USER MOD reduce.3.24.130724 H: found=0, std=0, add=1460, rem=0, adj=61 USER MOD reduce.3.24.130724 removed 1464 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 76 LYS NZ :NH3+ 157:sc= 1.28 (180deg=0) USER MOD Set 1.2: A 190 SER OG : rot 180:sc= 0 USER MOD Set 1.3: A 194 ASN : amide:sc= 0.732 K(o=2,f=-8.7!) USER MOD Set 2.1: A 173 THR OG1 : rot 141:sc= -0.257 USER MOD Set 2.2: A 187 THR OG1 : rot -88:sc= 0.0797 USER MOD Set 2.3: A 188 MET CE :methyl -150:sc= -3.04! (180deg=-4.14!) USER MOD Set 3.1: A 129 SER OG : rot 90:sc= 1.34 USER MOD Set 3.2: A 151 CYS SG : rot -8:sc= -1.99! USER MOD Set 4.1: A 67 GLN : amide:sc= -3.72! C(o=-4.8!,f=-11!) USER MOD Set 4.2: A 81 TYR OH : rot 6:sc= 1.39 USER MOD Set 4.3: A 83 MET CE :methyl -136:sc= -0.28 (180deg=-1.01) USER MOD Set 4.4: A 94 CYS SG : rot -53:sc= -2.19! USER MOD Set 5.1: A 79 GLN : amide:sc= 1.05 K(o=2.1,f=-2.9!) USER MOD Set 5.2: A 99 GLN : amide:sc= 1.05 K(o=2.1,f=-4.1!) USER MOD Set 6.1: A 77 SER OG : rot 109:sc= -1.05 USER MOD Set 6.2: A 198 ASN : amide:sc= -5.93! C(o=-7!,f=-8.2!) USER MOD Set 7.1: A 62 SER OG : rot 90:sc= 1.29 USER MOD Set 7.2: A 125 ASN : amide:sc= -0.286 K(o=1,f=-0.56) USER MOD Set 8.1: A 10 THR OG1 : rot 36:sc= -0.974 USER MOD Set 8.2: A 130 LYS NZ :NH3+ -163:sc= 1.04 (180deg=0.824) USER MOD Single : A 4 LYS NZ :NH3+ -172:sc= 1.18 (180deg=1.06) USER MOD Single : A 8 GLN : amide:sc= -3.8! C(o=-3.8!,f=-6.9!) USER MOD Single : A 9 GLN :FLIP amide:sc= -0.291 F(o=-1.3,f=-0.29) USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -3.9 K(o=-3.9,f=-5.3!) USER MOD Single : A 21 THR OG1 : rot 51:sc= 0.325 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 143:sc= 0.92 (180deg=-0.363!) USER MOD Single : A 28 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.107) USER MOD Single : A 29 THR OG1 : rot 49:sc= 1.3 USER MOD Single : A 30 SER OG : rot 180:sc= 0.477 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ -116:sc= 0.182 (180deg=-0.283) USER MOD Single : A 34 THR OG1 : rot 79:sc= 0.115 USER MOD Single : A 36 SER OG : rot 33:sc= 0.397 USER MOD Single : A 37 SER OG : rot 107:sc= 0.48 USER MOD Single : A 38 LYS NZ :NH3+ -176:sc= 0.282 (180deg=0.231) USER MOD Single : A 46 ASN : amide:sc= -0.0881 K(o=-0.088,f=-1.6!) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0.00775 USER MOD Single : A 60 LYS NZ :NH3+ -152:sc= 1.06 (180deg=-0.612) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot -42:sc= 0.598 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot 129:sc= -0.193 USER MOD Single : A 95 HIS : no HE2:sc= -0.658 X(o=-0.66,f=-0.99) USER MOD Single : A 96 THR OG1 : rot -79:sc= -1.43! USER MOD Single : A 98 THR OG1 : rot 171:sc= 1.79 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -166:sc= -0.0297 (180deg=-0.259) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 ASN :FLIP amide:sc= -0.0697 F(o=-1.5!,f=-0.07) USER MOD Single : A 124 MET CE :methyl -155:sc= -0.213 (180deg=-0.917) USER MOD Single : A 128 SER OG : rot 85:sc= -0.85! USER MOD Single : A 131 SER OG : rot 129:sc= -0.93! USER MOD Single : A 137 TYR OH : rot 165:sc= -0.0557 USER MOD Single : A 140 SER OG : rot 170:sc= 0.0108 USER MOD Single : A 141 SER OG : rot 180:sc= 0.00341 USER MOD Single : A 142 ASN : amide:sc=-0.00224 K(o=-0.0022,f=-0.84) 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 148 ASN : amide:sc= -1.05! C(o=-1.1!,f=-4.6!) USER MOD Single : A 149 HIS : no HD1:sc= 0.721 K(o=0.72,f=-5.9!) USER MOD Single : A 155 CYS SG : rot -150:sc= -0.308 USER MOD Single : A 156 SER OG : rot 180:sc= -0.129 USER MOD Single : A 158 MET CE :methyl -134:sc= -0.254 (180deg=-0.741) USER MOD Single : A 161 ASN : amide:sc= -3.78! C(o=-3.8!,f=-8.6!) USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 165 SER OG : rot 69:sc= 0.779 USER MOD Single : A 166 LYS NZ :NH3+ 170:sc=-0.00123 (180deg=-0.141) USER MOD Single : A 169 MET CE :methyl 158:sc= 0 (180deg=-0.226) USER MOD Single : A 172 GLN :FLIP amide:sc= -3.72! C(o=-4.8!,f=-3.7!) USER MOD Single : A 186 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 191 ASN : amide:sc= -1.2 X(o=-1.2,f=-1) USER MOD Single : A 200 LYS NZ :NH3+ -174:sc= -0.0418 (180deg=-0.122) USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N ASP A 2 -9.146 -5.227 -19.706 1.00 0.84 N ATOM 21 CA ASP A 2 -9.852 -4.048 -19.237 1.00 0.67 C ATOM 22 C ASP A 2 -9.169 -3.456 -18.025 1.00 0.52 C ATOM 23 O ASP A 2 -9.171 -2.246 -17.833 1.00 0.53 O ATOM 24 CB ASP A 2 -11.298 -4.395 -18.892 1.00 0.98 C ATOM 25 CG ASP A 2 -12.112 -4.764 -20.115 1.00 1.50 C ATOM 26 OD1 ASP A 2 -12.703 -3.857 -20.738 1.00 1.72 O ATOM 27 OD2 ASP A 2 -12.158 -5.960 -20.468 1.00 2.25 O ATOM 0 HA ASP A 2 -9.841 -3.310 -20.039 1.00 0.67 H new ATOM 0 HB2 ASP A 2 -11.311 -5.226 -18.186 1.00 0.98 H new ATOM 0 HB3 ASP A 2 -11.763 -3.545 -18.392 1.00 0.98 H new ATOM 32 N PHE A 3 -8.541 -4.307 -17.229 1.00 0.43 N ATOM 33 CA PHE A 3 -7.916 -3.875 -15.994 1.00 0.34 C ATOM 34 C PHE A 3 -6.741 -2.986 -16.310 1.00 0.37 C ATOM 35 O PHE A 3 -6.444 -2.038 -15.596 1.00 0.40 O ATOM 36 CB PHE A 3 -7.445 -5.072 -15.185 1.00 0.30 C ATOM 37 CG PHE A 3 -8.549 -5.933 -14.656 1.00 0.29 C ATOM 38 CD1 PHE A 3 -9.216 -5.579 -13.501 1.00 0.28 C ATOM 39 CD2 PHE A 3 -8.898 -7.109 -15.293 1.00 0.30 C ATOM 40 CE1 PHE A 3 -10.206 -6.377 -12.984 1.00 0.29 C ATOM 41 CE2 PHE A 3 -9.894 -7.913 -14.787 1.00 0.31 C ATOM 42 CZ PHE A 3 -10.547 -7.548 -13.628 1.00 0.29 C ATOM 0 H PHE A 3 -8.452 -5.305 -17.420 1.00 0.43 H new ATOM 0 HA PHE A 3 -8.649 -3.323 -15.405 1.00 0.34 H new ATOM 0 HB2 PHE A 3 -6.792 -5.682 -15.808 1.00 0.30 H new ATOM 0 HB3 PHE A 3 -6.845 -4.716 -14.347 1.00 0.30 H new ATOM 0 HD1 PHE A 3 -8.955 -4.660 -12.996 1.00 0.28 H new ATOM 0 HD2 PHE A 3 -8.384 -7.400 -16.197 1.00 0.30 H new ATOM 0 HE1 PHE A 3 -10.716 -6.089 -12.077 1.00 0.29 H new ATOM 0 HE2 PHE A 3 -10.163 -8.827 -15.296 1.00 0.31 H new ATOM 0 HZ PHE A 3 -11.325 -8.179 -13.225 1.00 0.29 H new ATOM 52 N LYS A 4 -6.117 -3.281 -17.429 1.00 0.40 N ATOM 53 CA LYS A 4 -4.977 -2.549 -17.896 1.00 0.47 C ATOM 54 C LYS A 4 -5.420 -1.215 -18.468 1.00 0.54 C ATOM 55 O LYS A 4 -4.623 -0.438 -18.963 1.00 0.95 O ATOM 56 CB LYS A 4 -4.244 -3.351 -18.961 1.00 0.54 C ATOM 57 CG LYS A 4 -2.742 -3.431 -18.731 1.00 0.68 C ATOM 58 CD LYS A 4 -2.053 -4.298 -19.772 1.00 0.83 C ATOM 59 CE LYS A 4 -0.546 -4.306 -19.573 1.00 1.10 C ATOM 60 NZ LYS A 4 0.154 -5.062 -20.645 1.00 1.51 N ATOM 0 H LYS A 4 -6.396 -4.047 -18.042 1.00 0.40 H new ATOM 0 HA LYS A 4 -4.302 -2.372 -17.059 1.00 0.47 H new ATOM 0 HB2 LYS A 4 -4.654 -4.361 -18.991 1.00 0.54 H new ATOM 0 HB3 LYS A 4 -4.431 -2.902 -19.936 1.00 0.54 H new ATOM 0 HG2 LYS A 4 -2.317 -2.427 -18.756 1.00 0.68 H new ATOM 0 HG3 LYS A 4 -2.548 -3.834 -17.737 1.00 0.68 H new ATOM 0 HD2 LYS A 4 -2.436 -5.317 -19.711 1.00 0.83 H new ATOM 0 HD3 LYS A 4 -2.288 -3.928 -20.770 1.00 0.83 H new ATOM 0 HE2 LYS A 4 -0.178 -3.280 -19.553 1.00 1.10 H new ATOM 0 HE3 LYS A 4 -0.311 -4.748 -18.605 1.00 1.10 H new ATOM 0 HZ1 LYS A 4 1.160 -5.159 -20.401 1.00 1.51 H new ATOM 0 HZ2 LYS A 4 -0.272 -6.006 -20.739 1.00 1.51 H new ATOM 0 HZ3 LYS A 4 0.064 -4.551 -21.546 1.00 1.51 H new ATOM 74 N ALA A 5 -6.712 -0.988 -18.461 1.00 0.45 N ATOM 75 CA ALA A 5 -7.243 0.303 -18.809 1.00 0.47 C ATOM 76 C ALA A 5 -7.434 1.145 -17.554 1.00 0.42 C ATOM 77 O ALA A 5 -7.074 2.316 -17.521 1.00 0.42 O ATOM 78 CB ALA A 5 -8.536 0.130 -19.579 1.00 0.54 C ATOM 0 H ALA A 5 -7.415 -1.685 -18.217 1.00 0.45 H new ATOM 0 HA ALA A 5 -6.540 0.832 -19.452 1.00 0.47 H new ATOM 0 HB1 ALA A 5 -8.937 1.109 -19.842 1.00 0.54 H new ATOM 0 HB2 ALA A 5 -8.345 -0.440 -20.488 1.00 0.54 H new ATOM 0 HB3 ALA A 5 -9.258 -0.404 -18.962 1.00 0.54 H new ATOM 84 N ILE A 6 -7.951 0.521 -16.499 1.00 0.42 N ATOM 85 CA ILE A 6 -8.293 1.255 -15.279 1.00 0.43 C ATOM 86 C ILE A 6 -7.077 1.414 -14.399 1.00 0.37 C ATOM 87 O ILE A 6 -6.917 2.417 -13.719 1.00 0.38 O ATOM 88 CB ILE A 6 -9.420 0.613 -14.429 1.00 0.53 C ATOM 89 CG1 ILE A 6 -9.340 -0.925 -14.429 1.00 0.91 C ATOM 90 CG2 ILE A 6 -10.786 1.118 -14.869 1.00 1.07 C ATOM 91 CD1 ILE A 6 -10.417 -1.621 -15.239 1.00 0.65 C ATOM 0 H ILE A 6 -8.142 -0.480 -16.461 1.00 0.42 H new ATOM 0 HA ILE A 6 -8.664 2.217 -15.633 1.00 0.43 H new ATOM 0 HB ILE A 6 -9.273 0.925 -13.395 1.00 0.53 H new ATOM 0 HG12 ILE A 6 -8.365 -1.223 -14.815 1.00 0.91 H new ATOM 0 HG13 ILE A 6 -9.396 -1.277 -13.399 1.00 0.91 H new ATOM 0 HG21 ILE A 6 -11.560 0.653 -14.258 1.00 1.07 H new ATOM 0 HG22 ILE A 6 -10.830 2.200 -14.749 1.00 1.07 H new ATOM 0 HG23 ILE A 6 -10.948 0.863 -15.916 1.00 1.07 H new ATOM 0 HD11 ILE A 6 -10.277 -2.700 -15.178 1.00 0.65 H new ATOM 0 HD12 ILE A 6 -11.398 -1.359 -14.842 1.00 0.65 H new ATOM 0 HD13 ILE A 6 -10.351 -1.305 -16.280 1.00 0.65 H new ATOM 103 N ALA A 7 -6.245 0.397 -14.409 1.00 0.33 N ATOM 104 CA ALA A 7 -5.062 0.344 -13.577 1.00 0.31 C ATOM 105 C ALA A 7 -3.935 1.148 -14.174 1.00 0.30 C ATOM 106 O ALA A 7 -3.188 1.810 -13.475 1.00 0.32 O ATOM 107 CB ALA A 7 -4.624 -1.076 -13.463 1.00 0.34 C ATOM 0 H ALA A 7 -6.371 -0.425 -15.000 1.00 0.33 H new ATOM 0 HA ALA A 7 -5.307 0.762 -12.601 1.00 0.31 H new ATOM 0 HB1 ALA A 7 -3.733 -1.133 -12.838 1.00 0.34 H new ATOM 0 HB2 ALA A 7 -5.421 -1.668 -13.012 1.00 0.34 H new ATOM 0 HB3 ALA A 7 -4.398 -1.468 -14.455 1.00 0.34 H new ATOM 113 N GLN A 8 -3.804 1.041 -15.473 1.00 0.31 N ATOM 114 CA GLN A 8 -2.818 1.797 -16.214 1.00 0.34 C ATOM 115 C GLN A 8 -3.115 3.268 -16.097 1.00 0.35 C ATOM 116 O GLN A 8 -2.217 4.111 -16.069 1.00 0.39 O ATOM 117 CB GLN A 8 -2.830 1.375 -17.669 1.00 0.38 C ATOM 118 CG GLN A 8 -1.993 0.154 -17.940 1.00 0.96 C ATOM 119 CD GLN A 8 -1.493 0.093 -19.377 1.00 1.04 C ATOM 120 OE1 GLN A 8 -1.303 -0.985 -19.937 1.00 1.59 O ATOM 121 NE2 GLN A 8 -1.257 1.249 -19.981 1.00 1.50 N ATOM 0 H GLN A 8 -4.378 0.426 -16.050 1.00 0.31 H new ATOM 0 HA GLN A 8 -1.829 1.601 -15.801 1.00 0.34 H new ATOM 0 HB2 GLN A 8 -3.858 1.178 -17.975 1.00 0.38 H new ATOM 0 HB3 GLN A 8 -2.467 2.200 -18.283 1.00 0.38 H new ATOM 0 HG2 GLN A 8 -1.140 0.145 -17.262 1.00 0.96 H new ATOM 0 HG3 GLN A 8 -2.580 -0.739 -17.725 1.00 0.96 H new ATOM 0 HE21 GLN A 8 -1.425 2.126 -19.488 1.00 1.50 H new ATOM 0 HE22 GLN A 8 -0.907 1.262 -20.939 1.00 1.50 H new ATOM 130 N GLN A 9 -4.392 3.563 -16.009 1.00 0.36 N ATOM 131 CA GLN A 9 -4.820 4.925 -15.767 1.00 0.40 C ATOM 132 C GLN A 9 -4.657 5.241 -14.298 1.00 0.38 C ATOM 133 O GLN A 9 -4.158 6.299 -13.938 1.00 0.45 O ATOM 134 CB GLN A 9 -6.264 5.146 -16.212 1.00 0.48 C ATOM 135 CG GLN A 9 -6.409 5.267 -17.720 1.00 0.74 C ATOM 136 CD GLN A 9 -5.625 6.436 -18.286 1.00 1.65 C ATOM 137 OE1 GLN A 9 -5.499 7.502 -17.511 1.00 2.47 O flip ATOM 138 NE2 GLN A 9 -5.142 6.385 -19.415 1.00 2.31 N flip ATOM 0 H GLN A 9 -5.149 2.885 -16.100 1.00 0.36 H new ATOM 0 HA GLN A 9 -4.198 5.599 -16.356 1.00 0.40 H new ATOM 0 HB2 GLN A 9 -6.878 4.317 -15.859 1.00 0.48 H new ATOM 0 HB3 GLN A 9 -6.649 6.051 -15.742 1.00 0.48 H new ATOM 0 HG2 GLN A 9 -6.069 4.344 -18.190 1.00 0.74 H new ATOM 0 HG3 GLN A 9 -7.463 5.384 -17.972 1.00 0.74 H new ATOM 0 HE21 GLN A 9 -5.260 5.546 -19.983 1.00 2.31 H new ATOM 0 HE22 GLN A 9 -4.623 7.182 -19.784 1.00 2.31 H new ATOM 147 N THR A 10 -5.043 4.288 -13.459 1.00 0.34 N ATOM 148 CA THR A 10 -4.947 4.432 -12.018 1.00 0.34 C ATOM 149 C THR A 10 -3.506 4.648 -11.580 1.00 0.30 C ATOM 150 O THR A 10 -3.255 5.383 -10.629 1.00 0.30 O ATOM 151 CB THR A 10 -5.574 3.222 -11.290 1.00 0.37 C ATOM 152 OG1 THR A 10 -6.622 3.674 -10.433 1.00 0.48 O ATOM 153 CG2 THR A 10 -4.552 2.426 -10.486 1.00 0.34 C ATOM 0 H THR A 10 -5.431 3.395 -13.762 1.00 0.34 H new ATOM 0 HA THR A 10 -5.516 5.319 -11.738 1.00 0.34 H new ATOM 0 HB THR A 10 -5.971 2.551 -12.052 1.00 0.37 H new ATOM 0 HG1 THR A 10 -7.090 4.424 -10.856 1.00 0.48 H new ATOM 0 HG21 THR A 10 -5.048 1.588 -9.996 1.00 0.34 H new ATOM 0 HG22 THR A 10 -3.777 2.049 -11.154 1.00 0.34 H new ATOM 0 HG23 THR A 10 -4.099 3.071 -9.733 1.00 0.34 H new ATOM 161 N ALA A 11 -2.564 3.999 -12.262 1.00 0.29 N ATOM 162 CA ALA A 11 -1.151 4.280 -12.042 1.00 0.28 C ATOM 163 C ALA A 11 -0.883 5.776 -12.075 1.00 0.30 C ATOM 164 O ALA A 11 -0.401 6.353 -11.110 1.00 0.31 O ATOM 165 CB ALA A 11 -0.302 3.599 -13.092 1.00 0.31 C ATOM 0 H ALA A 11 -2.753 3.283 -12.964 1.00 0.29 H new ATOM 0 HA ALA A 11 -0.888 3.893 -11.058 1.00 0.28 H new ATOM 0 HB1 ALA A 11 0.749 3.821 -12.910 1.00 0.31 H new ATOM 0 HB2 ALA A 11 -0.459 2.521 -13.044 1.00 0.31 H new ATOM 0 HB3 ALA A 11 -0.584 3.963 -14.080 1.00 0.31 H new ATOM 171 N GLN A 12 -1.212 6.393 -13.197 1.00 0.35 N ATOM 172 CA GLN A 12 -1.005 7.819 -13.381 1.00 0.40 C ATOM 173 C GLN A 12 -1.988 8.639 -12.554 1.00 0.40 C ATOM 174 O GLN A 12 -1.762 9.827 -12.318 1.00 0.45 O ATOM 175 CB GLN A 12 -1.111 8.171 -14.860 1.00 0.48 C ATOM 176 CG GLN A 12 -0.053 7.482 -15.697 1.00 0.98 C ATOM 177 CD GLN A 12 -0.203 7.758 -17.180 1.00 0.97 C ATOM 178 OE1 GLN A 12 0.352 8.726 -17.701 1.00 1.30 O ATOM 179 NE2 GLN A 12 -0.946 6.908 -17.871 1.00 1.64 N ATOM 0 H GLN A 12 -1.628 5.923 -14.001 1.00 0.35 H new ATOM 0 HA GLN A 12 -0.004 8.067 -13.029 1.00 0.40 H new ATOM 0 HB2 GLN A 12 -2.099 7.892 -15.227 1.00 0.48 H new ATOM 0 HB3 GLN A 12 -1.019 9.250 -14.981 1.00 0.48 H new ATOM 0 HG2 GLN A 12 0.933 7.810 -15.369 1.00 0.98 H new ATOM 0 HG3 GLN A 12 -0.104 6.407 -15.525 1.00 0.98 H new ATOM 0 HE21 GLN A 12 -1.389 6.118 -17.401 1.00 1.64 H new ATOM 0 HE22 GLN A 12 -1.076 7.043 -18.874 1.00 1.64 H new ATOM 188 N GLU A 13 -3.073 8.011 -12.116 1.00 0.38 N ATOM 189 CA GLU A 13 -3.993 8.667 -11.193 1.00 0.39 C ATOM 190 C GLU A 13 -3.309 8.834 -9.847 1.00 0.37 C ATOM 191 O GLU A 13 -3.147 9.948 -9.355 1.00 0.42 O ATOM 192 CB GLU A 13 -5.298 7.876 -11.007 1.00 0.43 C ATOM 193 CG GLU A 13 -6.145 7.755 -12.265 1.00 1.10 C ATOM 194 CD GLU A 13 -7.494 7.099 -12.017 1.00 1.65 C ATOM 195 OE1 GLU A 13 -7.518 5.878 -11.746 1.00 2.54 O ATOM 196 OE2 GLU A 13 -8.534 7.791 -12.073 1.00 1.64 O ATOM 0 H GLU A 13 -3.336 7.061 -12.380 1.00 0.38 H new ATOM 0 HA GLU A 13 -4.256 9.636 -11.618 1.00 0.39 H new ATOM 0 HB2 GLU A 13 -5.054 6.875 -10.650 1.00 0.43 H new ATOM 0 HB3 GLU A 13 -5.892 8.356 -10.229 1.00 0.43 H new ATOM 0 HG2 GLU A 13 -6.303 8.748 -12.686 1.00 1.10 H new ATOM 0 HG3 GLU A 13 -5.598 7.176 -13.009 1.00 1.10 H new ATOM 203 N VAL A 14 -2.857 7.721 -9.285 1.00 0.34 N ATOM 204 CA VAL A 14 -2.246 7.731 -7.972 1.00 0.33 C ATOM 205 C VAL A 14 -0.909 8.435 -7.996 1.00 0.33 C ATOM 206 O VAL A 14 -0.584 9.212 -7.097 1.00 0.36 O ATOM 207 CB VAL A 14 -2.062 6.319 -7.410 1.00 0.32 C ATOM 208 CG1 VAL A 14 -1.142 5.482 -8.268 1.00 0.53 C ATOM 209 CG2 VAL A 14 -1.554 6.394 -5.990 1.00 0.49 C ATOM 0 H VAL A 14 -2.904 6.801 -9.722 1.00 0.34 H new ATOM 0 HA VAL A 14 -2.930 8.275 -7.320 1.00 0.33 H new ATOM 0 HB VAL A 14 -3.034 5.826 -7.416 1.00 0.32 H new ATOM 0 HG11 VAL A 14 -1.041 4.489 -7.831 1.00 0.53 H new ATOM 0 HG12 VAL A 14 -1.558 5.396 -9.272 1.00 0.53 H new ATOM 0 HG13 VAL A 14 -0.162 5.957 -8.321 1.00 0.53 H new ATOM 0 HG21 VAL A 14 -1.425 5.386 -5.596 1.00 0.49 H new ATOM 0 HG22 VAL A 14 -0.597 6.915 -5.973 1.00 0.49 H new ATOM 0 HG23 VAL A 14 -2.273 6.935 -5.375 1.00 0.49 H new ATOM 219 N LEU A 15 -0.143 8.166 -9.036 1.00 0.32 N ATOM 220 CA LEU A 15 1.102 8.830 -9.259 1.00 0.33 C ATOM 221 C LEU A 15 0.866 10.314 -9.330 1.00 0.39 C ATOM 222 O LEU A 15 1.701 11.118 -8.930 1.00 0.43 O ATOM 223 CB LEU A 15 1.639 8.377 -10.579 1.00 0.34 C ATOM 224 CG LEU A 15 2.991 8.920 -10.918 1.00 0.43 C ATOM 225 CD1 LEU A 15 3.999 7.794 -10.885 1.00 0.56 C ATOM 226 CD2 LEU A 15 2.977 9.604 -12.275 1.00 0.60 C ATOM 0 H LEU A 15 -0.379 7.474 -9.747 1.00 0.32 H new ATOM 0 HA LEU A 15 1.799 8.602 -8.453 1.00 0.33 H new ATOM 0 HB2 LEU A 15 1.687 7.288 -10.583 1.00 0.34 H new ATOM 0 HB3 LEU A 15 0.938 8.668 -11.361 1.00 0.34 H new ATOM 0 HG LEU A 15 3.273 9.672 -10.181 1.00 0.43 H new ATOM 0 HD11 LEU A 15 4.987 8.183 -11.131 1.00 0.56 H new ATOM 0 HD12 LEU A 15 4.020 7.354 -9.888 1.00 0.56 H new ATOM 0 HD13 LEU A 15 3.717 7.032 -11.612 1.00 0.56 H new ATOM 0 HD21 LEU A 15 3.972 9.990 -12.498 1.00 0.60 H new ATOM 0 HD22 LEU A 15 2.686 8.886 -13.042 1.00 0.60 H new ATOM 0 HD23 LEU A 15 2.263 10.427 -12.260 1.00 0.60 H new ATOM 238 N GLY A 16 -0.310 10.652 -9.825 1.00 0.43 N ATOM 239 CA GLY A 16 -0.676 12.041 -9.989 1.00 0.50 C ATOM 240 C GLY A 16 -0.764 12.719 -8.651 1.00 0.50 C ATOM 241 O GLY A 16 -0.511 13.912 -8.517 1.00 0.57 O ATOM 0 H GLY A 16 -1.024 9.985 -10.119 1.00 0.43 H new ATOM 0 HA2 GLY A 16 0.061 12.547 -10.613 1.00 0.50 H new ATOM 0 HA3 GLY A 16 -1.634 12.113 -10.505 1.00 0.50 H new ATOM 245 N TYR A 17 -1.084 11.924 -7.649 1.00 0.45 N ATOM 246 CA TYR A 17 -1.214 12.422 -6.290 1.00 0.48 C ATOM 247 C TYR A 17 0.097 12.261 -5.564 1.00 0.50 C ATOM 248 O TYR A 17 0.320 12.860 -4.516 1.00 0.64 O ATOM 249 CB TYR A 17 -2.294 11.672 -5.526 1.00 0.49 C ATOM 250 CG TYR A 17 -3.705 11.971 -5.976 1.00 0.96 C ATOM 251 CD1 TYR A 17 -4.125 11.644 -7.251 1.00 1.41 C ATOM 252 CD2 TYR A 17 -4.613 12.574 -5.118 1.00 1.59 C ATOM 253 CE1 TYR A 17 -5.417 11.907 -7.670 1.00 2.13 C ATOM 254 CE2 TYR A 17 -5.907 12.841 -5.523 1.00 2.29 C ATOM 255 CZ TYR A 17 -6.305 12.505 -6.800 1.00 2.49 C ATOM 256 OH TYR A 17 -7.594 12.771 -7.208 1.00 3.27 O ATOM 0 H TYR A 17 -1.260 10.924 -7.750 1.00 0.45 H new ATOM 0 HA TYR A 17 -1.492 13.475 -6.345 1.00 0.48 H new ATOM 0 HB2 TYR A 17 -2.114 10.602 -5.625 1.00 0.49 H new ATOM 0 HB3 TYR A 17 -2.206 11.913 -4.467 1.00 0.49 H new ATOM 0 HD1 TYR A 17 -3.432 11.174 -7.933 1.00 1.41 H new ATOM 0 HD2 TYR A 17 -4.304 12.839 -4.118 1.00 1.59 H new ATOM 0 HE1 TYR A 17 -5.728 11.646 -8.671 1.00 2.13 H new ATOM 0 HE2 TYR A 17 -6.603 13.310 -4.843 1.00 2.29 H new ATOM 0 HH TYR A 17 -8.089 13.193 -6.475 1.00 3.27 H new ATOM 266 N ASN A 18 0.968 11.427 -6.113 1.00 0.43 N ATOM 267 CA ASN A 18 2.214 11.121 -5.447 1.00 0.51 C ATOM 268 C ASN A 18 3.305 12.019 -5.994 1.00 0.62 C ATOM 269 O ASN A 18 4.429 12.045 -5.493 1.00 0.77 O ATOM 270 CB ASN A 18 2.545 9.641 -5.629 1.00 0.60 C ATOM 271 CG ASN A 18 1.774 8.735 -4.675 1.00 1.20 C ATOM 272 OD1 ASN A 18 2.245 7.667 -4.296 1.00 2.03 O ATOM 273 ND2 ASN A 18 0.582 9.152 -4.280 1.00 1.65 N ATOM 0 H ASN A 18 0.833 10.957 -7.008 1.00 0.43 H new ATOM 0 HA ASN A 18 2.129 11.308 -4.377 1.00 0.51 H new ATOM 0 HB2 ASN A 18 2.325 9.349 -6.656 1.00 0.60 H new ATOM 0 HB3 ASN A 18 3.614 9.492 -5.478 1.00 0.60 H new ATOM 0 HD21 ASN A 18 0.027 8.581 -3.643 1.00 1.65 H new ATOM 0 HD22 ASN A 18 0.218 10.045 -4.613 1.00 1.65 H new ATOM 280 N ARG A 19 2.937 12.774 -7.019 1.00 0.61 N ATOM 281 CA ARG A 19 3.828 13.753 -7.624 1.00 0.80 C ATOM 282 C ARG A 19 3.336 15.163 -7.306 1.00 0.90 C ATOM 283 O ARG A 19 4.072 16.140 -7.439 1.00 1.10 O ATOM 284 CB ARG A 19 3.876 13.548 -9.140 1.00 0.83 C ATOM 285 CG ARG A 19 2.610 14.005 -9.848 1.00 1.26 C ATOM 286 CD ARG A 19 2.459 13.348 -11.205 1.00 1.01 C ATOM 287 NE ARG A 19 1.357 13.929 -11.973 1.00 1.65 N ATOM 288 CZ ARG A 19 1.098 13.643 -13.249 1.00 1.85 C ATOM 289 NH1 ARG A 19 1.865 12.789 -13.916 1.00 1.70 N ATOM 290 NH2 ARG A 19 0.072 14.220 -13.861 1.00 2.72 N ATOM 0 H ARG A 19 2.015 12.726 -7.453 1.00 0.61 H new ATOM 0 HA ARG A 19 4.831 13.623 -7.217 1.00 0.80 H new ATOM 0 HB2 ARG A 19 4.728 14.092 -9.547 1.00 0.83 H new ATOM 0 HB3 ARG A 19 4.042 12.492 -9.352 1.00 0.83 H new ATOM 0 HG2 ARG A 19 1.743 13.770 -9.231 1.00 1.26 H new ATOM 0 HG3 ARG A 19 2.631 15.088 -9.968 1.00 1.26 H new ATOM 0 HD2 ARG A 19 3.388 13.455 -11.765 1.00 1.01 H new ATOM 0 HD3 ARG A 19 2.287 12.280 -11.074 1.00 1.01 H new ATOM 0 HE ARG A 19 0.747 14.597 -11.501 1.00 1.65 H new ATOM 0 HH11 ARG A 19 2.659 12.347 -13.452 1.00 1.70 H new ATOM 0 HH12 ARG A 19 1.661 12.575 -14.892 1.00 1.70 H new ATOM 0 HH21 ARG A 19 -0.517 14.881 -13.355 1.00 2.72 H new ATOM 0 HH22 ARG A 19 -0.128 14.002 -14.837 1.00 2.72 H new ATOM 304 N ASP A 20 2.077 15.248 -6.893 1.00 0.87 N ATOM 305 CA ASP A 20 1.449 16.523 -6.573 1.00 1.08 C ATOM 306 C ASP A 20 1.431 16.736 -5.077 1.00 0.94 C ATOM 307 O ASP A 20 1.130 15.813 -4.321 1.00 1.32 O ATOM 308 CB ASP A 20 0.015 16.541 -7.067 1.00 1.59 C ATOM 309 CG ASP A 20 -0.662 17.877 -6.844 1.00 1.74 C ATOM 310 OD1 ASP A 20 -0.484 18.786 -7.687 1.00 1.91 O ATOM 311 OD2 ASP A 20 -1.368 18.023 -5.825 1.00 2.16 O ATOM 0 H ASP A 20 1.466 14.440 -6.771 1.00 0.87 H new ATOM 0 HA ASP A 20 2.024 17.312 -7.058 1.00 1.08 H new ATOM 0 HB2 ASP A 20 -0.002 16.303 -8.130 1.00 1.59 H new ATOM 0 HB3 ASP A 20 -0.551 15.762 -6.557 1.00 1.59 H new ATOM 316 N THR A 21 1.723 17.946 -4.645 1.00 0.91 N ATOM 317 CA THR A 21 1.761 18.235 -3.228 1.00 1.05 C ATOM 318 C THR A 21 1.096 19.566 -2.917 1.00 1.13 C ATOM 319 O THR A 21 1.741 20.614 -2.892 1.00 1.46 O ATOM 320 CB THR A 21 3.212 18.210 -2.727 1.00 1.45 C ATOM 321 OG1 THR A 21 4.028 19.086 -3.518 1.00 1.82 O ATOM 322 CG2 THR A 21 3.740 16.792 -2.820 1.00 1.70 C ATOM 0 H THR A 21 1.936 18.739 -5.250 1.00 0.91 H new ATOM 0 HA THR A 21 1.198 17.463 -2.703 1.00 1.05 H new ATOM 0 HB THR A 