM 0 H MET A 158 15.880 7.674 -4.627 1.00 0.37 H new ATOM 0 HA MET A 158 14.999 10.207 -5.531 1.00 0.43 H new ATOM 0 HB2 MET A 158 16.472 9.120 -3.178 1.00 0.43 H new ATOM 0 HB3 MET A 158 16.795 10.802 -3.548 1.00 0.43 H new ATOM 0 HG2 MET A 158 14.258 11.141 -3.571 1.00 0.50 H new ATOM 0 HG3 MET A 158 14.133 9.533 -2.884 1.00 0.50 H new ATOM 0 HE1 MET A 158 15.977 13.265 -0.951 1.00 1.16 H new ATOM 0 HE2 MET A 158 17.147 12.210 -1.780 1.00 1.16 H new ATOM 0 HE3 MET A 158 15.788 12.916 -2.686 1.00 1.16 H new ATOM 2517 N GLU A 159 17.462 11.467 -5.547 1.00 0.57 N ATOM 2518 CA GLU A 159 18.659 12.093 -6.061 1.00 0.62 C ATOM 2519 C GLU A 159 19.887 11.307 -5.607 1.00 0.54 C ATOM 2520 O GLU A 159 20.955 11.378 -6.211 1.00 0.59 O ATOM 2521 CB GLU A 159 18.711 13.537 -5.566 1.00 0.76 C ATOM 2522 CG GLU A 159 19.746 14.406 -6.248 1.00 1.38 C ATOM 2523 CD GLU A 159 19.513 15.874 -5.967 1.00 1.87 C ATOM 2524 OE1 GLU A 159 20.064 16.382 -4.966 1.00 2.63 O ATOM 2525 OE2 GLU A 159 18.803 16.531 -6.748 1.00 2.09 O ATOM 0 H GLU A 159 16.926 12.055 -4.909 1.00 0.57 H new ATOM 0 HA GLU A 159 18.648 12.096 -7.151 1.00 0.62 H new ATOM 0 HB2 GLU A 159 17.729 13.989 -5.705 1.00 0.76 H new ATOM 0 HB3 GLU A 159 18.911 13.532 -4.494 1.00 0.76 H new ATOM 0 HG2 GLU A 159 20.742 14.123 -5.906 1.00 1.38 H new ATOM 0 HG3 GLU A 159 19.717 14.232 -7.324 1.00 1.38 H new ATOM 2532 N GLU A 160 19.702 10.522 -4.552 1.00 0.52 N ATOM 2533 CA GLU A 160 20.770 9.702 -4.001 1.00 0.55 C ATOM 2534 C GLU A 160 20.548 8.237 -4.358 1.00 0.58 C ATOM 2535 O GLU A 160 21.223 7.357 -3.839 1.00 0.76 O ATOM 2536 CB GLU A 160 20.826 9.880 -2.485 1.00 0.63 C ATOM 2537 CG GLU A 160 21.073 11.317 -2.059 1.00 0.77 C ATOM 2538 CD GLU A 160 22.431 11.824 -2.492 1.00 1.32 C ATOM 2539 OE1 GLU A 160 22.529 12.356 -3.614 1.00 2.05 O ATOM 2540 OE2 GLU A 160 23.400 11.695 -1.715 1.00 1.61 O ATOM 0 H GLU A 160 18.813 10.437 -4.059 1.00 0.52 H new ATOM 0 HA GLU A 160 21.721 10.019 -4.429 1.00 0.55 H new ATOM 0 HB2 GLU A 160 19.888 9.535 -2.050 1.00 0.63 H new ATOM 0 HB3 GLU A 160 21.616 9.247 -2.080 1.00 0.63 H new ATOM 0 HG2 GLU A 160 20.298 11.956 -2.482 1.00 0.77 H new ATOM 0 HG3 GLU A 160 20.990 11.391 -0.975 1.00 0.77 H new ATOM 2547 N ASN A 161 19.586 8.025 -5.257 1.00 0.51 N ATOM 2548 CA ASN A 161 19.138 6.703 -5.728 1.00 0.65 C ATOM 2549 C ASN A 161 19.334 5.544 -4.719 1.00 0.53 C ATOM 2550 O ASN A 161 18.452 5.340 -3.890 1.00 0.53 O ATOM 2551 CB ASN A 161 19.693 6.378 -7.128 1.00 0.92 C ATOM 2552 CG ASN A 161 19.044 7.190 -8.234 1.00 1.07 C ATOM 2553 OD1 ASN A 161 18.032 6.787 -8.800 1.00 1.93 O ATOM 2554 ND2 ASN A 161 19.631 8.329 -8.567 1.00 1.62 N ATOM 0 H ASN A 161 19.076 8.792 -5.696 1.00 0.51 H new ATOM 0 HA ASN A 161 18.055 6.788 -5.813 1.00 0.65 H new ATOM 0 HB2 ASN A 161 20.768 6.559 -7.136 1.00 0.92 H new ATOM 0 HB3 ASN A 161 19.547 5.317 -7.332 1.00 0.92 H new ATOM 0 HD21 ASN A 161 19.243 8.903 -9.316 1.00 1.62 H new ATOM 0 HD22 ASN A 161 20.471 8.633 -8.075 1.00 1.62 H new ATOM 2561 N PRO A 162 20.452 4.757 -4.732 1.00 0.55 N ATOM 2562 CA PRO A 162 20.556 3.576 -3.873 1.00 0.57 C ATOM 2563 C PRO A 162 20.839 3.924 -2.416 1.00 0.55 C ATOM 2564 O PRO A 162 20.775 3.067 -1.536 1.00 0.63 O ATOM 2565 CB PRO A 162 21.734 2.808 -4.463 1.00 0.71 C ATOM 2566 CG PRO A 162 22.606 3.869 -5.017 1.00 0.73 C ATOM 2567 CD PRO A 162 21.673 4.914 -5.554 1.00 0.67 C ATOM 0 HA PRO A 162 19.621 3.016 -3.854 1.00 0.57 H new ATOM 0 HB2 PRO A 162 22.251 2.222 -3.703 1.00 0.71 H new ATOM 0 HB3 PRO A 162 21.410 2.112 -5.237 1.00 0.71 H new ATOM 0 HG2 PRO A 162 23.258 4.283 -4.248 1.00 0.73 H new ATOM 0 HG3 PRO A 162 23.250 3.477 -5.804 1.00 0.73 H new ATOM 0 HD2 PRO A 162 22.095 5.914 -5.456 1.00 0.67 H new ATOM 0 HD3 PRO A 162 21.465 4.758 -6.613 1.00 0.67 H new ATOM 2575 N ALA A 163 21.167 5.182 -2.174 1.00 0.53 N ATOM 2576 CA ALA A 163 21.483 5.641 -0.835 1.00 0.59 C ATOM 2577 C ALA A 163 20.225 6.119 -0.130 1.00 0.53 C ATOM 2578 O ALA A 163 20.075 5.946 1.081 1.00 0.58 O ATOM 2579 CB ALA A 163 22.520 6.748 -0.889 1.00 0.68 C ATOM 0 H ALA A 163 21.221 5.905 -2.891 1.00 0.53 H new ATOM 0 HA ALA A 163 21.898 4.808 -0.268 1.00 0.59 H new ATOM 0 HB1 ALA A 163 22.748 7.083 0.123 1.00 0.68 H new ATOM 0 HB2 ALA A 163 23.429 6.373 -1.360 1.00 0.68 H new ATOM 0 HB3 ALA A 163 22.130 7.584 -1.469 1.00 0.68 H new ATOM 2585 N TYR A 164 19.319 6.715 -0.894 1.00 0.45 N ATOM 2586 CA TYR A 164 18.057 7.180 -0.353 1.00 0.40 C ATOM 2587 C TYR A 164 16.949 6.895 -1.346 1.00 0.32 C ATOM 2588 O TYR A 164 16.974 7.395 -2.470 1.00 0.38 O ATOM 2589 CB TYR A 164 18.107 8.681 -0.044 1.00 0.46 C ATOM 2590 CG TYR A 164 19.016 9.049 1.108 1.00 0.56 C ATOM 2591 CD1 TYR A 164 18.591 8.915 2.424 1.00 0.61 C ATOM 2592 CD2 TYR A 164 20.294 9.536 0.879 1.00 0.67 C ATOM 2593 CE1 TYR A 164 19.417 9.256 3.477 1.00 0.73 C ATOM 2594 CE2 TYR A 164 21.125 9.881 1.925 1.00 0.78 C ATOM 2595 CZ TYR A 164 20.683 9.740 3.221 1.00 0.79 C ATOM 2596 OH TYR A 164 21.509 10.088 4.265 1.00 0.93 O ATOM 0 H TYR A 164 19.439 6.886 -1.892 1.00 0.45 H new ATOM 0 HA TYR A 164 17.863 6.650 0.580 1.00 0.40 H new ATOM 0 HB2 TYR A 164 18.437 9.213 -0.936 1.00 0.46 H new ATOM 0 HB3 TYR A 164 17.098 9.028 0.179 1.00 0.46 H new ATOM 0 HD1 TYR A 164 17.599 8.538 2.627 1.00 0.61 H new ATOM 0 HD2 TYR A 164 20.645 9.647 -0.136 1.00 0.67 H new ATOM 0 HE1 TYR A 164 19.074 9.144 4.495 1.00 0.73 H new ATOM 0 HE2 TYR A 164 22.117 10.260 1.728 1.00 0.78 H new ATOM 0 HH TYR A 164 22.365 10.409 3.912 1.00 0.93 H new ATOM 2606 N SER A 165 15.985 6.093 -0.939 1.00 0.26 N ATOM 2607 CA SER A 165 14.898 5.735 -1.817 1.00 0.24 C ATOM 2608 C SER A 165 13.578 6.242 -1.268 1.00 0.23 C ATOM 2609 O SER A 165 13.306 6.151 -0.072 1.00 0.26 O ATOM 2610 CB SER A 165 14.863 4.230 -2.008 1.00 0.30 C ATOM 2611 OG SER A 165 16.033 3.784 -2.658 1.00 1.41 O ATOM 0 H SER A 165 15.936 5.680 -0.008 1.00 0.26 H new ATOM 0 HA SER A 165 15.058 6.205 -2.787 1.00 0.24 H new ATOM 0 HB2 SER A 165 14.768 3.737 -1.040 1.00 0.30 H new ATOM 0 HB3 SER A 165 13.987 3.953 -2.594 1.00 0.30 H new ATOM 0 HG SER A 165 16.653 3.412 -1.997 1.00 1.41 H new ATOM 2617 N LYS A 166 12.768 6.789 -2.148 1.00 0.24 N ATOM 2618 CA LYS A 166 11.531 7.407 -1.754 1.00 0.26 C ATOM 2619 C LYS A 166 10.443 6.387 -1.527 1.00 0.28 C ATOM 2620 O LYS A 166 10.196 5.529 -2.368 1.00 0.43 O ATOM 2621 CB LYS A 166 11.055 8.357 -2.834 1.00 0.36 C ATOM 2622 CG LYS A 166 9.978 9.284 -2.375 1.00 0.32 C ATOM 2623 CD LYS A 166 10.554 10.231 -1.381 1.00 0.37 C ATOM 2624 CE LYS A 166 9.659 11.426 -1.158 1.00 0.47 C ATOM 2625 NZ LYS A 166 10.337 12.496 -0.379 1.00 0.74 N ATOM 0 H LYS A 166 12.951 6.816 -3.151 1.00 0.24 H new ATOM 0 HA LYS A 166 11.726 7.940 -0.823 1.00 0.26 H new ATOM 0 HB2 LYS A 166 11.902 8.944 -3.191 1.00 0.36 H new ATOM 0 HB3 LYS A 166 10.689 7.778 -3.682 1.00 0.36 H new ATOM 0 HG2 LYS A 166 9.564 9.831 -3.222 1.00 0.32 H new ATOM 0 HG3 LYS A 166 9.159 8.720 -1.929 1.00 0.32 H new ATOM 0 HD2 LYS A 166 10.711 9.713 -0.435 1.00 0.37 H new ATOM 0 HD3 LYS A 166 11.531 10.569 -1.725 1.00 0.37 H new ATOM 0 HE2 LYS A 166 9.342 11.825 -2.121 1.00 0.47 H new ATOM 0 HE3 LYS A 166 8.758 11.110 -0.632 1.00 0.47 H new ATOM 0 HZ1 LYS A 166 9.698 13.310 -0.279 1.00 0.74 H new ATOM 0 HZ2 LYS A 166 10.587 12.134 0.563 1.00 0.74 H new ATOM 0 HZ3 LYS A 166 11.201 12.793 -0.876 1.00 0.74 H new ATOM 2639 N LEU A 167 9.819 6.481 -0.382 1.00 0.20 N ATOM 2640 CA LEU A 167 8.576 5.788 -0.141 1.00 0.21 C ATOM 2641 C LEU A 167 7.421 6.787 0.003 1.00 0.20 C ATOM 2642 O LEU A 167 7.262 7.404 1.057 1.00 0.24 O ATOM 2643 CB LEU A 167 8.711 4.960 1.130 1.00 0.23 C ATOM 2644 CG LEU A 167 7.935 3.650 1.137 1.00 0.24 C ATOM 2645 CD1 LEU A 167 6.439 3.906 1.152 1.00 0.27 C ATOM 2646 CD2 LEU A 167 8.337 2.802 -0.067 1.00 0.25 C ATOM 0 H LEU A 167 10.153 7.035 0.406 1.00 0.20 H new ATOM 0 HA LEU A 167 8.358 5.136 -0.986 1.00 0.21 H new ATOM 0 HB2 LEU A 167 9.766 4.739 1.290 1.00 0.23 H new ATOM 0 HB3 LEU A 167 8.380 5.564 1.975 1.00 0.23 H new ATOM 0 HG LEU A 167 8.182 3.101 2.046 1.00 0.24 H new ATOM 0 HD11 LEU A 167 5.907 2.955 1.157 1.00 0.27 H new ATOM 0 HD12 LEU A 167 6.176 4.473 2.045 1.00 0.27 H new ATOM 0 HD13 LEU A 167 6.158 4.474 0.265 1.00 0.27 H new ATOM 0 HD21 LEU A 167 7.778 1.866 -0.056 1.00 0.25 H new ATOM 0 HD22 LEU A 167 8.116 3.346 -0.985 1.00 0.25 H new ATOM 0 HD23 LEU A 167 9.405 2.587 -0.021 1.00 0.25 H new ATOM 2658 N VAL A 168 6.627 6.965 -1.050 1.00 0.19 N ATOM 2659 CA VAL A 168 5.441 7.827 -0.965 1.00 0.20 C ATOM 2660 C VAL A 168 4.181 7.073 -1.409 1.00 0.23 C ATOM 2661 O VAL A 168 4.059 6.636 -2.549 1.00 0.28 O ATOM 2662 CB VAL A 168 5.631 9.163 -1.749 1.00 0.20 C ATOM 2663 CG1 VAL A 168 6.680 9.022 -2.837 1.00 0.21 C ATOM 2664 CG2 VAL A 168 4.317 9.674 -2.338 1.00 0.26 C ATOM 0 H VAL A 168 6.776 6.533 -1.962 1.00 0.19 H new ATOM 0 HA VAL A 168 5.308 8.101 0.082 1.00 0.20 H new ATOM 0 HB VAL A 168 5.980 9.902 -1.028 1.00 0.20 H new ATOM 0 HG11 VAL A 168 6.788 9.970 -3.364 1.00 0.21 H new ATOM 0 HG12 VAL A 168 7.634 8.746 -2.389 1.00 0.21 H new ATOM 0 HG13 VAL A 168 6.372 8.249 -3.541 1.00 0.21 H new ATOM 0 HG21 VAL A 168 4.497 10.606 -2.875 1.00 0.26 H new ATOM 0 HG22 VAL A 168 3.913 8.931 -3.026 1.00 0.26 H new ATOM 0 HG23 VAL A 168 3.602 9.851 -1.534 1.00 0.26 H new ATOM 2674 N MET A 169 3.250 6.926 -0.479 1.00 0.29 N ATOM 2675 CA MET A 169 2.058 6.117 -0.672 1.00 0.32 C ATOM 2676 C MET A 169 0.814 6.921 -0.316 1.00 0.34 C ATOM 2677 O MET A 169 0.779 7.625 0.693 1.00 0.45 O ATOM 2678 CB MET A 169 2.182 4.842 0.180 1.00 0.35 C ATOM 2679 CG MET A 169 0.874 4.159 0.577 1.00 0.40 C ATOM 2680 SD MET A 169 -0.182 3.692 -0.799 1.00 0.74 S ATOM 2681 CE MET A 169 -1.548 2.922 0.065 1.00 1.24 C ATOM 0 H MET A 169 3.302 7.369 0.438 1.00 0.29 H new ATOM 0 HA MET A 169 1.962 5.826 -1.718 1.00 0.32 H new ATOM 0 HB2 MET A 169 2.790 4.123 -0.369 1.00 0.35 H new ATOM 0 HB3 MET A 169 2.727 5.091 1.090 1.00 0.35 H new ATOM 0 HG2 MET A 169 1.108 3.266 1.156 1.00 0.40 H new ATOM 0 HG3 MET A 169 0.317 4.827 1.234 1.00 0.40 H new ATOM 0 HE1 MET A 169 -2.289 2.579 -0.658 1.00 1.24 H new ATOM 0 HE2 MET A 169 -1.182 2.072 0.640 1.00 1.24 H new ATOM 0 HE3 MET A 169 -2.006 3.646 0.739 1.00 1.24 H new ATOM 2691 N PHE A 170 -0.193 6.818 -1.159 1.00 0.36 N ATOM 2692 CA PHE A 170 -1.425 7.570 -0.994 1.00 0.42 C ATOM 2693 C PHE A 170 -2.546 6.621 -0.640 1.00 0.37 C ATOM 2694 O PHE A 170 -2.757 5.627 -1.339 1.00 0.38 O ATOM 2695 CB PHE A 170 -1.787 8.316 -2.278 1.00 0.69 C ATOM 2696 CG PHE A 170 -0.673 9.160 -2.825 1.00 1.26 C ATOM 2697 CD1 PHE A 170 0.294 8.606 -3.642 1.00 1.74 C ATOM 2698 CD2 PHE A 170 -0.598 10.510 -2.519 1.00 2.02 C ATOM 2699 CE1 PHE A 170 1.315 9.385 -4.146 1.00 2.73 C ATOM 2700 CE2 PHE A 170 0.420 11.290 -3.019 1.00 3.07 C ATOM 2701 CZ PHE A 170 1.391 10.710 -3.835 1.00 3.37 C ATOM 0 H PHE A 170 -0.183 6.211 -1.979 1.00 0.36 H new ATOM 0 HA PHE A 170 -1.280 8.299 -0.197 1.00 0.42 H new ATOM 0 HB2 PHE A 170 -2.087 7.592 -3.035 1.00 0.69 H new ATOM 0 HB3 PHE A 170 -2.651 8.952 -2.086 1.00 0.69 H new ATOM 0 HD1 PHE A 170 0.250 7.555 -3.888 1.00 1.74 H new ATOM 0 HD2 PHE A 170 -1.347 10.955 -1.881 1.00 2.02 H new ATOM 0 HE1 PHE A 170 2.059 8.942 -4.791 1.00 2.73 H new ATOM 0 HE2 PHE A 170 0.466 12.343 -2.781 1.00 3.07 H new ATOM 0 HZ PHE A 170 2.202 11.310 -4.220 1.00 3.37 H new ATOM 2711 N VAL A 171 -3.259 6.926 0.432 1.00 0.43 N ATOM 2712 CA VAL A 171 -4.303 6.043 0.914 1.00 0.50 C ATOM 2713 C VAL A 171 -5.686 6.671 0.689 1.00 0.49 C ATOM 2714 O VAL A 171 -5.970 7.778 1.149 1.00 0.50 O ATOM 2715 CB VAL A 171 -4.056 5.684 2.408 1.00 0.66 C ATOM 2716 CG1 VAL A 171 -4.673 6.685 3.378 1.00 1.28 C ATOM 2717 CG2 VAL A 171 -4.513 4.272 2.716 1.00 1.40 C ATOM 0 H VAL A 171 -3.133 7.776 0.982 1.00 0.43 H new ATOM 0 HA VAL A 171 -4.277 5.113 0.346 1.00 0.50 H new ATOM 0 HB VAL A 171 -2.978 5.739 2.558 1.00 0.66 H new ATOM 0 HG11 VAL A 171 -4.464 6.376 4.402 1.00 1.28 H new ATOM 0 HG12 VAL A 171 -4.246 7.672 3.203 1.00 1.28 H new ATOM 0 HG13 VAL A 171 -5.751 6.724 3.224 1.00 1.28 H new ATOM 0 HG21 VAL A 171 -4.327 4.051 3.767 1.00 1.40 H new ATOM 0 HG22 VAL A 171 -5.579 4.181 2.509 1.00 1.40 H new ATOM 0 HG23 VAL A 171 -3.961 3.567 2.094 1.00 1.40 H new ATOM 2727 N GLN A 172 -6.529 5.977 -0.063 1.00 0.57 N ATOM 2728 CA GLN A 172 -7.864 6.474 -0.374 1.00 0.65 C ATOM 2729 C GLN A 172 -8.867 5.379 -0.065 1.00 0.65 C ATOM 2730 O GLN A 172 -9.732 5.027 -0.870 1.00 0.95 O ATOM 2731 CB GLN A 172 -7.961 6.917 -1.838 1.00 0.80 C ATOM 2732 CG GLN A 172 -9.185 7.777 -2.129 1.00 1.01 C ATOM 2733 CD GLN A 172 -9.189 8.363 -3.529 1.00 1.54 C ATOM 2734 OE1 GLN A 172 -8.677 7.767 -4.473 1.00 2.17 O ATOM 2735 NE2 GLN A 172 -9.759 9.548 -3.668 1.00 2.15 N ATOM 0 H GLN A 172 -6.313 5.067 -0.470 1.00 0.57 H new ATOM 0 HA GLN A 172 -8.081 7.351 0.236 1.00 0.65 H new ATOM 0 HB2 GLN A 172 -7.063 7.475 -2.101 1.00 0.80 H new ATOM 0 HB3 GLN A 172 -7.986 6.034 -2.476 1.00 0.80 H new ATOM 0 HG2 GLN A 172 -10.084 7.176 -1.992 1.00 1.01 H new ATOM 0 HG3 GLN A 172 -9.231 8.589 -1.403 1.00 1.01 H new ATOM 0 HE21 GLN A 172 -10.174 10.012 -2.860 1.00 2.15 H new ATOM 0 HE22 GLN A 172 -9.784 9.998 -4.583 1.00 2.15 H new ATOM 2744 N THR A 173 -8.718 4.846 1.123 1.00 0.59 N ATOM 2745 CA THR A 173 -9.487 3.694 1.562 1.00 0.66 C ATOM 2746 C THR A 173 -10.912 4.090 1.958 1.00 0.75 C ATOM 2747 O THR A 173 -11.136 5.130 2.573 1.00 1.01 O ATOM 2748 CB THR A 173 -8.780 3.004 2.742 1.00 0.93 C ATOM 2749 OG1 THR A 173 -7.404 2.776 2.411 1.00 1.65 O ATOM 2750 CG2 THR A 173 -9.434 1.673 3.073 1.00 1.12 C ATOM 0 H THR A 173 -8.060 5.196 1.819 1.00 0.59 H new ATOM 0 HA THR A 173 -9.554 2.997 0.726 1.00 0.66 H new ATOM 0 HB THR A 173 -8.858 3.658 3.611 1.00 0.93 H new ATOM 0 HG1 THR A 173 -7.336 2.010 1.804 1.00 1.65 H new ATOM 0 HG21 THR A 173 -8.912 1.210 3.910 1.00 1.12 H new ATOM 0 HG22 THR A 173 -10.478 1.837 3.341 1.00 1.12 H new ATOM 0 HG23 THR A 173 -9.382 1.016 2.205 1.00 1.12 H new ATOM 2758 N GLU A 174 -11.868 3.240 1.591 1.00 0.69 N ATOM 2759 CA GLU A 174 -13.282 3.509 1.820 1.00 