21 3.243 18.550 -1.692 1.00 1.45 H new ATOM 0 HG1 THR A 21 3.607 19.969 -3.568 1.00 1.82 H new ATOM 0 HG21 THR A 21 4.771 16.764 -2.466 1.00 1.70 H new ATOM 0 HG22 THR A 21 3.127 16.134 -2.204 1.00 1.70 H new ATOM 0 HG23 THR A 21 3.703 16.457 -3.857 1.00 1.70 H new ATOM 330 N SER A 22 -0.205 19.504 -2.682 1.00 1.05 N ATOM 331 CA SER A 22 -0.998 20.696 -2.410 1.00 1.30 C ATOM 332 C SER A 22 -2.432 20.337 -2.024 1.00 1.31 C ATOM 333 O SER A 22 -2.983 19.342 -2.501 1.00 2.15 O ATOM 334 CB SER A 22 -0.998 21.609 -3.640 1.00 1.67 C ATOM 335 OG SER A 22 -1.388 20.901 -4.809 1.00 2.19 O ATOM 0 H SER A 22 -0.739 18.635 -2.674 1.00 1.05 H new ATOM 0 HA SER A 22 -0.547 21.219 -1.567 1.00 1.30 H new ATOM 0 HB2 SER A 22 -1.678 22.445 -3.475 1.00 1.67 H new ATOM 0 HB3 SER A 22 -0.003 22.031 -3.783 1.00 1.67 H new ATOM 0 HG SER A 22 -1.380 21.509 -5.578 1.00 2.19 H new ATOM 341 N GLY A 23 -3.019 21.136 -1.137 1.00 0.96 N ATOM 342 CA GLY A 23 -4.417 20.968 -0.779 1.00 1.10 C ATOM 343 C GLY A 23 -4.610 20.083 0.436 1.00 0.89 C ATOM 344 O GLY A 23 -5.740 19.815 0.847 1.00 1.01 O ATOM 0 H GLY A 23 -2.547 21.902 -0.657 1.00 0.96 H new ATOM 0 HA2 GLY A 23 -4.857 21.946 -0.584 1.00 1.10 H new ATOM 0 HA3 GLY A 23 -4.955 20.539 -1.624 1.00 1.10 H new ATOM 348 N TRP A 24 -3.507 19.638 1.014 1.00 0.79 N ATOM 349 CA TRP A 24 -3.548 18.714 2.135 1.00 0.66 C ATOM 350 C TRP A 24 -2.880 19.317 3.358 1.00 0.67 C ATOM 351 O TRP A 24 -2.740 20.533 3.466 1.00 0.83 O ATOM 352 CB TRP A 24 -2.902 17.380 1.743 1.00 0.71 C ATOM 353 CG TRP A 24 -1.450 17.437 1.403 1.00 0.81 C ATOM 354 CD1 TRP A 24 -0.520 18.311 1.873 1.00 1.34 C ATOM 355 CD2 TRP A 24 -0.759 16.545 0.534 1.00 0.87 C ATOM 356 NE1 TRP A 24 0.711 18.011 1.363 1.00 1.41 N ATOM 357 CE2 TRP A 24 0.591 16.932 0.530 1.00 0.99 C ATOM 358 CE3 TRP A 24 -1.155 15.453 -0.240 1.00 1.36 C ATOM 359 CZ2 TRP A 24 1.550 16.262 -0.214 1.00 1.09 C ATOM 360 CZ3 TRP A 24 -0.202 14.789 -0.980 1.00 1.67 C ATOM 361 CH2 TRP A 24 1.136 15.196 -0.963 1.00 1.37 C ATOM 0 H TRP A 24 -2.566 19.904 0.723 1.00 0.79 H new ATOM 0 HA TRP A 24 -4.589 18.523 2.394 1.00 0.66 H new ATOM 0 HB2 TRP A 24 -3.036 16.677 2.565 1.00 0.71 H new ATOM 0 HB3 TRP A 24 -3.441 16.975 0.887 1.00 0.71 H new ATOM 0 HD1 TRP A 24 -0.725 19.125 2.552 1.00 1.34 H new ATOM 0 HE1 TRP A 24 1.577 18.509 1.569 1.00 1.41 H new ATOM 0 HE3 TRP A 24 -2.187 15.135 -0.258 1.00 1.36 H new ATOM 0 HZ2 TRP A 24 2.585 16.571 -0.202 1.00 1.09 H new ATOM 0 HZ3 TRP A 24 -0.492 13.941 -1.583 1.00 1.67 H new ATOM 0 HH2 TRP A 24 1.859 14.655 -1.556 1.00 1.37 H new ATOM 372 N LYS A 25 -2.462 18.461 4.264 1.00 0.60 N ATOM 373 CA LYS A 25 -1.911 18.875 5.518 1.00 0.70 C ATOM 374 C LYS A 25 -1.254 17.688 6.176 1.00 0.61 C ATOM 375 O LYS A 25 -1.919 16.690 6.444 1.00 0.59 O ATOM 376 CB LYS A 25 -3.016 19.386 6.425 1.00 0.89 C ATOM 377 CG LYS A 25 -2.481 20.060 7.665 1.00 1.29 C ATOM 378 CD LYS A 25 -2.776 21.558 7.704 1.00 1.62 C ATOM 379 CE LYS A 25 -2.045 22.337 6.615 1.00 2.23 C ATOM 380 NZ LYS A 25 -2.824 22.420 5.347 1.00 2.95 N ATOM 0 H LYS A 25 -2.499 17.449 4.141 1.00 0.60 H new ATOM 0 HA LYS A 25 -1.184 19.669 5.349 1.00 0.70 H new ATOM 0 HB2 LYS A 25 -3.638 20.090 5.873 1.00 0.89 H new ATOM 0 HB3 LYS A 25 -3.657 18.554 6.716 1.00 0.89 H new ATOM 0 HG2 LYS A 25 -2.916 19.587 8.545 1.00 1.29 H new ATOM 0 HG3 LYS A 25 -1.403 19.906 7.719 1.00 1.29 H new ATOM 0 HD2 LYS A 25 -3.849 21.714 7.597 1.00 1.62 H new ATOM 0 HD3 LYS A 25 -2.492 21.954 8.679 1.00 1.62 H new ATOM 0 HE2 LYS A 25 -1.834 23.344 6.974 1.00 2.23 H new ATOM 0 HE3 LYS A 25 -1.084 21.862 6.416 1.00 2.23 H new ATOM 0 HZ1 LYS A 25 -2.680 23.354 4.912 1.00 2.95 H new ATOM 0 HZ2 LYS A 25 -2.501 21.679 4.692 1.00 2.95 H new ATOM 0 HZ3 LYS A 25 -3.835 22.285 5.551 1.00 2.95 H new ATOM 394 N VAL A 26 0.038 17.764 6.424 1.00 0.63 N ATOM 395 CA VAL A 26 0.687 16.688 7.134 1.00 0.58 C ATOM 396 C VAL A 26 0.129 16.592 8.536 1.00 0.66 C ATOM 397 O VAL A 26 0.219 17.523 9.340 1.00 0.80 O ATOM 398 CB VAL A 26 2.215 16.800 7.165 1.00 0.64 C ATOM 399 CG1 VAL A 26 2.658 18.167 7.644 1.00 1.22 C ATOM 400 CG2 VAL A 26 2.793 15.700 8.031 1.00 1.56 C ATOM 0 H VAL A 26 0.643 18.539 6.152 1.00 0.63 H new ATOM 0 HA VAL A 26 0.471 15.773 6.582 1.00 0.58 H new ATOM 0 HB VAL A 26 2.593 16.679 6.150 1.00 0.64 H new ATOM 0 HG11 VAL A 26 3.747 18.214 7.654 1.00 1.22 H new ATOM 0 HG12 VAL A 26 2.268 18.932 6.972 1.00 1.22 H new ATOM 0 HG13 VAL A 26 2.278 18.341 8.651 1.00 1.22 H new ATOM 0 HG21 VAL A 26 3.880 15.784 8.049 1.00 1.56 H new ATOM 0 HG22 VAL A 26 2.405 15.793 9.045 1.00 1.56 H new ATOM 0 HG23 VAL A 26 2.511 14.729 7.623 1.00 1.56 H new ATOM 410 N VAL A 27 -0.477 15.464 8.798 1.00 0.62 N ATOM 411 CA VAL A 27 -1.127 15.224 10.056 1.00 0.73 C ATOM 412 C VAL A 27 -0.162 14.519 10.980 1.00 0.76 C ATOM 413 O VAL A 27 -0.274 14.607 12.204 1.00 0.90 O ATOM 414 CB VAL A 27 -2.423 14.391 9.882 1.00 0.75 C ATOM 415 CG1 VAL A 27 -2.121 13.005 9.331 1.00 1.21 C ATOM 416 CG2 VAL A 27 -3.189 14.295 11.195 1.00 1.22 C ATOM 0 H VAL A 27 -0.533 14.685 8.142 1.00 0.62 H new ATOM 0 HA VAL A 27 -1.419 16.182 10.487 1.00 0.73 H new ATOM 0 HB VAL A 27 -3.052 14.908 9.157 1.00 0.75 H new ATOM 0 HG11 VAL A 27 -3.051 12.447 9.221 1.00 1.21 H new ATOM 0 HG12 VAL A 27 -1.636 13.098 8.359 1.00 1.21 H new ATOM 0 HG13 VAL A 27 -1.460 12.477 10.018 1.00 1.21 H new ATOM 0 HG21 VAL A 27 -4.094 13.706 11.046 1.00 1.22 H new ATOM 0 HG22 VAL A 27 -2.563 13.815 11.947 1.00 1.22 H new ATOM 0 HG23 VAL A 27 -3.459 15.296 11.533 1.00 1.22 H new ATOM 426 N LYS A 28 0.818 13.840 10.390 1.00 0.65 N ATOM 427 CA LYS A 28 1.721 13.035 11.177 1.00 0.68 C ATOM 428 C LYS A 28 3.025 12.820 10.424 1.00 0.58 C ATOM 429 O LYS A 28 3.025 12.341 9.299 1.00 0.55 O ATOM 430 CB LYS A 28 1.040 11.704 11.536 1.00 0.77 C ATOM 431 CG LYS A 28 1.818 10.847 12.518 1.00 0.87 C ATOM 432 CD LYS A 28 2.919 10.069 11.826 1.00 1.45 C ATOM 433 CE LYS A 28 3.890 9.463 12.828 1.00 2.02 C ATOM 434 NZ LYS A 28 3.194 8.622 13.840 1.00 2.41 N ATOM 0 H LYS A 28 0.998 13.836 9.386 1.00 0.65 H new ATOM 0 HA LYS A 28 1.964 13.552 12.105 1.00 0.68 H new ATOM 0 HB2 LYS A 28 0.057 11.915 11.956 1.00 0.77 H new ATOM 0 HB3 LYS A 28 0.880 11.133 10.621 1.00 0.77 H new ATOM 0 HG2 LYS A 28 2.250 11.481 13.292 1.00 0.87 H new ATOM 0 HG3 LYS A 28 1.139 10.154 13.015 1.00 0.87 H new ATOM 0 HD2 LYS A 28 2.480 9.277 11.219 1.00 1.45 H new ATOM 0 HD3 LYS A 28 3.460 10.728 11.147 1.00 1.45 H new ATOM 0 HE2 LYS A 28 4.627 8.858 12.299 1.00 2.02 H new ATOM 0 HE3 LYS A 28 4.435 10.261 13.333 1.00 2.02 H new ATOM 0 HZ1 LYS A 28 3.896 8.082 14.385 1.00 2.41 H new ATOM 0 HZ2 LYS A 28 2.650 9.232 14.484 1.00 2.41 H new ATOM 0 HZ3 LYS A 28 2.548 7.963 13.359 1.00 2.41 H new ATOM 448 N THR A 29 4.132 13.193 11.036 1.00 0.61 N ATOM 449 CA THR A 29 5.427 13.063 10.394 1.00 0.59 C ATOM 450 C THR A 29 6.537 12.868 11.414 1.00 0.72 C ATOM 451 O THR A 29 6.424 13.284 12.567 1.00 0.88 O ATOM 452 CB THR A 29 5.722 14.291 9.505 1.00 0.75 C ATOM 453 OG1 THR A 29 7.106 14.361 9.146 1.00 1.38 O ATOM 454 CG2 THR A 29 5.302 15.570 10.195 1.00 0.82 C ATOM 0 H THR A 29 4.162 13.588 11.976 1.00 0.61 H new ATOM 0 HA THR A 29 5.393 12.175 9.763 1.00 0.59 H new ATOM 0 HB THR A 29 5.139 14.175 8.591 1.00 0.75 H new ATOM 0 HG1 THR A 29 7.403 13.488 8.815 1.00 1.38 H new ATOM 0 HG21 THR A 29 5.520 16.420 9.549 1.00 0.82 H new ATOM 0 HG22 THR A 29 4.233 15.537 10.403 1.00 0.82 H new ATOM 0 HG23 THR A 29 5.850 15.675 11.131 1.00 0.82 H new ATOM 462 N SER A 30 7.586 12.194 10.983 1.00 0.80 N ATOM 463 CA SER A 30 8.768 12.000 11.793 1.00 1.04 C ATOM 464 C SER A 30 9.921 12.783 11.167 1.00 1.45 C ATOM 465 O SER A 30 9.704 13.820 10.546 1.00 2.37 O ATOM 466 CB SER A 30 9.097 10.502 11.876 1.00 1.24 C ATOM 467 OG SER A 30 10.194 10.252 12.742 1.00 1.93 O ATOM 0 H SER A 30 7.640 11.766 10.059 1.00 0.80 H new ATOM 0 HA SER A 30 8.600 12.364 12.807 1.00 1.04 H new ATOM 0 HB2 SER A 30 8.222 9.956 12.230 1.00 1.24 H new ATOM 0 HB3 SER A 30 9.327 10.124 10.880 1.00 1.24 H new ATOM 0 HG SER A 30 10.374 9.289 12.772 1.00 1.93 H new ATOM 473 N LYS A 31 11.131 12.281 11.304 1.00 1.32 N ATOM 474 CA LYS A 31 12.285 12.900 10.678 1.00 1.71 C ATOM 475 C LYS A 31 12.624 12.155 9.396 1.00 1.47 C ATOM 476 O LYS A 31 13.766 12.151 8.939 1.00 2.02 O ATOM 477 CB LYS A 31 13.477 12.943 11.651 1.00 2.29 C ATOM 478 CG LYS A 31 13.661 11.689 12.503 1.00 2.73 C ATOM 479 CD LYS A 31 14.263 10.533 11.720 1.00 3.59 C ATOM 480 CE LYS A 31 14.491 9.323 12.612 1.00 4.18 C ATOM 481 NZ LYS A 31 15.212 8.231 11.908 1.00 4.55 N ATOM 0 H LYS A 31 11.343 11.443 11.845 1.00 1.32 H new ATOM 0 HA LYS A 31 12.050 13.933 10.422 1.00 1.71 H new ATOM 0 HB2 LYS A 31 14.389 13.111 11.078 1.00 2.29 H new ATOM 0 HB3 LYS A 31 13.355 13.800 12.314 1.00 2.29 H new ATOM 0 HG2 LYS A 31 14.304 11.922 13.352 1.00 2.73 H new ATOM 0 HG3 LYS A 31 12.696 11.385 12.908 1.00 2.73 H new ATOM 0 HD2 LYS A 31 13.600 10.262 10.899 1.00 3.59 H new ATOM 0 HD3 LYS A 31 15.209 10.844 11.277 1.00 3.59 H new ATOM 0 HE2 LYS A 31 15.061 9.624 13.491 1.00 4.18 H new ATOM 0 HE3 LYS A 31 13.530 8.951 12.968 1.00 4.18 H new ATOM 0 HZ1 LYS A 31 15.344 7.428 12.556 1.00 4.55 H new ATOM 0 HZ2 LYS A 31 14.657 7.923 11.084 1.00 4.55 H new ATOM 0 HZ3 LYS A 31 16.140 8.576 11.591 1.00 4.55 H new ATOM 495 N LYS A 32 11.599 11.522 8.827 1.00 0.87 N ATOM 496 CA LYS A 32 11.743 10.751 7.601 1.00 0.69 C ATOM 497 C LYS A 32 10.417 10.613 6.859 1.00 0.51 C ATOM 498 O LYS A 32 10.367 10.772 5.642 1.00 0.59 O ATOM 499 CB LYS A 32 12.313 9.359 7.892 1.00 0.80 C ATOM 500 CG LYS A 32 13.835 9.313 7.924 1.00 1.00 C ATOM 501 CD LYS A 32 14.429 9.575 6.546 1.00 0.93 C ATOM 502 CE LYS A 32 15.927 9.834 6.613 1.00 1.14 C ATOM 503 NZ LYS A 32 16.241 11.112 7.306 1.00 1.42 N ATOM 0 H LYS A 32 10.651 11.531 9.204 1.00 0.87 H new ATOM 0 HA LYS A 32 12.438 11.298 6.964 1.00 0.69 H new ATOM 0 HB2 LYS A 32 11.928 9.012 8.851 1.00 0.80 H new ATOM 0 HB3 LYS A 32 11.954 8.663 7.134 1.00 0.80 H new ATOM 0 HG2 LYS A 32 14.208 10.055 8.630 1.00 1.00 H new ATOM 0 HG3 LYS A 32 14.163 8.338 8.284 1.00 1.00 H new ATOM 0 HD2 LYS A 32 14.237 8.719 5.899 1.00 0.93 H new ATOM 0 HD3 LYS A 32 13.932 10.433 6.094 1.00 0.93 H new ATOM 0 HE2 LYS A 32 16.414 9.010 7.134 1.00 1.14 H new ATOM 0 HE3 LYS A 32 16.336 9.859 5.603 1.00 1.14 H new ATOM 0 HZ1 LYS A 32 16.694 11.767 6.638 1.00 1.42 H new ATOM 0 HZ2 LYS A 32 15.362 11.537 7.665 1.00 1.42 H new ATOM 0 HZ3 LYS A 32 16.886 10.927 8.100 1.00 1.42 H new ATOM 517 N ILE A 33 9.346 10.305 7.585 1.00 0.37 N ATOM 518 CA ILE A 33 8.054 10.053 6.951 1.00 0.33 C ATOM 519 C ILE A 33 7.108 11.221 7.141 1.00 0.36 C ATOM 520 O ILE A 33 7.287 12.034 8.044 1.00 0.46 O ATOM 521 CB ILE A 33 7.383 8.774 7.482 1.00 0.41 C ATOM 522 CG1 ILE A 33 6.967 8.956 8.940 1.00 0.58 C ATOM 523 CG2 ILE A 33 8.321 7.588 7.335 1.00 0.76 C ATOM 524 CD1 ILE A 33 6.288 7.739 9.526 1.00 0.75 C ATOM 0 H ILE A 33 9.345 10.224 8.602 1.00 0.37 H new ATOM 0 HA ILE A 33 8.261 9.921 5.889 1.00 0.33 H new ATOM 0 HB ILE A 33 6.487 8.579 6.893 1.00 0.41 H new ATOM 0 HG12 ILE A 33 7.849 9.193 9.535 1.00 0.58 H new ATOM 0 HG13 ILE A 33 6.294 9.810 9.014 1.00 0.58 H new ATOM 0 HG21 ILE A 33 7.834 6.690 7.714 1.00 0.76 H new ATOM 0 HG22 ILE A 33 8.570 7.449 6.283 1.00 0.76 H new ATOM 0 HG23 ILE A 33 9.233 7.773 7.902 1.00 0.76 H new ATOM 0 HD11 ILE A 33 6.019 7.937 10.564 1.00 0.75 H new ATOM 0 HD12 ILE A 33 5.388 7.514 8.954 1.00 0.75 H new ATOM 0 HD13 ILE A 33 6.967 6.888 9.483 1.00 0.75 H new ATOM 536 N THR A 34 6.092 11.277 6.293 1.00 0.33 N ATOM 537 CA THR A 34 5.202 12.422 6.221 1.00 0.36 C ATOM 538 C THR A 34 3.805 11.986 5.792 1.00 0.36 C ATOM 539 O THR A 34 3.602 11.594 4.649 1.00 0.39 O ATOM 540 CB THR A 34 5.749 13.430 5.191 1.00 0.39 C ATOM 541 OG1 THR A 34 7.179 13.499 5.285 1.00 0.58 O ATOM 542 CG2 THR A 34 5.167 14.807 5.411 1.00 0.56 C ATOM 0 H THR A 34 5.863 10.530 5.637 1.00 0.33 H new ATOM 0 HA THR A 34 5.145 12.883 7.207 1.00 0.36 H new ATOM 0 HB THR A 34 5.459 13.085 4.198 1.00 0.39 H new ATOM 0 HG1 THR A 34 7.575 12.728 4.827 1.00 0.58 H new ATOM 0 HG21 THR A 34 5.572 15.496 4.669 1.00 0.56 H new ATOM 0 HG22 THR A 34 4.082 14.764 5.312 1.00 0.56 H new ATOM 0 HG23 THR A 34 5.427 15.156 6.410 1.00 0.56 H new ATOM 550 N VAL A 35 2.849 12.045 6.708 1.00 0.39 N ATOM 551 CA VAL A 35 1.488 11.620 6.406 1.00 0.40 C ATOM 552 C VAL A 35 0.600 12.837 6.190 1.00 0.40 C ATOM 553 O VAL A 35 0.192 13.501 7.137 1.00 0.44 O ATOM 554 CB VAL A 35 0.897 10.736 7.526 1.00 0.48 C ATOM 555 CG1 VAL A 35 -0.415 10.106 7.085 1.00 0.82 C ATOM 556 CG2 VAL A 35 1.887 9.661 7.938 1.00 0.86 C ATOM 0 H VAL A 35 2.988 12.381 7.661 1.00 0.39 H new ATOM 0 HA VAL A 35 1.525 11.022 5.495 1.00 0.40 H new ATOM 0 HB VAL A 35 0.698 11.373 8.388 1.00 0.48 H new ATOM 0 HG11 VAL A 35 -0.811 9.488 7.891 1.00 0.82 H new ATOM 0 HG12 VAL A 35 -1.132 10.890 6.843 1.00 0.82 H new ATOM 0 HG13 VAL A 35 -0.244 9.487 6.204 1.00 0.82 H new ATOM 0 HG21 VAL A 35 1.452 9.049 8.728 1.00 0.86 H new ATOM 0 HG22 VAL A 35 2.120 9.032 7.079 1.00 0.86 H new ATOM 0 HG23 VAL A 35 2.801 10.129 8.304 1.00 0.86 H new ATOM 566 N SER A 36 0.330 13.126 4.934 1.00 0.42 N ATOM 567 CA SER A 36 -0.441 14.292 4.542 1.00 0.42 C ATOM 568 C SER A 36 -1.898 13.944 4.294 1.00 0.43 C ATOM 569 O SER A 36 -2.224 13.061 3.503 1.00 0.47 O ATOM 570 CB SER A 36 0.220 14.930 3.325 1.00 0.45 C ATOM 571 OG SER A 36 0.705 13.948 2.423 1.00 1.10 O ATOM 0 H SER A 36 0.641 12.555 4.148 1.00 0.42 H new ATOM 0 HA SER A 36 -0.447 15.016 5.357 1.00 0.42 H new ATOM 0 HB2 SER A 36 -0.498 15.572 2.814 1.00 0.45 H new ATOM 0 HB3 SER A 36 1.043 15.567 3.649 1.00 0.45 H new ATOM 0 HG SER A 36 0.116 13.165 2.444 1.00 1.10 H new ATOM 577 N SER A 37 -2.760 14.655 5.000 1.00 0.45 N ATOM 578 CA SER A 37 -4.187 14.410 4.974 1.00 0.48 C ATOM 579 C SER A 37 -4.867 15.462 4.116 1.00 0.53 C ATOM 580 O SER A 37 -4.697 16.661 4.339 1.00 0.59 O ATOM 581 CB SER A 37 -4.742 14.447 6.403 1.00 0.59 C ATOM 582 OG SER A 37 -6.123 14.135 6.432 1.00 1.27 O ATOM 0 H SER A 37 -2.485 15.424 5.611 1.00 0.45 H new ATOM 0 HA SER A 37 -4.382 13.426 4.547 1.00 0.48 H new ATOM 0 HB2 SER A 37 -4.195 13.739 7.025 1.00 0.59 H new ATOM 0 HB3 SER A 37 -4.583 15.437 6.831 1.00 0.59 H new ATOM 0 HG SER A 37 -6.248 13.237 6.804 1.00 1.27 H new ATOM 588 N LYS A 38 -5.627 15.016 3.137 1.00 0.59 N ATOM 589 CA LYS A 38 -6.266 15.928 2.206 1.00 0.76 C ATOM 590 C LYS A 38 -7.788 15.776 2.236 1.00 0.90 C ATOM 591 O LYS A 38 -8.453 16.416 3.048 1.00 1.69 O ATOM 592 CB LYS A 38 -5.711 15.715 0.791 1.00 0.99 C ATOM 593 CG LYS A 38 -6.006 16.866 -0.153 1.00 1.06 C ATOM 594 CD LYS A 38 -5.100 16.866 -1.379 1.00 1.11 C ATOM 595 CE LYS A 38 -5.132 15.548 -2.135 1.00 1.44 C ATOM 596 NZ LYS A 38 -4.387 15.641 -3.419 1.00 1.91 N ATOM 0 H LYS A 38 -5.818 14.029 2.964 1.00 0.59 H new ATOM 0 HA LYS A 38 -6.039 16.949 2.513 1.00 0.76 H new ATOM 0 HB2 LYS A 38 -4.632 15.571 0.850 1.00 0.99 H new ATOM 0 HB3 LYS A 38 -6.133 14.799 0.378 1.00 0.99 H new ATOM 0 HG2 LYS A 38 -7.046 16.810 -0.474 1.00 1.06 H new ATOM 0 HG3 LYS A 38 -5.888 17.809 0.381 1.00 1.06 H new ATOM 0 HD2 LYS A 38 -5.402 17.671 -2.049 1.00 1.11 H new ATOM 0 HD3 LYS A 38 -4.077 17.077 -1.069 1.00 1.11 H new ATOM 0 HE2 LYS A 38 -4.698 14.762 -1.517 1.00 1.44 H new ATOM 0 HE3 LYS A 38 -6.166 15.265 -2.332 1.00 1.44 H new ATOM 0 HZ1 LYS A 38 -4.484 14.748 -3.942 1.00 1.91 H new ATOM 0 HZ2 LYS A 38 -4.774 16.420 -3.989 1.00 1.91 H new ATOM 0 HZ3 LYS A 38 -3.381 15.820 -3.225 1.00 1.91 H new ATOM 722 N ASN A 46 -10.906 11.900 5.005 1.00 1.06 N ATOM 723 CA ASN A 46 -9.760 12.517 4.396 1.00 0.90 C ATOM 724 C ASN A 46 -8.883 11.483 3.717 1.00 0.81 C ATOM 725 O ASN A 46 -8.762 10.354 4.183 1.00 0.95 O ATOM 726 CB ASN A 46 -8.985 13.279 5.454 1.00 0.91 C ATOM 727 CG ASN A 46 -9.610 14.620 5.777 1.00 1.32 C ATOM 728 OD1 ASN A 46 -10.260 15.233 4.932 1.00 2.05 O ATOM 729 ND2 ASN A 46 -9.414 15.086 6.998 1.00 1.87 N ATOM 0 HA ASN A 46 -10.093 13.213 3.626 1.00 0.90 H new ATOM 0 HB2 ASN A 46 -8.930 12.679 6.362 1.00 0.91 H new ATOM 0 HB3 ASN A 46 -7.962 13.432 5.111 1.00 0.91 H new ATOM 0 HD21 ASN A 46 -9.809 15.987 7.270 1.00 1.87 H new ATOM 0 HD22 ASN A 46 -8.868 14.545 7.669 1.00 1.87 H new ATOM 736 N LEU A 47 -8.309 11.867 2.591 1.00 0.70 N ATOM 737 CA LEU A 47 -7.372 11.016 1.879 1.00 0.62 C ATOM 738 C LEU A 47 -5.999 11.219 2.490 1.00 0.54 C ATOM 739 O LEU A 47 -5.577 12.355 2.702 1.00 0.58 O ATOM 740 CB LEU A 47 -7.363 11.383 0.387 1.00 0.66 C ATOM 741 CG LEU A 47 -6.758 10.346 -0.571 1.00 0.70 C ATOM 742 CD1 LEU A 47 -6.980 10.768 -2.012 1.00 0.77 C ATOM 743 CD2 LEU A 47 -5.276 10.156 -0.319 1.00 0.87 C ATOM 0 H LEU A 47 -8.477 12.770 2.147 1.00 0.70 H new ATOM 0 HA LEU A 47 -7.663 9.969 1.964 1.00 0.62 H new ATOM 0 HB2 LEU A 47 -8.390 11.575 0.077 1.00 0.66 H new ATOM 0 HB3 LEU A 47 -6.814 12.317 0.269 1.00 0.66 H new ATOM 0 HG LEU A 47 -7.260 9.396 -0.388 1.00 0.70 H new ATOM 0 HD11 LEU A 47 -6.546 10.024 -2.680 1.00 0.77 H new ATOM 0 HD12 LEU A 47 -8.049 10.851 -2.206 1.00 0.77 H new ATOM 0 HD13 LEU A 47 -6.504 11.733 -2.186 1.00 0.77 H new ATOM 0 HD21 LEU A 47 -4.881 9.416 -1.014 1.00 0.87 H new ATOM 0 HD22 LEU A 47 -4.758 11.104 -0.465 1.00 0.87 H new ATOM 0 HD23 LEU A 47 -5.122 9.812 0.704 1.00 0.87 H new ATOM 755 N TYR A 48 -5.301 10.135 2.766 1.00 0.48 N ATOM 756 CA TYR A 48 -4.019 10.230 3.422 1.00 0.45 C ATOM 757 C TYR A 48 -2.918 9.778 2.482 1.00 0.46 C ATOM 758 O TYR A 48 -3.001 8.707 1.874 1.00 0.54 O ATOM 759 CB TYR A 48 -4.008 9.397 4.704 1.00 0.48 C ATOM 760 CG TYR A 48 -4.993 9.867 5.751 1.00 0.53 C ATOM 761 CD1 TYR A 48 -4.630 10.815 6.696 1.00 0.64 C ATOM 762 CD2 TYR A 48 -6.289 9.371 5.786 1.00 0.63 C ATOM 763 CE1 TYR A 48 -5.527 11.255 7.647 1.00 0.78 C ATOM 764 CE2 TYR A 48 -7.192 9.806 6.738 1.00 0.76 C ATOM 765 CZ TYR A 48 -6.802 10.711 7.683 1.00 0.82 C ATOM 766 OH TYR A 48 -7.700 11.187 8.606 1.00 0.99 O ATOM 0 H TYR A 48 -5.601 9.185 2.546 1.00 0.48 H new ATOM 0 HA TYR A 48 -3.841 11.271 3.692 1.00 0.45 H new ATOM 0 HB2 TYR A 48 -4.228 8.359 4.453 1.00 0.48 H new ATOM 0 HB3 TYR A 48 -3.005 9.416 5.129 1.00 0.48 H new ATOM 0 HD1 TYR A 48 -3.627 11.216 6.687 1.00 0.64 H new ATOM 0 HD2 TYR A 48 -6.596 8.634 5.059 1.00 0.63 H new ATOM 0 HE1 TYR A 48 -5.239 12.016 8.357 1.00 0.78 H new ATOM 0 HE2 TYR A 48 -8.205 9.430 6.734 1.00 0.76 H new ATOM 0 HH TYR A 48 -8.551 10.711 8.510 1.00 0.99 H new ATOM 776 N ARG A 49 -1.908 10.611 2.347 1.00 0.45 N ATOM 777 CA ARG A 49 -0.758 10.289 1.521 1.00 0.48 C ATOM 778 C ARG A 49 0.508 10.361 2.370 1.00 0.40 C ATOM 779 O ARG A 49 0.715 11.335 3.081 1.00 0.48 O ATOM 780 CB ARG A 49 -0.691 11.254 0.323 1.00 0.59 C ATOM 781 CG ARG A 49 0.524 11.078 -0.586 1.00 0.71 C ATOM 782 CD ARG A 49 1.694 11.931 -0.124 1.00 1.32 C ATOM 783 NE ARG A 49 2.779 11.957 -1.099 1.00 1.69 N ATOM 784 CZ ARG A 49 3.851 12.740 -0.993 1.00 2.18 C ATOM 785 NH1 ARG A 49 3.968 13.576 0.031 1.00 2.54 N ATOM 786 NH2 ARG A 49 4.805 12.701 -1.913 1.00 2.92 N ATOM 0 H ARG A 49 -1.858 11.523 2.801 1.00 0.45 H new ATOM 0 HA ARG A 49 -0.850 9.276 1.128 1.00 0.48 H new ATOM 0 HB2 ARG A 49 -1.594 11.129 -0.275 1.00 0.59 H new ATOM 0 HB3 ARG A 49 -0.698 12.277 0.700 1.00 0.59 H new ATOM 0 HG2 ARG A 49 0.820 10.029 -0.600 1.00 0.71 H new ATOM 0 HG3 ARG A 49 0.257 11.347 -1.608 1.00 0.71 H new ATOM 0 HD2 ARG A 49 1.349 12.949 0.059 1.00 1.32 H new ATOM 0 HD3 ARG A 49 2.070 11.546 0.824 1.00 1.32 H new ATOM 0 HE ARG A 49 2.713 11.340 -1.908 1.00 1.69 H new ATOM 0 HH11 ARG A 49 3.236 13.620 0.740 1.00 2.54 H new ATOM 0 HH12 ARG A 49 4.790 14.174 0.109 1.00 2.54 H new ATOM 0 HH21 ARG A 49 4.721 12.068 -2.709 1.00 2.92 H new ATOM 0 HH22 ARG A 49 5.623 13.304 -1.825 1.00 2.92 H new ATOM 800 N VAL A 50 1.349 9.344 2.298 1.00 0.37 N ATOM 801 CA VAL A 50 2.537 9.293 3.129 1.00 0.42 C ATOM 802 C VAL A 50 3.795 9.326 2.267 1.00 0.46 C ATOM 803 O VAL A 50 3.786 8.895 1.114 1.00 0.62 O ATOM 804 CB VAL A 50 2.538 8.064 4.070 1.00 0.63 C ATOM 805 CG1 VAL A 50 2.677 6.762 3.297 1.00 1.29 C ATOM 806 CG2 VAL A 50 3.626 8.186 5.126 1.00 1.33 C ATOM 0 H VAL A 50 1.231 8.545 1.675 1.00 0.37 H new ATOM 0 HA VAL A 50 2.529 10.178 3.765 1.00 0.42 H new ATOM 0 HB VAL A 50 1.573 8.043 4.576 1.00 0.63 H new ATOM 0 HG11 VAL A 50 2.673 5.923 3.993 1.00 1.29 H new ATOM 0 HG12 VAL A 50 1.843 6.660 2.602 1.00 1.29 H new ATOM 0 HG13 VAL A 50 3.614 6.768 2.740 1.00 1.29 H new ATOM 0 HG21 VAL A 50 3.604 7.309 5.774 1.00 1.33 H new ATOM 0 HG22 VAL A 50 4.599 8.254 4.640 1.00 1.33 H new ATOM 0 HG23 VAL A 50 3.455 9.082 5.723 1.00 1.33 H new ATOM 816 N GLU A 51 4.858 9.861 2.836 1.00 0.37 N ATOM 817 CA GLU A 51 6.088 10.127 2.114 1.00 0.37 C ATOM 818 C GLU A 51 7.269 9.978 3.057 1.00 0.38 C ATOM 819 O GLU A 51 7.461 10.805 3.946 1.00 0.56 O ATOM 820 CB GLU A 51 6.054 11.553 1.551 1.00 0.40 C ATOM 821 CG GLU A 51 7.352 11.993 0.893 1.00 0.47 C ATOM 822 CD GLU A 51 7.372 13.473 0.560 1.00 0.52 C ATOM 823 OE1 