0.87 C ATOM 2760 C GLU A 174 -13.716 3.093 3.225 1.00 0.99 C ATOM 2761 O GLU A 174 -14.631 3.693 3.778 1.00 1.32 O ATOM 2762 CB GLU A 174 -14.101 2.778 0.757 1.00 0.97 C ATOM 2763 CG GLU A 174 -15.597 2.995 0.854 1.00 1.10 C ATOM 2764 CD GLU A 174 -16.283 2.799 -0.483 1.00 1.80 C ATOM 2765 OE1 GLU A 174 -16.262 3.731 -1.313 1.00 2.45 O ATOM 2766 OE2 GLU A 174 -16.869 1.717 -0.693 1.00 2.30 O ATOM 0 H GLU A 174 -11.684 2.350 1.129 1.00 0.69 H new ATOM 0 HA GLU A 174 -13.454 4.583 1.744 1.00 0.87 H new ATOM 0 HB2 GLU A 174 -13.763 3.100 -0.228 1.00 0.97 H new ATOM 0 HB3 GLU A 174 -13.897 1.710 0.830 1.00 0.97 H new ATOM 0 HG2 GLU A 174 -16.018 2.303 1.583 1.00 1.10 H new ATOM 0 HG3 GLU A 174 -15.795 4.003 1.220 1.00 1.10 H new ATOM 2773 N MET A 175 -13.055 2.087 3.800 1.00 1.04 N ATOM 2774 CA MET A 175 -13.311 1.688 5.196 1.00 1.36 C ATOM 2775 C MET A 175 -14.809 1.551 5.459 1.00 1.31 C ATOM 2776 O MET A 175 -15.332 2.071 6.449 1.00 1.63 O ATOM 2777 CB MET A 175 -12.727 2.730 6.151 1.00 1.69 C ATOM 2778 CG MET A 175 -11.235 2.948 5.996 1.00 2.10 C ATOM 2779 SD MET A 175 -10.658 4.389 6.903 1.00 3.24 S ATOM 2780 CE MET A 175 -11.492 5.701 6.011 1.00 3.74 C ATOM 0 H MET A 175 -12.341 1.532 3.328 1.00 1.04 H new ATOM 0 HA MET A 175 -12.834 0.722 5.364 1.00 1.36 H new ATOM 0 HB2 MET A 175 -13.240 3.679 5.993 1.00 1.69 H new ATOM 0 HB3 MET A 175 -12.933 2.423 7.176 1.00 1.69 H new ATOM 0 HG2 MET A 175 -10.703 2.064 6.346 1.00 2.10 H new ATOM 0 HG3 MET A 175 -10.995 3.067 4.939 1.00 2.10 H new ATOM 0 HE1 MET A 175 -10.812 6.544 5.884 1.00 3.74 H new ATOM 0 HE2 MET A 175 -11.803 5.335 5.032 1.00 3.74 H new ATOM 0 HE3 MET A 175 -12.368 6.023 6.573 1.00 3.74 H new ATOM 2790 N ARG A 176 -15.475 0.851 4.544 1.00 1.20 N ATOM 2791 CA ARG A 176 -16.939 0.833 4.453 1.00 1.41 C ATOM 2792 C ARG A 176 -17.654 0.588 5.772 1.00 1.43 C ATOM 2793 O ARG A 176 -18.558 1.345 6.123 1.00 2.27 O ATOM 2794 CB ARG A 176 -17.411 -0.188 3.420 1.00 1.92 C ATOM 2795 CG ARG A 176 -17.346 0.345 2.006 1.00 2.40 C ATOM 2796 CD ARG A 176 -18.163 -0.487 1.037 1.00 3.21 C ATOM 2797 NE ARG A 176 -17.508 -1.743 0.680 1.00 3.99 N ATOM 2798 CZ ARG A 176 -17.049 -2.001 -0.545 1.00 4.83 C ATOM 2799 NH1 ARG A 176 -17.038 -1.036 -1.460 1.00 5.05 N ATOM 2800 NH2 ARG A 176 -16.560 -3.199 -0.837 1.00 5.78 N ATOM 0 H ARG A 176 -15.014 0.276 3.839 1.00 1.20 H new ATOM 0 HA ARG A 176 -17.209 1.842 4.140 1.00 1.41 H new ATOM 0 HB2 ARG A 176 -16.797 -1.086 3.495 1.00 1.92 H new ATOM 0 HB3 ARG A 176 -18.436 -0.482 3.647 1.00 1.92 H new ATOM 0 HG2 ARG A 176 -17.707 1.374 1.991 1.00 2.40 H new ATOM 0 HG3 ARG A 176 -16.307 0.367 1.676 1.00 2.40 H new ATOM 0 HD2 ARG A 176 -19.135 -0.702 1.480 1.00 3.21 H new ATOM 0 HD3 ARG A 176 -18.346 0.092 0.132 1.00 3.21 H new ATOM 0 HE ARG A 176 -17.397 -2.456 1.401 1.00 3.99 H new ATOM 0 HH11 ARG A 176 -17.379 -0.105 -1.223 1.00 5.05 H new ATOM 0 HH12 ARG A 176 -16.688 -1.227 -2.399 1.00 5.05 H new ATOM 0 HH21 ARG A 176 -16.534 -3.927 -0.123 1.00 5.78 H new ATOM 0 HH22 ARG A 176 -16.210 -3.392 -1.775 1.00 5.78 H new ATOM 2814 N GLY A 177 -17.285 -0.456 6.492 1.00 1.09 N ATOM 2815 CA GLY A 177 -18.015 -0.776 7.698 1.00 1.32 C ATOM 2816 C GLY A 177 -17.277 -1.702 8.630 1.00 1.51 C ATOM 2817 O GLY A 177 -17.497 -2.911 8.601 1.00 2.26 O ATOM 0 H GLY A 177 -16.508 -1.078 6.270 1.00 1.09 H new ATOM 0 HA2 GLY A 177 -18.246 0.148 8.227 1.00 1.32 H new ATOM 0 HA3 GLY A 177 -18.966 -1.233 7.425 1.00 1.32 H new ATOM 2821 N LYS A 178 -16.405 -1.149 9.459 1.00 1.79 N ATOM 2822 CA LYS A 178 -15.733 -1.940 10.483 1.00 2.45 C ATOM 2823 C LYS A 178 -15.134 -1.043 11.563 1.00 2.04 C ATOM 2824 O LYS A 178 -14.448 -1.523 12.461 1.00 2.30 O ATOM 2825 CB LYS A 178 -14.635 -2.814 9.861 1.00 3.40 C ATOM 2826 CG LYS A 178 -14.521 -4.194 10.495 1.00 4.30 C ATOM 2827 CD LYS A 178 -15.802 -4.994 10.295 1.00 4.79 C ATOM 2828 CE LYS A 178 -15.705 -6.398 10.874 1.00 5.70 C ATOM 2829 NZ LYS A 178 -15.534 -6.385 12.351 1.00 6.23 N ATOM 0 H LYS A 178 -16.146 -0.163 9.445 1.00 1.79 H new ATOM 0 HA LYS A 178 -16.479 -2.587 10.944 1.00 2.45 H new ATOM 0 HB2 LYS A 178 -14.834 -2.928 8.795 1.00 3.40 H new ATOM 0 HB3 LYS A 178 -13.678 -2.301 9.954 1.00 3.40 H new ATOM 0 HG2 LYS A 178 -13.680 -4.731 10.056 1.00 4.30 H new ATOM 0 HG3 LYS A 178 -14.314 -4.093 11.560 1.00 4.30 H new ATOM 0 HD2 LYS A 178 -16.633 -4.467 10.764 1.00 4.79 H new ATOM 0 HD3 LYS A 178 -16.025 -5.058 9.230 1.00 4.79 H new ATOM 0 HE2 LYS A 178 -16.605 -6.958 10.619 1.00 5.70 H new ATOM 0 HE3 LYS A 178 -14.865 -6.921 10.417 1.00 5.70 H new ATOM 0 HZ1 LYS A 178 -14.603 -6.777 12.596 1.00 6.23 H new ATOM 0 HZ2 LYS A 178 -15.601 -5.407 12.700 1.00 6.23 H new ATOM 0 HZ3 LYS A 178 -16.279 -6.961 12.792 1.00 6.23 H new ATOM 2843 N LEU A 179 -15.389 0.260 11.473 1.00 1.64 N ATOM 2844 CA LEU A 179 -14.823 1.209 12.415 1.00 1.35 C ATOM 2845 C LEU A 179 -15.812 2.331 12.709 1.00 1.40 C ATOM 2846 O LEU A 179 -16.872 2.433 12.087 1.00 1.56 O ATOM 2847 CB LEU A 179 -13.544 1.858 11.869 1.00 1.23 C ATOM 2848 CG LEU A 179 -12.524 0.957 11.181 1.00 1.17 C ATOM 2849 CD1 LEU A 179 -12.896 0.727 9.726 1.00 1.61 C ATOM 2850 CD2 LEU A 179 -11.151 1.584 11.261 1.00 1.15 C ATOM 0 H LEU A 179 -15.983 0.678 10.757 1.00 1.64 H new ATOM 0 HA LEU A 179 -14.594 0.646 13.320 1.00 1.35 H new ATOM 0 HB2 LEU A 179 -13.838 2.632 11.160 1.00 1.23 H new ATOM 0 HB3 LEU A 179 -13.043 2.358 12.698 1.00 1.23 H new ATOM 0 HG LEU A 179 -12.518 -0.006 11.692 1.00 1.17 H new ATOM 0 HD11 LEU A 179 -12.153 0.081 9.258 1.00 1.61 H new ATOM 0 HD12 LEU A 179 -13.875 0.252 9.672 1.00 1.61 H new ATOM 0 HD13 LEU A 179 -12.927 1.683 9.203 1.00 1.61 H new ATOM 0 HD21 LEU A 179 -10.426 0.936 10.768 1.00 1.15 H new ATOM 0 HD22 LEU A 179 -11.165 2.555 10.766 1.00 1.15 H new ATOM 0 HD23 LEU A 179 -10.870 1.713 12.306 1.00 1.15 H new ATOM 2862 N SER A 180 -15.439 3.156 13.667 1.00 1.31 N ATOM 2863 CA SER A 180 -16.142 4.390 13.976 1.00 1.39 C ATOM 2864 C SER A 180 -15.218 5.558 13.636 1.00 1.32 C ATOM 2865 O SER A 180 -14.014 5.345 13.500 1.00 1.19 O ATOM 2866 CB SER A 180 -16.533 4.426 15.456 1.00 1.41 C ATOM 2867 OG SER A 180 -17.330 3.305 15.798 1.00 2.04 O ATOM 0 H SER A 180 -14.628 2.988 14.262 1.00 1.31 H new ATOM 0 HA SER A 180 -17.059 4.457 13.391 1.00 1.39 H new ATOM 0 HB2 SER A 180 -15.635 4.440 16.073 1.00 1.41 H new ATOM 0 HB3 SER A 180 -17.080 5.344 15.669 1.00 1.41 H new ATOM 0 HG SER A 180 -17.566 3.349 16.748 1.00 2.04 H new ATOM 2873 N PRO A 181 -15.738 6.791 13.496 1.00 1.45 N ATOM 2874 CA PRO A 181 -14.915 7.967 13.158 1.00 1.44 C ATOM 2875 C PRO A 181 -13.604 8.032 13.951 1.00 1.30 C ATOM 2876 O PRO A 181 -12.532 8.266 13.389 1.00 1.20 O ATOM 2877 CB PRO A 181 -15.823 9.135 13.532 1.00 1.65 C ATOM 2878 CG PRO A 181 -17.206 8.617 13.320 1.00 1.74 C ATOM 2879 CD PRO A 181 -17.165 7.144 13.640 1.00 1.64 C ATOM 0 HA PRO A 181 -14.601 7.956 12.114 1.00 1.44 H new ATOM 0 HB2 PRO A 181 -15.669 9.442 14.566 1.00 1.65 H new ATOM 0 HB3 PRO A 181 -15.626 10.007 12.908 1.00 1.65 H new ATOM 0 HG2 PRO A 181 -17.917 9.134 13.964 1.00 1.74 H new ATOM 0 HG3 PRO A 181 -17.529 8.782 12.292 1.00 1.74 H new ATOM 0 HD2 PRO A 181 -17.527 6.944 14.649 1.00 1.64 H new ATOM 0 HD3 PRO A 181 -17.790 6.569 12.957 1.00 1.64 H new ATOM 2887 N SER A 182 -13.693 7.771 15.251 1.00 1.34 N ATOM 2888 CA SER A 182 -12.541 7.855 16.143 1.00 1.28 C ATOM 2889 C SER A 182 -11.530 6.730 15.889 1.00 1.11 C ATOM 2890 O SER A 182 -10.391 6.797 16.343 1.00 1.09 O ATOM 2891 CB SER A 182 -13.027 7.815 17.590 1.00 1.40 C ATOM 2892 OG SER A 182 -13.977 6.778 17.770 1.00 2.14 O ATOM 0 H SER A 182 -14.560 7.497 15.714 1.00 1.34 H new ATOM 0 HA SER A 182 -12.025 8.795 15.947 1.00 1.28 H new ATOM 0 HB2 SER A 182 -12.181 7.660 18.259 1.00 1.40 H new ATOM 0 HB3 SER A 182 -13.472 8.774 17.856 1.00 1.40 H new ATOM 0 HG SER A 182 -14.276 6.766 18.703 1.00 2.14 H new ATOM 2898 N ILE A 183 -11.942 5.705 15.161 1.00 1.04 N ATOM 2899 CA ILE A 183 -11.065 4.577 14.853 1.00 0.90 C ATOM 2900 C ILE A 183 -10.355 4.844 13.549 1.00 0.79 C ATOM 2901 O ILE A 183 -9.188 4.534 13.364 1.00 0.69 O ATOM 2902 CB ILE A 183 -11.856 3.272 14.681 1.00 0.96 C ATOM 2903 CG1 ILE A 183 -12.936 3.141 15.750 1.00 1.09 C ATOM 2904 CG2 ILE A 183 -10.915 2.079 14.721 1.00 0.92 C ATOM 2905 CD1 ILE A 183 -12.396 3.030 17.162 1.00 1.12 C ATOM 0 H ILE A 183 -12.881 5.627 14.769 1.00 1.04 H new ATOM 0 HA ILE A 183 -10.367 4.470 15.683 1.00 0.90 H new ATOM 0 HB ILE A 183 -12.349 3.296 13.709 1.00 0.96 H new ATOM 0 HG12 ILE A 183 -13.597 4.006 15.692 1.00 1.09 H new ATOM 0 HG13 ILE A 183 -13.542 2.261 15.534 1.00 1.09 H new ATOM 0 HG21 ILE A 183 -11.488 1.160 14.598 1.00 0.92 H new ATOM 0 HG22 ILE A 183 -10.186 2.163 13.915 1.00 0.92 H new ATOM 0 HG23 ILE A 183 -10.395 2.057 15.679 1.00 0.92 H new ATOM 0 HD11 ILE A 183 -13.226 2.940 17.863 1.00 1.12 H new ATOM 0 HD12 ILE A 183 -11.759 2.149 17.240 1.00 1.12 H new ATOM 0 HD13 ILE A 183 -11.815 3.921 17.400 1.00 1.12 H new ATOM 2917 N ILE A 184 -11.118 5.426 12.662 1.00 0.87 N ATOM 2918 CA ILE A 184 -10.717 5.736 11.317 1.00 0.83 C ATOM 2919 C ILE A 184 -9.628 6.800 11.301 1.00 0.81 C ATOM 2920 O ILE A 184 -8.683 6.729 10.510 1.00 0.75 O ATOM 2921 CB ILE A 184 -11.943 6.205 10.512 1.00 0.96 C ATOM 2922 CG1 ILE A 184 -12.670 5.018 9.891 1.00 0.98 C ATOM 2923 CG2 ILE A 184 -11.568 7.219 9.437 1.00 1.00 C ATOM 2924 CD1 ILE A 184 -13.984 4.708 10.563 1.00 1.13 C ATOM 0 H ILE A 184 -12.076 5.709 12.867 1.00 0.87 H new ATOM 0 HA ILE A 184 -10.306 4.837 10.858 1.00 0.83 H new ATOM 0 HB ILE A 184 -12.614 6.702 11.212 1.00 0.96 H new ATOM 0 HG12 ILE A 184 -12.848 5.222 8.835 1.00 0.98 H new ATOM 0 HG13 ILE A 184 -12.027 4.139 9.942 1.00 0.98 H new ATOM 0 HG21 ILE A 184 -12.463 7.522 8.894 1.00 1.00 H new ATOM 0 HG22 ILE A 184 -11.114 8.093 9.904 1.00 1.00 H new ATOM 0 HG23 ILE A 184 -10.858 6.768 8.743 1.00 1.00 H new ATOM 0 HD11 ILE A 184 -14.450 3.853 10.073 1.00 1.13 H new ATOM 0 HD12 ILE A 184 -13.809 4.474 11.613 1.00 1.13 H new ATOM 0 HD13 ILE A 184 -14.643 5.573 10.489 1.00 1.13 H new ATOM 2936 N GLU A 185 -9.753 7.771 12.199 1.00 0.91 N ATOM 2937 CA GLU A 185 -8.739 8.807 12.336 1.00 0.99 C ATOM 2938 C GLU A 185 -7.422 8.172 12.752 1.00 0.91 C ATOM 2939 O GLU A 185 -6.350 8.740 12.560 1.00 0.99 O ATOM 2940 CB GLU A 185 -9.163 9.874 13.354 1.00 1.17 C ATOM 2941 CG GLU A 185 -9.450 9.333 14.745 1.00 1.58 C ATOM 2942 CD GLU A 185 -9.680 10.434 15.764 1.00 2.26 C ATOM 2943 OE1 GLU A 185 -10.633 11.219 15.595 1.00 2.89 O ATOM 2944 OE2 GLU A 185 -8.899 10.524 16.738 1.00 2.46 O ATOM 0 H GLU A 185 -10.542 7.861 12.839 1.00 0.91 H new ATOM 0 HA GLU A 185 -8.618 9.303 11.373 1.00 0.99 H new ATOM 0 HB2 GLU A 185 -8.376 10.625 13.424 1.00 1.17 H new ATOM 0 HB3 GLU A 185 -10.054 10.380 12.983 1.00 1.17 H new ATOM 0 HG2 GLU A 185 -10.329 8.690 14.706 1.00 1.58 H new ATOM 0 HG3 GLU A 185 -8.615 8.712 15.069 1.00 1.58 H new ATOM 2951 N LYS A 186 -7.523 6.981 13.325 1.00 0.82 N ATOM 2952 CA LYS A 186 -6.360 6.212 13.690 1.00 0.79 C ATOM 2953 C LYS A 186 -5.973 5.267 12.562 1.00 0.70 C ATOM 2954 O LYS A 186 -4.794 5.124 12.247 1.00 0.86 O ATOM 2955 CB LYS A 186 -6.631 5.417 14.965 1.00 0.80 C ATOM 2956 CG LYS A 186 -7.120 6.277 16.114 1.00 1.27 C ATOM 2957 CD LYS A 186 -7.281 5.466 17.389 1.00 1.28 C ATOM 2958 CE LYS A 186 -8.540 4.615 17.369 1.00 0.96 C ATOM 2959 NZ LYS A 186 -8.609 3.726 18.561 1.00 1.09 N ATOM 0 H LYS A 186 -8.411 6.530 13.545 1.00 0.82 H new ATOM 0 HA LYS A 186 -5.534 6.900 13.870 1.00 0.79 H new ATOM 0 HB2 LYS A 186 -7.374 4.647 14.754 1.00 0.80 H new ATOM 0 HB3 LYS A 186 -5.718 4.904 15.267 1.00 0.80 H new ATOM 0 HG2 LYS A 186 -6.415 7.091 16.286 1.00 1.27 H new ATOM 0 HG3 LYS A 186 -8.074 6.732 15.848 1.00 1.27 H new ATOM 0 HD2 LYS A 186 -6.411 4.823 17.521 1.00 1.28 H new ATOM 0 HD3 LYS A 186 -7.313 6.140 18.245 1.00 1.28 H new ATOM 0 HE2 LYS A 186 -9.418 5.261 17.342 1.00 0.96 H new ATOM 0 HE3 LYS A 186 -8.560 4.012 16.461 1.00 0.96 H new ATOM 0 HZ1 LYS A 186 -9.479 3.157 18.520 1.00 1.09 H new ATOM 0 HZ2 LYS A 186 -7.783 3.095 18.571 1.00 1.09 H new ATOM 0 HZ3 LYS A 186 -8.614 4.304 19.425 1.00 1.09 H new ATOM 2973 N THR A 187 -6.976 4.637 11.939 1.00 0.59 N ATOM 2974 CA THR A 187 -6.713 3.537 11.013 1.00 0.54 C ATOM 2975 C THR A 187 -5.902 3.966 9.786 1.00 0.50 C ATOM 2976 O THR A 187 -5.084 3.195 9.299 1.00 0.53 O ATOM 2977 CB THR A 187 -8.013 2.835 10.555 1.00 0.58 C ATOM 2978 OG1 THR A 187 -7.700 1.623 9.846 1.00 0.62 O ATOM 2979 CG2 THR A 187 -8.834 3.735 9.655 1.00 0.60 C ATOM 0 H THR A 187 -7.962 4.868 12.059 1.00 0.59 H new ATOM 0 HA THR A 187 -6.111 2.828 11.581 1.00 0.54 H new ATOM 0 HB THR A 187 -8.595 2.603 11.447 1.00 0.58 H new ATOM 0 HG1 THR A 187 -7.731 1.791 8.881 1.00 0.62 H new ATOM 0 HG21 THR A 187 -9.741 3.214 9.349 1.00 0.60 H new ATOM 0 HG22 THR A 187 -9.101 4.643 10.195 1.00 0.60 H new ATOM 0 HG23 THR A 187 -8.251 3.996 8.772 1.00 0.60 H new ATOM 2987 N MET A 188 -6.115 5.180 9.285 1.00 0.52 N ATOM 2988 CA MET A 188 -5.404 5.617 8.083 1.00 0.53 C ATOM 2989 C MET A 188 -3.967 6.023 8.399 1.00 0.54 C ATOM 2990 O MET A 188 -3.033 5.409 7.883 1.00 0.54 O ATOM 2991 CB MET A 188 -6.135 6.756 7.362 1.00 0.62 C ATOM 2992 CG MET A 188 -7.455 6.356 6.715 1.00 0.80 C ATOM 2993 SD MET A 188 -7.273 5.086 5.443 1.00 1.06 S ATOM 2994 CE MET A 188 -7.386 3.587 6.418 1.00 0.83 C ATOM 0 H MET A 188 -6.758 5.866 9.680 1.00 0.52 H new ATOM 0 HA MET A 188 -5.379 4.760 7.410 1.00 0.53 H new ATOM 0 HB2 MET A 188 -6.324 7.558 8.076 1.00 0.62 H new ATOM 0 HB3 MET A 188 -5.478 7.162 6.593 1.00 0.62 H new ATOM 0 HG2 MET A 188 -8.134 5.993 7.486 1.00 0.80 H new ATOM 0 HG3 MET A 188 -7.917 7.239 6.273 1.00 0.80 H new ATOM 0 HE1 MET A 188 -6.490 2.985 6.265 1.00 0.83 H new ATOM 0 HE2 MET A 188 -7.474 3.845 7.473 1.00 0.83 H new ATOM 0 HE3 MET A 188 -8.262 3.017 6.109 1.00 0.83 H new ATOM 3004 N PRO A 189 -3.747 7.041 9.261 1.00 0.60 N ATOM 3005 CA PRO A 189 -2.398 7.517 9.568 1.00 0.71 C ATOM 3006 C PRO A 189 -1.509 6.417 10.133 1.00 0.74 C ATOM 3007 O PRO A 189 -0.332 6.340 9.800 1.00 0.91 