GLU A 51 6.778 13.866 -0.468 1.00 1.07 O ATOM 824 OE2 GLU A 51 7.999 14.247 1.310 1.00 1.02 O ATOM 0 H GLU A 51 4.893 10.126 3.820 1.00 0.37 H new ATOM 0 HA GLU A 51 6.189 9.418 1.292 1.00 0.37 H new ATOM 0 HB2 GLU A 51 5.247 11.625 0.822 1.00 0.40 H new ATOM 0 HB3 GLU A 51 5.816 12.245 2.359 1.00 0.40 H new ATOM 0 HG2 GLU A 51 8.186 11.764 1.556 1.00 0.47 H new ATOM 0 HG3 GLU A 51 7.504 11.418 -0.020 1.00 0.47 H new ATOM 831 N GLY A 52 8.048 8.929 2.880 1.00 0.27 N ATOM 832 CA GLY A 52 9.174 8.714 3.751 1.00 0.29 C ATOM 833 C GLY A 52 10.378 8.198 3.011 1.00 0.25 C ATOM 834 O GLY A 52 10.258 7.348 2.132 1.00 0.29 O ATOM 0 H GLY A 52 7.921 8.226 2.152 1.00 0.27 H new ATOM 0 HA2 GLY A 52 9.430 9.650 4.248 1.00 0.29 H new ATOM 0 HA3 GLY A 52 8.897 8.004 4.530 1.00 0.29 H new ATOM 838 N ILE A 53 11.542 8.710 3.350 1.00 0.24 N ATOM 839 CA ILE A 53 12.764 8.228 2.749 1.00 0.23 C ATOM 840 C ILE A 53 13.261 6.997 3.489 1.00 0.23 C ATOM 841 O ILE A 53 13.349 6.987 4.719 1.00 0.30 O ATOM 842 CB ILE A 53 13.866 9.301 2.737 1.00 0.29 C ATOM 843 CG1 ILE A 53 13.367 10.558 2.021 1.00 0.37 C ATOM 844 CG2 ILE A 53 15.111 8.755 2.050 1.00 0.27 C ATOM 845 CD1 ILE A 53 14.336 11.715 2.074 1.00 0.58 C ATOM 0 H ILE A 53 11.666 9.456 4.035 1.00 0.24 H new ATOM 0 HA ILE A 53 12.536 7.972 1.714 1.00 0.23 H new ATOM 0 HB ILE A 53 14.120 9.565 3.764 1.00 0.29 H new ATOM 0 HG12 ILE A 53 13.163 10.314 0.978 1.00 0.37 H new ATOM 0 HG13 ILE A 53 12.422 10.867 2.466 1.00 0.37 H new ATOM 0 HG21 ILE A 53 15.888 9.519 2.044 1.00 0.27 H new ATOM 0 HG22 ILE A 53 15.469 7.878 2.589 1.00 0.27 H new ATOM 0 HG23 ILE A 53 14.868 8.477 1.024 1.00 0.27 H new ATOM 0 HD11 ILE A 53 13.912 12.569 1.545 1.00 0.58 H new ATOM 0 HD12 ILE A 53 14.521 11.987 3.113 1.00 0.58 H new ATOM 0 HD13 ILE A 53 15.275 11.425 1.602 1.00 0.58 H new ATOM 857 N ILE A 54 13.547 5.953 2.737 1.00 0.24 N ATOM 858 CA ILE A 54 14.078 4.736 3.300 1.00 0.26 C ATOM 859 C ILE A 54 15.534 4.576 2.889 1.00 0.29 C ATOM 860 O ILE A 54 15.848 4.565 1.700 1.00 0.31 O ATOM 861 CB ILE A 54 13.246 3.506 2.878 1.00 0.26 C ATOM 862 CG1 ILE A 54 11.797 3.717 3.320 1.00 0.32 C ATOM 863 CG2 ILE A 54 13.822 2.233 3.490 1.00 0.32 C ATOM 864 CD1 ILE A 54 10.872 2.599 2.933 1.00 0.35 C ATOM 0 H ILE A 54 13.418 5.928 1.726 1.00 0.24 H new ATOM 0 HA ILE A 54 14.020 4.804 4.386 1.00 0.26 H new ATOM 0 HB ILE A 54 13.281 3.393 1.794 1.00 0.26 H new ATOM 0 HG12 ILE A 54 11.772 3.837 4.403 1.00 0.32 H new ATOM 0 HG13 ILE A 54 11.428 4.647 2.887 1.00 0.32 H new ATOM 0 HG21 ILE A 54 13.222 1.377 3.181 1.00 0.32 H new ATOM 0 HG22 ILE A 54 14.849 2.098 3.150 1.00 0.32 H new ATOM 0 HG23 ILE A 54 13.807 2.313 4.577 1.00 0.32 H new ATOM 0 HD11 ILE A 54 9.864 2.823 3.282 1.00 0.35 H new ATOM 0 HD12 ILE A 54 10.865 2.492 1.848 1.00 0.35 H new ATOM 0 HD13 ILE A 54 11.215 1.669 3.387 1.00 0.35 H new ATOM 876 N PRO A 55 16.434 4.541 3.883 1.00 0.36 N ATOM 877 CA PRO A 55 17.879 4.357 3.685 1.00 0.44 C ATOM 878 C PRO A 55 18.218 3.020 3.033 1.00 0.47 C ATOM 879 O PRO A 55 18.786 2.122 3.664 1.00 0.62 O ATOM 880 CB PRO A 55 18.452 4.418 5.104 1.00 0.54 C ATOM 881 CG PRO A 55 17.412 5.110 5.910 1.00 0.53 C ATOM 882 CD PRO A 55 16.100 4.727 5.294 1.00 0.42 C ATOM 0 HA PRO A 55 18.289 5.111 3.013 1.00 0.44 H new ATOM 0 HB2 PRO A 55 18.652 3.419 5.492 1.00 0.54 H new ATOM 0 HB3 PRO A 55 19.396 4.963 5.125 1.00 0.54 H new ATOM 0 HG2 PRO A 55 17.458 4.803 6.955 1.00 0.53 H new ATOM 0 HG3 PRO A 55 17.554 6.190 5.888 1.00 0.53 H new ATOM 0 HD2 PRO A 55 15.699 3.815 5.736 1.00 0.42 H new ATOM 0 HD3 PRO A 55 15.349 5.505 5.431 1.00 0.42 H new ATOM 890 N GLU A 56 17.851 2.906 1.774 1.00 0.43 N ATOM 891 CA GLU A 56 18.142 1.743 0.971 1.00 0.49 C ATOM 892 C GLU A 56 17.941 2.116 -0.489 1.00 0.46 C ATOM 893 O GLU A 56 17.545 3.243 -0.785 1.00 0.60 O ATOM 894 CB GLU A 56 17.213 0.594 1.366 1.00 0.66 C ATOM 895 CG GLU A 56 17.645 -0.756 0.828 1.00 0.77 C ATOM 896 CD GLU A 56 19.004 -1.176 1.346 1.00 1.18 C ATOM 897 OE1 GLU A 56 20.024 -0.764 0.756 1.00 1.68 O ATOM 898 OE2 GLU A 56 19.064 -1.914 2.349 1.00 1.38 O ATOM 0 H GLU A 56 17.335 3.630 1.275 1.00 0.43 H new ATOM 0 HA GLU A 56 19.169 1.415 1.130 1.00 0.49 H new ATOM 0 HB2 GLU A 56 17.159 0.541 2.453 1.00 0.66 H new ATOM 0 HB3 GLU A 56 16.207 0.813 1.007 1.00 0.66 H new ATOM 0 HG2 GLU A 56 16.906 -1.508 1.105 1.00 0.77 H new ATOM 0 HG3 GLU A 56 17.670 -0.719 -0.261 1.00 0.77 H new ATOM 905 N SER A 57 18.225 1.197 -1.392 1.00 0.45 N ATOM 906 CA SER A 57 17.995 1.417 -2.783 1.00 0.45 C ATOM 907 C SER A 57 16.554 1.083 -3.139 1.00 0.43 C ATOM 908 O SER A 57 15.906 0.254 -2.488 1.00 0.43 O ATOM 909 CB SER A 57 18.964 0.558 -3.597 1.00 0.53 C ATOM 910 OG SER A 57 18.860 -0.810 -3.230 1.00 1.18 O ATOM 0 H SER A 57 18.620 0.283 -1.170 1.00 0.45 H new ATOM 0 HA SER A 57 18.166 2.468 -3.017 1.00 0.45 H new ATOM 0 HB2 SER A 57 18.751 0.671 -4.660 1.00 0.53 H new ATOM 0 HB3 SER A 57 19.985 0.905 -3.438 1.00 0.53 H new ATOM 0 HG SER A 57 19.487 -1.341 -3.764 1.00 1.18 H new ATOM 916 N PRO A 58 16.052 1.720 -4.199 1.00 0.44 N ATOM 917 CA PRO A 58 14.684 1.552 -4.671 1.00 0.43 C ATOM 918 C PRO A 58 14.490 0.156 -5.234 1.00 0.46 C ATOM 919 O PRO A 58 13.374 -0.274 -5.516 1.00 0.46 O ATOM 920 CB PRO A 58 14.527 2.629 -5.762 1.00 0.44 C ATOM 921 CG PRO A 58 15.736 3.506 -5.634 1.00 0.49 C ATOM 922 CD PRO A 58 16.806 2.655 -5.028 1.00 0.52 C ATOM 0 HA PRO A 58 13.941 1.663 -3.881 1.00 0.43 H new ATOM 0 HB2 PRO A 58 14.472 2.179 -6.753 1.00 0.44 H new ATOM 0 HB3 PRO A 58 13.610 3.201 -5.620 1.00 0.44 H new ATOM 0 HG2 PRO A 58 16.046 3.887 -6.607 1.00 0.49 H new ATOM 0 HG3 PRO A 58 15.524 4.371 -5.006 1.00 0.49 H new ATOM 0 HD2 PRO A 58 17.390 2.138 -5.789 1.00 0.52 H new ATOM 0 HD3 PRO A 58 17.505 3.246 -4.436 1.00 0.52 H new ATOM 930 N ALA A 59 15.605 -0.544 -5.373 1.00 0.50 N ATOM 931 CA ALA A 59 15.612 -1.909 -5.844 1.00 0.54 C ATOM 932 C ALA A 59 15.123 -2.856 -4.776 1.00 0.50 C ATOM 933 O ALA A 59 14.265 -3.694 -5.031 1.00 0.51 O ATOM 934 CB ALA A 59 17.010 -2.300 -6.259 1.00 0.64 C ATOM 0 H ALA A 59 16.531 -0.174 -5.160 1.00 0.50 H new ATOM 0 HA ALA A 59 14.939 -1.975 -6.699 1.00 0.54 H new ATOM 0 HB1 ALA A 59 17.009 -3.331 -6.613 1.00 0.64 H new ATOM 0 HB2 ALA A 59 17.350 -1.642 -7.058 1.00 0.64 H new ATOM 0 HB3 ALA A 59 17.681 -2.210 -5.405 1.00 0.64 H new ATOM 940 N LYS A 60 15.666 -2.719 -3.576 1.00 0.49 N ATOM 941 CA LYS A 60 15.295 -3.597 -2.489 1.00 0.49 C ATOM 942 C LYS A 60 13.901 -3.233 -2.022 1.00 0.42 C ATOM 943 O LYS A 60 13.161 -4.060 -1.491 1.00 0.43 O ATOM 944 CB LYS A 60 16.305 -3.488 -1.350 1.00 0.58 C ATOM 945 CG LYS A 60 16.110 -4.519 -0.255 1.00 0.65 C ATOM 946 CD LYS A 60 17.341 -5.378 -0.132 1.00 1.35 C ATOM 947 CE LYS A 60 18.562 -4.532 0.177 1.00 2.45 C ATOM 948 NZ LYS A 60 18.825 -4.453 1.633 1.00 3.30 N ATOM 0 H LYS A 60 16.360 -2.011 -3.336 1.00 0.49 H new ATOM 0 HA LYS A 60 15.297 -4.632 -2.830 1.00 0.49 H new ATOM 0 HB2 LYS A 60 17.310 -3.591 -1.758 1.00 0.58 H new ATOM 0 HB3 LYS A 60 16.239 -2.492 -0.913 1.00 0.58 H new ATOM 0 HG2 LYS A 60 15.908 -4.021 0.693 1.00 0.65 H new ATOM 0 HG3 LYS A 60 15.243 -5.141 -0.480 1.00 0.65 H new ATOM 0 HD2 LYS A 60 17.197 -6.117 0.656 1.00 1.35 H new ATOM 0 HD3 LYS A 60 17.500 -5.928 -1.060 1.00 1.35 H new ATOM 0 HE2 LYS A 60 19.432 -4.953 -0.327 1.00 2.45 H new ATOM 0 HE3 LYS A 60 18.418 -3.528 -0.221 1.00 2.45 H new ATOM 0 HZ1 LYS A 60 19.309 -3.559 1.850 1.00 3.30 H new ATOM 0 HZ2 LYS A 60 17.924 -4.494 2.151 1.00 3.30 H new ATOM 0 HZ3 LYS A 60 19.427 -5.251 1.921 1.00 3.30 H new ATOM 962 N LEU A 61 13.555 -1.976 -2.241 1.00 0.37 N ATOM 963 CA LEU A 61 12.213 -1.496 -1.980 1.00 0.35 C ATOM 964 C LEU A 61 11.222 -2.203 -2.903 1.00 0.38 C ATOM 965 O LEU A 61 10.253 -2.833 -2.448 1.00 0.41 O ATOM 966 CB LEU A 61 12.162 0.022 -2.164 1.00 0.34 C ATOM 967 CG LEU A 61 12.953 0.832 -1.122 1.00 0.31 C ATOM 968 CD1 LEU A 61 12.863 2.315 -1.413 1.00 0.34 C ATOM 969 CD2 LEU A 61 12.420 0.555 0.268 1.00 0.30 C ATOM 0 H LEU A 61 14.192 -1.266 -2.602 1.00 0.37 H new ATOM 0 HA LEU A 61 11.935 -1.722 -0.950 1.00 0.35 H new ATOM 0 HB2 LEU A 61 12.543 0.265 -3.156 1.00 0.34 H new ATOM 0 HB3 LEU A 61 11.120 0.341 -2.135 1.00 0.34 H new ATOM 0 HG LEU A 61 13.998 0.527 -1.177 1.00 0.31 H new ATOM 0 HD11 LEU A 61 13.430 2.868 -0.664 1.00 0.34 H new ATOM 0 HD12 LEU A 61 13.275 2.517 -2.402 1.00 0.34 H new ATOM 0 HD13 LEU A 61 11.820 2.629 -1.383 1.00 0.34 H new ATOM 0 HD21 LEU A 61 12.987 1.134 0.997 1.00 0.30 H new ATOM 0 HD22 LEU A 61 11.369 0.839 0.318 1.00 0.30 H new ATOM 0 HD23 LEU A 61 12.520 -0.507 0.491 1.00 0.30 H new ATOM 981 N SER A 62 11.506 -2.145 -4.198 1.00 0.41 N ATOM 982 CA SER A 62 10.712 -2.852 -5.192 1.00 0.46 C ATOM 983 C SER A 62 10.819 -4.361 -4.985 1.00 0.46 C ATOM 984 O SER A 62 10.044 -5.138 -5.545 1.00 0.50 O ATOM 985 CB SER A 62 11.189 -2.485 -6.595 1.00 0.53 C ATOM 986 OG SER A 62 11.213 -1.079 -6.775 1.00 1.29 O ATOM 0 H SER A 62 12.285 -1.612 -4.585 1.00 0.41 H new ATOM 0 HA SER A 62 9.669 -2.557 -5.079 1.00 0.46 H new ATOM 0 HB2 SER A 62 12.186 -2.893 -6.762 1.00 0.53 H new ATOM 0 HB3 SER A 62 10.531 -2.938 -7.336 1.00 0.53 H new ATOM 0 HG SER A 62 12.091 -0.731 -6.513 1.00 1.29 H new ATOM 992 N ASP A 63 11.786 -4.766 -4.171 1.00 0.44 N ATOM 993 CA ASP A 63 12.019 -6.180 -3.905 1.00 0.48 C ATOM 994 C ASP A 63 11.117 -6.697 -2.784 1.00 0.49 C ATOM 995 O ASP A 63 10.542 -7.781 -2.898 1.00 0.60 O ATOM 996 CB ASP A 63 13.492 -6.411 -3.553 1.00 0.53 C ATOM 997 CG ASP A 63 13.804 -7.844 -3.176 1.00 0.87 C ATOM 998 OD1 ASP A 63 13.507 -8.748 -3.984 1.00 1.10 O ATOM 999 OD2 ASP A 63 14.318 -8.080 -2.063 1.00 1.32 O ATOM 0 H ASP A 63 12.422 -4.135 -3.683 1.00 0.44 H new ATOM 0 HA ASP A 63 11.774 -6.737 -4.809 1.00 0.48 H new ATOM 0 HB2 ASP A 63 14.110 -6.124 -4.404 1.00 0.53 H new ATOM 0 HB3 ASP A 63 13.767 -5.758 -2.725 1.00 0.53 H new ATOM 1004 N PHE A 64 10.965 -5.922 -1.712 1.00 0.44 N ATOM 1005 CA PHE A 64 10.224 -6.400 -0.550 1.00 0.48 C ATOM 1006 C PHE A 64 8.721 -6.433 -0.828 1.00 0.51 C ATOM 1007 O PHE A 64 8.051 -7.416 -0.502 1.00 0.61 O ATOM 1008 CB PHE A 64 10.532 -5.567 0.719 1.00 0.51 C ATOM 1009 CG PHE A 64 9.892 -4.199 0.761 1.00 0.46 C ATOM 1010 CD1 PHE A 64 8.553 -4.037 1.096 1.00 0.59 C ATOM 1011 CD2 PHE A 64 10.625 -3.080 0.448 1.00 0.50 C ATOM 1012 CE1 PHE A 64 7.970 -2.795 1.112 1.00 0.59 C ATOM 1013 CE2 PHE A 64 10.039 -1.830 0.458 1.00 0.50 C ATOM 1014 CZ PHE A 64 8.713 -1.692 0.788 1.00 0.47 C ATOM 0 H PHE A 64 11.338 -4.977 -1.625 1.00 0.44 H new ATOM 0 HA PHE A 64 10.558 -7.420 -0.358 1.00 0.48 H new ATOM 0 HB2 PHE A 64 10.205 -6.131 1.593 1.00 0.51 H new ATOM 0 HB3 PHE A 64 11.612 -5.448 0.803 1.00 0.51 H new ATOM 0 HD1 PHE A 64 7.961 -4.904 1.348 1.00 0.59 H new ATOM 0 HD2 PHE A 64 11.669 -3.179 0.192 1.00 0.50 H new ATOM 0 HE1 PHE A 64 6.929 -2.688 1.379 1.00 0.59 H new ATOM 0 HE2 PHE A 64 10.625 -0.958 0.206 1.00 0.50 H new ATOM 0 HZ PHE A 64 8.257 -0.713 0.792 1.00 0.47 H new ATOM 1024 N LEU A 65 8.188 -5.378 -1.446 1.00 0.49 N ATOM 1025 CA LEU A 65 6.740 -5.272 -1.614 1.00 0.58 C ATOM 1026 C LEU A 65 6.243 -6.094 -2.790 1.00 0.64 C ATOM 1027 O LEU A 65 5.060 -6.422 -2.845 1.00 0.81 O ATOM 1028 CB LEU A 65 6.329 -3.821 -1.861 1.00 0.66 C ATOM 1029 CG LEU A 65 6.231 -3.437 -3.344 1.00 0.78 C ATOM 1030 CD1 LEU A 65 5.327 -2.247 -3.537 1.00 1.25 C ATOM 1031 CD2 LEU A 65 7.601 -3.147 -3.924 1.00 1.50 C ATOM 0 H LEU A 65 8.725 -4.601 -1.831 1.00 0.49 H new ATOM 0 HA LEU A 65 6.297 -5.649 -0.692 1.00 0.58 H new ATOM 0 HB2 LEU A 65 5.364 -3.643 -1.387 1.00 0.66 H new ATOM 0 HB3 LEU A 65 7.049 -3.164 -1.374 1.00 0.66 H new ATOM 0 HG LEU A 65 5.803 -4.288 -3.874 1.00 0.78 H new ATOM 0 HD11 LEU A 65 5.276 -1.997 -4.597 1.00 1.25 H new ATOM 0 HD12 LEU A 65 4.328 -2.486 -3.172 1.00 1.25 H new ATOM 0 HD13 LEU A 65 5.722 -1.396 -2.982 1.00 1.25 H new ATOM 0 HD21 LEU A 65 7.501 -2.878 -4.976 1.00 1.50 H new ATOM 0 HD22 LEU A 65 8.059 -2.321 -3.380 1.00 1.50 H new ATOM 0 HD23 LEU A 65 8.229 -4.033 -3.834 1.00 1.50 H new ATOM 1043 N TYR A 66 7.174 -6.474 -3.662 1.00 0.58 N ATOM 1044 CA TYR A 66 6.886 -6.760 -5.079 1.00 0.64 C ATOM 1045 C TYR A 66 5.445 -7.205 -5.339 1.00 0.72 C ATOM 1046 O TYR A 66 4.641 -6.422 -5.833 1.00 0.89 O ATOM 1047 CB TYR A 66 7.865 -7.801 -5.630 1.00 0.73 C ATOM 1048 CG TYR A 66 7.555 -8.236 -7.049 1.00 0.88 C ATOM 1049 CD1 TYR A 66 7.472 -7.304 -8.075 1.00 0.82 C ATOM 1050 CD2 TYR A 66 7.357 -9.575 -7.364 1.00 1.27 C ATOM 1051 CE1 TYR A 66 7.197 -7.690 -9.371 1.00 1.01 C ATOM 1052 CE2 TYR A 66 7.083 -9.969 -8.660 1.00 1.47 C ATOM 1053 CZ TYR A 66 6.968 -9.046 -9.644 1.00 1.29 C ATOM 1054 OH TYR A 66 6.728 -9.408 -10.954 1.00 1.52 O ATOM 0 H TYR A 66 8.155 -6.595 -3.412 1.00 0.58 H new ATOM 0 HA TYR A 66 7.016 -5.814 -5.605 1.00 0.64 H new ATOM 0 HB2 TYR A 66 8.874 -7.391 -5.597 1.00 0.73 H new ATOM 0 HB3 TYR A 66 7.855 -8.676 -4.980 1.00 0.73 H new ATOM 0 HD1 TYR A 66 7.625 -6.258 -7.855 1.00 0.82 H new ATOM 0 HD2 TYR A 66 7.418 -10.319 -6.584 1.00 1.27 H new ATOM 0 HE1 TYR A 66 7.159 -6.958 -10.164 1.00 1.01 H new ATOM 0 HE2 TYR A 66 6.960 -11.017 -8.889 1.00 1.47 H new ATOM 0 HH TYR A 66 6.586 -10.376 -11.005 1.00 1.52 H new ATOM 1064 N GLN A 67 5.131 -8.429 -4.926 1.00 0.89 N ATOM 1065 CA GLN A 67 3.830 -9.060 -5.134 1.00 1.13 C ATOM 1066 C GLN A 67 3.903 -10.464 -4.620 1.00 1.10 C ATOM 1067 O GLN A 67 4.660 -11.274 -5.152 1.00 1.76 O ATOM 1068 CB GLN A 67 3.392 -9.173 -6.590 1.00 1.54 C ATOM 1069 CG GLN A 67 2.718 -7.940 -7.177 1.00 2.13 C ATOM 1070 CD GLN A 67 1.459 -7.529 -6.437 1.00 2.94 C ATOM 1071 OE1 GLN A 67 1.323 -7.738 -5.231 1.00 3.50 O ATOM 1072 NE2 GLN A 67 0.522 -6.941 -7.158 1.00 3.60 N ATOM 0 H GLN A 67 5.790 -9.025 -4.425 1.00 0.89 H new ATOM 0 HA GLN A 67 3.113 -8.422 -4.618 1.00 1.13 H new ATOM 0 HB2 GLN A 67 4.267 -9.409 -7.196 1.00 1.54 H new ATOM 0 HB3 GLN A 67 2.706 -10.016 -6.679 1.00 1.54 H new ATOM 0 HG2 GLN A 67 3.424 -7.110 -7.166 1.00 2.13 H new ATOM 0 HG3 GLN A 67 2.470 -8.133 -8.221 1.00 2.13 H new ATOM 0 HE21 GLN A 67 0.669 -6.784 -8.155 1.00 3.60 H new ATOM 0 HE22 GLN A 67 -0.349 -6.644 -6.718 1.00 3.60 H new ATOM 1081 N THR A 68 3.118 -10.740 -3.597 1.00 0.83 N ATOM 1082 CA THR A 68 3.092 -12.036 -2.929 1.00 0.93 C ATOM 1083 C THR A 68 4.489 -12.644 -2.770 1.00 1.09 C ATOM 1084 O THR A 68 4.667 -13.863 -2.761 1.00 1.39 O ATOM 1085 CB THR A 68 2.135 -13.047 -3.620 1.00 1.18 C ATOM 1086 OG1 THR A 68 1.962 -14.202 -2.791 1.00 1.48 O ATOM 1087 CG2 THR A 68 2.646 -13.487 -4.989 1.00 1.29 C ATOM 0 H THR A 68 2.469 -10.063 -3.197 1.00 0.83 H new ATOM 0 HA THR A 68 2.700 -11.838 -1.931 1.00 0.93 H new ATOM 0 HB THR A 68 1.183 -12.537 -3.765 1.00 1.18 H new ATOM 0 HG1 THR A 68 2.826 -14.465 -2.411 1.00 1.48 H new ATOM 0 HG21 THR A 68 1.942 -14.193 -5.430 1.00 1.29 H new ATOM 0 HG22 THR A 68 2.743 -12.617 -5.638 1.00 1.29 H new ATOM 0 HG23 THR A 68 3.619 -13.966 -4.878 1.00 1.29 H new ATOM 1095 N GLY A 69 5.471 -11.778 -2.621 1.00 1.06 N ATOM 1096 CA GLY A 69 6.841 -12.200 -2.699 1.00 1.39 C ATOM 1097 C GLY A 69 7.368 -12.714 -1.400 1.00 1.17 C ATOM 1098 O GLY A 69 8.082 -13.713 -1.355 1.00 1.46 O ATOM 0 H GLY A 69 5.339 -10.782 -2.446 1.00 1.06 H new ATOM 0 HA2 GLY A 69 6.933 -12.979 -3.456 1.00 1.39 H new ATOM 0 HA3 GLY A 69 7.455 -11.362 -3.028 1.00 1.39 H new ATOM 1102 N ASP A 70 6.957 -12.049 -0.345 1.00 0.84 N ATOM 1103 CA ASP A 70 7.608 -12.164 0.945 1.00 0.83 C ATOM 1104 C ASP A 70 7.053 -11.083 1.859 1.00 0.65 C ATOM 1105 O ASP A 70 7.079 -11.205 3.073 1.00 0.61 O ATOM 1106 CB ASP A 70 9.124 -11.986 0.765 1.00 1.12 C ATOM 1107 CG ASP A 70 9.941 -12.484 1.936 1.00 1.45 C ATOM 1108 OD1 ASP A 70 9.814 -13.675 2.280 1.00 2.19 O ATOM 1109 OD2 ASP A 70 10.688 -11.685 2.528 1.00 1.68 O ATOM 0 H ASP A 70 6.161 -11.411 -0.354 1.00 0.84 H new ATOM 0 HA ASP A 70 7.422 -13.144 1.384 1.00 0.83 H new ATOM 0 HB2 ASP A 70 9.438 -12.514 -0.135 1.00 1.12 H new ATOM 0 HB3 ASP A 70 9.340 -10.929 0.607 1.00 1.12 H new ATOM 1114 N ARG A 71 6.506 -10.039 1.225 1.00 0.60 N ATOM 1115 CA ARG A 71 5.946 -8.877 1.898 1.00 0.51 C ATOM 1116 C ARG A 71 5.097 -9.289 3.089 1.00 0.43 C ATOM 1117 O ARG A 71 5.285 -8.794 4.184 1.00 0.49 O ATOM 1118 CB ARG A 71 5.093 -8.051 0.912 1.00 0.59 C ATOM 1119 CG ARG A 71 4.024 -8.864 0.213 1.00 0.83 C ATOM 1120 CD ARG A 71 2.810 -8.031 -0.134 1.00 0.87 C ATOM 1121 NE ARG A 71 3.037 -7.098 -1.235 1.00 1.77 N ATOM 1122 CZ ARG A 71 2.081 -6.329 -1.770 1.00 2.46 C ATOM 1123 NH1 ARG A 71 0.861 -6.309 -1.243 1.00 2.69 N ATOM 1124 NH2 ARG A 71 2.353 -5.566 -2.820 1.00 3.38 N ATOM 0 H ARG A 71 6.442 -9.984 0.208 1.00 0.60 H new ATOM 0 HA ARG A 71 6.774 -8.268 2.260 1.00 0.51 H new ATOM 0 HB2 ARG A 71 4.620 -7.231 1.452 1.00 0.59 H new ATOM 0 HB3 ARG A 71 5.747 -7.605 0.163 1.00 0.59 H new ATOM 0 HG2 ARG A 71 4.437 -9.298 -0.697 1.00 0.83 H new ATOM 0 HG3 ARG A 71 3.723 -9.693 0.854 1.00 0.83 H new ATOM 0 HD2 ARG A 71 1.986 -8.695 -0.396 1.00 0.87 H new ATOM 0 HD3 ARG A 71 2.500 -7.471 0.748 1.00 0.87 H new ATOM 0 HE ARG A 71 3.980 -7.029 -1.619 1.00 1.77 H new ATOM 0 HH11 ARG A 71 0.649 -6.882 -0.426 1.00 2.69 H new ATOM 0 HH12 ARG A 71 0.137 -5.721 -1.655 1.00 2.69 H new ATOM 0 HH21 ARG A 71 3.291 -5.565 -3.220 1.00 3.38 H new ATOM 0 HH22 ARG A 71 1.624 -4.980 -3.227 1.00 3.38 H new ATOM 1138 N ILE A 72 4.211 -10.252 2.880 1.00 0.44 N ATOM 1139 CA ILE A 72 3.237 -10.604 3.908 1.00 0.44 C ATOM 1140 C ILE A 72 3.848 -11.481 4.977 1.00 0.54 C ATOM 1141 O ILE A 72 3.292 -11.620 6.066 1.00 0.64 O ATOM 1142 CB ILE A 72 1.971 -11.314 3.361 1.00 0.45 C ATOM 1143 CG1 ILE A 72 2.282 -12.650 2.676 1.00 0.62 C ATOM 1144 CG2 ILE A 72 1.219 -10.414 2.416 1.00 0.47 C ATOM 1145 CD1 ILE A 72 2.958 -12.544 1.319 1.00 0.71 C ATOM 0 H ILE A 72 4.144 -10.798 2.021 1.00 0.44 H new ATOM 0 HA ILE A 72 2.930 -9.646 4.329 1.00 0.44 H new ATOM 0 HB ILE A 72 1.347 -11.535 4.227 1.00 0.45 H new ATOM 0 HG12 ILE A 72 2.920 -13.238 3.336 1.00 0.62 H new ATOM 0 HG13 ILE A 72 1.351 -13.204 2.557 1.00 0.62 H new ATOM 0 HG21 ILE A 72 0.335 -10.933 2.045 1.00 0.47 H new ATOM 0 HG22 ILE A 72 0.914 -9.508 2.941 1.00 0.47 H new ATOM 0 HG23 ILE A 72 1.862 -10.148 1.577 1.00 0.47 H new ATOM 0 HD11 ILE A 72 3.134 -13.543 0.921 1.00 0.71 H new ATOM 0 HD12 ILE A 72 2.316 -11.989 0.635 1.00 0.71 H new ATOM 0 HD13 ILE A 72 3.910 -12.024 1.426 1.00 0.71 H new ATOM 1157 N THR A 73 5.000 -12.059 4.687 1.00 0.59 N ATOM 1158 CA THR A 73 5.585 -12.992 5.613 1.00 0.72 C ATOM 1159 C THR A 73 6.345 -12.240 6.701 1.00 0.74 C ATOM 1160 O THR A 73 6.338 -12.642 7.863 1.00 0.88 O ATOM 1161 CB THR A 73 6.523 -14.019 4.920 1.00 0.81 C ATOM 1162 OG1 THR A 73 6.594 -15.222 5.698 1.00 0.97 O ATOM 1163 CG2 THR A 73 7.932 -13.465 4.737 1.00 0.80 C ATOM 0 H THR A 73 5.535 -11.899 3.833 1.00 0.59 H new ATOM 0 HA THR A 73 4.766 -13.558 6.056 1.00 0.72 H new ATOM 0 HB THR A 73 6.104 -14.229 3.936 1.00 0.81 H new ATOM 0 HG1 THR A 73 7.186 -15.864 5.254 1.00 0.97 H new ATOM 0 HG21 THR A 73 8.557 -14.213 4.249 1.00 0.80 H new ATOM 0 HG22 THR A 73 7.893 -12.567 4.120 1.00 0.80 H new ATOM 0 HG23 THR A 73 8.355 -13.218 5.711 1.00 0.80 H new ATOM 1171 N TRP A 74 6.979 -11.130 6.331 1.00 0.64 N ATOM 1172 CA TRP A 74 7.777 -10.378 7.298 1.00 0.66 C ATOM 1173 C TRP A 74 7.021 -9.158 7.814 1.00 0.63 C ATOM 1174 O TRP A 74 7.494 -8.454 8.708 1.00 0.75 O ATOM 1175 CB TRP A 74 9.124 -9.961 6.687 1.00 0.66 C ATOM 1176 CG TRP A 74 9.009 -9.279 5.357 1.00 0.59 C ATOM 1177 CD1 TRP A 74 9.365 -9.788 4.147 1.00 0.66 C ATOM 1178 CD2 TRP A 74 8.502 -7.969 5.101 1.00 0.53 C ATOM 1179 NE1 TRP A 74 9.109 -8.877 3.157 1.00 0.65 N ATOM 1180 CE2 TRP A 74 8.579 -7.757 3.718 1.00 0.58 C ATOM 1181 CE3 TRP A 74 7.988 -6.957 5.904 1.00 0.52 C ATOM 1182 CZ2 TRP A 74 8.164 -6.580 3.122 1.00 0.62 C ATOM 1183 CZ3 TRP A 74 7.574 -5.789 5.315 1.00 0.56 C ATOM 1184 CH2 TRP A 74 7.660 -5.603 3.933 1.00 0.61 C ATOM 0 H TRP A 74 6.958 -10.737 5.390 1.00 0.64 H new ATOM 0 HA TRP A 74 7.971 -11.034 8.147 1.00 0.66 H new ATOM 0 HB2 TRP A 74 9.635 -9.294 7.382 1.00 0.66 H new ATOM 0 HB3 TRP A 74 9.750 -10.846 6.576 1.00 0.66 H new ATOM 0 HD1 TRP A 74 9.788 -10.769 3.990 1.00 0.66 H new ATOM 0 HE1 TRP A 74 9.287 -9.016 2.162 1.00 0.65 H new ATOM 0 HE3 TRP A 74 7.916 -7.088 6.974 1.00 0.52 H new ATOM 0 HZ2 TRP A 74 8.236 -6.438 2.054 1.00 0.62 H new ATOM 0 HZ3 TRP A 74 7.174 -4.998 5.932 1.00 0.56 H new ATOM 0 HH2 TRP A 74 7.323 -4.673 3.499 1.00 0.61 H new ATOM 1195 N ASP A 75 5.838 -8.941 7.264 1.00 0.55 N ATOM 1196 CA ASP A 75 5.077 -7.716 7.499 1.00 0.58 C ATOM 1197 C ASP A 75 4.431 -7.693 8.880 1.00 0.58 C ATOM 1198 O ASP A 75 4.526 -8.657 9.647 1.00 0.73 O ATOM 1199 CB ASP A 75 3.990 -7.604 6.446 1.00 0.83 C ATOM 1200 CG ASP A 75 3.599 -6.176 6.147 1.00 1.44 C ATOM 1201 OD1 ASP A 75 2.791 -5.611 6.907 1.00 1.44 O ATOM 1202 OD2 ASP A 75 4.115 -5.612 5.162 1.00 2.19 O ATOM 0 H ASP A 75 5.375 -9.605 6.643 1.00 0.55 H new ATOM 0 HA ASP A 75 5.770 -6.877 7.442 1.00 0.58 H new ATOM 0 HB2 ASP A 75 4.332 -8.081 5.527 1.00 0.83 H new ATOM 0 HB3 ASP A 75 3.110 -8.153 6.781 1.00 0.83 H new ATOM 1207 N LYS A 76 3.768 -6.582 9.184 1.00 0.58 N ATOM 1208 CA LYS A 76 3.085 -6.407 10.448 1.00 0.65 C ATOM 1209 C LYS A 76 1.681 -5.835 10.249 1.00 0.62 C ATOM 1210 O LYS A 76 0.869 -5.817 11.173 1.00 0.75 O ATOM 1211 CB LYS A 76 3.901 -5.482 11.324 1.00 0.88 C ATOM 1212 CG LYS A 76 4.210 -4.154 10.661 1.00 0.78 C ATOM 1213 CD LYS A 76 3.289 -3.081 11.179 1.00 1.63 C ATOM 1214 CE LYS A 76 3.718 -2.608 12.549 1.00 1.97 C ATOM 1215 NZ LYS A 76 2.747 -1.661 13.156 1.00 3.19 N ATOM 0 H LYS A 76 3.693 -5.781 8.557 1.00 0.58 H new ATOM 0 HA LYS A 76 2.980 -7.381 10.926 1.00 0.65 H new ATOM 0 HB2 LYS A 76 3.360 -5.300 12.253 1.00 0.88 H new ATOM 0 HB3 LYS A 76 4.836 -5.975 11.590 1.00 0.88 H new ATOM 0 HG2 LYS A 76 5.246 -3.877 10.854 1.00 0.78 H new ATOM 0 HG3 LYS A 76 4.100 -4.246 9.580 1.00 0.78 H new ATOM 0 HD2 LYS A 76 3.281 -2.239 10.487 1.00 1.63 H new ATOM 0 HD3 LYS A 76 2.270 -3.464 11.226 1.00 1.63 H new ATOM 0 HE2 LYS A 76 3.839 -3.470 13.206 1.00 1.97 H new ATOM 0 HE3 LYS A 76 4.692 -2.125 12.474 1.00 1.97 H new ATOM 0 HZ1 LYS A 76 2.856 -1.667 14.190 1.00 3.19 H new ATOM 0 HZ2 LYS A 76 2.925 -0.702 12.795 1.00 3.19 H new ATOM 0 HZ3 LYS A 76 1.779 -1.950 12.909 1.00 3.19 H new ATOM 1229 N SER A 77 1.408 -5.360 9.045 1.00 0.61 N ATOM 1230 CA SER A 77 0.107 -4.824 8.699 1.00 0.72 C ATOM 1231 C SER A 77 -0.548 -5.766 7.711 1.00 0.61 C ATOM 1232 O SER A 77 -1.684 -5.568 7.285 1.00 0.65 O ATOM 1233 CB SER A 77 0.254 -3.434 8.079 1.00 0.91 C ATOM 1234 OG SER A 77 1.092 -2.610 8.870 1.00 1.58 O ATOM 0 H SER A 77 2.084 -5.336 8.282 1.00 0.61 H new ATOM 0 HA SER A 77 -0.507 -4.733 9.595 1.00 0.72 H new ATOM 0 HB2 SER A 77 0.668 -3.522 7.075 1.00 0.91 H new ATOM 0 HB3 SER A 77 -0.728 -2.971 7.979 1.00 0.91 H new ATOM 0 HG SER A 77 1.944 -2.470 8.407 1.00 1.58 H new ATOM 1240 N LEU A 78 0.193 -6.804 7.368 1.00 0.54 N ATOM 1241 CA LEU A 78 -0.263 -7.789 6.401 1.00 0.50 C ATOM 1242 C LEU A 78 -0.537 -9.109 7.094 1.00 0.53 C ATOM 1243 O LEU A 78 -0.305 -9.255 8.298 1.00 0.71 O ATOM 1244 CB LEU A 78 0.765 -8.003 5.277 1.00 0.45 C ATOM 1245 CG LEU A 78 0.881 -6.875 4.246 1.00 0.45 C ATOM 1246 CD1 LEU A 78 2.032 -7.140 3.269 1.00 0.49 C ATOM 1247 CD2 LEU A 78 -0.435 -6.721 3.497 1.00 0.51 C ATOM 0 H LEU A 78 1.121 -6.988 7.748 1.00 0.54 H new ATOM 0 HA LEU A 78 -1.181 -7.408 5.952 1.00 0.50 H new ATOM 0 HB2 LEU A 78 1.744 -8.154 5.732 1.00 0.45 H new ATOM 0 HB3 LEU A 78 0.512 -8.924 4.751 1.00 0.45 H new ATOM 0 HG LEU A 78 1.099 -5.945 4.772 1.00 0.45 H new ATOM 0 HD11 LEU A 78 2.092 -6.325 2.548 1.00 0.49 H new ATOM 0 HD12 LEU A 78 2.970 -7.207 3.821 1.00 0.49 H new ATOM 0 HD13 LEU A 78 1.854 -8.078 2.742 1.00 0.49 H new ATOM 0 HD21 LEU A 78 -0.346 -5.918 2.766 1.00 0.51 H new ATOM 0 HD22 LEU A 78 -0.673 -7.653 2.985 1.00 0.51 H new ATOM 0 HD23 LEU A 78 -1.230 -6.482 4.203 1.00 0.51 H new ATOM 1259 N GLN A 79 -1.021 -10.065 6.324 1.00 0.46 N ATOM 1260 CA GLN A 79 -1.404 -11.354 6.855 1.00 0.50 C ATOM 1261 C GLN A 79 -1.188 -12.431 5.809 1.00 0.48 C ATOM 1262 O GLN A 79 -0.300 -13.275 5.938 1.00 0.55 O ATOM 1263 CB GLN A 79 -2.876 -11.328 7.272 1.00 0.56 C ATOM 1264 CG GLN A 79 -3.107 -11.491 8.758 1.00 0.55 C ATOM 1265 CD GLN A 79 -2.593 -12.812 9.296 1.00 1.03 C ATOM 1266 OE1 GLN A 79 -2.590 -13.825 8.599 1.00 1.66 O ATOM 1267 NE2 GLN A 79 -2.143 -12.806 10.537 1.00 1.73 N ATOM 0 H GLN A 79 -1.158 -9.968 5.318 1.00 0.46 H new ATOM 0 HA GLN A 79 -0.788 -11.575 7.727 1.00 0.50 H new ATOM 0 HB2 GLN A 79 -3.316 -10.384 6.950 1.00 0.56 H new ATOM 0 HB3 GLN A 79 -3.404 -12.122 6.745 1.00 0.56 H new ATOM 0 HG2 GLN A 79 -2.617 -10.674 9.288 1.00 0.55 H new ATOM 0 HG3 GLN A 79 -4.174 -11.411 8.965 1.00 0.55 H new ATOM 0 HE21 GLN A 79 -2.163 -11.944 11.082 1.00 1.73 H new ATOM 0 HE22 GLN A 79 -1.775 -13.663 10.950 1.00 1.73 H new ATOM 1276 N VAL A 80 -1.988 -12.375 4.755 1.00 0.41 N ATOM 1277 CA VAL A 80 -1.992 -13.411 3.731 1.00 0.43 C ATOM 1278 C VAL A 80 -2.223 -12.783 2.362 1.00 0.39 C ATOM 1279 O VAL A 80 -3.070 -11.907 2.219 1.00 0.45 O ATOM 1280 CB VAL A 80 -3.105 -14.458 3.989 1.00 0.48 C ATOM 1281 CG1 VAL A 80 -2.996 -15.616 3.010 1.00 0.78 C ATOM 1282 CG2 VAL A 80 -3.079 -14.961 5.427 1.00 0.74 C ATOM 0 H VAL A 80 -2.648 -11.617 4.585 1.00 0.41 H new ATOM 0 HA VAL A 80 -1.024 -13.911 3.763 1.00 0.43 H new ATOM 0 HB VAL A 80 -4.063 -13.964 3.831 1.00 0.48 H new ATOM 0 HG11 VAL A 80 -3.788 -16.338 3.211 1.00 0.78 H new ATOM 0 HG12 VAL A 80 -3.096 -15.242 1.991 1.00 0.78 H new ATOM 0 HG13 VAL A 80 -2.026 -16.100 3.125 1.00 0.78 H new ATOM 0 HG21 VAL A 80 -3.873 -15.693 5.571 1.00 0.74 H new ATOM 0 HG22 VAL A 80 -2.115 -15.426 5.632 1.00 0.74 H new ATOM 0 HG23 VAL A 80 -3.230 -14.124 6.108 1.00 0.74 H new ATOM 1292 N TYR A 81 -1.464 -13.205 1.365 1.00 0.42 N ATOM 1293 CA TYR A 81 -1.669 -12.720 0.012 1.00 0.46 C ATOM 1294 C TYR A 81 -2.183 -13.852 -0.870 1.00 0.51 C ATOM 1295 O TYR A 81 -1.724 -14.991 -0.766 1.00 0.78 O ATOM 1296 CB TYR A 81 -0.356 -12.168 -0.549 1.00 0.74 C ATOM 1297 CG TYR A 81 -0.504 -11.394 -1.840 1.00 1.91 C ATOM 1298 CD1 TYR A 81 -0.804 -12.037 -3.031 1.00 2.02 C ATOM 1299 CD2 TYR A 81 -0.334 -10.016 -1.864 1.00 3.05 C ATOM 1300 CE1 TYR A 81 -0.932 -11.336 -4.209 1.00 3.15 C ATOM 1301 CE2 TYR A 81 -0.457 -9.308 -3.041 1.00 4.21 C ATOM 1302 CZ TYR A 81 -0.758 -9.974 -4.210 1.00 4.24 C ATOM 1303 OH TYR A 81 -0.874 -9.276 -5.383 1.00 5.40 O ATOM 0 H TYR A 81 -0.705 -13.878 1.466 1.00 0.42 H new ATOM 0 HA TYR A 81 -2.409 -11.920 0.027 1.00 0.46 H new ATOM 0 HB2 TYR A 81 0.100 -11.519 0.199 1.00 0.74 H new ATOM 0 HB3 TYR A 81 0.332 -12.997 -0.714 1.00 0.74 H new ATOM 0 HD1 TYR A 81 -0.940 -13.108 -3.035 1.00 2.02 H new ATOM 0 HD2 TYR A 81 -0.102 -9.492 -0.949 1.00 3.05 H new ATOM 0 HE1 TYR A 81 -1.168 -11.854 -5.127 1.00 3.15 H new ATOM 0 HE2 TYR A 81 -0.318 -8.237 -3.047 1.00 4.21 H new ATOM 0 HH TYR A 81 -1.174 -9.880 -6.095 1.00 5.40 H new ATOM 1313 N ASN A 82 -3.132 -13.527 -1.728 1.00 0.42 N ATOM 1314 CA ASN A 82 -3.658 -14.461 -2.701 1.00 0.46 C ATOM 1315 C ASN A 82 -3.825 -13.747 -4.026 1.00 0.44 C ATOM 1316 O ASN A 82 -4.601 -12.803 -4.142 1.00 0.45 O ATOM 1317 CB ASN A 82 -5.002 -15.049 -2.259 1.00 0.50 C ATOM 1318 CG ASN A 82 -4.876 -16.048 -1.127 1.00 0.93 C ATOM 1319 OD1 ASN A 82 -4.959 -15.693 0.048 1.00 1.69 O ATOM 1320 ND2 ASN A 82 -4.680 -17.311 -1.475 1.00 1.40 N ATOM 0 H ASN A 82 -3.561 -12.602 -1.768 1.00 0.42 H new ATOM 0 HA ASN A 82 -2.954 -15.288 -2.798 1.00 0.46 H new ATOM 0 HB2 ASN A 82 -5.660 -14.238 -1.947 1.00 0.50 H new ATOM 0 HB3 ASN A 82 -5.476 -15.535 -3.112 1.00 0.50 H new ATOM 0 HD21 ASN A 82 -4.592 -18.030 -0.757 1.00 1.40 H new ATOM 0 HD22 ASN A 82 -4.617 -17.564 -2.461 1.00 1.40 H new ATOM 1327 N MET A 83 -3.063 -14.167 -5.007 1.00 0.47 N ATOM 1328 CA MET A 83 -3.156 -13.592 -6.333 1.00 0.48 C ATOM 1329 C MET A 83 -4.414 -14.125 -7.011 1.00 0.47 C ATOM 1330 O MET A 83 -4.512 -15.318 -7.299 1.00 0.57 O ATOM 1331 CB MET A 83 -1.898 -13.956 -7.119 1.00 0.58 C ATOM 1332 CG MET A 83 -1.666 -13.113 -8.365 1.00 0.63 C ATOM 1333 SD MET A 83 -1.250 -11.403 -7.990 1.00 1.66 S ATOM 1334 CE MET A 83 0.444 -11.588 -7.440 1.00 2.05 C ATOM 0 H MET A 83 -2.368 -14.908 -4.914 1.00 0.47 H new ATOM 0 HA MET A 83 -3.226 -12.505 -6.285 1.00 0.48 H new ATOM 0 HB2 MET A 83 -1.033 -13.857 -6.463 1.00 0.58 H new ATOM 0 HB3 MET A 83 -1.958 -15.004 -7.411 1.00 0.58 H new ATOM 0 HG2 MET A 83 -0.862 -13.556 -8.952 1.00 0.63 H new ATOM 0 HG3 MET A 83 -2.563 -13.136 -8.984 1.00 0.63 H new ATOM 0 HE1 MET A 83 0.603 -10.988 -6.544 1.00 2.05 H new ATOM 0 HE2 MET A 83 0.641 -12.636 -7.215 1.00 2.05 H new ATOM 0 HE3 MET A 83 1.120 -11.252 -8.226 1.00 2.05 H new ATOM 1344 N VAL A 84 -5.378 -13.240 -7.249 1.00 0.38 N ATOM 1345 CA VAL A 84 -6.707 -13.668 -7.696 1.00 0.39 C ATOM 1346 C VAL A 84 -6.728 -13.821 -9.205 1.00 0.42 C ATOM 1347 O VAL A 84 -6.802 -14.930 -9.731 1.00 0.64 O ATOM 1348 CB VAL A 84 -7.834 -12.683 -7.277 1.00 0.38 C ATOM 1349 CG1 VAL A 84 -8.912 -13.382 -6.457 1.00 0.55 C ATOM 1350 CG2 VAL A 84 -7.284 -11.495 -6.511 1.00 0.42 C ATOM 0 H VAL A 84 -5.270 -12.231 -7.142 1.00 0.38 H new ATOM 0 HA VAL A 84 -6.901 -14.624 -7.209 1.00 0.39 H new ATOM 0 HB VAL A 84 -8.287 -12.315 -8.198 1.00 0.38 H new ATOM 0 HG11 VAL A 84 -9.683 -12.663 -6.182 1.00 0.55 H new ATOM 0 HG12 VAL A 84 -9.357 -14.183 -7.048 1.00 0.55 H new ATOM 0 HG13 VAL A 84 -8.468 -13.801 -5.554 1.00 0.55 H new ATOM 0 HG21 VAL A 84 -8.102 -10.829 -6.236 1.00 0.42 H new ATOM 0 HG22 VAL A 84 -6.781 -11.845 -5.609 1.00 0.42 H new ATOM 0 HG23 VAL A 84 -6.573 -10.956 -7.137 1.00 0.42 H new ATOM 1360 N HIS A 85 -6.649 -12.700 -9.895 1.00 0.30 N ATOM 1361 CA HIS A 85 -6.623 -12.703 -11.341 1.00 0.31 C ATOM 1362 C HIS A 85 -5.513 -11.796 -11.834 1.00 0.32 C ATOM 1363 O HIS A 85 -5.446 -10.624 -11.470 1.00 0.38 O ATOM 1364 CB HIS A 85 -7.971 -12.255 -11.909 1.00 0.37 C ATOM 1365 CG HIS A 85 -8.056 -12.348 -13.401 1.00 0.80 C ATOM 1366 ND1 HIS A 85 -8.195 -13.544 -14.070 1.00 1.36 N ATOM 1367 CD2 HIS A 85 -8.009 -11.390 -14.355 1.00 1.71 C ATOM 1368 CE1 HIS A 85 -8.226 -13.318 -15.369 1.00 1.75 C ATOM 1369 NE2 HIS A 85 -8.117 -12.020 -15.569 1.00 1.96 N ATOM 0 H HIS A 85 -6.602 -11.772 -9.473 1.00 0.30 H new ATOM 0 HA HIS A 85 -6.433 -13.719 -11.686 1.00 0.31 H new ATOM 0 HB2 HIS A 85 -8.761 -12.865 -11.470 1.00 0.37 H new ATOM 0 HB3 HIS A 85 -8.158 -11.225 -11.607 1.00 0.37 H new ATOM 0 HD2 HIS A 85 -7.906 -10.327 -14.191 1.00 1.71 H new ATOM 0 HE1 HIS A 85 -8.324 -14.069 -16.139 1.00 1.75 H new ATOM 0 HE2 HIS A 85 -8.113 -11.559 -16.479 1.00 1.96 H new ATOM 1378 N ARG A 86 -4.637 -12.347 -12.646 1.00 0.34 N ATOM 1379 CA ARG A 86 -3.536 -11.590 -13.204 1.00 0.36 C ATOM 1380 C ARG A 86 -3.870 -11.223 -14.638 1.00 0.38 C ATOM 1381 O ARG A 86 -4.269 -12.076 -15.427 1.00 0.52 O ATOM 1382 CB ARG A 86 -2.252 -12.412 -13.152 1.00 0.40 C ATOM 1383 CG ARG A 86 -2.123 -13.269 -11.902 1.00 0.45 C ATOM 1384 CD ARG A 86 -0.763 -13.948 -11.850 1.00 0.69 C ATOM 1385 NE ARG A 86 -0.676 -14.936 -10.777 1.00 1.15 N ATOM 1386 CZ ARG A 86 0.470 -15.368 -10.252 1.00 1.68 C ATOM 1387 NH1 ARG A 86 1.632 -14.906 -10.704 1.00 1.98 N ATOM 1388 NH2 ARG A 86 0.454 -16.269 -9.277 1.00 2.44 N ATOM 0 H ARG A 86 -4.666 -13.324 -12.937 1.00 0.34 H new ATOM 0 HA ARG A 86 -3.382 -10.682 -12.622 1.00 0.36 H new ATOM 0 HB2 ARG A 86 -2.209 -13.057 -14.030 1.00 0.40 H new ATOM 0 HB3 ARG A 86 -1.397 -11.738 -13.209 1.00 0.40 H new ATOM 0 HG2 ARG A 86 -2.259 -12.650 -11.015 1.00 0.45 H new ATOM 0 HG3 ARG A 86 -2.911 -14.022 -11.889 1.00 0.45 H new ATOM 0 HD2 ARG A 86 -0.566 -14.434 -12.805 1.00 0.69 H new ATOM 0 HD3 ARG A 86 0.012 -13.194 -11.710 1.00 0.69 H new ATOM 0 HE ARG A 86 -1.546 -15.319 -10.407 1.00 1.15 H new ATOM 0 HH11 ARG A 86 1.649 -14.217 -11.456 1.00 1.98 H new ATOM 0 HH12 ARG A 86 2.506 -15.240 -10.298 1.00 1.98 H new ATOM 0 HH21 ARG A 86 -0.435 -16.630 -8.931 1.00 2.44 H new ATOM 0 HH22 ARG A 86 1.331 -16.600 -8.874 1.00 2.44 H new ATOM 1402 N ILE A 87 -3.734 -9.954 -14.966 1.00 0.35 N ATOM 1403 CA ILE A 87 -4.100 -9.473 -16.288 1.00 0.36 C ATOM 1404 C ILE A 87 -2.894 -9.533 -17.196 1.00 0.39 C ATOM 1405 O ILE A 87 -2.991 -9.888 -18.370 1.00 0.47 O ATOM 1406 CB ILE A 87 -4.629 -8.019 -16.278 1.00 0.38 C ATOM 1407 CG1 ILE A 87 -4.802 -7.471 -14.849 1.00 0.32 C ATOM 1408 CG2 ILE A 87 -5.935 -7.942 -17.048 1.00 0.44 C ATOM 1409 CD1 ILE A 87 -5.846 -8.175 -14.006 1.00 0.27 C ATOM 0 H ILE A 87 -3.373 -9.236 -14.338 1.00 0.35 H new ATOM 0 HA ILE A 87 -4.903 -10.118 -16.645 1.00 0.36 H new ATOM 0 HB ILE A 87 -3.885 -7.390 -16.767 1.00 0.38 H new ATOM 0 HG12 ILE A 87 -3.843 -7.533 -14.336 1.00 0.32 H new ATOM 0 HG13 ILE A 87 -5.062 -6.414 -14.912 1.00 0.32 H new ATOM 0 HG21 ILE A 87 -6.303 -6.916 -17.038 1.00 0.44 H new ATOM 0 HG22 ILE A 87 -5.769 -8.258 -18.078 1.00 0.44 H new ATOM 0 HG23 ILE A 87 -6.671 -8.596 -16.582 1.00 0.44 H new ATOM 0 HD11 ILE A 87 -5.889 -7.713 -13.020 1.00 0.27 H new ATOM 0 HD12 ILE A 87 -6.820 -8.092 -14.488 1.00 0.27 H new ATOM 0 HD13 ILE A 87 -5.581 -9.227 -13.903 1.00 0.27 H new ATOM 1421 N ASP A 88 -1.754 -9.193 -16.630 1.00 0.42 N ATOM 1422 CA ASP A 88 -0.505 -9.198 -17.362 1.00 0.56 C ATOM 1423 C ASP A 88 0.629 -9.486 -16.392 1.00 0.67 C ATOM 1424 O ASP A 88 0.384 -9.833 -15.234 1.00 1.18 O ATOM 1425 CB ASP A 88 -0.288 -7.845 -18.050 1.00 0.65 C ATOM 1426 CG ASP A 88 0.544 -7.955 -19.313 1.00 1.16 C ATOM 1427 OD1 ASP A 88 1.750 -8.257 -19.205 1.00 1.86 O ATOM 1428 OD2 ASP A 88 0.001 -7.748 -20.414 1.00 1.35 O ATOM 0 H ASP A 88 -1.668 -8.907 -15.655 1.00 0.42 H new ATOM 0 HA ASP A 88 -0.533 -9.969 -18.132 1.00 0.56 H new ATOM 0 HB2 ASP A 88 -1.256 -7.408 -18.295 1.00 0.65 H new ATOM 0 HB3 ASP A 88 0.203 -7.164 -17.355 1.00 0.65 H new ATOM 1433 N SER A 89 1.856 -9.318 -16.839 1.00 0.65 N ATOM 1434 CA SER A 89 3.012 -9.560 -15.998 1.00 0.70 C ATOM 1435 C SER A 89 3.267 -8.372 -15.075 1.00 0.53 C ATOM 1436 O SER A 89 4.152 -8.416 -14.217 1.00 0.59 O ATOM 1437 CB SER A 89 4.236 -9.821 -16.870 1.00 0.94 C ATOM 1438 OG SER A 89 3.995 -10.892 -17.773 1.00 1.44 O ATOM 0 H SER A 89 2.080 -9.013 -17.786 1.00 0.65 H new ATOM 0 HA SER A 89 2.817 -10.436 -15.379 1.00 0.70 H new ATOM 0 HB2 SER A 89 4.489 -8.919 -17.428 1.00 0.94 H new ATOM 0 HB3 SER A 89 5.093 -10.057 -16.240 1.00 0.94 H new ATOM 0 HG SER A 89 4.792 -11.041 -18.324 1.00 1.44 H new ATOM 1444 N ASP A 90 2.483 -7.310 -15.244 1.00 0.47 N ATOM 1445 CA ASP A 90 2.654 -6.112 -14.440 1.00 0.48 C ATOM 1446 C ASP A 90 1.308 -5.609 -13.975 1.00 0.39 C ATOM 1447 O ASP A 90 1.188 -4.482 -13.498 1.00 0.41 O ATOM 1448 CB ASP A 90 3.360 -5.006 -15.232 1.00 0.73 C ATOM 1449 CG ASP A 90 4.754 -5.391 -15.673 1.00 1.21 C ATOM 1450 OD1 ASP A 90 5.668 -5.409 -14.824 1.00 1.70 O ATOM 1451 OD2 ASP A 90 4.942 -5.682 -16.874 1.00 1.87 O ATOM 0 H ASP A 90 1.728 -7.258 -15.928 1.00 0.47 H new ATOM 0 HA ASP A 90 3.272 -6.371 -13.581 1.00 0.48 H new ATOM 0 HB2 ASP A 90 2.763 -4.758 -16.110 1.00 0.73 H new ATOM 0 HB3 ASP A 90 3.415 -4.106 -14.619 1.00 0.73 H new ATOM 1456 N THR A 91 0.282 -6.435 -14.117 1.00 0.35 N ATOM 1457 CA THR A 91 -1.044 -6.023 -13.769 1.00 0.32 C ATOM 1458 C THR A 91 -1.746 -7.164 -13.066 1.00 0.28 C ATOM 1459 O THR A 91 -2.032 -8.198 -13.669 1.00 0.30 O ATOM 1460 CB THR A 91 -1.829 -5.607 -15.023 1.00 0.36 C ATOM 1461 OG1 THR A 91 -0.928 -5.063 -15.998 1.00 0.46 O ATOM 1462 CG2 THR A 91 -2.875 -4.567 -14.682 1.00 0.35 C ATOM 0 H THR A 91 0.355 -7.389 -14.471 1.00 0.35 H new ATOM 0 HA THR A 91 -0.990 -5.161 -13.104 1.00 0.32 H new ATOM 0 HB THR A 91 -2.326 -6.490 -15.424 1.00 0.36 H new ATOM 0 HG1 THR A 91 -1.072 -5.507 -16.860 1.00 0.46 H new ATOM 0 HG21 THR A 91 -3.418 -4.288 -15.585 1.00 0.35 H new ATOM 0 HG22 THR A 91 -3.572 -4.978 -13.952 1.00 0.35 H new ATOM 0 HG23 THR A 91 -2.389 -3.686 -14.264 1.00 0.35 H new ATOM 1470 N PHE A 92 -1.991 -6.985 -11.786 1.00 0.25 N ATOM 1471 CA PHE A 92 -2.529 -8.046 -10.966 1.00 0.25 C ATOM 1472 C PHE A 92 -3.739 -7.559 -10.209 1.00 0.22 C ATOM 1473 O PHE A 92 -4.124 -6.398 -10.312 1.00 0.21 O ATOM 1474 CB PHE A 92 -1.494 -8.514 -9.946 1.00 0.30 C ATOM 1475 CG PHE A 92 -0.163 -8.862 -10.531 1.00 0.32 C ATOM 1476 CD1 PHE A 92 0.795 -7.882 -10.716 1.00 0.33 C ATOM 1477 CD2 PHE A 92 0.132 -10.161 -10.885 1.00 0.39 C ATOM 1478 CE1 PHE A 92 2.026 -8.189 -11.247 1.00 0.38 C ATOM 1479 CE2 PHE A 92 1.359 -10.483 -11.416 1.00 0.43 C ATOM 1480 CZ PHE A 92 2.314 -9.495 -11.600 1.00 0.41 C ATOM 0 H PHE A 92 -1.825 -6.110 -11.290 1.00 0.25 H new ATOM 0 HA PHE A 92 -2.801 -8.869 -11.627 1.00 0.25 H new ATOM 0 HB2 PHE A 92 -1.356 -7.730 -9.201 1.00 0.30 H new ATOM 0 HB3 PHE A 92 -1.886 -9.386 -9.423 1.00 0.30 H new ATOM 0 HD1 PHE A 92 0.574 -6.862 -10.440 1.00 0.33 H new ATOM 0 HD2 PHE A 92 -0.609 -10.934 -10.744 1.00 0.39 H new ATOM 0 HE1 PHE A 92 2.765 -7.414 -11.388 1.00 0.38 H new ATOM 0 HE2 PHE A 92 1.578 -11.505 -11.689 1.00 0.43 H new ATOM 0 HZ PHE A 92 3.279 -9.744 -12.017 1.00 0.41 H new ATOM 1490 N ILE A 93 -4.325 -8.451 -9.444 1.00 0.23 N ATOM 1491 CA ILE A 93 -5.345 -8.082 -8.493 1.00 0.23 C ATOM 1492 C ILE A 93 -5.024 -8.753 -7.165 1.00 0.28 C ATOM 1493 O ILE A 93 -4.834 -9.972 -7.106 1.00 0.33 O ATOM 1494 CB ILE A 93 -6.755 -8.474 -8.977 1.00 0.23 C ATOM 1495 CG1 ILE A 93 -6.993 -7.977 -10.401 1.00 0.24 C ATOM 1496 CG2 ILE A 93 -7.807 -7.895 -8.049 1.00 0.26 C ATOM 1497 CD1 ILE A 93 -8.334 -8.375 -10.959 1.00 0.41 C ATOM 0 H ILE A 93 -4.109 -9.448 -9.464 1.00 0.23 H new ATOM 0 HA ILE A 93 -5.349 -6.998 -8.378 1.00 0.23 H new ATOM 0 HB ILE A 93 -6.829 -9.561 -8.969 1.00 0.23 H new ATOM 0 HG12 ILE A 93 -6.910 -6.890 -10.417 1.00 0.24 H new ATOM 0 HG13 ILE A 93 -6.208 -8.367 -11.049 1.00 0.24 H new ATOM 0 HG21 ILE A 93 -8.799 -8.179 -8.401 1.00 0.26 H new ATOM 0 HG22 ILE A 93 -7.656 -8.282 -7.041 1.00 0.26 H new ATOM 0 HG23 ILE A 93 -7.723 -6.808 -8.037 1.00 0.26 H new ATOM 0 HD11 ILE A 93 -8.435 -7.989 -11.973 1.00 0.41 H new ATOM 0 HD12 ILE A 93 -8.413 -9.462 -10.975 1.00 0.41 H new ATOM 0 HD13 ILE A 93 -9.125 -7.963 -10.333 1.00 0.41 H new ATOM 1509 N CYS A 94 -4.923 -7.952 -6.118 1.00 0.36 N ATOM 1510 CA CYS A 94 -4.455 -8.428 -4.825 1.00 0.48 C ATOM 1511 C CYS A 94 -5.600 -8.862 -3.924 1.00 0.39 C ATOM 1512 O CYS A 94 -6.341 -8.025 -3.427 1.00 0.47 O ATOM 1513 CB CYS A 94 -3.670 -7.319 -4.118 1.00 0.74 C ATOM 1514 SG CYS A 94 -2.196 -6.769 -4.999 1.00 2.01 S ATOM 0 H CYS A 94 -5.161 -6.960 -6.138 1.00 0.36 H new ATOM 0 HA CYS A 94 -3.819 -9.294 -5.012 1.00 0.48 H new ATOM 0 HB2 CYS A 94 -4.329 -6.464 -3.968 1.00 0.74 H new ATOM 0 HB3 CYS A 94 -3.377 -7.672 -3.129 1.00 0.74 H new ATOM 0 HG CYS A 94 -1.455 -7.797 -5.289 1.00 2.01 H new ATOM 1520 N HIS A 95 -5.747 -10.165 -3.720 1.00 0.37 N ATOM 1521 CA HIS A 95 -6.585 -10.666 -2.638 1.00 0.36 C ATOM 1522 C HIS A 95 -5.732 -10.749 -1.382 1.00 0.39 C ATOM 1523 O HIS A 95 -5.192 -11.797 -1.035 1.00 0.56 O ATOM 1524 CB HIS A 95 -7.212 -12.022 -2.988 1.00 0.41 C ATOM 1525 CG HIS A 95 -8.025 -12.645 -1.885 1.00 0.50 C ATOM 1526 ND1 HIS A 95 -8.760 -11.922 -0.968 1.00 1.20 N ATOM 1527 CD2 HIS A 95 -8.210 -13.947 -1.562 1.00 1.23 C ATOM 1528 CE1 HIS A 95 -9.357 -12.753 -0.137 1.00 0.99 C ATOM 1529 NE2 HIS A 95 -9.041 -13.985 -0.475 1.00 0.95 N ATOM 0 H HIS A 95 -5.301 -10.889 -4.284 1.00 0.37 H new ATOM 0 HA HIS A 95 -7.419 -9.984 -2.472 1.00 0.36 H new ATOM 0 HB2 HIS A 95 -7.849 -11.897 -3.864 1.00 0.41 H new ATOM 0 HB3 HIS A 95 -6.417 -12.713 -3.269 1.00 0.41 H new ATOM 0 HD1 HIS A 95 -8.830 -10.905 -0.938 1.00 1.20 H new ATOM 0 HD2 HIS A 95 -7.781 -14.799 -2.069 1.00 1.23 H new ATOM 0 HE1 HIS A 95 -9.999 -12.470 0.684 1.00 0.99 H new ATOM 1538 N THR A 96 -5.593 -9.613 -0.736 1.00 0.35 N ATOM 1539 CA THR A 96 -4.670 -9.450 0.361 1.00 0.38 C ATOM 1540 C THR A 96 -5.392 -9.336 1.692 1.00 0.36 C ATOM 1541 O THR A 96 -6.084 -8.348 1.948 1.00 0.41 O ATOM 1542 CB THR A 96 -3.825 -8.185 0.143 1.00 0.43 C ATOM 1543 OG1 THR A 96 -3.138 -8.282 -1.110 1.00 0.50 O ATOM 1544 CG2 THR A 96 -2.815 -7.996 1.268 1.00 0.47 C ATOM 0 H THR A 96 -6.122 -8.770 -0.960 1.00 0.35 H new ATOM 0 HA THR A 96 -4.033 -10.334 0.390 1.00 0.38 H new ATOM 0 HB THR A 96 -4.492 -7.323 0.137 1.00 0.43 H new ATOM 0 HG1 THR A 96 -2.354 -8.861 -1.009 1.00 0.50 H new ATOM 0 HG21 THR A 96 -2.232 -7.093 1.086 1.00 0.47 H new ATOM 0 HG22 THR A 96 -3.342 -7.903 2.218 1.00 0.47 H new ATOM 0 HG23 THR A 96 -2.148 -8.857 1.306 1.00 0.47 H new ATOM 1552 N ILE A 97 -5.218 -10.330 2.546 1.00 0.38 N ATOM 1553 CA ILE A 97 -5.742 -10.244 3.887 1.00 0.40 C ATOM 1554 C ILE A 97 -4.821 -9.349 4.701 1.00 0.41 C ATOM 1555 O ILE A 97 -3.618 -9.600 4.814 1.00 0.42 O ATOM 1556 CB ILE A 97 -5.900 -11.612 4.595 1.00 0.47 C ATOM 1557 CG1 ILE A 97 -6.895 -12.530 3.861 1.00 0.56 C ATOM 1558 CG2 ILE A 97 -6.380 -11.377 6.020 1.00 0.51 C ATOM 1559 CD1 ILE A 97 -6.389 -13.112 2.553 1.00 1.03 C ATOM 0 H ILE A 97 -4.722 -11.195 2.333 1.00 0.38 H new ATOM 0 HA ILE A 97 -6.749 -9.832 3.814 1.00 0.40 H new ATOM 0 HB ILE A 97 -4.931 -12.110 4.592 1.00 0.47 H new ATOM 0 HG12 ILE A 97 -7.166 -13.351 4.525 1.00 0.56 H new ATOM 0 HG13 ILE A 97 -7.806 -11.966 3.662 1.00 0.56 H new ATOM 0 HG21 ILE A 97 -6.495 -12.335 6.528 1.00 0.51 H new ATOM 0 HG22 ILE A 97 -5.650 -10.768 6.554 1.00 0.51 H new ATOM 0 HG23 ILE A 97 -7.339 -10.860 6.000 1.00 0.51 H new ATOM 0 HD11 ILE A 97 -7.161 -13.743 2.113 1.00 1.03 H new ATOM 0 HD12 ILE A 97 -6.146 -12.303 1.864 1.00 1.03 H new ATOM 0 HD13 ILE A 97 -5.496 -13.708 2.741 1.00 1.03 H new ATOM 1571 N THR A 98 -5.398 -8.297 5.230 1.00 0.49 N ATOM 1572 CA THR A 98 -4.661 -7.237 5.878 1.00 0.56 C ATOM 1573 C THR A 98 -4.930 -7.231 7.382 1.00 0.63 C ATOM 1574 O THR A 98 -6.017 -7.596 7.834 1.00 0.77 O ATOM 1575 CB THR A 98 -5.064 -5.896 5.239 1.00 0.71 C ATOM 1576 OG1 THR A 98 -4.684 -5.897 3.860 1.00 1.38 O ATOM 1577 CG2 THR A 98 -4.438 -4.711 5.944 1.00 0.86 C ATOM 0 H THR A 98 -6.407 -8.150 5.223 