O ATOM 3008 CB PRO A 189 -2.618 8.620 10.608 1.00 0.84 C ATOM 3009 CG PRO A 189 -4.028 9.048 10.411 1.00 0.83 C ATOM 3010 CD PRO A 189 -4.770 7.812 9.995 1.00 0.63 C ATOM 0 HA PRO A 189 -1.884 7.866 8.672 1.00 0.71 H new ATOM 0 HB2 PRO A 189 -2.454 8.249 11.620 1.00 0.84 H new ATOM 0 HB3 PRO A 189 -1.927 9.450 10.457 1.00 0.84 H new ATOM 0 HG2 PRO A 189 -4.443 9.464 11.329 1.00 0.83 H new ATOM 0 HG3 PRO A 189 -4.099 9.824 9.648 1.00 0.83 H new ATOM 0 HD2 PRO A 189 -5.150 7.261 10.855 1.00 0.63 H new ATOM 0 HD3 PRO A 189 -5.627 8.049 9.364 1.00 0.63 H new ATOM 3018 N SER A 190 -2.077 5.547 10.960 1.00 0.66 N ATOM 3019 CA SER A 190 -1.300 4.476 11.572 1.00 0.76 C ATOM 3020 C SER A 190 -0.917 3.428 10.537 1.00 0.72 C ATOM 3021 O SER A 190 0.156 2.840 10.607 1.00 0.90 O ATOM 3022 CB SER A 190 -2.075 3.823 12.721 1.00 0.84 C ATOM 3023 OG SER A 190 -2.438 4.783 13.698 1.00 1.50 O ATOM 0 H SER A 190 -3.063 5.561 11.220 1.00 0.66 H new ATOM 0 HA SER A 190 -0.389 4.916 11.977 1.00 0.76 H new ATOM 0 HB2 SER A 190 -2.970 3.339 12.332 1.00 0.84 H new ATOM 0 HB3 SER A 190 -1.465 3.045 13.180 1.00 0.84 H new ATOM 0 HG SER A 190 -3.317 5.156 13.479 1.00 1.50 H new ATOM 3029 N ASN A 191 -1.787 3.237 9.558 1.00 0.57 N ATOM 3030 CA ASN A 191 -1.586 2.216 8.533 1.00 0.61 C ATOM 3031 C ASN A 191 -0.524 2.670 7.547 1.00 0.51 C ATOM 3032 O ASN A 191 0.338 1.899 7.145 1.00 0.52 O ATOM 3033 CB ASN A 191 -2.899 1.941 7.795 1.00 0.70 C ATOM 3034 CG ASN A 191 -2.797 0.804 6.799 1.00 1.08 C ATOM 3035 OD1 ASN A 191 -2.041 -0.143 6.991 1.00 1.88 O ATOM 3036 ND2 ASN A 191 -3.563 0.894 5.723 1.00 1.46 N ATOM 0 H ASN A 191 -2.645 3.777 9.448 1.00 0.57 H new ATOM 0 HA ASN A 191 -1.254 1.297 9.015 1.00 0.61 H new ATOM 0 HB2 ASN A 191 -3.676 1.709 8.523 1.00 0.70 H new ATOM 0 HB3 ASN A 191 -3.211 2.846 7.273 1.00 0.70 H new ATOM 0 HD21 ASN A 191 -3.538 0.159 5.016 1.00 1.46 H new ATOM 0 HD22 ASN A 191 -4.178 1.698 5.601 1.00 1.46 H new ATOM 3043 N LEU A 192 -0.607 3.932 7.164 1.00 0.45 N ATOM 3044 CA LEU A 192 0.370 4.552 6.284 1.00 0.42 C ATOM 3045 C LEU A 192 1.792 4.379 6.790 1.00 0.36 C ATOM 3046 O LEU A 192 2.659 3.875 6.075 1.00 0.35 O ATOM 3047 CB LEU A 192 0.058 6.033 6.162 1.00 0.48 C ATOM 3048 CG LEU A 192 -1.263 6.345 5.484 1.00 0.62 C ATOM 3049 CD1 LEU A 192 -1.506 7.836 5.483 1.00 1.04 C ATOM 3050 CD2 LEU A 192 -1.264 5.792 4.071 1.00 1.09 C ATOM 0 H LEU A 192 -1.357 4.559 7.456 1.00 0.45 H new ATOM 0 HA LEU A 192 0.304 4.060 5.314 1.00 0.42 H new ATOM 0 HB2 LEU A 192 0.053 6.473 7.159 1.00 0.48 H new ATOM 0 HB3 LEU A 192 0.861 6.516 5.604 1.00 0.48 H new ATOM 0 HG LEU A 192 -2.072 5.869 6.038 1.00 0.62 H new ATOM 0 HD11 LEU A 192 -2.457 8.049 4.994 1.00 1.04 H new ATOM 0 HD12 LEU A 192 -1.536 8.200 6.510 1.00 1.04 H new ATOM 0 HD13 LEU A 192 -0.701 8.336 4.944 1.00 1.04 H new ATOM 0 HD21 LEU A 192 -2.216 6.020 3.592 1.00 1.09 H new ATOM 0 HD22 LEU A 192 -0.453 6.246 3.502 1.00 1.09 H new ATOM 0 HD23 LEU A 192 -1.124 4.712 4.103 1.00 1.09 H new ATOM 3062 N VAL A 193 2.029 4.801 8.022 1.00 0.36 N ATOM 3063 CA VAL A 193 3.368 4.735 8.595 1.00 0.36 C ATOM 3064 C VAL A 193 3.777 3.286 8.769 1.00 0.39 C ATOM 3065 O VAL A 193 4.946 2.930 8.665 1.00 0.42 O ATOM 3066 CB VAL A 193 3.460 5.466 9.952 1.00 0.44 C ATOM 3067 CG1 VAL A 193 2.593 6.708 9.936 1.00 0.68 C ATOM 3068 CG2 VAL A 193 3.076 4.574 11.126 1.00 0.59 C ATOM 0 H VAL A 193 1.319 5.190 8.642 1.00 0.36 H new ATOM 0 HA VAL A 193 4.045 5.238 7.905 1.00 0.36 H new ATOM 0 HB VAL A 193 4.503 5.748 10.092 1.00 0.44 H new ATOM 0 HG11 VAL A 193 2.666 7.215 10.898 1.00 0.68 H new ATOM 0 HG12 VAL A 193 2.932 7.378 9.146 1.00 0.68 H new ATOM 0 HG13 VAL A 193 1.556 6.426 9.752 1.00 0.68 H new ATOM 0 HG21 VAL A 193 3.159 5.139 12.054 1.00 0.59 H new ATOM 0 HG22 VAL A 193 2.049 4.230 11.001 1.00 0.59 H new ATOM 0 HG23 VAL A 193 3.745 3.714 11.164 1.00 0.59 H new ATOM 3078 N ASN A 194 2.781 2.465 9.024 1.00 0.43 N ATOM 3079 CA ASN A 194 2.963 1.041 9.202 1.00 0.48 C ATOM 3080 C ASN A 194 3.335 0.367 7.893 1.00 0.45 C ATOM 3081 O ASN A 194 4.169 -0.533 7.881 1.00 0.49 O ATOM 3082 CB ASN A 194 1.693 0.441 9.798 1.00 0.58 C ATOM 3083 CG ASN A 194 1.772 0.277 11.309 1.00 1.28 C ATOM 3084 OD1 ASN A 194 1.129 -0.600 11.884 1.00 1.80 O ATOM 3085 ND2 ASN A 194 2.560 1.118 11.965 1.00 2.07 N ATOM 0 H ASN A 194 1.812 2.771 9.114 1.00 0.43 H new ATOM 0 HA ASN A 194 3.790 0.870 9.891 1.00 0.48 H new ATOM 0 HB2 ASN A 194 0.844 1.078 9.550 1.00 0.58 H new ATOM 0 HB3 ASN A 194 1.506 -0.531 9.341 1.00 0.58 H new ATOM 0 HD21 ASN A 194 2.647 1.049 12.979 1.00 2.07 H new ATOM 0 HD22 ASN A 194 3.079 1.833 11.456 1.00 2.07 H new ATOM 3092 N PHE A 195 2.736 0.818 6.796 1.00 0.44 N ATOM 3093 CA PHE A 195 3.127 0.348 5.472 1.00 0.44 C ATOM 3094 C PHE A 195 4.576 0.720 5.187 1.00 0.36 C ATOM 3095 O PHE A 195 5.295 -0.008 4.503 1.00 0.36 O ATOM 3096 CB PHE A 195 2.222 0.932 4.383 1.00 0.47 C ATOM 3097 CG PHE A 195 0.926 0.195 4.194 1.00 0.73 C ATOM 3098 CD1 PHE A 195 0.814 -1.142 4.539 1.00 1.06 C ATOM 3099 CD2 PHE A 195 -0.174 0.837 3.650 1.00 1.51 C ATOM 3100 CE1 PHE A 195 -0.373 -1.823 4.350 1.00 1.43 C ATOM 3101 CE2 PHE A 195 -1.362 0.161 3.454 1.00 2.00 C ATOM 3102 CZ PHE A 195 -1.462 -1.172 3.804 1.00 1.76 C ATOM 0 H PHE A 195 1.982 1.505 6.797 1.00 0.44 H new ATOM 0 HA PHE A 195 3.021 -0.737 5.461 1.00 0.44 H new ATOM 0 HB2 PHE A 195 2.003 1.971 4.628 1.00 0.47 H new ATOM 0 HB3 PHE A 195 2.766 0.935 3.438 1.00 0.47 H new ATOM 0 HD1 PHE A 195 1.664 -1.658 4.960 1.00 1.06 H new ATOM 0 HD2 PHE A 195 -0.102 1.879 3.376 1.00 1.51 H new ATOM 0 HE1 PHE A 195 -0.449 -2.864 4.629 1.00 1.43 H new ATOM 0 HE2 PHE A 195 -2.212 0.673 3.028 1.00 2.00 H new ATOM 0 HZ PHE A 195 -2.390 -1.704 3.651 1.00 1.76 H new ATOM 3112 N ILE A 196 5.007 1.855 5.717 1.00 0.31 N ATOM 3113 CA ILE A 196 6.380 2.280 5.557 1.00 0.27 C ATOM 3114 C ILE A 196 7.295 1.549 6.527 1.00 0.28 C ATOM 3115 O ILE A 196 8.462 1.322 6.241 1.00 0.28 O ATOM 3116 CB ILE A 196 6.509 3.798 5.743 1.00 0.25 C ATOM 3117 CG1 ILE A 196 5.840 4.515 4.571 1.00 0.25 C ATOM 3118 CG2 ILE A 196 7.966 4.197 5.878 1.00 0.29 C ATOM 3119 CD1 ILE A 196 5.982 6.014 4.619 1.00 0.26 C ATOM 0 H ILE A 196 4.424 2.493 6.259 1.00 0.31 H new ATOM 0 HA ILE A 196 6.688 2.030 4.542 1.00 0.27 H new ATOM 0 HB ILE A 196 6.004 4.094 6.663 1.00 0.25 H new ATOM 0 HG12 ILE A 196 6.269 4.148 3.639 1.00 0.25 H new ATOM 0 HG13 ILE A 196 4.781 4.259 4.557 1.00 0.25 H new ATOM 0 HG21 ILE A 196 8.037 5.277 6.009 1.00 0.29 H new ATOM 0 HG22 ILE A 196 8.401 3.697 6.743 1.00 0.29 H new ATOM 0 HG23 ILE A 196 8.508 3.904 4.979 1.00 0.29 H new ATOM 0 HD11 ILE A 196 5.483 6.455 3.756 1.00 0.26 H new ATOM 0 HD12 ILE A 196 5.527 6.393 5.534 1.00 0.26 H new ATOM 0 HD13 ILE A 196 7.039 6.280 4.602 1.00 0.26 H new ATOM 3131 N LEU A 197 6.762 1.173 7.668 1.00 0.33 N ATOM 3132 CA LEU A 197 7.516 0.403 8.636 1.00 0.37 C ATOM 3133 C LEU A 197 7.702 -0.996 8.142 1.00 0.36 C ATOM 3134 O LEU A 197 8.739 -1.610 8.360 1.00 0.38 O ATOM 3135 CB LEU A 197 6.810 0.383 9.974 1.00 0.50 C ATOM 3136 CG LEU A 197 6.873 1.696 10.718 1.00 0.52 C ATOM 3137 CD1 LEU A 197 6.142 1.570 12.036 1.00 1.00 C ATOM 3138 CD2 LEU A 197 8.329 2.086 10.907 1.00 1.03 C ATOM 0 H LEU A 197 5.806 1.388 7.950 1.00 0.33 H new ATOM 0 HA LEU A 197 8.490 0.874 8.765 1.00 0.37 H new ATOM 0 HB2 LEU A 197 5.765 0.114 9.819 1.00 0.50 H new ATOM 0 HB3 LEU A 197 7.251 -0.397 10.595 1.00 0.50 H new ATOM 0 HG LEU A 197 6.382 2.484 10.148 1.00 0.52 H new ATOM 0 HD11 LEU A 197 6.189 2.519 12.570 1.00 1.00 H new ATOM 0 HD12 LEU A 197 5.100 1.309 11.851 1.00 1.00 H new ATOM 0 HD13 LEU A 197 6.609 0.791 12.638 1.00 1.00 H new ATOM 0 HD21 LEU A 197 8.385 3.033 11.443 1.00 1.03 H new ATOM 0 HD22 LEU A 197 8.841 1.313 11.480 1.00 1.03 H new ATOM 0 HD23 LEU A 197 8.807 2.192 9.933 1.00 1.03 H new ATOM 3150 N ASN A 198 6.671 -1.496 7.499 1.00 0.38 N ATOM 3151 CA ASN A 198 6.803 -2.676 6.673 1.00 0.43 C ATOM 3152 C ASN A 198 8.010 -2.512 5.787 1.00 0.31 C ATOM 3153 O ASN A 198 8.889 -3.359 5.737 1.00 0.32 O ATOM 3154 CB ASN A 198 5.596 -2.857 5.760 1.00 0.65 C ATOM 3155 CG ASN A 198 4.346 -3.301 6.479 1.00 1.05 C ATOM 3156 OD1 ASN A 198 3.242 -2.879 6.142 1.00 1.90 O ATOM 3157 ND2 ASN A 198 4.503 -4.172 7.453 1.00 1.61 N ATOM 0 H ASN A 198 5.730 -1.104 7.532 1.00 0.38 H new ATOM 0 HA ASN A 198 6.891 -3.539 7.333 1.00 0.43 H new ATOM 0 HB2 ASN A 198 5.395 -1.915 5.250 1.00 0.65 H new ATOM 0 HB3 ASN A 198 5.841 -3.590 4.991 1.00 0.65 H new ATOM 0 HD21 ASN A 198 3.690 -4.522 7.960 1.00 1.61 H new ATOM 0 HD22 ASN A 198 5.438 -4.497 7.701 1.00 1.61 H new ATOM 3164 N ALA A 199 8.062 -1.380 5.121 1.00 0.29 N ATOM 3165 CA ALA A 199 9.081 -1.128 4.154 1.00 0.25 C ATOM 3166 C ALA A 199 10.425 -1.039 4.815 1.00 0.23 C ATOM 3167 O ALA A 199 11.379 -1.648 4.356 1.00 0.26 O ATOM 3168 CB ALA A 199 8.748 0.141 3.443 1.00 0.26 C ATOM 0 H ALA A 199 7.396 -0.617 5.241 1.00 0.29 H new ATOM 0 HA ALA A 199 9.127 -1.948 3.437 1.00 0.25 H new ATOM 0 HB1 ALA A 199 9.515 0.353 2.698 1.00 0.26 H new ATOM 0 HB2 ALA A 199 7.782 0.039 2.949 1.00 0.26 H new ATOM 0 HB3 ALA A 199 8.704 0.960 4.161 1.00 0.26 H new ATOM 3174 N LYS A 200 10.483 -0.296 5.905 1.00 0.26 N ATOM 3175 CA LYS A 200 11.687 -0.219 6.699 1.00 0.29 C ATOM 3176 C LYS A 200 12.139 -1.614 7.073 1.00 0.31 C ATOM 3177 O LYS A 200 13.275 -1.993 6.835 1.00 0.36 O ATOM 3178 CB LYS A 200 11.419 0.559 7.977 1.00 0.34 C ATOM 3179 CG LYS A 200 11.067 2.024 7.765 1.00 0.57 C ATOM 3180 CD LYS A 200 12.181 2.776 7.051 1.00 0.54 C ATOM 3181 CE LYS A 200 12.110 4.268 7.326 1.00 0.64 C ATOM 3182 NZ LYS A 200 12.173 4.557 8.784 1.00 0.97 N ATOM 0 H LYS A 200 9.706 0.263 6.258 1.00 0.26 H new ATOM 0 HA LYS A 200 12.458 0.283 6.115 1.00 0.29 H new ATOM 0 HB2 LYS A 200 10.603 0.077 8.516 1.00 0.34 H new ATOM 0 HB3 LYS A 200 12.301 0.499 8.615 1.00 0.34 H new ATOM 0 HG2 LYS A 200 10.148 2.096 7.183 1.00 0.57 H new ATOM 0 HG3 LYS A 200 10.871 2.494 8.729 1.00 0.57 H new ATOM 0 HD2 LYS A 200 13.148 2.391 7.375 1.00 0.54 H new ATOM 0 HD3 LYS A 200 12.111 2.599 5.978 1.00 0.54 H new ATOM 0 HE2 LYS A 200 12.932 4.772 6.818 1.00 0.64 H new ATOM 0 HE3 LYS A 200 11.185 4.672 6.914 1.00 0.64 H new ATOM 0 HZ1 LYS A 200 12.620 5.484 8.935 1.00 0.97 H new ATOM 0 HZ2 LYS A 200 11.210 4.568 9.178 1.00 0.97 H new ATOM 0 HZ3 LYS A 200 12.733 3.821 9.260 1.00 0.97 H new ATOM 3196 N ASP A 201 11.207 -2.389 7.601 1.00 0.30 N ATOM 3197 CA ASP A 201 11.534 -3.667 8.223 1.00 0.33 C ATOM 3198 C ASP A 201 11.820 -4.744 7.183 1.00 0.31 C ATOM 3199 O ASP A 201 12.728 -5.547 7.363 1.00 0.36 O ATOM 3200 CB ASP A 201 10.401 -4.114 9.150 1.00 0.40 C ATOM 3201 CG ASP A 201 10.779 -5.307 10.007 1.00 1.10 C ATOM 3202 OD1 ASP A 201 11.675 -5.161 10.868 1.00 1.18 O ATOM 3203 OD2 ASP A 201 10.165 -6.385 9.847 1.00 1.94 O ATOM 0 H ASP A 201 10.214 -2.157 7.613 1.00 0.30 H new ATOM 0 HA ASP A 201 12.441 -3.524 8.810 1.00 0.33 H new ATOM 0 HB2 ASP A 201 10.117 -3.283 9.796 1.00 0.40 H new ATOM 0 HB3 ASP A 201 9.526 -4.365 8.551 1.00 0.40 H new ATOM 3208 N GLY A 202 11.062 -4.754 6.090 1.00 0.31 N ATOM 3209 CA GLY A 202 11.328 -5.724 5.028 1.00 0.37 C ATOM 3210 C GLY A 202 12.633 -5.409 4.340 1.00 0.37 C ATOM 3211 O GLY A 202 13.371 -6.293 3.904 1.00 0.47 O ATOM 0 H GLY A 202 10.280 -4.122 5.917 1.00 0.31 H new ATOM 0 HA2 GLY A 202 11.364 -6.730 5.447 1.00 0.37 H new ATOM 0 HA3 GLY A 202 10.515 -5.710 4.302 1.00 0.37 H new ATOM 3215 N ILE A 203 12.892 -4.125 4.239 1.00 0.30 N ATOM 3216 CA ILE A 203 14.142 -3.602 3.747 1.00 0.37 C ATOM 3217 C ILE A 203 15.290 -3.964 4.681 1.00 0.47 C ATOM 3218 O ILE A 203 16.408 -4.233 4.240 1.00 0.61 O ATOM 3219 CB ILE A 203 14.017 -2.079 3.606 1.00 0.32 C ATOM 3220 CG1 ILE A 203 13.962 -1.689 2.145 1.00 0.41 C ATOM 3221 CG2 ILE A 203 15.113 -1.325 4.327 1.00 0.38 C ATOM 3222 CD1 ILE A 203 12.723 -2.146 1.438 1.00 0.52 C ATOM 0 H ILE A 203 12.224 -3.401 4.503 1.00 0.30 H new ATOM 0 HA ILE A 203 14.362 -4.044 2.775 1.00 0.37 H new ATOM 0 HB ILE A 203 13.083 -1.792 4.088 1.00 0.32 H new ATOM 0 HG12 ILE A 203 14.034 -0.604 2.066 1.00 0.41 H new ATOM 0 HG13 ILE A 203 14.832 -2.104 1.636 1.00 0.41 H new ATOM 0 HG21 ILE A 203 14.969 -0.253 4.189 1.00 0.38 H new ATOM 0 HG22 ILE A 203 15.079 -1.562 5.390 1.00 0.38 H new ATOM 0 HG23 ILE A 203 16.082 -1.616 3.921 1.00 0.38 H new ATOM 0 HD11 ILE A 203 12.760 -1.827 0.396 1.00 0.52 H new ATOM 0 HD12 ILE A 203 12.659 -3.233 1.483 1.00 0.52 H new ATOM 0 HD13 ILE A 203 11.848 -1.711 1.920 1.00 0.52 H new ATOM 3234 N LYS A 204 15.009 -3.979 5.972 1.00 0.47 N ATOM 3235 CA LYS A 204 16.017 -4.353 6.944 1.00 0.63 C ATOM 3236 C LYS A 204 16.204 -5.853 6.900 1.00 0.64 C ATOM 3237 O LYS A 204 17.306 -6.361 6.989 1.00 0.78 O ATOM 3238 CB LYS A 204 15.646 -3.942 8.366 1.00 0.74 C ATOM 3239 CG LYS A 204 15.467 -2.458 8.596 1.00 1.21 C ATOM 3240 CD LYS A 204 16.533 -1.687 7.881 1.00 1.55 C ATOM 3241 CE LYS A 204 16.371 -0.187 8.055 1.00 2.41 C ATOM 3242 NZ LYS A 204 17.571 0.556 7.587 1.00 3.37 N ATOM 0 H LYS A 204 14.100 -3.739 6.367 1.00 0.47 H new ATOM 0 HA LYS A 204 16.936 -3.829 6.682 1.00 0.63 H new ATOM 0 HB2 LYS A 204 14.720 -4.447 8.640 1.00 0.74 H new ATOM 0 HB3 LYS A 204 16.420 -4.305 9.043 1.00 0.74 H new ATOM 0 HG2 LYS A 204 14.484 -2.145 8.244 1.00 1.21 H new ATOM 0 HG3 LYS A 204 15.507 -2.242 9.664 1.00 1.21 H new ATOM 0 HD2 LYS A 204 17.511 -1.991 8.254 1.00 1.55 H new ATOM 0 HD3 LYS A 204 16.507 -1.933 6.819 1.00 1.55 H new ATOM 0 HE2 LYS A 204 15.495 0.151 7.501 1.00 2.41 H new ATOM 0 HE3 LYS A 204 16.190 0.040 9.106 1.00 2.41 H new ATOM 0 HZ1 LYS A 204 17.422 1.576 7.722 1.00 3.37 H new ATOM 0 HZ2 LYS A 204 18.402 0.252 8.133 1.00 3.37 H new ATOM 0 HZ3 LYS A 204 17.729 0.360 6.578 1.00 3.37 H new ATOM 3256 N ALA A 205 15.100 -6.550 6.747 1.00 0.57 N ATOM 3257 CA ALA A 205 15.105 -7.985 6.539 1.00 0.69 C ATOM 3258 C ALA A 205 15.967 -8.309 5.332 1.00 0.87 C ATOM 3259 O ALA A 205 16.662 -9.327 5.294 1.00 1.02 O ATOM 3260 CB ALA A 205 13.681 -8.473 6.335 1.00 0.68 C ATOM 0 H ALA A 205 14.167 -6.137 6.763 1.00 0.57 H new ATOM 0 HA