1.00 0.49 H new ATOM 0 HA THR A 98 -3.591 -7.397 5.742 1.00 0.56 H new ATOM 0 HB THR A 98 -6.145 -5.793 5.335 1.00 0.71 H new ATOM 0 HG1 THR A 98 -5.067 -5.113 3.415 1.00 1.38 H new ATOM 0 HG21 THR A 98 -4.753 -3.789 5.455 1.00 0.86 H new ATOM 0 HG22 THR A 98 -4.758 -4.697 6.986 1.00 0.86 H new ATOM 0 HG23 THR A 98 -3.352 -4.793 5.899 1.00 0.86 H new ATOM 1585 N GLN A 99 -3.945 -6.806 8.149 1.00 0.59 N ATOM 1586 CA GLN A 99 -4.037 -6.824 9.594 1.00 0.72 C ATOM 1587 C GLN A 99 -3.979 -5.406 10.152 1.00 0.99 C ATOM 1588 O GLN A 99 -3.111 -5.077 10.963 1.00 1.32 O ATOM 1589 CB GLN A 99 -2.906 -7.661 10.191 1.00 0.61 C ATOM 1590 CG GLN A 99 -3.360 -8.489 11.378 1.00 0.80 C ATOM 1591 CD GLN A 99 -2.223 -9.208 12.074 1.00 1.04 C ATOM 1592 OE1 GLN A 99 -1.904 -10.351 11.752 1.00 1.62 O ATOM 1593 NE2 GLN A 99 -1.600 -8.541 13.031 1.00 1.82 N ATOM 0 H GLN A 99 -3.063 -6.440 7.790 1.00 0.59 H new ATOM 0 HA GLN A 99 -4.992 -7.272 9.868 1.00 0.72 H new ATOM 0 HB2 GLN A 99 -2.504 -8.322 9.424 1.00 0.61 H new ATOM 0 HB3 GLN A 99 -2.095 -7.002 10.501 1.00 0.61 H new ATOM 0 HG2 GLN A 99 -3.863 -7.840 12.094 1.00 0.80 H new ATOM 0 HG3 GLN A 99 -4.093 -9.222 11.042 1.00 0.80 H new ATOM 0 HE21 GLN A 99 -1.896 -7.594 13.268 1.00 1.82 H new ATOM 0 HE22 GLN A 99 -0.824 -8.974 13.532 1.00 1.82 H new ATOM 1677 N ILE A 106 -10.902 -2.824 14.870 1.00 1.05 N ATOM 1678 CA ILE A 106 -10.814 -3.206 13.477 1.00 0.96 C ATOM 1679 C ILE A 106 -10.503 -4.686 13.365 1.00 0.94 C ATOM 1680 O ILE A 106 -9.472 -5.145 13.859 1.00 1.12 O ATOM 1681 CB ILE A 106 -9.711 -2.416 12.752 1.00 0.93 C ATOM 1682 CG1 ILE A 106 -9.877 -0.917 13.000 1.00 1.01 C ATOM 1683 CG2 ILE A 106 -9.733 -2.719 11.259 1.00 0.98 C ATOM 1684 CD1 ILE A 106 -8.693 -0.099 12.547 1.00 0.94 C ATOM 0 HA ILE A 106 -11.774 -2.985 13.011 1.00 0.96 H new ATOM 0 HB ILE A 106 -8.745 -2.725 13.150 1.00 0.93 H new ATOM 0 HG12 ILE A 106 -10.770 -0.567 12.482 1.00 1.01 H new ATOM 0 HG13 ILE A 106 -10.040 -0.748 14.065 1.00 1.01 H new ATOM 0 HG21 ILE A 106 -8.946 -2.152 10.761 1.00 0.98 H new ATOM 0 HG22 ILE A 106 -9.567 -3.785 11.102 1.00 0.98 H new ATOM 0 HG23 ILE A 106 -10.701 -2.437 10.845 1.00 0.98 H new ATOM 0 HD11 ILE A 106 -8.879 0.955 12.753 1.00 0.94 H new ATOM 0 HD12 ILE A 106 -7.801 -0.422 13.084 1.00 0.94 H new ATOM 0 HD13 ILE A 106 -8.543 -0.238 11.476 1.00 0.94 H new ATOM 1696 N SER A 107 -11.401 -5.428 12.747 1.00 0.84 N ATOM 1697 CA SER A 107 -11.166 -6.832 12.473 1.00 0.86 C ATOM 1698 C SER A 107 -10.224 -6.964 11.279 1.00 0.79 C ATOM 1699 O SER A 107 -10.124 -6.036 10.471 1.00 0.77 O ATOM 1700 CB SER A 107 -12.499 -7.526 12.183 1.00 0.97 C ATOM 1701 OG SER A 107 -13.425 -7.303 13.234 1.00 1.35 O ATOM 0 H SER A 107 -12.304 -5.080 12.424 1.00 0.84 H new ATOM 0 HA SER A 107 -10.705 -7.307 13.339 1.00 0.86 H new ATOM 0 HB2 SER A 107 -12.911 -7.154 11.245 1.00 0.97 H new ATOM 0 HB3 SER A 107 -12.336 -8.596 12.057 1.00 0.97 H new ATOM 0 HG SER A 107 -14.270 -7.754 13.027 1.00 1.35 H new ATOM 1707 N PRO A 108 -9.488 -8.090 11.175 1.00 0.82 N ATOM 1708 CA PRO A 108 -8.651 -8.383 10.009 1.00 0.82 C ATOM 1709 C PRO A 108 -9.394 -8.084 8.714 1.00 0.73 C ATOM 1710 O PRO A 108 -10.468 -8.631 8.460 1.00 0.81 O ATOM 1711 CB PRO A 108 -8.373 -9.877 10.148 1.00 0.91 C ATOM 1712 CG PRO A 108 -8.396 -10.119 11.618 1.00 1.07 C ATOM 1713 CD PRO A 108 -9.406 -9.156 12.190 1.00 0.92 C ATOM 0 HA PRO A 108 -7.744 -7.780 9.971 1.00 0.82 H new ATOM 0 HB2 PRO A 108 -9.129 -10.472 9.635 1.00 0.91 H new ATOM 0 HB3 PRO A 108 -7.409 -10.144 9.716 1.00 0.91 H new ATOM 0 HG2 PRO A 108 -8.674 -11.150 11.838 1.00 1.07 H new ATOM 0 HG3 PRO A 108 -7.411 -9.954 12.055 1.00 1.07 H new ATOM 0 HD2 PRO A 108 -10.372 -9.635 12.346 1.00 0.92 H new ATOM 0 HD3 PRO A 108 -9.084 -8.765 13.156 1.00 0.92 H new ATOM 1721 N ARG A 109 -8.820 -7.226 7.893 1.00 0.61 N ATOM 1722 CA ARG A 109 -9.555 -6.664 6.777 1.00 0.56 C ATOM 1723 C ARG A 109 -8.894 -7.046 5.476 1.00 0.52 C ATOM 1724 O ARG A 109 -7.683 -7.002 5.359 1.00 0.66 O ATOM 1725 CB ARG A 109 -9.661 -5.142 6.926 1.00 0.64 C ATOM 1726 CG ARG A 109 -10.171 -4.430 5.688 1.00 1.05 C ATOM 1727 CD ARG A 109 -10.679 -3.042 6.026 1.00 0.88 C ATOM 1728 NE ARG A 109 -9.614 -2.195 6.567 1.00 1.89 N ATOM 1729 CZ ARG A 109 -9.820 -1.156 7.379 1.00 2.34 C ATOM 1730 NH1 ARG A 109 -11.060 -0.790 7.701 1.00 2.06 N ATOM 1731 NH2 ARG A 109 -8.781 -0.485 7.863 1.00 3.45 N ATOM 0 H ARG A 109 -7.855 -6.905 7.976 1.00 0.61 H new ATOM 0 HA ARG A 109 -10.566 -7.070 6.772 1.00 0.56 H new ATOM 0 HB2 ARG A 109 -10.324 -4.915 7.761 1.00 0.64 H new ATOM 0 HB3 ARG A 109 -8.679 -4.744 7.182 1.00 0.64 H new ATOM 0 HG2 ARG A 109 -9.371 -4.358 4.951 1.00 1.05 H new ATOM 0 HG3 ARG A 109 -10.972 -5.013 5.234 1.00 1.05 H new ATOM 0 HD2 ARG A 109 -11.094 -2.578 5.131 1.00 0.88 H new ATOM 0 HD3 ARG A 109 -11.489 -3.117 6.752 1.00 0.88 H new ATOM 0 HE ARG A 109 -8.652 -2.413 6.306 1.00 1.89 H new ATOM 0 HH11 ARG A 109 -11.857 -1.305 7.327 1.00 2.06 H new ATOM 0 HH12 ARG A 109 -11.212 0.005 8.322 1.00 2.06 H new ATOM 0 HH21 ARG A 109 -7.832 -0.765 7.614 1.00 3.45 H new ATOM 0 HH22 ARG A 109 -8.932 0.310 8.484 1.00 3.45 H new ATOM 1745 N ASP A 110 -9.689 -7.412 4.500 1.00 0.46 N ATOM 1746 CA ASP A 110 -9.156 -7.965 3.273 1.00 0.47 C ATOM 1747 C ASP A 110 -9.279 -6.968 2.141 1.00 0.44 C ATOM 1748 O ASP A 110 -10.210 -6.164 2.109 1.00 0.64 O ATOM 1749 CB ASP A 110 -9.870 -9.264 2.911 1.00 0.62 C ATOM 1750 CG ASP A 110 -9.289 -9.912 1.673 1.00 0.83 C ATOM 1751 OD1 ASP A 110 -8.310 -10.668 1.799 1.00 1.37 O ATOM 1752 OD2 ASP A 110 -9.795 -9.654 0.572 1.00 1.32 O ATOM 0 H ASP A 110 -10.706 -7.338 4.529 1.00 0.46 H new ATOM 0 HA ASP A 110 -8.100 -8.183 3.431 1.00 0.47 H new ATOM 0 HB2 ASP A 110 -9.802 -9.959 3.748 1.00 0.62 H new ATOM 0 HB3 ASP A 110 -10.929 -9.061 2.750 1.00 0.62 H new ATOM 1757 N PHE A 111 -8.334 -7.004 1.228 1.00 0.39 N ATOM 1758 CA PHE A 111 -8.362 -6.111 0.086 1.00 0.43 C ATOM 1759 C PHE A 111 -8.443 -6.880 -1.224 1.00 0.41 C ATOM 1760 O PHE A 111 -8.044 -8.041 -1.311 1.00 0.54 O ATOM 1761 CB PHE A 111 -7.124 -5.210 0.052 1.00 0.61 C ATOM 1762 CG PHE A 111 -7.020 -4.238 1.197 1.00 0.94 C ATOM 1763 CD1 PHE A 111 -8.146 -3.604 1.702 1.00 1.36 C ATOM 1764 CD2 PHE A 111 -5.787 -3.947 1.756 1.00 1.60 C ATOM 1765 CE1 PHE A 111 -8.040 -2.702 2.744 1.00 2.01 C ATOM 1766 CE2 PHE A 111 -5.677 -3.046 2.797 1.00 2.30 C ATOM 1767 CZ PHE A 111 -6.805 -2.423 3.293 1.00 2.41 C ATOM 0 H PHE A 111 -7.537 -7.640 1.252 1.00 0.39 H new ATOM 0 HA PHE A 111 -9.255 -5.496 0.196 1.00 0.43 H new ATOM 0 HB2 PHE A 111 -6.234 -5.839 0.046 1.00 0.61 H new ATOM 0 HB3 PHE A 111 -7.125 -4.650 -0.883 1.00 0.61 H new ATOM 0 HD1 PHE A 111 -9.115 -3.817 1.277 1.00 1.36 H new ATOM 0 HD2 PHE A 111 -4.900 -4.431 1.373 1.00 1.60 H new ATOM 0 HE1 PHE A 111 -8.924 -2.215 3.129 1.00 2.01 H new ATOM 0 HE2 PHE A 111 -4.709 -2.829 3.223 1.00 2.30 H new ATOM 0 HZ PHE A 111 -6.721 -1.719 4.108 1.00 2.41 H new ATOM 1777 N ILE A 112 -8.967 -6.198 -2.226 1.00 0.34 N ATOM 1778 CA ILE A 112 -8.953 -6.660 -3.608 1.00 0.33 C ATOM 1779 C ILE A 112 -8.566 -5.485 -4.479 1.00 0.35 C ATOM 1780 O ILE A 112 -9.411 -4.845 -5.113 1.00 0.43 O ATOM 1781 CB ILE A 112 -10.300 -7.216 -4.132 1.00 0.34 C ATOM 1782 CG1 ILE A 112 -10.817 -8.369 -3.280 1.00 0.40 C ATOM 1783 CG2 ILE A 112 -10.119 -7.685 -5.557 1.00 0.36 C ATOM 1784 CD1 ILE A 112 -9.954 -9.603 -3.350 1.00 0.42 C ATOM 0 H ILE A 112 -9.422 -5.293 -2.104 1.00 0.34 H new ATOM 0 HA ILE A 112 -8.248 -7.490 -3.647 1.00 0.33 H new ATOM 0 HB ILE A 112 -11.037 -6.414 -4.080 1.00 0.34 H new ATOM 0 HG12 ILE A 112 -10.885 -8.042 -2.243 1.00 0.40 H new ATOM 0 HG13 ILE A 112 -11.827 -8.623 -3.601 1.00 0.40 H new ATOM 0 HG21 ILE A 112 -11.063 -8.078 -5.933 1.00 0.36 H new ATOM 0 HG22 ILE A 112 -9.801 -6.848 -6.178 1.00 0.36 H new ATOM 0 HG23 ILE A 112 -9.362 -8.468 -5.589 1.00 0.36 H new ATOM 0 HD11 ILE A 112 -10.382 -10.382 -2.720 1.00 0.42 H new ATOM 0 HD12 ILE A 112 -9.906 -9.955 -4.380 1.00 0.42 H new ATOM 0 HD13 ILE A 112 -8.949 -9.365 -3.001 1.00 0.42 H new ATOM 1796 N ASP A 113 -7.297 -5.177 -4.479 1.00 0.36 N ATOM 1797 CA ASP A 113 -6.814 -4.028 -5.204 1.00 0.42 C ATOM 1798 C ASP A 113 -6.240 -4.444 -6.535 1.00 0.33 C ATOM 1799 O ASP A 113 -5.320 -5.259 -6.594 1.00 0.35 O ATOM 1800 CB ASP A 113 -5.763 -3.282 -4.391 1.00 0.58 C ATOM 1801 CG ASP A 113 -6.374 -2.306 -3.404 1.00 1.23 C ATOM 1802 OD1 ASP A 113 -6.597 -1.142 -3.786 1.00 1.86 O ATOM 1803 OD2 ASP A 113 -6.630 -2.702 -2.247 1.00 1.32 O ATOM 0 H ASP A 113 -6.577 -5.705 -3.985 1.00 0.36 H new ATOM 0 HA ASP A 113 -7.657 -3.360 -5.380 1.00 0.42 H new ATOM 0 HB2 ASP A 113 -5.148 -4.002 -3.851 1.00 0.58 H new ATOM 0 HB3 ASP A 113 -5.101 -2.742 -5.068 1.00 0.58 H new ATOM 1808 N LEU A 114 -6.806 -3.915 -7.605 1.00 0.28 N ATOM 1809 CA LEU A 114 -6.230 -4.108 -8.914 1.00 0.23 C ATOM 1810 C LEU A 114 -5.020 -3.230 -9.060 1.00 0.22 C ATOM 1811 O LEU A 114 -5.093 -2.011 -8.959 1.00 0.24 O ATOM 1812 CB LEU A 114 -7.208 -3.815 -10.026 1.00 0.23 C ATOM 1813 CG LEU A 114 -6.550 -3.568 -11.378 1.00 0.22 C ATOM 1814 CD1 LEU A 114 -6.144 -4.887 -12.020 1.00 0.21 C ATOM 1815 CD2 LEU A 114 -7.472 -2.762 -12.271 1.00 0.26 C ATOM 0 H LEU A 114 -7.657 -3.353 -7.589 1.00 0.28 H new ATOM 0 HA LEU A 114 -5.952 -5.159 -8.998 1.00 0.23 H new ATOM 0 HB2 LEU A 114 -7.900 -4.652 -10.117 1.00 0.23 H new ATOM 0 HB3 LEU A 114 -7.799 -2.940 -9.755 1.00 0.23 H new ATOM 0 HG LEU A 114 -5.641 -2.984 -11.233 1.00 0.22 H new ATOM 0 HD11 LEU A 114 -5.676 -4.693 -12.985 1.00 0.21 H new ATOM 0 HD12 LEU A 114 -5.438 -5.405 -11.371 1.00 0.21 H new ATOM 0 HD13 LEU A 114 -7.028 -5.509 -12.164 1.00 0.21 H new ATOM 0 HD21 LEU A 114 -6.990 -2.593 -13.234 1.00 0.26 H new ATOM 0 HD22 LEU A 114 -8.402 -3.310 -12.423 1.00 0.26 H new ATOM 0 HD23 LEU A 114 -7.688 -1.803 -11.800 1.00 0.26 H new ATOM 1827 N VAL A 115 -3.927 -3.862 -9.330 1.00 0.23 N ATOM 1828 CA VAL A 115 -2.649 -3.241 -9.195 1.00 0.23 C ATOM 1829 C VAL A 115 -1.856 -3.277 -10.475 1.00 0.23 C ATOM 1830 O VAL A 115 -1.657 -4.335 -11.077 1.00 0.24 O ATOM 1831 CB VAL A 115 -1.893 -3.934 -8.058 1.00 0.24 C ATOM 1832 CG1 VAL A 115 -2.398 -5.361 -7.915 1.00 0.25 C ATOM 1833 CG2 VAL A 115 -0.387 -3.889 -8.265 1.00 0.26 C ATOM 0 H VAL A 115 -3.893 -4.829 -9.652 1.00 0.23 H new ATOM 0 HA VAL A 115 -2.793 -2.186 -8.961 1.00 0.23 H new ATOM 0 HB VAL A 115 -2.087 -3.395 -7.131 1.00 0.24 H new ATOM 0 HG11 VAL A 115 -1.862 -5.857 -7.106 1.00 0.25 H new ATOM 0 HG12 VAL A 115 -3.464 -5.349 -7.689 1.00 0.25 H new ATOM 0 HG13 VAL A 115 -2.230 -5.901 -8.847 1.00 0.25 H new ATOM 0 HG21 VAL A 115 0.110 -4.392 -7.435 1.00 0.26 H new ATOM 0 HG22 VAL A 115 -0.133 -4.391 -9.198 1.00 0.26 H new ATOM 0 HG23 VAL A 115 -0.057 -2.851 -8.310 1.00 0.26 H new ATOM 1843 N TYR A 116 -1.422 -2.111 -10.901 1.00 0.25 N ATOM 1844 CA TYR A 116 -0.516 -2.040 -12.023 1.00 0.25 C ATOM 1845 C TYR A 116 0.850 -1.543 -11.578 1.00 0.26 C ATOM 1846 O TYR A 116 0.976 -0.470 -10.985 1.00 0.28 O ATOM 1847 CB TYR A 116 -1.074 -1.159 -13.144 1.00 0.31 C ATOM 1848 CG TYR A 116 -0.161 -1.032 -14.346 1.00 0.83 C ATOM 1849 CD1 TYR A 116 -0.082 -2.047 -15.291 1.00 1.31 C ATOM 1850 CD2 TYR A 116 0.617 0.101 -14.537 1.00 1.10 C ATOM 1851 CE1 TYR A 116 0.747 -1.937 -16.390 1.00 1.87 C ATOM 1852 CE2 TYR A 116 1.448 0.218 -15.635 1.00 1.65 C ATOM 1853 CZ TYR A 116 1.510 -0.802 -16.558 1.00 1.99 C ATOM 1854 OH TYR A 116 2.338 -0.685 -17.652 1.00 2.57 O ATOM 0 H TYR A 116 -1.678 -1.212 -10.494 1.00 0.25 H new ATOM 0 HA TYR A 116 -0.406 -3.048 -12.422 1.00 0.25 H new ATOM 0 HB2 TYR A 116 -2.031 -1.567 -13.470 1.00 0.31 H new ATOM 0 HB3 TYR A 116 -1.271 -0.164 -12.745 1.00 0.31 H new ATOM 0 HD1 TYR A 116 -0.679 -2.938 -15.164 1.00 1.31 H new ATOM 0 HD2 TYR A 116 0.572 0.904 -13.816 1.00 1.10 H new ATOM 0 HE1 TYR A 116 0.797 -2.737 -17.114 1.00 1.87 H new ATOM 0 HE2 TYR A 116 2.047 1.107 -15.769 1.00 1.65 H new ATOM 0 HH TYR A 116 2.804 0.177 -17.619 1.00 2.57 H new ATOM 1864 N ILE A 117 1.862 -2.337 -11.868 1.00 0.30 N ATOM 1865 CA ILE A 117 3.228 -2.025 -11.491 1.00 0.33 C ATOM 1866 C ILE A 117 3.916 -1.267 -12.623 1.00 0.38 C ATOM 1867 O ILE A 117 4.173 -1.822 -13.693 1.00 0.46 O ATOM 1868 CB ILE A 117 4.018 -3.316 -11.144 1.00 0.42 C ATOM 1869 CG1 ILE A 117 3.423 -4.002 -9.911 1.00 0.45 C ATOM 1870 CG2 ILE A 117 5.488 -3.030 -10.909 1.00 0.52 C ATOM 1871 CD1 ILE A 117 2.240 -4.884 -10.219 1.00 0.89 C ATOM 0 H ILE A 117 1.761 -3.218 -12.372 1.00 0.30 H new ATOM 0 HA ILE A 117 3.207 -1.396 -10.601 1.00 0.33 H new ATOM 0 HB ILE A 117 3.934 -3.983 -12.002 1.00 0.42 H new ATOM 0 HG12 ILE A 117 4.197 -4.602 -9.431 1.00 0.45 H new ATOM 0 HG13 ILE A 117 3.119 -3.240 -9.193 1.00 0.45 H new ATOM 0 HG21 ILE A 117 6.006 -3.959 -10.669 1.00 0.52 H new ATOM 0 HG22 ILE A 117 5.922 -2.595 -11.809 1.00 0.52 H new ATOM 0 HG23 ILE A 117 5.595 -2.331 -10.080 1.00 0.52 H new ATOM 0 HD11 ILE A 117 1.873 -5.335 -9.297 1.00 0.89 H new ATOM 0 HD12 ILE A 117 1.448 -4.286 -10.671 1.00 0.89 H new ATOM 0 HD13 ILE A 117 2.542 -5.669 -10.912 1.00 0.89 H new ATOM 1883 N LYS A 118 4.190 0.007 -12.387 1.00 0.42 N ATOM 1884 CA LYS A 118 4.785 0.865 -13.402 1.00 0.52 C ATOM 1885 C LYS A 118 6.193 1.281 -12.994 1.00 0.39 C ATOM 1886 O LYS A 118 6.461 1.542 -11.824 1.00 0.34 O ATOM 1887 CB LYS A 118 3.908 2.099 -13.642 1.00 0.70 C ATOM 1888 CG LYS A 118 4.515 3.101 -14.615 1.00 0.93 C ATOM 1889 CD LYS A 118 3.577 4.262 -14.889 1.00 0.94 C ATOM 1890 CE LYS A 118 2.349 3.831 -15.680 1.00 0.72 C ATOM 1891 NZ LYS A 118 2.707 3.326 -17.032 1.00 1.20 N ATOM 0 H LYS A 118 4.009 0.472 -11.497 1.00 0.42 H new ATOM 0 HA LYS A 118 4.850 0.302 -14.333 1.00 0.52 H new ATOM 0 HB2 LYS A 118 2.939 1.777 -14.023 1.00 0.70 H new ATOM 0 HB3 LYS A 118 3.726 2.596 -12.689 1.00 0.70 H new ATOM 0 HG2 LYS A 118 5.453 3.480 -14.208 1.00 0.93 H new ATOM 0 HG3 LYS A 118 4.754 2.598 -15.552 1.00 0.93 H new ATOM 0 HD2 LYS A 118 3.262 4.704 -13.944 1.00 0.94 H new ATOM 0 HD3 LYS A 118 4.110 5.036 -15.441 1.00 0.94 H new ATOM 0 HE2 LYS A 118 1.819 3.053 -15.131 1.00 0.72 H new ATOM 0 HE3 LYS A 118 1.666 4.675 -15.777 1.00 0.72 H new ATOM 0 HZ1 LYS A 118 1.850 3.268 -17.619 1.00 1.20 H new ATOM 0 HZ2 LYS A 118 3.387 3.975 -17.476 1.00 1.20 H new ATOM 0 HZ3 LYS A 118 3.134 2.381 -16.948 1.00 1.20 H new ATOM 1905 N ARG A 119 7.080 1.360 -13.971 1.00 0.52 N ATOM 1906 CA ARG A 119 8.474 1.620 -13.722 1.00 0.52 C ATOM 1907 C ARG A 119 8.965 2.759 -14.588 1.00 0.49 C ATOM 1908 O ARG A 119 9.412 2.554 -15.718 1.00 0.58 O ATOM 1909 CB ARG A 119 9.283 0.352 -14.002 1.00 0.79 C ATOM 1910 CG ARG A 119 10.749 0.469 -13.641 1.00 1.00 C ATOM 1911 CD ARG A 119 10.905 1.035 -12.249 1.00 1.25 C ATOM 1912 NE ARG A 119 12.027 0.430 -11.531 1.00 1.68 N ATOM 1913 CZ ARG A 119 12.927 1.112 -10.824 1.00 2.18 C ATOM 1914 NH1 ARG A 119 12.857 2.436 -10.748 1.00 2.57 N ATOM 1915 NH2 ARG A 119 13.896 0.466 -10.187 1.00 2.80 N ATOM 0 H ARG A 119 6.847 1.245 -14.957 1.00 0.52 H new ATOM 0 HA ARG A 119 8.603 1.908 -12.679 1.00 0.52 H new ATOM 0 HB2 ARG A 119 8.846 -0.477 -13.444 1.00 0.79 H new ATOM 0 HB3 ARG A 119 9.198 0.104 -15.060 1.00 0.79 H new ATOM 0 HG2 ARG A 119 11.223 -0.511 -13.697 1.00 1.00 H new ATOM 0 HG3 ARG A 119 11.257 1.111 -14.361 1.00 1.00 H new ATOM 0 HD2 ARG A 119 11.054 2.113 -12.311 1.00 1.25 H new ATOM 0 HD3 ARG A 119 9.985 0.872 -11.687 1.00 1.25 H new ATOM 0 HE ARG A 119 12.127 -0.584 -11.575 1.00 1.68 H new ATOM 0 HH11 ARG A 119 12.111 2.936 -11.232 1.00 2.57 H new ATOM 0 HH12 ARG A 119 13.549 2.953 -10.205 1.00 2.57 H new ATOM 0 HH21 ARG A 119 13.951 -0.551 -10.239 1.00 2.80 H new ATOM 0 HH22 ARG A 119 14.586 0.987 -9.645 1.00 2.80 H new ATOM 1929 N TYR A 120 8.851 3.963 -14.068 1.00 0.43 N ATOM 1930 CA TYR A 120 9.509 5.092 -14.674 1.00 0.46 C ATOM 1931 C TYR A 120 10.995 4.963 -14.404 1.00 0.50 C ATOM 1932 O TYR A 120 11.426 5.052 -13.253 1.00 0.48 O ATOM 1933 CB TYR A 120 8.963 6.416 -14.135 1.00 0.46 C ATOM 1934 CG TYR A 120 7.582 6.753 -14.649 1.00 0.51 C ATOM 1935 CD1 TYR A 120 7.343 6.869 -16.014 1.00 0.76 C ATOM 1936 CD2 TYR A 120 6.523 6.964 -13.778 1.00 0.58 C ATOM 1937 CE1 TYR A 120 6.087 7.182 -16.495 1.00 0.83 C ATOM 1938 CE2 TYR A 120 5.263 7.279 -14.252 1.00 0.66 C ATOM 1939 CZ TYR A 120 5.051 7.386 -15.610 1.00 0.70 C ATOM 1940 OH TYR A 120 3.796 7.700 -16.083 1.00 0.81 O ATOM 0 H TYR A 120 8.311 4.181 -13.231 1.00 0.43 H new ATOM 0 HA TYR A 120 9.321 5.096 -15.748 1.00 0.46 H new ATOM 0 HB2 TYR A 120 8.936 6.372 -13.046 1.00 0.46 H new ATOM 0 HB3 TYR A 120 9.648 7.219 -14.405 1.00 0.46 H new ATOM 0 HD1 TYR A 120 8.154 6.712 -16.710 1.00 0.76 H new ATOM 0 HD2 TYR A 120 6.685 6.881 -12.714 1.00 0.58 H new ATOM 0 HE1 TYR A 120 5.918 7.266 -17.558 1.00 0.83 H new ATOM 0 HE2 TYR A 120 4.448 7.441 -13.561 1.00 0.66 H new ATOM 0 HH TYR A 120 3.180 7.810 -15.329 1.00 0.81 H new ATOM 1950 N GLU A 121 11.732 4.653 -15.465 1.00 0.61 N ATOM 1951 CA GLU A 121 13.179 4.455 -15.428 1.00 0.73 C ATOM 1952 C GLU A 121 13.886 5.450 -14.527 1.00 0.70 C ATOM 1953 O GLU A 121 14.118 6.603 -14.890 1.00 0.79 O ATOM 1954 CB GLU A 121 13.761 4.534 -16.836 1.00 0.96 C ATOM 1955 CG GLU A 121 13.400 3.344 -17.705 1.00 1.06 C ATOM 1956 CD GLU A 121 13.883 2.038 -17.110 1.00 1.69 C ATOM 1957 OE1 GLU A 121 15.111 1.821 -17.053 1.00 2.28 O ATOM 1958 OE2 GLU A 121 13.034 1.212 -16.713 1.00 2.27 O ATOM 0 H GLU A 121 11.333 4.529 -16.395 1.00 0.61 H new ATOM 0 HA GLU A 121 13.347 3.462 -15.011 1.00 0.73 H new ATOM 0 HB2 GLU A 121 13.407 5.446 -17.317 1.00 0.96 H new ATOM 0 HB3 GLU A 121 14.846 4.609 -16.769 1.00 0.96 H new ATOM 0 HG2 GLU A 121 12.318 3.305 -17.835 1.00 1.06 H new ATOM 0 HG3 GLU A 121 13.835 3.474 -18.696 1.00 1.06 H new ATOM 1965 N GLY A 122 14.204 4.970 -13.344 1.00 0.67 N ATOM 1966 CA GLY A 122 14.946 5.744 -12.373 1.00 0.71 C ATOM 1967 C GLY A 122 14.175 6.924 -11.844 1.00 0.66 C ATOM 1968 O GLY A 122 14.757 7.917 -11.412 1.00 0.76 O ATOM 0 H GLY A 122 13.955 4.032 -13.029 1.00 0.67 H new ATOM 0 HA2 GLY A 122 15.227 5.099 -11.541 1.00 0.71 H new ATOM 0 HA3 GLY A 122 15.871 6.097 -12.829 1.00 0.71 H new ATOM 1972 N ASN A 123 12.863 6.804 -11.863 1.00 0.57 N ATOM 1973 CA ASN A 123 11.998 7.829 -11.314 1.00 0.54 C ATOM 1974 C ASN A 123 11.021 7.229 -10.323 1.00 0.45 C ATOM 1975 O ASN A 123 10.844 7.769 -9.236 1.00 0.45 O ATOM 1976 CB ASN A 123 11.231 8.569 -12.412 1.00 0.60 C ATOM 1977 CG ASN A 123 12.101 9.499 -13.238 1.00 1.01 C ATOM 1978 OD1 ASN A 123 13.145 10.044 -12.635 1.00 1.65 O flip ATOM 1979 ND2 ASN A 123 11.825 9.732 -14.415 1.00 1.61 N flip ATOM 0 H ASN A 123 12.370 6.002 -12.255 1.00 0.57 H new ATOM 0 HA ASN A 123 12.636 8.548 -10.800 1.00 0.54 H new ATOM 0 HB2 ASN A 123 10.764 7.839 -13.073 1.00 0.60 H new ATOM 0 HB3 ASN A 123 10.427 9.146 -11.956 1.00 0.60 H new ATOM 0 HD21 ASN A 123 11.011 9.292 -14.845 1.00 1.61 H new ATOM 0 HD22 ASN A 123 12.410 10.365 -14.960 1.00 1.61 H new ATOM 1986 N MET A 124 10.388 6.108 -10.681 1.00 0.39 N ATOM 1987 CA MET A 124 9.381 5.514 -9.807 1.00 0.34 C ATOM 1988 C MET A 124 9.103 4.065 -10.164 1.00 0.33 C ATOM 1989 O MET A 124 8.905 3.734 -11.329 1.00 0.40 O ATOM 1990 CB MET A 124 8.080 6.328 -9.857 1.00 0.34 C ATOM 1991 CG MET A 124 7.930 7.291 -8.693 1.00 0.56 C ATOM 1992 SD MET A 124 6.712 8.590 -8.990 1.00 1.09 S ATOM 1993 CE MET A 124 7.479 9.481 -10.343 1.00 1.12 C ATOM 0 H MET A 124 10.552 5.604 -11.553 1.00 0.39 H new ATOM 0 HA MET A 124 9.780 5.534 -8.793 1.00 0.34 H new ATOM 0 HB2 MET A 124 8.046 6.889 -10.791 1.00 0.34 H new ATOM 0 HB3 MET A 124 7.231 5.644 -9.865 1.00 0.34 H new ATOM 0 HG2 MET A 124 7.644 6.731 -7.803 1.00 0.56 H new ATOM 0 HG3 MET A 124 8.896 7.750 -8.484 1.00 0.56 H new ATOM 0 HE1 MET A 124 7.120 10.510 -10.351 1.00 1.12 H new ATOM 0 HE2 MET A 124 8.561 9.475 -10.215 1.00 1.12 H new ATOM 0 HE3 MET A 124 7.222 9.000 -11.287 1.00 1.12 H new ATOM 2003 N ASN A 125 9.116 3.205 -9.158 1.00 0.34 N ATOM 2004 CA ASN A 125 8.618 1.847 -9.311 1.00 0.37 C ATOM 2005 C ASN A 125 7.365 1.721 -8.470 1.00 0.32 C ATOM 2006 O ASN A 125 7.414 1.343 -7.300 1.00 0.37 O ATOM 2007 CB ASN A 125 9.645 0.795 -8.886 1.00 0.50 C ATOM 2008 CG ASN A 125 9.346 -0.572 -9.491 1.00 0.95 C ATOM 2009 OD1 ASN A 125 8.212 -0.871 -9.863 1.00 1.58 O ATOM 2010 ND2 ASN A 125 10.361 -1.417 -9.584 1.00 1.62 N ATOM 0 H ASN A 125 9.467 3.424 -8.225 1.00 0.34 H new ATOM 0 HA ASN A 125 8.409 1.664 -10.365 1.00 0.37 H new ATOM 0 HB2 ASN A 125 10.641 1.117 -9.191 1.00 0.50 H new ATOM 0 HB3 ASN A 125 9.655 0.716 -7.799 1.00 0.50 H new ATOM 0 HD21 ASN A 125 10.215 -2.348 -9.974 1.00 1.62 H new ATOM 0 HD22 ASN A 125 11.289 -1.137 -9.266 1.00 1.62 H new ATOM 2017 N ILE A 126 6.256 2.098 -9.062 1.00 0.26 N ATOM 2018 CA ILE A 126 4.996 2.192 -8.355 1.00 0.23 C ATOM 2019 C ILE A 126 4.130 0.959 -8.556 1.00 0.27 C ATOM 2020 O ILE A 126 3.989 0.461 -9.672 1.00 0.30 O ATOM 2021 CB ILE A 126 4.195 3.433 -8.819 1.00 0.22 C ATOM 2022 CG1 ILE A 126 2.703 3.251 -8.494 1.00 0.24 C ATOM 2023 CG2 