ALA A 205 15.519 -8.490 7.412 1.00 0.69 H new ATOM 0 HB1 ALA A 205 13.685 -9.552 6.179 1.00 0.68 H new ATOM 0 HB2 ALA A 205 13.085 -8.236 7.217 1.00 0.68 H new ATOM 0 HB3 ALA A 205 13.249 -7.982 5.463 1.00 0.68 H new ATOM 3266 N HIS A 206 15.924 -7.414 4.352 1.00 0.89 N ATOM 3267 CA HIS A 206 16.777 -7.517 3.176 1.00 1.11 C ATOM 3268 C HIS A 206 18.261 -7.451 3.536 1.00 1.21 C ATOM 3269 O HIS A 206 19.056 -8.231 3.009 1.00 1.52 O ATOM 3270 CB HIS A 206 16.428 -6.404 2.184 1.00 1.29 C ATOM 3271 CG HIS A 206 17.396 -6.234 1.044 1.00 2.13 C ATOM 3272 ND1 HIS A 206 17.421 -7.057 -0.058 1.00 2.83 N ATOM 3273 CD2 HIS A 206 18.346 -5.293 0.826 1.00 2.92 C ATOM 3274 CE1 HIS A 206 18.339 -6.629 -0.903 1.00 3.56 C ATOM 3275 NE2 HIS A 206 18.915 -5.558 -0.394 1.00 3.63 N ATOM 0 H HIS A 206 15.303 -6.605 4.350 1.00 0.89 H new ATOM 0 HA HIS A 206 16.595 -8.490 2.719 1.00 1.11 H new ATOM 0 HB2 HIS A 206 15.438 -6.603 1.773 1.00 1.29 H new ATOM 0 HB3 HIS A 206 16.363 -5.462 2.728 1.00 1.29 H new ATOM 0 HD2 HIS A 206 18.607 -4.483 1.491 1.00 2.92 H new ATOM 0 HE1 HIS A 206 18.579 -7.081 -1.854 1.00 3.56 H new ATOM 0 HE2 HIS A 206 19.659 -5.017 -0.834 1.00 3.63 H new ATOM 3284 N ARG A 207 18.650 -6.538 4.427 1.00 1.11 N ATOM 3285 CA ARG A 207 20.075 -6.304 4.635 1.00 1.23 C ATOM 3286 C ARG A 207 20.491 -6.319 6.107 1.00 1.36 C ATOM 3287 O ARG A 207 21.471 -6.968 6.469 1.00 1.67 O ATOM 3288 CB ARG A 207 20.520 -4.990 3.983 1.00 1.20 C ATOM 3289 CG ARG A 207 19.828 -3.756 4.533 1.00 1.41 C ATOM 3290 CD ARG A 207 20.582 -2.487 4.169 1.00 1.49 C ATOM 3291 NE ARG A 207 20.690 -2.300 2.725 1.00 1.73 N ATOM 3292 CZ ARG A 207 21.832 -2.346 2.043 1.00 2.04 C ATOM 3293 NH1 ARG A 207 22.979 -2.615 2.657 1.00 2.47 N ATOM 3294 NH2 ARG A 207 21.812 -2.136 0.736 1.00 2.59 N ATOM 0 H ARG A 207 18.024 -5.969 4.996 1.00 1.11 H new ATOM 0 HA ARG A 207 20.580 -7.142 4.154 1.00 1.23 H new ATOM 0 HB2 ARG A 207 21.596 -4.878 4.115 1.00 1.20 H new ATOM 0 HB3 ARG A 207 20.335 -5.049 2.910 1.00 1.20 H new ATOM 0 HG2 ARG A 207 18.812 -3.702 4.142 1.00 1.41 H new ATOM 0 HG3 ARG A 207 19.748 -3.835 5.617 1.00 1.41 H new ATOM 0 HD2 ARG A 207 20.075 -1.628 4.607 1.00 1.49 H new ATOM 0 HD3 ARG A 207 21.581 -2.523 4.604 1.00 1.49 H new ATOM 0 HE ARG A 207 19.832 -2.122 2.203 1.00 1.73 H new ATOM 0 HH11 ARG A 207 22.991 -2.789 3.662 1.00 2.47 H new ATOM 0 HH12 ARG A 207 23.848 -2.647 2.123 1.00 2.47 H new ATOM 0 HH21 ARG A 207 20.929 -1.942 0.264 1.00 2.59 H new ATOM 0 HH22 ARG A 207 22.680 -2.168 0.201 1.00 2.59 H new ATOM 3308 N THR A 208 19.743 -5.632 6.950 1.00 1.20 N ATOM 3309 CA THR A 208 20.136 -5.424 8.332 1.00 1.41 C ATOM 3310 C THR A 208 20.059 -6.733 9.124 1.00 1.48 C ATOM 3311 O THR A 208 19.116 -7.509 8.967 1.00 1.35 O ATOM 3312 CB THR A 208 19.232 -4.348 8.973 1.00 1.37 C ATOM 3313 OG1 THR A 208 19.212 -3.186 8.128 1.00 1.84 O ATOM 3314 CG2 THR A 208 19.722 -3.957 10.359 1.00 1.53 C ATOM 0 H THR A 208 18.851 -5.205 6.699 1.00 1.20 H new ATOM 0 HA THR A 208 21.170 -5.080 8.355 1.00 1.41 H new ATOM 0 HB THR A 208 18.229 -4.762 9.076 1.00 1.37 H new ATOM 0 HG1 THR A 208 19.399 -2.388 8.665 1.00 1.84 H new ATOM 0 HG21 THR A 208 19.061 -3.198 10.778 1.00 1.53 H new ATOM 0 HG22 THR A 208 19.723 -4.835 11.006 1.00 1.53 H new ATOM 0 HG23 THR A 208 20.734 -3.558 10.288 1.00 1.53 H new ATOM 3322 N PRO A 209 21.075 -7.005 9.969 1.00 1.78 N ATOM 3323 CA PRO A 209 21.141 -8.224 10.795 1.00 1.95 C ATOM 3324 C PRO A 209 20.012 -8.322 11.825 1.00 1.87 C ATOM 3325 O PRO A 209 20.005 -9.223 12.667 1.00 2.12 O ATOM 3326 CB PRO A 209 22.494 -8.107 11.509 1.00 2.33 C ATOM 3327 CG PRO A 209 23.274 -7.119 10.714 1.00 2.35 C ATOM 3328 CD PRO A 209 22.265 -6.158 10.163 1.00 2.03 C ATOM 0 HA PRO A 209 21.035 -9.118 10.180 1.00 1.95 H new ATOM 0 HB2 PRO A 209 22.368 -7.772 12.538 1.00 2.33 H new ATOM 0 HB3 PRO A 209 23.003 -9.070 11.548 1.00 2.33 H new ATOM 0 HG2 PRO A 209 24.006 -6.605 11.337 1.00 2.35 H new ATOM 0 HG3 PRO A 209 23.827 -7.609 9.913 1.00 2.35 H new ATOM 0 HD2 PRO A 209 22.069 -5.338 10.854 1.00 2.03 H new ATOM 0 HD3 PRO A 209 22.601 -5.713 9.227 1.00 2.03 H new ATOM 3336 N SER A 210 19.059 -7.404 11.752 1.00 1.76 N ATOM 3337 CA SER A 210 17.889 -7.436 12.612 1.00 1.78 C ATOM 3338 C SER A 210 17.015 -8.640 12.270 1.00 1.74 C ATOM 3339 O SER A 210 16.229 -9.109 13.094 1.00 2.01 O ATOM 3340 CB SER A 210 17.100 -6.136 12.456 1.00 1.85 C ATOM 3341 OG SER A 210 16.913 -5.821 11.086 1.00 2.31 O ATOM 0 H SER A 210 19.076 -6.621 11.098 1.00 1.76 H new ATOM 0 HA SER A 210 18.209 -7.531 13.650 1.00 1.78 H new ATOM 0 HB2 SER A 210 16.132 -6.232 12.947 1.00 1.85 H new ATOM 0 HB3 SER A 210 17.629 -5.322 12.952 1.00 1.85 H new ATOM 0 HG SER A 210 16.163 -5.197 10.993 1.00 2.31 H new ATOM 3347 N ARG A 211 17.185 -9.161 11.052 1.00 1.75 N ATOM 3348 CA ARG A 211 16.435 -10.334 10.611 1.00 1.94 C ATOM 3349 C ARG A 211 17.010 -11.615 11.220 1.00 2.32 C ATOM 3350 O ARG A 211 16.719 -12.724 10.768 1.00 2.55 O ATOM 3351 CB ARG A 211 16.402 -10.421 9.077 1.00 2.31 C ATOM 3352 CG ARG A 211 17.761 -10.605 8.420 1.00 2.60 C ATOM 3353 CD ARG A 211 17.879 -11.980 7.780 1.00 3.06 C ATOM 3354 NE ARG A 211 19.107 -12.132 6.997 1.00 3.80 N ATOM 3355 CZ ARG A 211 19.408 -13.225 6.291 1.00 4.56 C ATOM 3356 NH1 ARG A 211 18.548 -14.239 6.235 1.00 4.78 N ATOM 3357 NH2 ARG A 211 20.551 -13.294 5.620 1.00 5.45 N ATOM 0 H ARG A 211 17.833 -8.789 10.358 1.00 1.75 H new ATOM 0 HA ARG A 211 15.409 -10.227 10.964 1.00 1.94 H new ATOM 0 HB2 ARG A 211 15.759 -11.252 8.788 1.00 2.31 H new ATOM 0 HB3 ARG A 211 15.945 -9.513 8.685 1.00 2.31 H new ATOM 0 HG2 ARG A 211 17.910 -9.835 7.663 1.00 2.60 H new ATOM 0 HG3 ARG A 211 18.548 -10.478 9.163 1.00 2.60 H new ATOM 0 HD2 ARG A 211 17.852 -12.743 8.558 1.00 3.06 H new ATOM 0 HD3 ARG A 211 17.017 -12.152 7.135 1.00 3.06 H new ATOM 0 HE ARG A 211 19.771 -11.358 6.990 1.00 3.80 H new ATOM 0 HH11 ARG A 211 17.659 -14.182 6.731 1.00 4.78 H new ATOM 0 HH12 ARG A 211 18.778 -15.074 5.696 1.00 4.78 H new ATOM 0 HH21 ARG A 211 21.204 -12.510 5.642 1.00 5.45 H new ATOM 0 HH22 ARG A 211 20.777 -14.131 5.082 1.00 5.45 H new ATOM 3371 N ARG A 212 17.834 -11.453 12.251 1.00 2.62 N ATOM 3372 CA ARG A 212 18.298 -12.576 13.048 1.00 3.26 C ATOM 3373 C ARG A 212 17.100 -13.264 13.695 1.00 3.32 C ATOM 3374 O ARG A 212 17.050 -14.488 13.797 1.00 3.71 O ATOM 3375 CB ARG A 212 19.274 -12.085 14.121 1.00 3.80 C ATOM 3376 CG ARG A 212 19.747 -13.161 15.091 1.00 4.37 C ATOM 3377 CD ARG A 212 20.630 -14.205 14.419 1.00 4.99 C ATOM 3378 NE ARG A 212 19.883 -15.082 13.519 1.00 5.44 N ATOM 3379 CZ ARG A 212 20.428 -16.090 12.838 1.00 6.24 C ATOM 3380 NH1 ARG A 212 21.715 -16.378 12.980 1.00 6.66 N ATOM 3381 NH2 ARG A 212 19.683 -16.814 12.013 1.00 6.86 N ATOM 0 H ARG A 212 18.194 -10.548 12.553 1.00 2.62 H new ATOM 0 HA ARG A 212 18.817 -13.289 12.408 1.00 3.26 H new ATOM 0 HB2 ARG A 212 20.144 -11.650 13.630 1.00 3.80 H new ATOM 0 HB3 ARG A 212 18.797 -11.287 14.689 1.00 3.80 H new ATOM 0 HG2 ARG A 212 20.299 -12.693 15.906 1.00 4.37 H new ATOM 0 HG3 ARG A 212 18.881 -13.653 15.533 1.00 4.37 H new ATOM 0 HD2 ARG A 212 21.418 -13.702 13.858 1.00 4.99 H new ATOM 0 HD3 ARG A 212 21.119 -14.808 15.184 1.00 4.99 H new ATOM 0 HE ARG A 212 18.884 -14.912 13.405 1.00 5.44 H new ATOM 0 HH11 ARG A 212 22.294 -15.827 13.613 1.00 6.66 H new ATOM 0 HH12 ARG A 212 22.126 -17.151 12.456 1.00 6.66 H new ATOM 0 HH21 ARG A 212 18.692 -16.600 11.899 1.00 6.86 H new ATOM 0 HH22 ARG A 212 20.101 -17.585 11.492 1.00 6.86 H new ATOM 3395 N GLY A 213 16.132 -12.458 14.107 1.00 3.12 N ATOM 3396 CA GLY A 213 14.907 -12.987 14.668 1.00 3.37 C ATOM 3397 C GLY A 213 13.774 -12.936 13.665 1.00 2.92 C ATOM 3398 O GLY A 213 12.664 -12.516 13.989 1.00 3.19 O ATOM 0 H GLY A 213 16.175 -11.440 14.062 1.00 3.12 H new ATOM 0 HA2 GLY A 213 15.066 -14.017 14.988 1.00 3.37 H new ATOM 0 HA3 GLY A 213 14.635 -12.416 15.556 1.00 3.37 H new ATOM 3402 N PHE A 214 14.067 -13.347 12.438 1.00 2.56 N ATOM 3403 CA PHE A 214 13.081 -13.343 11.365 1.00 2.44 C ATOM 3404 C PHE A 214 12.098 -14.493 11.548 1.00 2.70 C ATOM 3405 O PHE A 214 12.492 -15.614 11.872 1.00 3.00 O ATOM 3406 CB PHE A 214 13.779 -13.457 10.007 1.00 2.65 C ATOM 3407 CG PHE A 214 12.865 -13.282 8.827 1.00 3.21 C ATOM 3408 CD1 PHE A 214 12.568 -12.016 8.351 1.00 3.82 C ATOM 3409 CD2 PHE A 214 12.303 -14.379 8.193 1.00 3.73 C ATOM 3410 CE1 PHE A 214 11.730 -11.847 7.267 1.00 4.85 C ATOM 3411 CE2 PHE A 214 11.464 -14.216 7.108 1.00 4.67 C ATOM 3412 CZ PHE A 214 11.177 -12.947 6.644 1.00 5.21 C ATOM 0 H PHE A 214 14.987 -13.690 12.160 1.00 2.56 H new ATOM 0 HA PHE A 214 12.530 -12.403 11.399 1.00 2.44 H new ATOM 0 HB2 PHE A 214 14.570 -12.709 9.954 1.00 2.65 H new ATOM 0 HB3 PHE A 214 14.259 -14.433 9.939 1.00 2.65 H new ATOM 0 HD1 PHE A 214 12.997 -11.150 8.834 1.00 3.82 H new ATOM 0 HD2 PHE A 214 12.524 -15.373 8.552 1.00 3.73 H new ATOM 0 HE1 PHE A 214 11.507 -10.854 6.907 1.00 4.85 H new ATOM 0 HE2 PHE A 214 11.033 -15.079 6.623 1.00 4.67 H new ATOM 0 HZ PHE A 214 10.521 -12.816 5.796 1.00 5.21 H new ATOM 3422 N HIS A 215 10.820 -14.212 11.350 1.00 2.97 N ATOM 3423 CA HIS A 215 9.793 -15.227 11.508 1.00 3.39 C ATOM 3424 C HIS A 215 9.042 -15.463 10.207 1.00 3.17 C ATOM 3425 O HIS A 215 8.114 -14.733 9.867 1.00 3.66 O ATOM 3426 CB HIS A 215 8.824 -14.847 12.627 1.00 4.23 C ATOM 3427 CG HIS A 215 9.416 -14.992 13.992 1.00 4.93 C ATOM 3428 ND1 HIS A 215 9.374 -16.167 14.708 1.00 5.70 N ATOM 3429 CD2 HIS A 215 10.092 -14.111 14.761 1.00 5.40 C ATOM 3430 CE1 HIS A 215 9.999 -16.001 15.858 1.00 6.46 C ATOM 3431 NE2 HIS A 215 10.445 -14.762 15.916 1.00 6.32 N ATOM 0 H HIS A 215 10.471 -13.292 11.080 1.00 2.97 H new ATOM 0 HA HIS A 215 10.288 -16.159 11.781 1.00 3.39 H new ATOM 0 HB2 HIS A 215 8.502 -13.815 12.485 1.00 4.23 H new ATOM 0 HB3 HIS A 215 7.934 -15.472 12.556 1.00 4.23 H new ATOM 0 HD1 HIS A 215 8.929 -17.031 14.398 1.00 5.70 H new ATOM 0 HD2 HIS A 215 10.314 -13.084 14.513 1.00 5.40 H new ATOM 0 HE1 HIS A 215 10.124 -16.753 16.623 1.00 6.46 H new ATOM 3440 N HIS A 216 9.451 -16.500 9.493 1.00 2.99 N ATOM 3441 CA HIS A 216 8.812 -16.889 8.243 1.00 3.27 C ATOM 3442 C HIS A 216 7.686 -17.882 8.536 1.00 3.26 C ATOM 3443 O HIS A 216 7.500 -18.874 7.829 1.00 3.78 O ATOM 3444 CB HIS A 216 9.855 -17.511 7.301 1.00 3.92 C ATOM 3445 CG HIS A 216 9.417 -17.621 5.866 1.00 4.66 C ATOM 3446 ND1 HIS A 216 8.954 -18.793 5.301 1.00 5.31 N ATOM 3447 CD2 HIS A 216 9.387 -16.696 4.875 1.00 5.27 C ATOM 3448 CE1 HIS A 216 8.661 -18.583 4.030 1.00 6.09 C ATOM 3449 NE2 HIS A 216 8.914 -17.321 3.747 1.00 6.09 N ATOM 0 H HIS A 216 10.234 -17.096 9.762 1.00 2.99 H new ATOM 0 HA HIS A 216 8.387 -16.011 7.756 1.00 3.27 H new ATOM 0 HB2 HIS A 216 10.766 -16.914 7.344 1.00 3.92 H new ATOM 0 HB3 HIS A 216 10.108 -18.506 7.667 1.00 3.92 H new ATOM 0 HD2 HIS A 216 9.681 -15.660 4.957 1.00 5.27 H new ATOM 0 HE1 HIS A 216 8.279 -19.321 3.340 1.00 6.09 H new ATOM 0 HE2 HIS A 216 8.780 -16.880 2.837 1.00 6.09 H new ATOM 3458 N ASN A 217 6.931 -17.598 9.587 1.00 3.18 N ATOM 3459 CA ASN A 217 5.887 -18.500 10.054 1.00 3.63 C ATOM 3460 C ASN A 217 4.559 -18.154 9.393 1.00 4.03 C ATOM 3461 O ASN A 217 3.743 -17.423 9.951 1.00 4.27 O ATOM 3462 CB ASN A 217 5.757 -18.432 11.582 1.00 3.95 C ATOM 3463 CG ASN A 217 7.075 -18.692 12.299 1.00 4.57 C ATOM 3464 OD1 ASN A 217 7.817 -17.762 12.615 1.00 5.00 O ATOM 3465 ND2 ASN A 217 7.377 -19.953 12.562 1.00 5.12 N ATOM 0 H ASN A 217 7.023 -16.744 10.136 1.00 3.18 H new ATOM 0 HA ASN A 217 6.161 -19.518 9.779 1.00 3.63 H new ATOM 0 HB2 ASN A 217 5.382 -17.449 11.867 1.00 3.95 H new ATOM 0 HB3 ASN A 217 5.019 -19.163 11.912 1.00 3.95 H new ATOM 0 HD21 ASN A 217 8.248 -20.179 13.041 1.00 5.12 H new ATOM 0 HD22 ASN A 217 6.738 -20.699 12.286 1.00 5.12 H new ATOM 3472 N SER A 218 4.350 -18.697 8.203 1.00 4.58 N ATOM 3473 CA SER A 218 3.161 -18.404 7.416 1.00 5.38 C ATOM 3474 C SER A 218 2.010 -19.348 7.767 1.00 5.75 C ATOM 3475 O SER A 218 0.921 -19.251 7.204 1.00 6.25 O ATOM 3476 CB SER A 218 3.504 -18.497 5.927 1.00 6.28 C ATOM 3477 OG SER A 218 4.296 -19.648 5.655 1.00 6.76 O ATOM 0 H SER A 218 4.995 -19.349 7.758 1.00 4.58 H new ATOM 0 HA SER A 218 2.829 -17.392 7.649 1.00 5.38 H new ATOM 0 HB2 SER A 218 2.586 -18.537 5.341 1.00 6.28 H new ATOM 0 HB3 SER A 218 4.041 -17.601 5.618 1.00 6.28 H new ATOM 0 HG SER A 218 4.500 -19.686 4.697 1.00 6.76 H new ATOM 3483 N HIS A 219 2.256 -20.264 8.694 1.00 5.79 N ATOM 3484 CA HIS A 219 1.223 -21.198 9.129 1.00 6.41 C ATOM 3485 C HIS A 219 0.632 -20.728 10.450 1.00 6.51 C ATOM 3486 O HIS A 219 -0.477 -20.195 10.486 1.00 6.61 O ATOM 3487 CB HIS A 219 1.789 -22.617 9.271 1.00 7.04 C ATOM 3488 CG HIS A 219 2.241 -23.229 7.977 1.00 7.61 C ATOM 3489 ND1 HIS A 219 2.008 -24.545 7.648 1.00 8.17 N ATOM 3490 CD2 HIS A 219 2.933 -22.703 6.938 1.00 8.02 C ATOM 3491 CE1 HIS A 219 2.537 -24.802 6.465 1.00 8.82 C ATOM 3492 NE2 HIS A 219 3.104 -23.700 6.014 1.00 8.76 N ATOM 0 H HIS A 219 3.157 -20.381 9.158 1.00 5.79 H new ATOM 0 HA HIS A 219 0.438 -21.226 8.373 1.00 6.41 H new ATOM 0 HB2 HIS A 219 2.631 -22.593 9.963 1.00 7.04 H new ATOM 0 HB3 HIS A 219 1.028 -23.257 9.717 1.00 7.04 H new ATOM 0 HD2 HIS A 219 3.285 -21.685 6.854 1.00 8.02 H new ATOM 0 HE1 HIS A 219 2.510 -25.753 5.954 1.00 8.82 H new ATOM 0 HE2 HIS A 219 3.591 -23.605 5.123 1.00 8.76 H new ATOM 3501 N SER A 220 1.386 -20.927 11.522 1.00 6.83 N ATOM 3502 CA SER A 220 1.031 -20.428 12.843 1.00 7.31 C ATOM 3503 C SER A 220 2.155 -20.777 13.810 1.00 7.98 C ATOM 3504 O SER A 220 2.220 -21.942 14.254 1.00 8.48 O ATOM 3505 CB SER A 220 -0.300 -21.016 13.336 1.00 7.71 C ATOM 3506 OG SER A 220 -0.742 -20.364 14.519 1.00 7.85 O ATOM 3507 OXT SER A 220 2.995 -19.901 14.087 1.00 8.25 O ATOM 0 H SER A 220 2.266 -21.442 11.499 1.00 6.83 H new ATOM 0 HA SER A 220 0.900 -19.347 12.788 1.00 7.31 H new ATOM 0 HB2 SER A 220 -1.056 -20.915 12.557 1.00 7.71 H new ATOM 0 HB3 SER A 220 -0.181 -22.082 13.528 1.00 7.71 H new ATOM 0 HG SER A 220 -1.591 -20.756 14.811 1.00 7.85 H new TER 3513 SER A 220