ILE A 126 4.423 3.700 -10.300 1.00 0.24 C ATOM 2024 CD1 ILE A 126 1.772 4.252 -9.148 1.00 0.26 C ATOM 0 H ILE A 126 6.200 2.349 -10.049 1.00 0.26 H new ATOM 0 HA ILE A 126 5.245 2.278 -7.297 1.00 0.23 H new ATOM 0 HB ILE A 126 4.551 4.308 -8.276 1.00 0.22 H new ATOM 0 HG12 ILE A 126 2.402 2.248 -8.796 1.00 0.24 H new ATOM 0 HG13 ILE A 126 2.573 3.311 -7.413 1.00 0.24 H new ATOM 0 HG21 ILE A 126 3.851 4.576 -10.604 1.00 0.24 H new ATOM 0 HG22 ILE A 126 5.483 3.879 -10.478 1.00 0.24 H new ATOM 0 HG23 ILE A 126 4.099 2.836 -10.880 1.00 0.24 H new ATOM 0 HD11 ILE A 126 0.744 4.038 -8.856 1.00 0.26 H new ATOM 0 HD12 ILE A 126 2.038 5.259 -8.828 1.00 0.26 H new ATOM 0 HD13 ILE A 126 1.864 4.180 -10.232 1.00 0.26 H new ATOM 2036 N ILE A 127 3.545 0.479 -7.470 1.00 0.30 N ATOM 2037 CA ILE A 127 2.457 -0.464 -7.578 1.00 0.34 C ATOM 2038 C ILE A 127 1.141 0.284 -7.363 1.00 0.38 C ATOM 2039 O ILE A 127 0.852 0.786 -6.278 1.00 0.45 O ATOM 2040 CB ILE A 127 2.574 -1.664 -6.599 1.00 0.41 C ATOM 2041 CG1 ILE A 127 2.371 -1.233 -5.146 1.00 0.42 C ATOM 2042 CG2 ILE A 127 3.932 -2.336 -6.756 1.00 0.50 C ATOM 2043 CD1 ILE A 127 1.975 -2.368 -4.226 1.00 0.59 C ATOM 0 H ILE A 127 3.806 0.727 -6.516 1.00 0.30 H new ATOM 0 HA ILE A 127 2.495 -0.900 -8.576 1.00 0.34 H new ATOM 0 HB ILE A 127 1.785 -2.373 -6.849 1.00 0.41 H new ATOM 0 HG12 ILE A 127 3.293 -0.783 -4.777 1.00 0.42 H new ATOM 0 HG13 ILE A 127 1.602 -0.461 -5.109 1.00 0.42 H new ATOM 0 HG21 ILE A 127 4.004 -3.176 -6.065 1.00 0.50 H new ATOM 0 HG22 ILE A 127 4.044 -2.696 -7.779 1.00 0.50 H new ATOM 0 HG23 ILE A 127 4.721 -1.617 -6.537 1.00 0.50 H new ATOM 0 HD11 ILE A 127 1.849 -1.988 -3.212 1.00 0.59 H new ATOM 0 HD12 ILE A 127 1.037 -2.804 -4.569 1.00 0.59 H new ATOM 0 HD13 ILE A 127 2.754 -3.131 -4.233 1.00 0.59 H new ATOM 2055 N SER A 128 0.393 0.437 -8.427 1.00 0.39 N ATOM 2056 CA SER A 128 -0.914 1.061 -8.355 1.00 0.50 C ATOM 2057 C SER A 128 -1.889 0.072 -7.757 1.00 0.55 C ATOM 2058 O SER A 128 -1.614 -1.116 -7.737 1.00 1.00 O ATOM 2059 CB SER A 128 -1.349 1.464 -9.754 1.00 0.68 C ATOM 2060 OG SER A 128 -0.246 1.966 -10.486 1.00 1.18 O ATOM 0 H SER A 128 0.666 0.137 -9.363 1.00 0.39 H new ATOM 0 HA SER A 128 -0.882 1.953 -7.729 1.00 0.50 H new ATOM 0 HB2 SER A 128 -1.776 0.605 -10.271 1.00 0.68 H new ATOM 0 HB3 SER A 128 -2.130 2.222 -9.695 1.00 0.68 H new ATOM 0 HG SER A 128 0.241 1.221 -10.896 1.00 1.18 H new ATOM 2066 N SER A 129 -3.003 0.553 -7.263 1.00 0.30 N ATOM 2067 CA SER A 129 -3.991 -0.320 -6.659 1.00 0.31 C ATOM 2068 C SER A 129 -5.383 0.316 -6.663 1.00 0.31 C ATOM 2069 O SER A 129 -5.597 1.393 -6.104 1.00 0.43 O ATOM 2070 CB SER A 129 -3.555 -0.693 -5.241 1.00 0.40 C ATOM 2071 OG SER A 129 -3.127 0.444 -4.510 1.00 1.24 O ATOM 0 H SER A 129 -3.252 1.542 -7.265 1.00 0.30 H new ATOM 0 HA SER A 129 -4.058 -1.230 -7.256 1.00 0.31 H new ATOM 0 HB2 SER A 129 -4.384 -1.171 -4.719 1.00 0.40 H new ATOM 0 HB3 SER A 129 -2.746 -1.422 -5.288 1.00 0.40 H new ATOM 0 HG SER A 129 -3.892 0.840 -4.044 1.00 1.24 H new ATOM 2077 N LYS A 130 -6.327 -0.362 -7.300 1.00 0.27 N ATOM 2078 CA LYS A 130 -7.676 0.124 -7.429 1.00 0.32 C ATOM 2079 C LYS A 130 -8.599 -0.972 -6.954 1.00 0.37 C ATOM 2080 O LYS A 130 -8.676 -2.018 -7.595 1.00 0.41 O ATOM 2081 CB LYS A 130 -7.951 0.481 -8.900 1.00 0.40 C ATOM 2082 CG LYS A 130 -9.413 0.765 -9.236 1.00 0.90 C ATOM 2083 CD LYS A 130 -9.561 1.259 -10.673 1.00 0.80 C ATOM 2084 CE LYS A 130 -9.475 2.777 -10.749 1.00 1.42 C ATOM 2085 NZ LYS A 130 -9.149 3.275 -12.113 1.00 2.26 N ATOM 0 H LYS A 130 -6.169 -1.268 -7.741 1.00 0.27 H new ATOM 0 HA LYS A 130 -7.835 1.023 -6.833 1.00 0.32 H new ATOM 0 HB2 LYS A 130 -7.358 1.357 -9.162 1.00 0.40 H new ATOM 0 HB3 LYS A 130 -7.603 -0.339 -9.528 1.00 0.40 H new ATOM 0 HG2 LYS A 130 -10.004 -0.140 -9.097 1.00 0.90 H new ATOM 0 HG3 LYS A 130 -9.809 1.513 -8.549 1.00 0.90 H new ATOM 0 HD2 LYS A 130 -8.781 0.817 -11.294 1.00 0.80 H new ATOM 0 HD3 LYS A 130 -10.517 0.926 -11.077 1.00 0.80 H new ATOM 0 HE2 LYS A 130 -10.425 3.205 -10.430 1.00 1.42 H new ATOM 0 HE3 LYS A 130 -8.716 3.128 -10.050 1.00 1.42 H new ATOM 0 HZ1 LYS A 130 -8.823 4.261 -12.054 1.00 2.26 H new ATOM 0 HZ2 LYS A 130 -8.398 2.686 -12.527 1.00 2.26 H new ATOM 0 HZ3 LYS A 130 -9.997 3.226 -12.712 1.00 2.26 H new ATOM 2099 N SER A 131 -9.249 -0.760 -5.818 1.00 0.41 N ATOM 2100 CA SER A 131 -10.135 -1.757 -5.259 1.00 0.44 C ATOM 2101 C SER A 131 -11.199 -2.042 -6.278 1.00 0.41 C ATOM 2102 O SER A 131 -12.164 -1.289 -6.433 1.00 0.47 O ATOM 2103 CB SER A 131 -10.755 -1.281 -3.950 1.00 0.56 C ATOM 2104 OG SER A 131 -11.499 -2.312 -3.318 1.00 1.39 O ATOM 0 H SER A 131 -9.176 0.096 -5.269 1.00 0.41 H new ATOM 0 HA SER A 131 -9.574 -2.662 -5.028 1.00 0.44 H new ATOM 0 HB2 SER A 131 -9.969 -0.935 -3.279 1.00 0.56 H new ATOM 0 HB3 SER A 131 -11.406 -0.428 -4.144 1.00 0.56 H new ATOM 0 HG SER A 131 -11.214 -2.396 -2.384 1.00 1.39 H new ATOM 2110 N VAL A 132 -10.999 -3.112 -6.993 1.00 0.35 N ATOM 2111 CA VAL A 132 -11.737 -3.339 -8.181 1.00 0.36 C ATOM 2112 C VAL A 132 -12.730 -4.445 -7.930 1.00 0.37 C ATOM 2113 O VAL A 132 -12.412 -5.475 -7.332 1.00 0.46 O ATOM 2114 CB VAL A 132 -10.795 -3.651 -9.370 1.00 0.40 C ATOM 2115 CG1 VAL A 132 -10.760 -5.115 -9.726 1.00 0.88 C ATOM 2116 CG2 VAL A 132 -11.145 -2.798 -10.574 1.00 1.05 C ATOM 0 H VAL A 132 -10.323 -3.840 -6.763 1.00 0.35 H new ATOM 0 HA VAL A 132 -12.284 -2.438 -8.457 1.00 0.36 H new ATOM 0 HB VAL A 132 -9.786 -3.395 -9.046 1.00 0.40 H new ATOM 0 HG11 VAL A 132 -10.083 -5.269 -10.566 1.00 0.88 H new ATOM 0 HG12 VAL A 132 -10.411 -5.690 -8.868 1.00 0.88 H new ATOM 0 HG13 VAL A 132 -11.761 -5.446 -10.002 1.00 0.88 H new ATOM 0 HG21 VAL A 132 -10.470 -3.035 -11.396 1.00 1.05 H new ATOM 0 HG22 VAL A 132 -12.172 -3.001 -10.878 1.00 1.05 H new ATOM 0 HG23 VAL A 132 -11.045 -1.744 -10.315 1.00 1.05 H new ATOM 2126 N ASP A 133 -13.932 -4.208 -8.359 1.00 0.39 N ATOM 2127 CA ASP A 133 -15.037 -5.057 -7.999 1.00 0.43 C ATOM 2128 C ASP A 133 -15.230 -6.100 -9.076 1.00 0.43 C ATOM 2129 O ASP A 133 -16.182 -6.063 -9.856 1.00 0.59 O ATOM 2130 CB ASP A 133 -16.268 -4.190 -7.805 1.00 0.54 C ATOM 2131 CG ASP A 133 -17.364 -4.875 -7.009 1.00 1.27 C ATOM 2132 OD1 ASP A 133 -17.962 -5.845 -7.515 1.00 1.39 O ATOM 2133 OD2 ASP A 133 -17.651 -4.430 -5.879 1.00 2.17 O ATOM 0 H ASP A 133 -14.179 -3.426 -8.966 1.00 0.39 H new ATOM 0 HA ASP A 133 -14.846 -5.584 -7.064 1.00 0.43 H new ATOM 0 HB2 ASP A 133 -15.980 -3.270 -7.296 1.00 0.54 H new ATOM 0 HB3 ASP A 133 -16.661 -3.905 -8.781 1.00 0.54 H new ATOM 2138 N PHE A 134 -14.287 -7.024 -9.116 1.00 0.35 N ATOM 2139 CA PHE A 134 -14.226 -8.014 -10.178 1.00 0.40 C ATOM 2140 C PHE A 134 -14.846 -9.344 -9.681 1.00 0.46 C ATOM 2141 O PHE A 134 -15.227 -9.433 -8.517 1.00 0.50 O ATOM 2142 CB PHE A 134 -12.754 -8.159 -10.615 1.00 0.39 C ATOM 2143 CG PHE A 134 -11.978 -9.098 -9.758 1.00 0.38 C ATOM 2144 CD1 PHE A 134 -11.808 -8.848 -8.411 1.00 0.36 C ATOM 2145 CD2 PHE A 134 -11.385 -10.210 -10.310 1.00 0.51 C ATOM 2146 CE1 PHE A 134 -11.050 -9.695 -7.637 1.00 0.42 C ATOM 2147 CE2 PHE A 134 -10.635 -11.058 -9.541 1.00 0.53 C ATOM 2148 CZ PHE A 134 -10.627 -10.866 -8.135 1.00 0.45 C ATOM 0 H PHE A 134 -13.547 -7.110 -8.419 1.00 0.35 H new ATOM 0 HA PHE A 134 -14.806 -7.707 -11.048 1.00 0.40 H new ATOM 0 HB2 PHE A 134 -12.721 -8.507 -11.647 1.00 0.39 H new ATOM 0 HB3 PHE A 134 -12.277 -7.179 -10.594 1.00 0.39 H new ATOM 0 HD1 PHE A 134 -12.273 -7.982 -7.963 1.00 0.36 H new ATOM 0 HD2 PHE A 134 -11.513 -10.416 -11.362 1.00 0.51 H new ATOM 0 HE1 PHE A 134 -10.795 -9.416 -6.625 1.00 0.42 H new ATOM 0 HE2 PHE A 134 -10.063 -11.854 -9.993 1.00 0.53 H new ATOM 0 HZ PHE A 134 -10.286 -11.651 -7.476 1.00 0.45 H new ATOM 2158 N PRO A 135 -14.985 -10.378 -10.545 1.00 0.61 N ATOM 2159 CA PRO A 135 -15.664 -11.652 -10.203 1.00 0.75 C ATOM 2160 C PRO A 135 -15.362 -12.240 -8.808 1.00 0.92 C ATOM 2161 O PRO A 135 -16.285 -12.580 -8.069 1.00 1.13 O ATOM 2162 CB PRO A 135 -15.151 -12.594 -11.285 1.00 1.28 C ATOM 2163 CG PRO A 135 -14.987 -11.724 -12.477 1.00 1.19 C ATOM 2164 CD PRO A 135 -14.534 -10.385 -11.956 1.00 0.76 C ATOM 0 HA PRO A 135 -16.742 -11.499 -10.163 1.00 0.75 H new ATOM 0 HB2 PRO A 135 -14.207 -13.056 -10.996 1.00 1.28 H new ATOM 0 HB3 PRO A 135 -15.856 -13.403 -11.476 1.00 1.28 H new ATOM 0 HG2 PRO A 135 -14.254 -12.142 -13.167 1.00 1.19 H new ATOM 0 HG3 PRO A 135 -15.925 -11.632 -13.025 1.00 1.19 H new ATOM 0 HD2 PRO A 135 -13.452 -10.273 -12.030 1.00 0.76 H new ATOM 0 HD3 PRO A 135 -14.978 -9.566 -12.521 1.00 0.76 H new ATOM 2172 N GLU A 136 -14.084 -12.363 -8.451 1.00 1.10 N ATOM 2173 CA GLU A 136 -13.679 -13.102 -7.238 1.00 1.59 C ATOM 2174 C GLU A 136 -13.667 -12.200 -6.009 1.00 1.68 C ATOM 2175 O GLU A 136 -13.441 -12.646 -4.883 1.00 2.17 O ATOM 2176 CB GLU A 136 -12.302 -13.707 -7.461 1.00 1.78 C ATOM 2177 CG GLU A 136 -12.068 -14.041 -8.916 1.00 2.38 C ATOM 2178 CD GLU A 136 -10.738 -14.713 -9.178 1.00 3.03 C ATOM 2179 OE1 GLU A 136 -10.446 -15.740 -8.526 1.00 3.30 O ATOM 2180 OE2 GLU A 136 -9.991 -14.233 -10.055 1.00 3.50 O ATOM 0 H GLU A 136 -13.307 -11.964 -8.978 1.00 1.10 H new ATOM 0 HA GLU A 136 -14.407 -13.892 -7.054 1.00 1.59 H new ATOM 0 HB2 GLU A 136 -11.538 -13.008 -7.120 1.00 1.78 H new ATOM 0 HB3 GLU A 136 -12.199 -14.610 -6.859 1.00 1.78 H new ATOM 0 HG2 GLU A 136 -12.869 -14.693 -9.264 1.00 2.38 H new ATOM 0 HG3 GLU A 136 -12.125 -13.125 -9.504 1.00 2.38 H new ATOM 2187 N TYR A 137 -13.908 -10.932 -6.259 1.00 1.38 N ATOM 2188 CA TYR A 137 -13.924 -9.889 -5.238 1.00 1.79 C ATOM 2189 C TYR A 137 -14.911 -10.132 -4.075 1.00 1.42 C ATOM 2190 O TYR A 137 -14.504 -9.981 -2.926 1.00 1.58 O ATOM 2191 CB TYR A 137 -14.216 -8.565 -5.936 1.00 2.49 C ATOM 2192 CG TYR A 137 -14.475 -7.386 -5.020 1.00 3.43 C ATOM 2193 CD1 TYR A 137 -15.728 -7.183 -4.475 1.00 4.47 C ATOM 2194 CD2 TYR A 137 -13.468 -6.482 -4.700 1.00 3.49 C ATOM 2195 CE1 TYR A 137 -15.983 -6.117 -3.638 1.00 5.35 C ATOM 2196 CE2 TYR A 137 -13.714 -5.412 -3.864 1.00 4.37 C ATOM 2197 CZ TYR A 137 -14.924 -5.216 -3.348 1.00 5.22 C ATOM 2198 OH TYR A 137 -15.224 -4.172 -2.505 1.00 6.12 O ATOM 0 H TYR A 137 -14.104 -10.582 -7.197 1.00 1.38 H new ATOM 0 HA TYR A 137 -12.946 -9.885 -4.756 1.00 1.79 H new ATOM 0 HB2 TYR A 137 -13.373 -8.322 -6.582 1.00 2.49 H new ATOM 0 HB3 TYR A 137 -15.084 -8.699 -6.581 1.00 2.49 H new ATOM 0 HD1 TYR A 137 -16.525 -7.874 -4.709 1.00 4.47 H new ATOM 0 HD2 TYR A 137 -12.479 -6.619 -5.112 1.00 3.49 H new ATOM 0 HE1 TYR A 137 -16.965 -5.971 -3.213 1.00 5.35 H new ATOM 0 HE2 TYR A 137 -12.915 -4.726 -3.626 1.00 4.37 H new ATOM 0 HH TYR A 137 -14.394 -3.762 -2.184 1.00 6.12 H new ATOM 2208 N PRO A 138 -16.206 -10.477 -4.337 1.00 1.33 N ATOM 2209 CA PRO A 138 -17.245 -10.621 -3.297 1.00 1.10 C ATOM 2210 C PRO A 138 -16.724 -11.122 -1.943 1.00 0.99 C ATOM 2211 O PRO A 138 -16.307 -12.276 -1.810 1.00 0.99 O ATOM 2212 CB PRO A 138 -18.182 -11.647 -3.918 1.00 0.97 C ATOM 2213 CG PRO A 138 -18.112 -11.393 -5.387 1.00 1.56 C ATOM 2214 CD PRO A 138 -16.783 -10.730 -5.671 1.00 1.77 C ATOM 0 HA PRO A 138 -17.699 -9.661 -3.053 1.00 1.10 H new ATOM 0 HB2 PRO A 138 -17.870 -12.663 -3.678 1.00 0.97 H new ATOM 0 HB3 PRO A 138 -19.199 -11.529 -3.545 1.00 0.97 H new ATOM 0 HG2 PRO A 138 -18.201 -12.327 -5.942 1.00 1.56 H new ATOM 0 HG3 PRO A 138 -18.935 -10.753 -5.705 1.00 1.56 H new ATOM 0 HD2 PRO A 138 -16.137 -11.374 -6.267 1.00 1.77 H new ATOM 0 HD3 PRO A 138 -16.913 -9.803 -6.230 1.00 1.77 H new ATOM 2222 N PRO A 139 -16.740 -10.236 -0.926 1.00 0.96 N ATOM 2223 CA PRO A 139 -16.185 -10.513 0.403 1.00 0.91 C ATOM 2224 C PRO A 139 -17.139 -11.261 1.332 1.00 1.00 C ATOM 2225 O PRO A 139 -18.104 -11.888 0.893 1.00 1.25 O ATOM 2226 CB PRO A 139 -15.914 -9.114 0.950 1.00 0.82 C ATOM 2227 CG PRO A 139 -16.940 -8.241 0.310 1.00 0.89 C ATOM 2228 CD PRO A 139 -17.297 -8.873 -1.011 1.00 1.06 C ATOM 0 HA PRO A 139 -15.313 -11.164 0.339 1.00 0.91 H new ATOM 0 HB2 PRO A 139 -16.000 -9.092 2.036 1.00 0.82 H new ATOM 0 HB3 PRO A 139 -14.905 -8.783 0.703 1.00 0.82 H new ATOM 0 HG2 PRO A 139 -17.821 -8.153 0.945 1.00 0.89 H new ATOM 0 HG3 PRO A 139 -16.551 -7.234 0.163 1.00 0.89 H new ATOM 0 HD2 PRO A 139 -18.376 -8.893 -1.163 1.00 1.06 H new ATOM 0 HD3 PRO A 139 -16.867 -8.319 -1.846 1.00 1.06 H new ATOM 2236 N SER A 140 -16.851 -11.180 2.624 1.00 0.90 N ATOM 2237 CA SER A 140 -17.633 -11.850 3.636 1.00 1.01 C ATOM 2238 C SER A 140 -17.850 -10.899 4.802 1.00 1.01 C ATOM 2239 O SER A 140 -17.635 -9.693 4.656 1.00 1.13 O ATOM 2240 CB SER A 140 -16.916 -13.123 4.089 1.00 1.09 C ATOM 2241 OG SER A 140 -15.559 -12.859 4.411 1.00 1.60 O ATOM 0 H SER A 140 -16.065 -10.645 2.993 1.00 0.90 H new ATOM 0 HA SER A 140 -18.603 -12.138 3.231 1.00 1.01 H new ATOM 0 HB2 SER A 140 -17.424 -13.541 4.958 1.00 1.09 H new ATOM 0 HB3 SER A 140 -16.966 -13.873 3.299 1.00 1.09 H new ATOM 0 HG SER A 140 -15.168 -13.644 4.848 1.00 1.60 H new ATOM 2247 N SER A 141 -18.261 -11.404 5.946 1.00 1.07 N ATOM 2248 CA SER A 141 -18.493 -10.537 7.081 1.00 1.19 C ATOM 2249 C SER A 141 -17.225 -10.379 7.916 1.00 1.07 C ATOM 2250 O SER A 141 -17.003 -9.338 8.541 1.00 1.22 O ATOM 2251 CB SER A 141 -19.652 -11.071 7.925 1.00 1.47 C ATOM 2252 OG SER A 141 -19.477 -12.446 8.232 1.00 1.97 O ATOM 0 H SER A 141 -18.439 -12.394 6.114 1.00 1.07 H new ATOM 0 HA SER A 141 -18.766 -9.548 6.713 1.00 1.19 H new ATOM 0 HB2 SER A 141 -19.727 -10.497 8.849 1.00 1.47 H new ATOM 0 HB3 SER A 141 -20.590 -10.933 7.387 1.00 1.47 H new ATOM 0 HG SER A 141 -20.232 -12.759 8.773 1.00 1.97 H new ATOM 2258 N ASN A 142 -16.387 -11.410 7.912 1.00 0.97 N ATOM 2259 CA ASN A 142 -15.138 -11.383 8.664 1.00 0.95 C ATOM 2260 C ASN A 142 -14.047 -10.679 7.871 1.00 0.86 C ATOM 2261 O ASN A 142 -13.183 -10.016 8.440 1.00 1.07 O ATOM 2262 CB ASN A 142 -14.687 -12.801 9.024 1.00 1.01 C ATOM 2263 CG ASN A 142 -15.618 -13.480 10.010 1.00 1.37 C ATOM 2264 OD1 ASN A 142 -16.247 -12.828 10.846 1.00 2.18 O ATOM 2265 ND2 ASN A 142 -15.713 -14.795 9.922 1.00 1.73 N ATOM 0 H ASN A 142 -16.550 -12.275 7.396 1.00 0.97 H new ATOM 0 HA ASN A 142 -15.316 -10.829 9.586 1.00 0.95 H new ATOM 0 HB2 ASN A 142 -14.627 -13.400 8.115 1.00 1.01 H new ATOM 0 HB3 ASN A 142 -13.683 -12.762 9.447 1.00 1.01 H new ATOM 0 HD21 ASN A 142 -16.323 -15.306 10.560 1.00 1.73 H new ATOM 0 HD22 ASN A 142 -15.176 -15.299 9.216 1.00 1.73 H new ATOM 2272 N TYR A 143 -14.093 -10.823 6.556 1.00 0.71 N ATOM 2273 CA TYR A 143 -13.145 -10.156 5.683 1.00 0.67 C ATOM 2274 C TYR A 143 -13.841 -9.035 4.949 1.00 0.61 C ATOM 2275 O TYR A 143 -14.661 -9.280 4.061 1.00 0.67 O ATOM 2276 CB TYR A 143 -12.543 -11.136 4.675 1.00 0.76 C ATOM 2277 CG TYR A 143 -11.703 -12.223 5.300 1.00 0.84 C ATOM 2278 CD1 TYR A 143 -10.468 -11.931 5.865 1.00 0.91 C ATOM 2279 CD2 TYR A 143 -12.136 -13.542 5.314 1.00 0.97 C ATOM 2280 CE1 TYR A 143 -9.690 -12.923 6.425 1.00 1.02 C ATOM 2281 CE2 TYR A 143 -11.363 -14.540 5.874 1.00 1.09 C ATOM 2282 CZ TYR A 143 -10.142 -14.225 6.427 1.00 1.09 C ATOM 2283 OH TYR A 143 -9.363 -15.217 6.976 1.00 1.23 O ATOM 0 H TYR A 143 -14.780 -11.399 6.070 1.00 0.71 H new ATOM 0 HA TYR A 143 -12.336 -9.754 6.293 1.00 0.67 H new ATOM 0 HB2 TYR A 143 -13.350 -11.597 4.106 1.00 0.76 H new ATOM 0 HB3 TYR A 143 -11.930 -10.580 3.966 1.00 0.76 H new ATOM 0 HD1 TYR A 143 -10.111 -10.912 5.866 1.00 0.91 H new ATOM 0 HD2 TYR A 143 -13.093 -13.792 4.880 1.00 0.97 H new ATOM 0 HE1 TYR A 143 -8.732 -12.681 6.860 1.00 1.02 H new ATOM 0 HE2 TYR A 143 -11.714 -15.561 5.878 1.00 1.09 H new ATOM 0 HH TYR A 143 -9.826 -16.077 6.898 1.00 1.23 H new ATOM 2293 N ILE A 144 -13.514 -7.805 5.302 1.00 0.56 N ATOM 2294 CA ILE A 144 -14.189 -6.680 4.710 1.00 0.53 C ATOM 2295 C ILE A 144 -13.323 -6.081 3.625 1.00 0.46 C ATOM 2296 O ILE A 144 -12.295 -5.468 3.901 1.00 0.47 O ATOM 2297 CB ILE A 144 -14.593 -5.611 5.755 1.00 0.61 C ATOM 2298 CG1 ILE A 144 -14.998 -4.312 5.060 1.00 0.62 C ATOM 2299 CG2 ILE A 144 -13.491 -5.366 6.770 1.00 0.68 C ATOM 2300 CD1 ILE A 144 -16.244 -4.457 4.214 1.00 0.82 C ATOM 0 H ILE A 144 -12.795 -7.568 5.986 1.00 0.56 H new ATOM 0 HA ILE A 144 -15.118 -7.043 4.271 1.00 0.53 H new ATOM 0 HB ILE A 144 -15.453 -5.994 6.304 1.00 0.61 H new ATOM 0 HG12 ILE A 144 -15.164 -3.541 5.812 1.00 0.62 H new ATOM 0 HG13 ILE A 144 -14.176 -3.972 4.430 1.00 0.62 H new ATOM 0 HG21 ILE A 144 -13.816 -4.609 7.484 1.00 0.68 H new ATOM 0 HG22 ILE A 144 -13.271 -6.293 7.299 1.00 0.68 H new ATOM 0 HG23 ILE A 144 -12.594 -5.019 6.257 1.00 0.68 H new ATOM 0 HD11 ILE A 144 -16.480 -3.501 3.747 1.00 0.82 H new ATOM 0 HD12 ILE A 144 -16.074 -5.206 3.441 1.00 0.82 H new ATOM 0 HD13 ILE A 144 -17.077 -4.768 4.844 1.00 0.82 H new ATOM 2312 N ARG A 145 -13.727 -6.319 2.390 1.00 0.43 N ATOM 2313 CA ARG A 145 -13.021 -5.794 1.237 1.00 0.41 C ATOM 2314 C ARG A 145 -12.974 -4.273 1.281 1.00 0.45 C ATOM 2315 O ARG A 145 -13.954 -3.596 0.962 1.00 0.48 O ATOM 2316 CB ARG A 145 -13.678 -6.270 -0.060 1.00 0.44 C ATOM 2317 CG ARG A 145 -12.759 -7.120 -0.919 1.00 0.81 C ATOM 2318 CD ARG A 145 -12.354 -8.406 -0.211 1.00 2.08 C ATOM 2319 NE ARG A 145 -13.078 -9.574 -0.717 1.00 2.70 N ATOM 2320 CZ ARG A 145 -12.930 -10.813 -0.239 1.00 3.63 C ATOM 2321 NH1 ARG A 145 -12.060 -11.056 0.723 1.00 4.14 N ATOM 2322 NH2 ARG A 145 -13.633 -11.814 -0.752 1.00 4.42 N ATOM 0 H ARG A 145 -14.548 -6.878 2.160 1.00 0.43 H new ATOM 0 HA ARG A 145 -11.998 -6.170 1.265 1.00 0.41 H new ATOM 0 HB2 ARG A 145 -14.572 -6.844 0.183 1.00 0.44 H new ATOM 0 HB3 ARG A 145 -14.003 -5.403 -0.635 1.00 0.44 H new ATOM 0 HG2 ARG A 145 -13.259 -7.363 -1.856 1.00 0.81 H new ATOM 0 HG3 ARG A 145 -11.867 -6.548 -1.173 1.00 0.81 H new ATOM 0 HD2 ARG A 145 -11.283 -8.564 -0.335 1.00 2.08 H new ATOM 0 HD3 ARG A 145 -12.539 -8.303 0.858 1.00 2.08 H new ATOM 0 HE ARG A 145 -13.737 -9.433 -1.483 1.00 2.70 H new ATOM 0 HH11 ARG A 145 -11.497 -10.296 1.105 1.00 4.14 H new ATOM 0 HH12 ARG A 145 -11.951 -12.004 1.084 1.00 4.14 H new ATOM 0 HH21 ARG A 145 -14.289 -11.639 -1.513 1.00 4.42 H new ATOM 0 HH22 ARG A 145 -13.518 -12.759 -0.385 1.00 4.42 H new ATOM 2336 N GLY A 146 -11.839 -3.748 1.717 1.00 0.62 N ATOM 2337 CA GLY A 146 -11.653 -2.320 1.763 1.00 0.79 C ATOM 2338 C GLY A 146 -11.644 -1.724 0.378 1.00 0.57 C ATOM 2339 O GLY A 146 -10.836 -2.112 -0.466 1.00 0.62 O ATOM 0 H GLY A 146 -11.040 -4.293 2.041 1.00 0.62 H new ATOM 0 HA2 GLY A 146 -12.450 -1.866 2.351 1.00 0.79 H new ATOM 0 HA3 GLY A 146 -10.714 -2.089 2.267 1.00 0.79 H new ATOM 2343 N TYR A 147 -12.545 -0.791 0.135 1.00 0.58 N ATOM 2344 CA TYR A 147 -12.657 -0.192 -1.182 1.00 0.56 C ATOM 2345 C TYR A 147 -11.670 0.957 -1.327 1.00 0.54 C ATOM 2346 O TYR A 147 -12.019 2.130 -1.186 1.00 0.67 O ATOM 2347 CB TYR A 147 -14.090 0.274 -1.445 1.00 0.86 C ATOM 2348 CG TYR A 147 -14.504 0.203 -2.899 1.00 1.69 C ATOM 2349 CD1 TYR A 147 -14.862 -1.008 -3.471 1.00 2.19 C ATOM 2350 CD2 TYR A 147 -14.549 1.341 -3.695 1.00 2.23 C ATOM 2351 CE1 TYR A 147 -15.256 -1.089 -4.792 1.00 3.07 C ATOM 2352 CE2 TYR A 147 -14.941 1.269 -5.020 1.00 3.13 C ATOM 2353 CZ TYR A 147 -15.293 0.050 -5.561 1.00 3.51 C ATOM 2354 OH TYR A 147 -15.693 -0.026 -6.877 1.00 4.44 O ATOM 0 H TYR A 147 -13.205 -0.434 0.826 1.00 0.58 H new ATOM 0 HA TYR A 147 -12.411 -0.947 -1.929 1.00 0.56 H new ATOM 0 HB2 TYR A 147 -14.773 -0.335 -0.853 1.00 0.86 H new ATOM 0 HB3 TYR A 147 -14.196 1.302 -1.097 1.00 0.86 H new ATOM 0 HD1 TYR A 147 -14.832 -1.906 -2.872 1.00 2.19 H new ATOM 0 HD2 TYR A 147 -14.274 2.296 -3.273 1.00 2.23 H new ATOM 0 HE1 TYR A 147 -15.533 -2.042 -5.219 1.00 3.07 H new ATOM 0 HE2 TYR A 147 -14.971 2.162 -5.627 1.00 3.13 H new ATOM 0 HH TYR A 147 -15.664 0.867 -7.280 1.00 4.44 H new ATOM 2364 N ASN A 148 -10.422 0.588 -1.567 1.00 0.46 N ATOM 2365 CA ASN A 148 -9.352 1.537 -1.825 1.00 0.47 C ATOM 2366 C ASN A 148 -9.512 2.151 -3.209 1.00 0.45 C ATOM 2367 O ASN A 148 -9.278 1.500 -4.224 1.00 0.58 O ATOM 2368 CB ASN A 148 -7.994 0.839 -1.731 1.00 0.49 C ATOM 2369 CG ASN A 148 -7.692 0.314 -0.342 1.00 1.08 C ATOM 2370 OD1 ASN A 148 -8.058 0.928 0.663 1.00 1.45 O ATOM 2371 ND2 ASN A 148 -7.047 -0.840 -0.275 1.00 1.62 N ATOM 0 H ASN A 148 -10.121 -0.386 -1.588 1.00 0.46 H new ATOM 0 HA ASN A 148 -9.404 2.327 -1.075 1.00 0.47 H new ATOM 0 HB2 ASN A 148 -7.967 0.011 -2.440 1.00 0.49 H new ATOM 0 HB3 ASN A 148 -7.212 1.538 -2.027 1.00 0.49 H new ATOM 0 HD21 ASN A 148 -6.835 -1.254 0.633 1.00 1.62 H new ATOM 0 HD22 ASN A 148 -6.762 -1.315 -1.131 1.00 1.62 H new ATOM 2378 N HIS A 149 -9.935 3.398 -3.244 1.00 0.43 N ATOM 2379 CA HIS A 149 -10.094 4.110 -4.503 1.00 0.45 C ATOM 2380 C HIS A 149 -8.732 4.523 -5.028 1.00 0.40 C ATOM 2381 O HIS A 149 -7.883 4.932 -4.242 1.00 0.69 O ATOM 2382 CB HIS A 149 -10.944 5.351 -4.298 1.00 0.60 C ATOM 2383 CG HIS A 149 -12.366 5.066 -3.908 1.00 1.08 C ATOM 2384 ND1 HIS A 149 -13.393 5.003 -4.823 1.00 1.67 N ATOM 2385 CD2 HIS A 149 -12.929 4.830 -2.699 1.00 1.88 C ATOM 2386 CE1 HIS A 149 -14.524 4.742 -4.198 1.00 2.14 C ATOM 2387 NE2 HIS A 149 -14.273 4.630 -2.907 1.00 2.32 N ATOM 0 H HIS A 149 -10.176 3.943 -2.416 1.00 0.43 H new ATOM 0 HA HIS A 149 -10.584 3.452 -5.220 1.00 0.45 H new ATOM 0 HB2 HIS A 149 -10.484 5.969 -3.527 1.00 0.60 H new ATOM 0 HB3 HIS A 149 -10.942 5.935 -5.218 1.00 0.60 H new ATOM 0 HD2 HIS A 149 -12.417 4.804 -1.748 1.00 1.88 H new ATOM 0 HE1 HIS A 149 -15.493 4.637 -4.664 1.00 2.14 H new ATOM 0 HE2 HIS A 149 -14.963 4.428 -2.183 1.00 2.32 H new ATOM 2396 N PRO A 150 -8.583 4.497 -6.380 1.00 0.32 N ATOM 2397 CA PRO A 150 -7.330 4.569 -7.146 1.00 0.32 C ATOM 2398 C PRO A 150 -6.091 5.001 -6.376 1.00 0.36 C ATOM 2399 O PRO A 150 -5.465 6.013 -6.691 1.00 0.47 O ATOM 2400 CB PRO A 150 -7.704 5.600 -8.209 1.00 0.41 C ATOM 2401 CG PRO A 150 -9.191 5.446 -8.399 1.00 0.53 C ATOM 2402 CD PRO A 150 -9.682 4.483 -7.338 1.00 0.46 C ATOM 0 HA PRO A 150 -7.025 3.586 -7.504 1.00 0.32 H new ATOM 0 HB2 PRO A 150 -7.450 6.610 -7.886 1.00 0.41 H new ATOM 0 HB3 PRO A 150 -7.167 5.419 -9.140 1.00 0.41 H new ATOM 0 HG2 PRO A 150 -9.692 6.409 -8.306 1.00 0.53 H new ATOM 0 HG3 PRO A 150 -9.414 5.066 -9.396 1.00 0.53 H new ATOM 0 HD2 PRO A 150 -10.618 4.814 -6.889 1.00 0.46 H new ATOM 0 HD3 PRO A 150 -9.858 3.486 -7.742 1.00 0.46 H new ATOM 2410 N CYS A 151 -5.735 4.209 -5.387 1.00 0.38 N ATOM 2411 CA CYS A 151 -4.556 4.447 -4.592 1.00 0.48 C ATOM 2412 C CYS A 151 -3.355 3.749 -5.207 1.00 0.43 C ATOM 2413 O CYS A 151 -3.438 3.192 -6.304 1.00 0.77 O ATOM 2414 CB CYS A 151 -4.792 3.947 -3.169 1.00 0.84 C ATOM 2415 SG CYS A 151 -5.306 2.218 -3.071 1.00 1.58 S ATOM 0 H CYS A 151 -6.260 3.379 -5.113 1.00 0.38 H new ATOM 0 HA CYS A 151 -4.352 5.517 -4.565 1.00 0.48 H new ATOM 0 HB2 CYS A 151 -3.875 4.076 -2.593 1.00 0.84 H new ATOM 0 HB3 CYS A 151 -5.554 4.569 -2.698 1.00 0.84 H new ATOM 0 HG CYS A 151 -5.549 1.769 -4.267 1.00 1.58 H new ATOM 2421 N GLY A 152 -2.235 3.808 -4.517 1.00 0.34 N ATOM 2422 CA GLY A 152 -1.049 3.158 -4.998 1.00 0.39 C ATOM 2423 C GLY A 152 0.111 3.374 -4.070 1.00 0.36 C ATOM 2424 O GLY A 152 -0.067 3.800 -2.929 1.00 0.43 O ATOM 0 H GLY A 152 -2.128 4.297 -3.628 1.00 0.34 H new ATOM 0 HA2 GLY A 152 -1.236 2.090 -5.105 1.00 0.39 H new ATOM 0 HA3 GLY A 152 -0.800 3.539 -5.988 1.00 0.39 H new ATOM 2428 N PHE A 153 1.298 3.150 -4.585 1.00 0.32 N ATOM 2429 CA PHE A 153 2.480 3.015 -3.760 1.00 0.31 C ATOM 2430 C PHE A 153 3.693 3.229 -4.639 1.00 0.30 C ATOM 2431 O PHE A 153 4.189 2.291 -5.267 1.00 0.38 O ATOM 2432 CB PHE A 153 2.492 1.612 -3.134 1.00 0.36 C ATOM 2433 CG PHE A 153 3.586 1.346 -2.133 1.00 0.38 C ATOM 2434 CD1 PHE A 153 4.873 1.042 -2.546 1.00 0.49 C ATOM 2435 CD2 PHE A 153 3.312 1.364 -0.776 1.00 0.54 C ATOM 2436 CE1 PHE A 153 5.864 0.766 -1.627 1.00 0.55 C ATOM 2437 CE2 PHE A 153 4.301 1.092 0.149 1.00 0.60 C ATOM 2438 CZ PHE A 153 5.577 0.790 -0.276 1.00 0.52 C ATOM 0 H PHE A 153 1.473 3.056 -5.585 1.00 0.32 H new ATOM 0 HA PHE A 153 2.488 3.750 -2.955 1.00 0.31 H new ATOM 0 HB2 PHE A 153 1.532 1.445 -2.646 1.00 0.36 H new ATOM 0 HB3 PHE A 153 2.574 0.878 -3.936 1.00 0.36 H new ATOM 0 HD1 PHE A 153 5.103 1.021 -3.601 1.00 0.49 H new ATOM 0 HD2 PHE A 153 2.313 1.594 -0.437 1.00 0.54 H new ATOM 0 HE1 PHE A 153 6.863 0.531 -1.963 1.00 0.55 H new ATOM 0 HE2 PHE A 153 4.075 1.116 1.205 1.00 0.60 H new ATOM 0 HZ PHE A 153 6.351 0.573 0.446 1.00 0.52 H new ATOM 2448 N VAL A 154 4.150 4.460 -4.723 1.00 0.25 N ATOM 2449 CA VAL A 154 5.230 4.769 -5.622 1.00 0.25 C ATOM 2450 C VAL A 154 6.563 4.811 -4.885 1.00 0.24 C ATOM 2451 O VAL A 154 6.698 5.395 -3.809 1.00 0.31 O ATOM 2452 CB VAL A 154 5.006 6.083 -6.411 1.00 0.25 C ATOM 2453 CG1 VAL A 154 3.580 6.204 -6.925 1.00 0.27 C ATOM 2454 CG2 VAL A 154 5.382 7.311 -5.611 1.00 0.26 C ATOM 0 H VAL A 154 3.794 5.250 -4.186 1.00 0.25 H new ATOM 0 HA VAL A 154 5.255 3.962 -6.354 1.00 0.25 H new ATOM 0 HB VAL A 154 5.675 6.030 -7.270 1.00 0.25 H new ATOM 0 HG11 VAL A 154 3.469 7.140 -7.472 1.00 0.27 H new ATOM 0 HG12 VAL A 154 3.360 5.368 -7.589 1.00 0.27 H new ATOM 0 HG13 VAL A 154 2.888 6.191 -6.083 1.00 0.27 H new ATOM 0 HG21 VAL A 154 5.206 8.204 -6.211 1.00 0.26 H new ATOM 0 HG22 VAL A 154 4.775 7.356 -4.706 1.00 0.26 H new ATOM 0 HG23 VAL A 154 6.436 7.259 -5.339 1.00 0.26 H new ATOM 2464 N CYS A 155 7.538 4.153 -5.458 1.00 0.21 N ATOM 2465 CA CYS A 155 8.880 4.163 -4.916 1.00 0.23 C ATOM 2466 C CYS A 155 9.782 4.967 -5.833 1.00 0.27 C ATOM 2467 O CYS A 155 9.944 4.632 -7.004 1.00 0.42 O ATOM 2468 CB CYS A 155 9.387 2.736 -4.766 1.00 0.27 C ATOM 2469 SG CYS A 155 11.140 2.610 -4.355 1.00 1.55 S ATOM 0 H CYS A 155 7.430 3.598 -6.307 1.00 0.21 H new ATOM 0 HA CYS A 155 8.879 4.627 -3.930 1.00 0.23 H new ATOM 0 HB2 CYS A 155 8.807 2.236 -3.990 1.00 0.27 H new ATOM 0 HB3 CYS A 155 9.204 2.198 -5.696 1.00 0.27 H new ATOM 0 HG CYS A 155 11.622 1.507 -4.845 1.00 1.55 H new ATOM 2475 N SER A 156 10.360 6.032 -5.309 1.00 0.25 N ATOM 2476 CA SER A 156 11.088 6.971 -6.137 1.00 0.29 C ATOM 2477 C SER A 156 12.562 7.008 -5.760 1.00 0.30 C ATOM 2478 O SER A 156 12.906 7.246 -4.608 1.00 0.29 O ATOM 2479 CB SER A 156 10.480 8.364 -5.984 1.00 0.32 C ATOM 2480 OG SER A 156 9.067 8.316 -6.079 1.00 1.06 O ATOM 0 H SER A 156 10.339 6.267 -4.317 1.00 0.25 H new ATOM 0 HA SER A 156 11.011 6.646 -7.175 1.00 0.29 H new ATOM 0 HB2 SER A 156 10.769 8.787 -5.022 1.00 0.32 H new ATOM 0 HB3 SER A 156 10.877 9.025 -6.755 1.00 0.32 H new ATOM 0 HG SER A 156 8.701 9.219 -5.976 1.00 1.06 H new ATOM 2486 N PRO A 157 13.449 6.731 -6.718 1.00 0.36 N ATOM 2487 CA PRO A 157 14.877 6.962 -6.538 1.00 0.39 C ATOM 2488 C PRO A 157 15.139 8.401 -6.109 1.00 0.40 C ATOM 2489 O PRO A 157 14.668 9.344 -6.755 1.00 0.49 O ATOM 2490 CB PRO A 157 15.465 6.707 -7.926 1.00 0.51 C ATOM 2491 CG PRO A 157 14.476 5.836 -8.623 1.00 0.56 C ATOM 2492 CD PRO A 157 13.133 6.152 -8.030 1.00 0.45 C ATOM 0 HA PRO A 157 15.312 6.326 -5.767 1.00 0.39 H new ATOM 0 HB2 PRO A 157 15.615 7.642 -8.467 1.00 0.51 H new ATOM 0 HB3 PRO A 157 16.437 6.219 -7.857 1.00 0.51 H new ATOM 0 HG2 PRO A 157 14.480 6.027 -9.696 1.00 0.56 H new ATOM 0 HG3 PRO A 157 14.722 4.783 -8.485 1.00 0.56 H new ATOM 0 HD2 PRO A 157 12.577 6.854 -8.652 1.00 0.45 H new ATOM 0 HD3 PRO A 157 12.519 5.257 -7.933 1.00 0.45 H new ATOM 2500 N MET A 158 15.862 8.574 -5.012 1.00 0.37 N ATOM 2501 CA MET A 158 16.153 9.910 -4.509 1.00 0.43 C ATOM 2502 C MET A 158 17.367 10.492 -5.184 1.00 0.48 C ATOM 2503 O MET A 158 17.844 9.973 -6.191 1.00 0.49 O ATOM 2504 CB MET A 158 16.405 9.907 -3.009 1.00 0.43 C ATOM 2505 CG MET A 158 15.152 9.954 -2.168 1.00 0.50 C ATOM 2506 SD MET A 158 14.172 11.445 -2.439 1.00 0.95 S ATOM 2507 CE MET A 158 15.297 12.718 -1.869 1.00 1.16 C ATOM 0 H MET A 158 16.255 7.814 -4.457 1.00 0.37 H new ATOM 0 HA MET A 158 15.274 10.516 -4.728 1.00 0.43 H new ATOM 0 HB2 MET A 158 16.969 9.012 -2.749 1.00 0.43 H new ATOM 0 HB3 MET A 158 17.031 10.763 -2.756 1.00 0.43 H new ATOM 0 HG2 MET A 158 14.540 9.079 -2.389 1.00 0.50 H new ATOM 0 HG3 MET A 158 15.426 9.893 -1.115 1.00 0.50 H new ATOM 0 HE1 MET A 158 14.761 13.416 -1.226 1.00 1.16 H new ATOM 0 HE2 MET A 158 16.111 12.259 -1.307 1.00 1.16 H new ATOM 0 HE3 MET A 158 15.705 13.254 -2.726 1.00 1.16 H new ATOM 2517 N GLU A 159 17.874 11.565 -4.618 1.00 0.57 N ATOM 2518 CA GLU A 159 19.085 12.162 -5.111 1.00 0.62 C ATOM 2519 C GLU A 159 20.274 11.299 -4.700 1.00 0.54 C ATOM 2520 O GLU A 159 21.236 11.131 -5.447 1.00 0.59 O ATOM 2521 CB GLU A 159 19.205 13.586 -4.578 1.00 0.76 C ATOM 2522 CG GLU A 159 17.927 14.386 -4.772 1.00 1.38 C ATOM 2523 CD GLU A 159 17.986 15.766 -4.161 1.00 1.87 C ATOM 2524 OE1 GLU A 159 18.049 15.870 -2.918 1.00 2.63 O ATOM 2525 OE2 GLU A 159 17.963 16.756 -4.920 1.00 2.09 O ATOM 0 H GLU A 159 17.462 12.039 -3.814 1.00 0.57 H new ATOM 0 HA GLU A 159 19.067 12.216 -6.200 1.00 0.62 H new ATOM 0 HB2 GLU A 159 19.453 13.554 -3.517 1.00 0.76 H new ATOM 0 HB3 GLU A 159 20.028 14.092 -5.083 1.00 0.76 H new ATOM 0 HG2 GLU A 159 17.722 14.477 -5.839 1.00 1.38 H new ATOM 0 HG3 GLU A 159 17.093 13.838 -4.333 1.00 1.38 H new ATOM 2532 N GLU A 160 20.162 10.726 -3.511 1.00 0.52 N ATOM 2533 CA GLU A 160 21.124 9.759 -2.999 1.00 0.55 C ATOM 2534 C GLU A 160 20.537 8.361 -3.135 1.00 0.58 C ATOM 2535 O GLU A 160 20.825 7.470 -2.342 1.00 0.76 O ATOM 2536 CB GLU A 160 21.425 10.051 -1.539 1.00 0.63 C ATOM 2537 CG GLU A 160 21.912 11.471 -1.281 1.00 0.77 C ATOM 2538 CD GLU A 160 23.234 11.778 -1.956 1.00 1.32 C ATOM 2539 OE1 GLU A 160 24.290 11.492 -1.359 1.00 1.61 O ATOM 2540 OE2 GLU A 160 23.227 12.323 -3.081 1.00 2.05 O ATOM 0 H GLU A 160 19.394 10.920 -2.868 1.00 0.52 H new ATOM 0 HA GLU A 160 22.051 9.827 -3.568 1.00 0.55 H new ATOM 0 HB2 GLU A 160 20.525 9.873 -0.950 1.00 0.63 H new ATOM 0 HB3 GLU A 160 22.180 9.349 -1.186 1.00 0.63 H new ATOM 0 HG2 GLU A 160 21.159 12.176 -1.632 1.00 0.77 H new ATOM 0 HG3 GLU A 160 22.015 11.624 -0.207 1.00 0.77 H new ATOM 2547 N ASN A 161 19.694 8.227 -4.152 1.00 0.51 N ATOM 2548 CA ASN A 161 18.852 7.043 -4.408 1.00 0.65 C ATOM 2549 C ASN A 161 19.395 5.696 -3.904 1.00 0.53 C ATOM 2550 O ASN A 161 18.694 5.028 -3.152 1.00 0.53 O ATOM 2551 CB ASN A 161 18.436 6.929 -5.894 1.00 0.92 C ATOM 2552 CG ASN A 161 19.534 7.222 -6.909 1.00 1.07 C ATOM 2553 OD1 ASN A 161 20.381 8.094 -6.714 1.00 1.93 O ATOM 2554 ND2 ASN A 161 19.523 6.487 -8.009 1.00 1.62 N ATOM 0 H ASN A 161 19.566 8.959 -4.850 1.00 0.51 H new ATOM 0 HA ASN A 161 17.974 7.240 -3.793 1.00 0.65 H new ATOM 0 HB2 ASN A 161 18.061 5.921 -6.072 1.00 0.92 H new ATOM 0 HB3 ASN A 161 17.607 7.614 -6.074 1.00 0.92 H new ATOM 0 HD21 ASN A 161 20.231 6.634 -8.728 1.00 1.62 H new ATOM 0 HD22 ASN A 161 18.806 5.773 -8.138 1.00 1.62 H new ATOM 2561 N PRO A 162 20.609 5.238 -4.272 1.00 0.55 N ATOM 2562 CA PRO A 162 21.038 3.898 -3.888 1.00 0.57 C ATOM 2563 C PRO A 162 21.287 3.765 -2.381 1.00 0.55 C ATOM 2564 O PRO A 162 21.419 2.659 -1.852 1.00 0.63 O ATOM 2565 CB PRO A 162 22.336 3.689 -4.667 1.00 0.71 C ATOM 2566 CG PRO A 162 22.853 5.062 -4.899 1.00 0.73 C ATOM 2567 CD PRO A 162 21.639 5.930 -5.065 1.00 0.67 C ATOM 0 HA PRO A 162 20.272 3.156 -4.112 1.00 0.57 H new ATOM 0 HB2 PRO A 162 23.047 3.087 -4.101 1.00 0.71 H new ATOM 0 HB3 PRO A 162 22.156 3.168 -5.607 1.00 0.71 H new ATOM 0 HG2 PRO A 162 23.463 5.398 -4.060 1.00 0.73 H new ATOM 0 HG3 PRO A 162 23.484 5.098 -5.787 1.00 0.73 H new ATOM 0 HD2 PRO A 162 21.816 6.941 -4.698 1.00 0.67 H new ATOM 0 HD3 PRO A 162 21.348 6.017 -6.112 1.00 0.67 H new ATOM 2575 N ALA A 163 21.358 4.902 -1.701 1.00 0.53 N ATOM 2576 CA ALA A 163 21.579 4.936 -0.263 1.00 0.59 C ATOM 2577 C ALA A 163 20.322 5.394 0.466 1.00 0.53 C ATOM 2578 O ALA A 163 20.057 4.975 1.592 1.00 0.58 O ATOM 2579 CB ALA A 163 22.744 5.855 0.066 1.00 0.68 C ATOM 0 H ALA A 163 21.264 5.823 -2.130 1.00 0.53 H new ATOM 0 HA ALA A 163 21.820 3.927 0.072 1.00 0.59 H new ATOM 0 HB1 ALA A 163 22.900 5.873 1.145 1.00 0.68 H new ATOM 0 HB2 ALA A 163 23.646 5.489 -0.425 1.00 0.68 H new ATOM 0 HB3 ALA A 163 22.523 6.863 -0.285 1.00 0.68 H new ATOM 2585 N TYR A 164 19.564 6.269 -0.180 1.00 0.45 N ATOM 2586 CA TYR A 164 18.316 6.781 0.371 1.00 0.40 C ATOM 2587 C TYR A 164 17.268 6.851 -0.730 1.00 0.32 C ATOM 2588 O TYR A 164 17.513 7.443 -1.776 1.00 0.38 O ATOM 2589 CB TYR A 164 18.527 8.174 0.976 1.00 0.46 C ATOM 2590 CG TYR A 164 19.359 8.174 2.242 1.00 0.56 C ATOM 2591 CD1 TYR A 164 18.771 7.982 3.487 1.00 0.61 C ATOM 2592 CD2 TYR A 164 20.732 8.374 2.190 1.00 0.67 C ATOM 2593 CE1 TYR A 164 19.531 7.989 4.642 1.00 0.73 C ATOM 2594 CE2 TYR A 164 21.497 8.383 3.340 1.00 0.78 C ATOM 2595 CZ TYR A 164 20.878 8.158 4.572 1.00 0.79 C ATOM 2596 OH TYR A 164 21.652 8.206 5.711 1.00 0.93 O ATOM 0 H TYR A 164 19.796 6.644 -1.100 1.00 0.45 H new ATOM 0 HA TYR A 164 17.976 6.109 1.159 1.00 0.40 H new ATOM 0 HB2 TYR A 164 19.010 8.812 0.236 1.00 0.46 H new ATOM 0 HB3 TYR A 164 17.555 8.617 1.192 1.00 0.46 H new ATOM 0 HD1 TYR A 164 17.705 7.825 3.553 1.00 0.61 H new ATOM 0 HD2 TYR A 164 21.210 8.525 1.234 1.00 0.67 H new ATOM 0 HE1 TYR A 164 19.053 7.860 5.602 1.00 0.73 H new ATOM 0 HE2 TYR A 164 22.561 8.562 3.287 1.00 0.78 H new ATOM 0 HH TYR A 164 22.592 8.331 5.463 1.00 0.93 H new ATOM 2606 N SER A 165 16.109 6.254 -0.506 1.00 0.26 N ATOM 2607 CA SER A 165 15.087 6.210 -1.541 1.00 0.24 C ATOM 2608 C SER A 165 13.761 6.764 -1.050 1.00 0.23 C ATOM 2609 O SER A 165 13.463 6.738 0.141 1.00 0.26 O ATOM 2610 CB SER A 165 14.905 4.787 -2.036 1.00 0.30 C ATOM 2611 OG SER A 165 16.074 4.328 -2.670 1.00 1.41 O ATOM 0 H SER A 165 15.853 5.799 0.370 1.00 0.26 H new ATOM 0 HA SER A 165 15.425 6.840 -2.364 1.00 0.24 H new ATOM 0 HB2 SER A 165 14.659 4.134 -1.199 1.00 0.30 H new ATOM 0 HB3 SER A 165 14.067 4.743 -2.731 1.00 0.30 H new ATOM 0 HG SER A 165 16.783 4.210 -2.004 1.00 1.41 H new ATOM 2617 N LYS A 166 12.963 7.255 -1.983 1.00 0.24 N ATOM 2618 CA LYS A 166 11.722 7.914 -1.651 1.00 0.26 C ATOM 2619 C LYS A 166 10.529 6.973 -1.753 1.00 0.28 C ATOM 2620 O LYS A 166 10.072 6.625 -2.831 1.00 0.43 O ATOM 2621 CB LYS A 166 11.546 9.158 -2.531 1.00 0.36 C ATOM 2622 CG LYS A 166 10.160 9.787 -2.481 1.00 0.32 C ATOM 2623 CD LYS A 166 9.672 9.976 -1.058 1.00 0.37 C ATOM 2624 CE LYS A 166 10.593 10.880 -0.255 1.00 0.47 C ATOM 2625 NZ LYS A 166 10.705 12.239 -0.851 1.00 0.74 N ATOM 0 H LYS A 166 13.159 7.206 -2.983 1.00 0.24 H new ATOM 0 HA LYS A 166 11.768 8.229 -0.609 1.00 0.26 H new ATOM 0 HB2 LYS A 166 12.280 9.906 -2.229 1.00 0.36 H new ATOM 0 HB3 LYS A 166 11.770 8.890 -3.563 1.00 0.36 H new ATOM 0 HG2 LYS A 166 10.181 10.752 -2.988 1.00 0.32 H new ATOM 0 HG3 LYS A 166 9.456 9.157 -3.025 1.00 0.32 H new ATOM 0 HD2 LYS A 166 8.669 10.402 -1.072 1.00 0.37 H new ATOM 0 HD3 LYS A 166 9.599 9.005 -0.568 1.00 0.37 H new ATOM 0 HE2 LYS A 166 10.219 10.962 0.766 1.00 0.47 H new ATOM 0 HE3 LYS A 166 11.583 10.428 -0.197 1.00 0.47 H new ATOM 0 HZ1 LYS A 166 11.201 12.869 -0.188 1.00 0.74 H new ATOM 0 HZ2 LYS A 166 11.239 12.184 -1.742 1.00 0.74 H new ATOM 0 HZ3 LYS A 166 9.754 12.615 -1.040 1.00 0.74 H new ATOM 2639 N LEU A 167 10.049 6.574 -0.600 1.00 0.20 N ATOM 2640 CA LEU A 167 8.863 5.754 -0.479 1.00 0.21 C ATOM 2641 C LEU A 167 7.644 6.656 -0.294 1.00 0.20 C ATOM 2642 O LEU A 167 7.490 7.281 0.756 1.00 0.24 O ATOM 2643 CB LEU A 167 9.035 4.838 0.739 1.00 0.23 C ATOM 2644 CG LEU A 167 8.205 3.553 0.767 1.00 0.24 C ATOM 2645 CD1 LEU A 167 6.719 3.844 0.708 1.00 0.27 C ATOM 2646 CD2 LEU A 167 8.627 2.632 -0.371 1.00 0.25 C ATOM 0 H LEU A 167 10.476 6.812 0.295 1.00 0.20 H new ATOM 0 HA LEU A 167 8.719 5.151 -1.375 1.00 0.21 H new ATOM 0 HB2 LEU A 167 10.087 4.563 0.809 1.00 0.23 H new ATOM 0 HB3 LEU A 167 8.796 5.415 1.633 1.00 0.23 H new ATOM 0 HG LEU A 167 8.395 3.049 1.715 1.00 0.24 H new ATOM 0 HD11 LEU A 167 6.163 2.906 0.730 1.00 0.27 H new ATOM 0 HD12 LEU A 167 6.434 4.455 1.564 1.00 0.27 H new ATOM 0 HD13 LEU A 167 6.490 4.380 -0.213 1.00 0.27 H new ATOM 0 HD21 LEU A 167 8.030 1.720 -0.342 1.00 0.25 H new ATOM 0 HD22 LEU A 167 8.472 3.137 -1.324 1.00 0.25 H new ATOM 0 HD23 LEU A 167 9.682 2.379 -0.262 1.00 0.25 H new ATOM 2658 N VAL A 168 6.794 6.749 -1.306 1.00 0.19 N ATOM 2659 CA VAL A 168 5.571 7.549 -1.174 1.00 0.20 C ATOM 2660 C VAL A 168 4.336 6.761 -1.611 1.00 0.23 C ATOM 2661 O VAL A 168 4.332 6.100 -2.640 1.00 0.28 O ATOM 2662 CB VAL A 168 5.684 8.910 -1.921 1.00 0.20 C ATOM 2663 CG1 VAL A 168 6.719 8.841 -3.024 1.00 0.21 C ATOM 2664 CG2 VAL A 168 4.340 9.364 -2.482 1.00 0.26 C ATOM 0 H VAL A 168 6.917 6.294 -2.211 1.00 0.19 H new ATOM 0 HA VAL A 168 5.450 7.779 -0.116 1.00 0.20 H new ATOM 0 HB VAL A 168 6.005 9.650 -1.188 1.00 0.20 H new ATOM 0 HG11 VAL A 168 6.777 9.805 -3.529 1.00 0.21 H new ATOM 0 HG12 VAL A 168 7.691 8.596 -2.596 1.00 0.21 H new ATOM 0 HG13 VAL A 168 6.435 8.072 -3.742 1.00 0.21 H new ATOM 0 HG21 VAL A 168 4.463 10.318 -2.995 1.00 0.26 H new ATOM 0 HG22 VAL A 168 3.969 8.619 -3.185 1.00 0.26 H new ATOM 0 HG23 VAL A 168 3.626 9.481 -1.667 1.00 0.26 H new ATOM 2674 N MET A 169 3.295 6.838 -0.800 1.00 0.29 N ATOM 2675 CA MET A 169 2.085 6.064 -1.003 1.00 0.32 C ATOM 2676 C MET A 169 0.881 6.900 -0.605 1.00 0.34 C ATOM 2677 O MET A 169 0.994 7.774 0.246 1.00 0.45 O ATOM 2678 CB MET A 169 2.138 4.793 -0.139 1.00 0.35 C ATOM 2679 CG MET A 169 0.834 4.010 -0.110 1.00 0.40 C ATOM 2680 SD MET A 169 0.832 2.681 1.105 1.00 0.74 S ATOM 2681 CE MET A 169 -0.806 2.003 0.843 1.00 1.24 C ATOM 0 H MET A 169 3.266 7.442 0.021 1.00 0.29 H new ATOM 0 HA MET A 169 2.002 5.784 -2.053 1.00 0.32 H new ATOM 0 HB2 MET A 169 2.931 4.145 -0.512 1.00 0.35 H new ATOM 0 HB3 MET A 169 2.406 5.070 0.880 1.00 0.35 H new ATOM 0 HG2 MET A 169 0.012 4.693 0.106 1.00 0.40 H new ATOM 0 HG3 MET A 169 0.648 3.590 -1.099 1.00 0.40 H new ATOM 0 HE1 MET A 169 -0.837 0.975 1.205 1.00 1.24 H new ATOM 0 HE2 MET A 169 -1.538 2.601 1.385 1.00 1.24 H new ATOM 0 HE3 MET A 169 -1.041 2.020 -0.221 1.00 1.24 H new ATOM 2691 N PHE A 170 -0.260 6.654 -1.216 1.00 0.36 N ATOM 2692 CA PHE A 170 -1.490 7.270 -0.751 1.00 0.42 C ATOM 2693 C PHE A 170 -2.587 6.241 -0.732 1.00 0.37 C ATOM 2694 O PHE A 170 -2.565 5.283 -1.513 1.00 0.38 O ATOM 2695 CB PHE A 170 -1.880 8.527 -1.576 1.00 0.69 C ATOM 2696 CG PHE A 170 -2.963 8.387 -2.642 1.00 1.26 C ATOM 2697 CD1 PHE A 170 -4.183 7.835 -2.314 1.00 2.02 C ATOM 2698 CD2 PHE A 170 -2.748 8.742 -3.971 1.00 1.74 C ATOM 2699 CE1 PHE A 170 -5.162 7.653 -3.275 1.00 3.07 C ATOM 2700 CE2 PHE A 170 -3.719 8.559 -4.930 1.00 2.73 C ATOM 2701 CZ PHE A 170 -4.947 8.250 -4.593 1.00 3.37 C ATOM 0 H PHE A 170 -0.364 6.041 -2.025 1.00 0.36 H new ATOM 0 HA PHE A 170 -1.329 7.632 0.264 1.00 0.42 H new ATOM 0 HB2 PHE A 170 -2.201 9.298 -0.875 1.00 0.69 H new ATOM 0 HB3 PHE A 170 -0.978 8.896 -2.065 1.00 0.69 H new ATOM 0 HD1 PHE A 170 -4.377 7.541 -1.293 1.00 2.02 H new ATOM 0 HD2 PHE A 170 -1.798 9.170 -4.256 1.00 1.74 H new ATOM 0 HE1 PHE A 170 -6.057 7.088 -3.059 1.00 3.07 H new ATOM 0 HE2 PHE A 170 -3.465 8.672 -5.974 1.00 2.73 H new ATOM 0 HZ PHE A 170 -5.773 8.430 -5.266 1.00 3.37 H new ATOM 2711 N VAL A 171 -3.546 6.441 0.154 1.00 0.43 N ATOM 2712 CA VAL A 171 -4.681 5.559 0.222 1.00 0.50 C ATOM 2713 C VAL A 171 -5.970 6.371 0.340 1.00 0.49 C ATOM 2714 O VAL A 171 -6.058 7.333 1.113 1.00 0.50 O ATOM 2715 CB VAL A 171 -4.540 4.548 1.386 1.00 0.66 C ATOM 2716 CG1 VAL A 171 -4.882 5.171 2.733 1.00 1.28 C ATOM 2717 CG2 VAL A 171 -5.377 3.310 1.117 1.00 1.40 C ATOM 0 H VAL A 171 -3.556 7.204 0.830 1.00 0.43 H new ATOM 0 HA VAL A 171 -4.724 4.979 -0.700 1.00 0.50 H new ATOM 0 HB VAL A 171 -3.493 4.250 1.440 1.00 0.66 H new ATOM 0 HG11 VAL A 171 -4.769 4.424 3.519 1.00 1.28 H new ATOM 0 HG12 VAL A 171 -4.211 6.007 2.928 1.00 1.28 H new ATOM 0 HG13 VAL A 171 -5.912 5.528 2.718 1.00 1.28 H new ATOM 0 HG21 VAL A 171 -5.267 2.609 1.945 1.00 1.40 H new ATOM 0 HG22 VAL A 171 -6.425 3.594 1.019 1.00 1.40 H new ATOM 0 HG23 VAL A 171 -5.041 2.837 0.194 1.00 1.40 H new ATOM 2727 N GLN A 172 -6.950 6.006 -0.471 1.00 0.57 N ATOM 2728 CA GLN A 172 -8.252 6.643 -0.440 1.00 0.65 C ATOM 2729 C GLN A 172 -9.267 5.566 -0.144 1.00 0.65 C ATOM 2730 O GLN A 172 -10.089 5.180 -0.981 1.00 0.95 O ATOM 2731 CB GLN A 172 -8.563 7.375 -1.754 1.00 0.80 C ATOM 2732 CG GLN A 172 -9.950 8.011 -1.787 1.00 1.01 C ATOM 2733 CD GLN A 172 -10.113 9.034 -2.894 1.00 1.54 C ATOM 2734 OE1 GLN A 172 -10.422 8.572 -4.090 1.00 2.17 O flip ATOM 2735 NE2 GLN A 172 -9.944 10.231 -2.678 1.00 2.15 N flip ATOM 0 H GLN A 172 -6.864 5.264 -1.165 1.00 0.57 H new ATOM 0 HA GLN A 172 -8.278 7.411 0.333 1.00 0.65 H new ATOM 0 HB2 GLN A 172 -7.813 8.150 -1.914 1.00 0.80 H new ATOM 0 HB3 GLN A 172 -8.476 6.671 -2.582 1.00 0.80 H new ATOM 0 HG2 GLN A 172 -10.698 7.228 -1.912 1.00 1.01 H new ATOM 0 HG3 GLN A 172 -10.146 8.490 -0.827 1.00 1.01 H new ATOM 0 HE21 GLN A 172 -9.706 10.551 -1.739 1.00 2.15 H new ATOM 0 HE22 GLN A 172 -10.042 10.905 -3.437 1.00 2.15 H new ATOM 2744 N THR A 173 -9.141 5.042 1.051 1.00 0.59 N ATOM 2745 CA THR A 173 -9.953 3.936 1.495 1.00 0.66 C ATOM 2746 C THR A 173 -11.398 4.376 1.676 1.00 0.75 C ATOM 2747 O THR A 173 -11.673 5.532 2.000 1.00 1.01 O ATOM 2748 CB THR A 173 -9.411 3.387 2.823 1.00 0.93 C ATOM 2749 OG1 THR A 173 -7.984 3.493 2.837 1.00 1.65 O ATOM 2750 CG2 THR A 173 -9.800 1.932 2.995 1.00 1.12 C ATOM 0 H THR A 173 -8.470 5.372 1.745 1.00 0.59 H new ATOM 0 HA THR A 173 -9.915 3.153 0.738 1.00 0.66 H new ATOM 0 HB THR A 173 -9.838 3.969 3.640 1.00 0.93 H new ATOM 0 HG1 THR A 173 -7.684 3.753 3.733 1.00 1.65 H new ATOM 0 HG21 THR A 173 -9.407 1.560 3.941 1.00 1.12 H new ATOM 0 HG22 THR A 173 -10.886 1.843 2.993 1.00 1.12 H new ATOM 0 HG23 THR A 173 -9.386 1.345 2.175 1.00 1.12 H new ATOM 2758 N GLU A 174 -12.322 3.451 1.462 1.00 0.69 N ATOM 2759 CA GLU A 174 -13.728 3.739 1.658 1.00 0.87 C ATOM 2760 C GLU A 174 -14.080 3.615 3.130 1.00 0.99 C ATOM 2761 O GLU A 174 -15.130 4.084 3.569 1.00 1.32 O ATOM 2762 CB GLU A 174 -14.573 2.769 0.843 1.00 0.97 C ATOM 2763 CG GLU A 174 -16.067 2.980 0.986 1.00 1.10 C ATOM 2764 CD GLU A 174 -16.649 3.781 -0.160 1.00 1.80 C ATOM 2765 OE1 GLU A 174 -16.141 3.662 -1.294 1.00 2.30 O ATOM 2766 OE2 GLU A 174 -17.606 4.547 0.068 1.00 2.45 O ATOM 0 H GLU A 174 -12.121 2.500 1.154 1.00 0.69 H new ATOM 0 HA GLU A 174 -13.932 4.757 1.326 1.00 0.87 H new ATOM 0 HB2 GLU A 174 -14.302 2.863 -0.209 1.00 0.97 H new ATOM 0 HB3 GLU A 174 -14.330 1.750 1.145 1.00 0.97 H new ATOM 0 HG2 GLU A 174 -16.565 2.012 1.038 1.00 1.10 H new ATOM 0 HG3 GLU A 174 -16.270 3.494 1.925 1.00 1.10 H new ATOM 2898 N ILE A 183 -11.543 5.954 14.791 1.00 1.04 N ATOM 2899 CA ILE A 183 -10.823 4.706 14.568 1.00 0.90 C ATOM 2900 C ILE A 183 -10.097 4.787 13.248 1.00 0.79 C ATOM 2901 O ILE A 183 -9.038 4.203 13.040 1.00 0.69 O ATOM 2902 CB ILE A 183 -11.806 3.529 14.496 1.00 0.96 C ATOM 2903 CG1 ILE A 183 -12.792 3.594 15.661 1.00 1.09 C ATOM 2904 CG2 ILE A 183 -11.063 2.200 14.485 1.00 0.92 C ATOM 2905 CD1 ILE A 183 -12.181 3.259 17.006 1.00 1.12 C ATOM 0 HA ILE A 183 -10.124 4.553 15.391 1.00 0.90 H new ATOM 0 HB ILE A 183 -12.367 3.603 13.564 1.00 0.96 H new ATOM 0 HG12 ILE A 183 -13.218 4.596 15.707 1.00 1.09 H new ATOM 0 HG13 ILE A 183 -13.615 2.906 15.466 1.00 1.09 H new ATOM 0 HG21 ILE A 183 -11.781 1.382 14.434 1.00 0.92 H new ATOM 0 HG22 ILE A 183 -10.404 2.159 13.618 1.00 0.92 H new ATOM 0 HG23 ILE A 183 -10.471 2.106 15.396 1.00 0.92 H new ATOM 0 HD11 ILE A 183 -12.945 3.328 17.780 1.00 1.12 H new ATOM 0 HD12 ILE A 183 -11.780 2.246 16.981 1.00 1.12 H new ATOM 0 HD13 ILE A 183 -11.378 3.962 17.226 1.00 1.12 H new ATOM 2917 N ILE A 184 -10.695 5.557 12.381 1.00 0.87 N ATOM 2918 CA ILE A 184 -10.296 5.668 11.013 1.00 0.83 C ATOM 2919 C ILE A 184 -9.156 6.661 10.870 1.00 0.81 C ATOM 2920 O ILE A 184 -8.221 6.455 10.090 1.00 0.75 O ATOM 2921 CB ILE A 184 -11.499 6.081 10.149 1.00 0.96 C ATOM 2922 CG1 ILE A 184 -12.322 4.864 9.739 1.00 0.98 C ATOM 2923 CG2 ILE A 184 -11.065 6.863 8.917 1.00 1.00 C ATOM 2924 CD1 ILE A 184 -13.598 4.711 10.531 1.00 1.13 C ATOM 0 H ILE A 184 -11.497 6.140 12.619 1.00 0.87 H new ATOM 0 HA ILE A 184 -9.939 4.698 10.667 1.00 0.83 H new ATOM 0 HB ILE A 184 -12.123 6.734 10.759 1.00 0.96 H new ATOM 0 HG12 ILE A 184 -12.567 4.940 8.680 1.00 0.98 H new ATOM 0 HG13 ILE A 184 -11.716 3.966 9.862 1.00 0.98 H new ATOM 0 HG21 ILE A 184 -11.943 7.137 8.332 1.00 1.00 H new ATOM 0 HG22 ILE A 184 -10.539 7.766 9.226 1.00 1.00 H new ATOM 0 HG23 ILE A 184 -10.402 6.247 8.310 1.00 1.00 H new ATOM 0 HD11 ILE A 184 -14.135 3.826 10.189 1.00 1.13 H new ATOM 0 HD12 ILE A 184 -13.359 4.604 11.589 1.00 1.13 H new ATOM 0 HD13 ILE A 184 -14.223 5.593 10.388 1.00 1.13 H new ATOM 2936 N GLU A 185 -9.221 7.721 11.661 1.00 0.91 N ATOM 2937 CA GLU A 185 -8.142 8.694 11.719 1.00 0.99 C ATOM 2938 C GLU A 185 -6.891 8.027 12.272 1.00 0.91 C ATOM 2939 O GLU A 185 -5.789 8.558 12.177 1.00 0.99 O ATOM 2940 CB GLU A 185 -8.531 9.909 12.562 1.00 1.17 C ATOM 2941 CG GLU A 185 -9.052 9.559 13.943 1.00 1.58 C ATOM 2942 CD GLU A 185 -9.334 10.785 14.782 1.00 2.26 C ATOM 2943 OE1 GLU A 185 -10.293 11.520 14.462 1.00 2.89 O ATOM 2944 OE2 GLU A 185 -8.599 11.022 15.765 1.00 2.46 O ATOM 0 H GLU A 185 -10.011 7.929 12.272 1.00 0.91 H new ATOM 0 HA GLU A 185 -7.941 9.055 10.710 1.00 0.99 H new ATOM 0 HB2 GLU A 185 -7.663 10.559 12.666 1.00 1.17 H new ATOM 0 HB3 GLU A 185 -9.294 10.478 12.030 1.00 1.17 H new ATOM 0 HG2 GLU A 185 -9.965 8.971 13.846 1.00 1.58 H new ATOM 0 HG3 GLU A 185 -8.322 8.932 14.455 1.00 1.58 H new ATOM 2951 N LYS A 186 -7.081 6.875 12.897 1.00 0.82 N ATOM 2952 CA LYS A 186 -5.971 6.043 13.300 1.00 0.79 C ATOM 2953 C LYS A 186 -5.645 5.030 12.211 1.00 0.70 C ATOM 2954 O LYS A 186 -4.483 4.837 11.870 1.00 0.86 O ATOM 2955 CB LYS A 186 -6.281 5.324 14.612 1.00 0.80 C ATOM 2956 CG LYS A 186 -6.635 6.280 15.734 1.00 1.27 C ATOM 2957 CD LYS A 186 -6.883 5.553 17.041 1.00 1.28 C ATOM 2958 CE LYS A 186 -8.202 4.802 17.019 1.00 0.96 C ATOM 2959 NZ LYS A 186 -8.457 4.108 18.304 1.00 1.09 N ATOM 0 H LYS A 186 -7.999 6.499 13.134 1.00 0.82 H new ATOM 0 HA LYS A 186 -5.104 6.684 13.455 1.00 0.79 H new ATOM 0 HB2 LYS A 186 -7.108 4.632 14.455 1.00 0.80 H new ATOM 0 HB3 LYS A 186 -5.418 4.727 14.907 1.00 0.80 H new ATOM 0 HG2 LYS A 186 -5.827 6.999 15.867 1.00 1.27 H new ATOM 0 HG3 LYS A 186 -7.524 6.847 15.460 1.00 1.27 H new ATOM 0 HD2 LYS A 186 -6.068 4.854 17.230 1.00 1.28 H new ATOM 0 HD3 LYS A 186 -6.885 6.270 17.862 1.00 1.28 H new ATOM 0 HE2 LYS A 186 -9.015 5.499 16.814 1.00 0.96 H new ATOM 0 HE3 LYS A 186 -8.193 4.074 16.207 1.00 0.96 H new ATOM 0 HZ1 LYS A 186 -9.366 3.606 18.253 1.00 1.09 H new ATOM 0 HZ2 LYS A 186 -7.694 3.425 18.487 1.00 1.09 H new ATOM 0 HZ3 LYS A 186 -8.490 4.806 19.075 1.00 1.09 H new ATOM 2973 N THR A 187 -6.678 4.412 11.637 1.00 0.59 N ATOM 2974 CA THR A 187 -6.466 3.276 10.744 1.00 0.54 C ATOM 2975 C THR A 187 -5.709 3.657 9.465 1.00 0.50 C ATOM 2976 O THR A 187 -4.846 2.906 9.027 1.00 0.53 O ATOM 2977 CB THR A 187 -7.787 2.551 10.385 1.00 0.58 C ATOM 2978 OG1 THR A 187 -7.501 1.316 9.714 1.00 0.62 O ATOM 2979 CG2 THR A 187 -8.666 3.399 9.492 1.00 0.60 C ATOM 0 H THR A 187 -7.654 4.674 11.772 1.00 0.59 H new ATOM 0 HA THR A 187 -5.840 2.584 11.307 1.00 0.54 H new ATOM 0 HB THR A 187 -8.319 2.362 11.318 1.00 0.58 H new ATOM 0 HG1 THR A 187 -7.425 1.477 8.750 1.00 0.62 H new ATOM 0 HG21 THR A 187 -9.583 2.856 9.262 1.00 0.60 H new ATOM 0 HG22 THR A 187 -8.914 4.329 10.003 1.00 0.60 H new ATOM 0 HG23 THR A 187 -8.136 3.623 8.566 1.00 0.60 H new ATOM 2987 N MET A 188 -6.010 4.811 8.870 1.00 0.52 N ATOM 2988 CA MET A 188 -5.341 5.209 7.626 1.00 0.53 C ATOM 2989 C MET A 188 -3.934 5.753 7.882 1.00 0.54 C ATOM 2990 O MET A 188 -2.963 5.179 7.394 1.00 0.54 O ATOM 2991 CB MET A 188 -6.151 6.246 6.842 1.00 0.62 C ATOM 2992 CG MET A 188 -7.041 5.691 5.732 1.00 0.80 C ATOM 2993 SD MET A 188 -8.343 4.585 6.311 1.00 1.06 S ATOM 2994 CE MET A 188 -7.473 3.023 6.325 1.00 0.83 C ATOM 0 H MET A 188 -6.699 5.477 9.219 1.00 0.52 H new ATOM 0 HA MET A 188 -5.263 4.302 7.027 1.00 0.53 H new ATOM 0 HB2 MET A 188 -6.778 6.796 7.544 1.00 0.62 H new ATOM 0 HB3 MET A 188 -5.459 6.964 6.402 1.00 0.62 H new ATOM 0 HG2 MET A 188 -7.498 6.524 5.198 1.00 0.80 H new ATOM 0 HG3 MET A 188 -6.418 5.156 5.015 1.00 0.80 H new ATOM 0 HE1 MET A 188 -8.176 2.213 6.131 1.00 0.83 H new ATOM 0 HE2 MET A 188 -6.704 3.028 5.553 1.00 0.83 H new ATOM 0 HE3 MET A 188 -7.008 2.874 7.299 1.00 0.83 H new ATOM 3004 N PRO A 189 -3.788 6.861 8.651 1.00 0.60 N ATOM 3005 CA PRO A 189 -2.482 7.488 8.871 1.00 0.71 C ATOM 3006 C PRO A 189 -1.469 6.518 9.448 1.00 0.74 C ATOM 3007 O PRO A 189 -0.307 6.521 9.053 1.00 0.91 O ATOM 3008 CB PRO A 189 -2.770 8.608 9.871 1.00 0.84 C ATOM 3009 CG PRO A 189 -4.212 8.900 9.698 1.00 0.83 C ATOM 3010 CD PRO A 189 -4.855 7.585 9.368 1.00 0.63 C ATOM 0 HA PRO A 189 -2.047 7.842 7.936 1.00 0.71 H new ATOM 0 HB2 PRO A 189 -2.548 8.295 10.891 1.00 0.84 H new ATOM 0 HB3 PRO A 189 -2.160 9.488 9.668 1.00 0.84 H new ATOM 0 HG2 PRO A 189 -4.637 9.327 10.607 1.00 0.83 H new ATOM 0 HG3 PRO A 189 -4.372 9.625 8.900 1.00 0.83 H new ATOM 0 HD2 PRO A 189 -5.169 7.053 10.266 1.00 0.63 H new ATOM 0 HD3 PRO A 189 -5.742 7.714 8.747 1.00 0.63 H new ATOM 3018 N SER A 190 -1.921 5.660 10.355 1.00 0.66 N ATOM 3019 CA SER A 190 -1.021 4.722 11.003 1.00 0.76 C ATOM 3020 C SER A 190 -0.616 3.644 10.012 1.00 0.72 C ATOM 3021 O SER A 190 0.535 3.224 9.976 1.00 0.90 O ATOM 3022 CB SER A 190 -1.672 4.097 12.244 1.00 0.84 C ATOM 3023 OG SER A 190 -0.746 3.310 12.975 1.00 1.50 O ATOM 0 H SER A 190 -2.894 5.596 10.654 1.00 0.66 H new ATOM 0 HA SER A 190 -0.133 5.260 11.334 1.00 0.76 H new ATOM 0 HB2 SER A 190 -2.067 4.885 12.885 1.00 0.84 H new ATOM 0 HB3 SER A 190 -2.517 3.479 11.941 1.00 0.84 H new ATOM 0 HG SER A 190 -1.190 2.927 13.760 1.00 1.50 H new ATOM 3029 N ASN A 191 -1.561 3.242 9.170 1.00 0.57 N ATOM 3030 CA ASN A 191 -1.321 2.183 8.199 1.00 0.61 C ATOM 3031 C ASN A 191 -0.318 2.642 7.150 1.00 0.51 C ATOM 3032 O ASN A 191 0.463 1.845 6.645 1.00 0.52 O ATOM 3033 CB ASN A 191 -2.629 1.757 7.529 1.00 0.70 C ATOM 3034 CG ASN A 191 -2.489 0.520 6.656 1.00 1.08 C ATOM 3035 OD1 ASN A 191 -3.203 0.366 5.670 1.00 1.88 O ATOM 3036 ND2 ASN A 191 -1.586 -0.383 7.019 1.00 1.46 N ATOM 0 H ASN A 191 -2.502 3.635 9.141 1.00 0.57 H new ATOM 0 HA ASN A 191 -0.908 1.323 8.727 1.00 0.61 H new ATOM 0 HB2 ASN A 191 -3.377 1.566 8.299 1.00 0.70 H new ATOM 0 HB3 ASN A 191 -3.001 2.581 6.920 1.00 0.70 H new ATOM 0 HD21 ASN A 191 -1.470 -1.236 6.472 1.00 1.46 H new ATOM 0 HD22 ASN A 191 -1.009 -0.223 7.845 1.00 1.46 H new ATOM 3043 N LEU A 192 -0.325 3.933 6.843 1.00 0.45 N ATOM 3044 CA LEU A 192 0.595 4.479 5.867 1.00 0.42 C ATOM 3045 C LEU A 192 2.022 4.463 6.394 1.00 0.36 C ATOM 3046 O LEU A 192 2.947 4.049 5.694 1.00 0.35 O ATOM 3047 CB LEU A 192 0.189 5.898 5.499 1.00 0.48 C ATOM 3048 CG LEU A 192 -1.193 6.039 4.868 1.00 0.62 C ATOM 3049 CD1 LEU A 192 -1.376 7.449 4.358 1.00 1.04 C ATOM 3050 CD2 LEU A 192 -1.376 5.036 3.738 1.00 1.09 C ATOM 0 H LEU A 192 -0.958 4.616 7.258 1.00 0.45 H new ATOM 0 HA LEU A 192 0.554 3.854 4.975 1.00 0.42 H new ATOM 0 HB2 LEU A 192 0.224 6.513 6.398 1.00 0.48 H new ATOM 0 HB3 LEU A 192 0.929 6.302 4.808 1.00 0.48 H new ATOM 0 HG LEU A 192 -1.949 5.832 5.626 1.00 0.62 H new ATOM 0 HD11 LEU A 192 -2.364 7.548 3.908 1.00 1.04 H new ATOM 0 HD12 LEU A 192 -1.283 8.151 5.187 1.00 1.04 H new ATOM 0 HD13 LEU A 192 -0.613 7.668 3.611 1.00 1.04 H new ATOM 0 HD21 LEU A 192 -2.368 5.155 3.303 1.00 1.09 H new ATOM 0 HD22 LEU A 192 -0.621 5.210 2.972 1.00 1.09 H new ATOM 0 HD23 LEU A 192 -1.270 4.024 4.129 1.00 1.09 H new ATOM 3062 N VAL A 193 2.202 4.905 7.635 1.00 0.36 N ATOM 3063 CA VAL A 193 3.524 4.860 8.260 1.00 0.36 C ATOM 3064 C VAL A 193 3.934 3.413 8.425 1.00 0.39 C ATOM 3065 O VAL A 193 5.101 3.060 8.313 1.00 0.42 O ATOM 3066 CB VAL A 193 3.570 5.565 9.639 1.00 0.44 C ATOM 3067 CG1 VAL A 193 2.588 6.712 9.682 1.00 0.68 C ATOM 3068 CG2 VAL A 193 3.311 4.614 10.805 1.00 0.59 C ATOM 0 H VAL A 193 1.463 5.293 8.222 1.00 0.36 H new ATOM 0 HA VAL A 193 4.212 5.397 7.607 1.00 0.36 H new ATOM 0 HB VAL A 193 4.585 5.946 9.756 1.00 0.44 H new ATOM 0 HG11 VAL A 193 2.635 7.195 10.658 1.00 0.68 H new ATOM 0 HG12 VAL A 193 2.840 7.436 8.907 1.00 0.68 H new ATOM 0 HG13 VAL A 193 1.580 6.334 9.512 1.00 0.68 H new ATOM 0 HG21 VAL A 193 3.357 5.167 11.743 1.00 0.59 H new ATOM 0 HG22 VAL A 193 2.324 4.165 10.696 1.00 0.59 H new ATOM 0 HG23 VAL A 193 4.068 3.829 10.810 1.00 0.59 H new ATOM 3078 N ASN A 194 2.933 2.594 8.684 1.00 0.43 N ATOM 3079 CA ASN A 194 3.099 1.167 8.839 1.00 0.48 C ATOM 3080 C ASN A 194 3.584 0.524 7.560 1.00 0.45 C ATOM 3081 O ASN A 194 4.495 -0.284 7.600 1.00 0.49 O ATOM 3082 CB ASN A 194 1.784 0.539 9.286 1.00 0.58 C ATOM 3083 CG ASN A 194 1.631 0.513 10.793 1.00 1.28 C ATOM 3084 OD1 ASN A 194 2.615 0.446 11.526 1.00 1.80 O ATOM 3085 ND2 ASN A 194 0.395 0.564 11.266 1.00 2.07 N ATOM 0 H ASN A 194 1.969 2.909 8.794 1.00 0.43 H new ATOM 0 HA ASN A 194 3.858 0.993 9.602 1.00 0.48 H new ATOM 0 HB2 ASN A 194 0.954 1.095 8.850 1.00 0.58 H new ATOM 0 HB3 ASN A 194 1.723 -0.479 8.901 1.00 0.58 H new ATOM 0 HD21 ASN A 194 0.233 0.548 12.273 1.00 2.07 H new ATOM 0 HD22 ASN A 194 -0.395 0.619 10.623 1.00 2.07 H new ATOM 3092 N PHE A 195 2.988 0.887 6.431 1.00 0.44 N ATOM 3093 CA PHE A 195 3.456 0.394 5.139 1.00 0.44 C ATOM 3094 C PHE A 195 4.907 0.790 4.914 1.00 0.36 C ATOM 3095 O PHE A 195 5.668 0.068 4.270 1.00 0.36 O ATOM 3096 CB PHE A 195 2.585 0.916 3.994 1.00 0.47 C ATOM 3097 CG PHE A 195 1.464 -0.011 3.622 1.00 0.73 C ATOM 3098 CD1 PHE A 195 1.716 -1.151 2.875 1.00 1.51 C ATOM 3099 CD2 PHE A 195 0.162 0.254 4.011 1.00 1.06 C ATOM 3100 CE1 PHE A 195 0.691 -2.008 2.524 1.00 2.00 C ATOM 3101 CE2 PHE A 195 -0.867 -0.600 3.663 1.00 1.43 C ATOM 3102 CZ PHE A 195 -0.603 -1.732 2.919 1.00 1.76 C ATOM 0 H PHE A 195 2.186 1.516 6.382 1.00 0.44 H new ATOM 0 HA PHE A 195 3.381 -0.693 5.152 1.00 0.44 H new ATOM 0 HB2 PHE A 195 2.168 1.882 4.277 1.00 0.47 H new ATOM 0 HB3 PHE A 195 3.212 1.084 3.119 1.00 0.47 H new ATOM 0 HD1 PHE A 195 2.726 -1.372 2.564 1.00 1.51 H new ATOM 0 HD2 PHE A 195 -0.052 1.138 4.593 1.00 1.06 H new ATOM 0 HE1 PHE A 195 0.901 -2.893 1.941 1.00 2.00 H new ATOM 0 HE2 PHE A 195 -1.878 -0.382 3.973 1.00 1.43 H new ATOM 0 HZ PHE A 195 -1.406 -2.400 2.646 1.00 1.76 H new ATOM 3112 N ILE A 196 5.292 1.932 5.462 1.00 0.31 N ATOM 3113 CA ILE A 196 6.658 2.383 5.363 1.00 0.27 C ATOM 3114 C ILE A 196 7.540 1.713 6.410 1.00 0.28 C ATOM 3115 O ILE A 196 8.739 1.551 6.213 1.00 0.28 O ATOM 3116 CB ILE A 196 6.732 3.907 5.505 1.00 0.25 C ATOM 3117 CG1 ILE A 196 6.062 4.563 4.299 1.00 0.25 C ATOM 3118 CG2 ILE A 196 8.169 4.362 5.653 1.00 0.29 C ATOM 3119 CD1 ILE A 196 6.194 6.062 4.282 1.00 0.26 C ATOM 0 H ILE A 196 4.674 2.558 5.978 1.00 0.31 H new ATOM 0 HA ILE A 196 7.030 2.102 4.378 1.00 0.27 H new ATOM 0 HB ILE A 196 6.201 4.211 6.407 1.00 0.25 H new ATOM 0 HG12 ILE A 196 6.498 4.157 3.386 1.00 0.25 H new ATOM 0 HG13 ILE A 196 5.004 4.299 4.292 1.00 0.25 H new ATOM 0 HG21 ILE A 196 8.199 5.447 5.752 1.00 0.29 H new ATOM 0 HG22 ILE A 196 8.606 3.904 6.540 1.00 0.29 H new ATOM 0 HG23 ILE A 196 8.738 4.063 4.773 1.00 0.29 H new ATOM 0 HD11 ILE A 196 5.696 6.461 3.399 1.00 0.26 H new ATOM 0 HD12 ILE A 196 5.733 6.478 5.178 1.00 0.26 H new ATOM 0 HD13 ILE A 196 7.249 6.334 4.257 1.00 0.26 H new ATOM 3131 N LEU A 197 6.947 1.321 7.517 1.00 0.33 N ATOM 3132 CA LEU A 197 7.663 0.589 8.544 1.00 0.37 C ATOM 3133 C LEU A 197 7.885 -0.824 8.099 1.00 0.36 C ATOM 3134 O LEU A 197 8.941 -1.404 8.333 1.00 0.38 O ATOM 3135 CB LEU A 197 6.891 0.600 9.851 1.00 0.50 C ATOM 3136 CG LEU A 197 6.924 1.922 10.586 1.00 0.52 C ATOM 3137 CD1 LEU A 197 6.019 1.862 11.799 1.00 1.00 C ATOM 3138 CD2 LEU A 197 8.353 2.237 10.982 1.00 1.03 C ATOM 0 H LEU A 197 5.965 1.497 7.731 1.00 0.33 H new ATOM 0 HA LEU A 197 8.625 1.075 8.706 1.00 0.37 H new ATOM 0 HB2 LEU A 197 5.853 0.337 9.648 1.00 0.50 H new ATOM 0 HB3 LEU A 197 7.294 -0.175 10.503 1.00 0.50 H new ATOM 0 HG LEU A 197 6.559 2.718 9.936 1.00 0.52 H new ATOM 0 HD11 LEU A 197 6.048 2.818 12.323 1.00 1.00 H new ATOM 0 HD12 LEU A 197 4.997 1.654 11.481 1.00 1.00 H new ATOM 0 HD13 LEU A 197 6.359 1.071 12.468 1.00 1.00 H new ATOM 0 HD21 LEU A 197 8.382 3.189 11.512 1.00 1.03 H new ATOM 0 HD22 LEU A 197 8.733 1.448 11.631 1.00 1.03 H new ATOM 0 HD23 LEU A 197 8.973 2.301 10.088 1.00 1.03 H new ATOM 3150 N ASN A 198 6.868 -1.368 7.472 1.00 0.38 N ATOM 3151 CA ASN A 198 7.006 -2.598 6.725 1.00 0.43 C ATOM 3152 C ASN A 198 8.192 -2.466 5.797 1.00 0.31 C ATOM 3153 O ASN A 198 8.956 -3.389 5.612 1.00 0.32 O ATOM 3154 CB ASN A 198 5.767 -2.888 5.880 1.00 0.65 C ATOM 3155 CG ASN A 198 4.498 -3.041 6.692 1.00 1.05 C ATOM 3156 OD1 ASN A 198 4.531 -3.387 7.870 1.00 1.90 O ATOM 3157 ND2 ASN A 198 3.362 -2.795 6.057 1.00 1.61 N ATOM 0 H ASN A 198 5.927 -0.974 7.465 1.00 0.38 H new ATOM 0 HA ASN A 198 7.139 -3.415 7.435 1.00 0.43 H new ATOM 0 HB2 ASN A 198 5.632 -2.081 5.160 1.00 0.65 H new ATOM 0 HB3 ASN A 198 5.934 -3.801 5.308 1.00 0.65 H new ATOM 0 HD21 ASN A 198 2.473 -2.891 6.547 1.00 1.61 H new ATOM 0 HD22 ASN A 198 3.377 -2.510 5.078 1.00 1.61 H new ATOM 3164 N ALA A 199 8.363 -1.287 5.242 1.00 0.29 N ATOM 3165 CA ALA A 199 9.417 -1.064 4.302 1.00 0.25 C ATOM 3166 C ALA A 199 10.749 -0.891 5.012 1.00 0.23 C ATOM 3167 O ALA A 199 11.749 -1.458 4.594 1.00 0.26 O ATOM 3168 CB ALA A 199 9.065 0.138 3.481 1.00 0.26 C ATOM 0 H ALA A 199 7.780 -0.472 5.432 1.00 0.29 H new ATOM 0 HA ALA A 199 9.526 -1.928 3.647 1.00 0.25 H new ATOM 0 HB1 ALA A 199 9.856 0.328 2.756 1.00 0.26 H new ATOM 0 HB2 ALA A 199 8.127 -0.042 2.956 1.00 0.26 H new ATOM 0 HB3 ALA A 199 8.955 1.005 4.133 1.00 0.26 H new ATOM 3174 N LYS A 200 10.750 -0.116 6.091 1.00 0.26 N ATOM 3175 CA LYS A 200 11.935 0.032 6.928 1.00 0.29 C ATOM 3176 C LYS A 200 12.419 -1.326 7.414 1.00 0.31 C ATOM 3177 O LYS A 200 13.608 -1.626 7.384 1.00 0.36 O ATOM 3178 CB LYS A 200 11.620 0.883 8.152 1.00 0.34 C ATOM 3179 CG LYS A 200 11.300 2.342 7.856 1.00 0.57 C ATOM 3180 CD LYS A 200 12.425 3.027 7.094 1.00 0.54 C ATOM 3181 CE LYS A 200 12.406 4.534 7.306 1.00 0.64 C ATOM 3182 NZ LYS A 200 11.068 5.123 7.038 1.00 0.97 N ATOM 0 H LYS A 200 9.942 0.420 6.407 1.00 0.26 H new ATOM 0 HA LYS A 200 12.706 0.511 6.325 1.00 0.29 H new ATOM 0 HB2 LYS A 200 10.773 0.440 8.676 1.00 0.34 H new ATOM 0 HB3 LYS A 200 12.471 0.844 8.832 1.00 0.34 H new ATOM 0 HG2 LYS A 200 10.380 2.401 7.275 1.00 0.57 H new ATOM 0 HG3 LYS A 200 11.121 2.871 8.792 1.00 0.57 H new ATOM 0 HD2 LYS A 200 13.384 2.625 7.420 1.00 0.54 H new ATOM 0 HD3 LYS A 200 12.332 2.807 6.030 1.00 0.54 H new ATOM 0 HE2 LYS A 200 12.701 4.758 8.331 1.00 0.64 H new ATOM 0 HE3 LYS A 200 13.144 5.000 6.653 1.00 0.64 H new ATOM 0 HZ1 LYS A 200 11.127 6.160 7.096 1.00 0.97 H new ATOM 0 HZ2 LYS A 200 10.751 4.847 6.087 1.00 0.97 H new ATOM 0 HZ3 LYS A 200 10.388 4.775 7.744 1.00 0.97 H new ATOM 3196 N ASP A 201 11.478 -2.141 7.852 1.00 0.30 N ATOM 3197 CA ASP A 201 11.807 -3.412 8.482 1.00 0.33 C ATOM 3198 C ASP A 201 11.950 -4.508 7.444 1.00 0.31 C ATOM 3199 O ASP A 201 12.833 -5.350 7.551 1.00 0.36 O ATOM 3200 CB ASP A 201 10.751 -3.797 9.520 1.00 0.40 C ATOM 3201 CG ASP A 201 11.173 -4.986 10.362 1.00 1.10 C ATOM 3202 OD1 ASP A 201 12.000 -4.814 11.281 1.00 1.18 O ATOM 3203 OD2 ASP A 201 10.686 -6.108 10.101 1.00 1.94 O ATOM 0 H ASP A 201 10.479 -1.948 7.785 1.00 0.30 H new ATOM 0 HA ASP A 201 12.763 -3.294 8.992 1.00 0.33 H new ATOM 0 HB2 ASP A 201 10.558 -2.944 10.171 1.00 0.40 H new ATOM 0 HB3 ASP A 201 9.815 -4.029 9.013 1.00 0.40 H new ATOM 3208 N GLY A 202 11.097 -4.480 6.428 1.00 0.31 N ATOM 3209 CA GLY A 202 11.173 -5.461 5.355 1.00 0.37 C ATOM 3210 C GLY A 202 12.417 -5.283 4.511 1.00 0.37 C ATOM 3211 O GLY A 202 12.936 -6.242 3.946 1.00 0.47 O ATOM 0 H GLY A 202 10.350 -3.793 6.325 1.00 0.31 H new ATOM 0 HA2 GLY A 202 11.164 -6.465 5.780 1.00 0.37 H new ATOM 0 HA3 GLY A 202 10.290 -5.375 4.722 1.00 0.37 H new ATOM 3215 N ILE A 203 12.895 -4.049 4.420 1.00 0.30 N ATOM 3216 CA ILE A 203 14.107 -3.753 3.685 1.00 0.37 C ATOM 3217 C ILE A 203 15.314 -4.307 4.429 1.00 0.47 C ATOM 3218 O ILE A 203 16.305 -4.710 3.817 1.00 0.61 O ATOM 3219 CB ILE A 203 14.282 -2.232 3.465 1.00 0.32 C ATOM 3220 CG1 ILE A 203 14.932 -1.948 2.137 1.00 0.41 C ATOM 3221 CG2 ILE A 203 15.122 -1.596 4.539 1.00 0.38 C ATOM 3222 CD1 ILE A 203 14.012 -2.132 0.978 1.00 0.52 C ATOM 0 H ILE A 203 12.455 -3.236 4.851 1.00 0.30 H new ATOM 0 HA ILE A 203 14.028 -4.228 2.707 1.00 0.37 H new ATOM 0 HB ILE A 203 13.279 -1.806 3.495 1.00 0.32 H new ATOM 0 HG12 ILE A 203 15.307 -0.924 2.135 1.00 0.41 H new ATOM 0 HG13 ILE A 203 15.794 -2.603 2.015 1.00 0.41 H new ATOM 0 HG21 ILE A 203 15.217 -0.528 4.342 1.00 0.38 H new ATOM 0 HG22 ILE A 203 14.647 -1.745 5.509 1.00 0.38 H new ATOM 0 HG23 ILE A 203 16.111 -2.053 4.545 1.00 0.38 H new ATOM 0 HD11 ILE A 203 14.544 -1.911 0.053 1.00 0.52 H new ATOM 0 HD12 ILE A 203 13.657 -3.162 0.955 1.00 0.52 H new ATOM 0 HD13 ILE A 203 13.162 -1.457 1.078 1.00 0.52 H new ATOM 3234 N LYS A 204 15.218 -4.332 5.757 1.00 0.47 N ATOM 3235 CA LYS A 204 16.267 -4.902 6.577 1.00 0.63 C ATOM 3236 C LYS A 204 16.052 -6.392 6.662 1.00 0.64 C ATOM 3237 O LYS A 204 16.987 -7.157 6.728 1.00 0.78 O ATOM 3238 CB LYS A 204 16.300 -4.300 7.974 1.00 0.74 C ATOM 3239 CG LYS A 204 16.382 -2.789 7.983 1.00 1.21 C ATOM 3240 CD LYS A 204 16.592 -2.266 9.387 1.00 1.55 C ATOM 3241 CE LYS A 204 16.649 -0.751 9.416 1.00 2.41 C ATOM 3242 NZ LYS A 204 16.803 -0.229 10.797 1.00 3.37 N ATOM 0 H LYS A 204 14.424 -3.963 6.280 1.00 0.47 H new ATOM 0 HA LYS A 204 17.227 -4.676 6.113 1.00 0.63 H new ATOM 0 HB2 LYS A 204 15.406 -4.610 8.515 1.00 0.74 H new ATOM 0 HB3 LYS A 204 17.156 -4.705 8.514 1.00 0.74 H new ATOM 0 HG2 LYS A 204 17.201 -2.462 7.343 1.00 1.21 H new ATOM 0 HG3 LYS A 204 15.466 -2.369 7.568 1.00 1.21 H new ATOM 0 HD2 LYS A 204 15.783 -2.613 10.030 1.00 1.55 H new ATOM 0 HD3 LYS A 204 17.518 -2.673 9.793 1.00 1.55 H new ATOM 0 HE2 LYS A 204 17.482 -0.407 8.803 1.00 2.41 H new ATOM 0 HE3 LYS A 204 15.739 -0.345 8.974 1.00 2.41 H new ATOM 0 HZ1 LYS A 204 16.838 0.810 10.773 1.00 3.37 H new ATOM 0 HZ2 LYS A 204 15.995 -0.535 11.376 1.00 3.37 H new ATOM 0 HZ3 LYS A 204 17.684 -0.596 11.210 1.00 3.37 H new ATOM 3256 N ALA A 205 14.801 -6.794 6.642 1.00 0.57 N ATOM 3257 CA ALA A 205 14.455 -8.193 6.507 1.00 0.69 C ATOM 3258 C ALA A 205 15.041 -8.738 5.219 1.00 0.87 C ATOM 3259 O ALA A 205 15.406 -9.902 5.130 1.00 1.02 O ATOM 3260 CB ALA A 205 12.946 -8.371 6.520 1.00 0.68 C ATOM 0 H ALA A 205 14.000 -6.167 6.718 1.00 0.57 H new ATOM 0 HA ALA A 205 14.870 -8.746 7.350 1.00 0.69 H new ATOM 0 HB1 ALA A 205 12.704 -9.429 6.418 1.00 0.68 H new ATOM 0 HB2 ALA A 205 12.543 -7.996 7.461 1.00 0.68 H new ATOM 0 HB3 ALA A 205 12.507 -7.816 5.691 1.00 0.68 H new