USER MOD reduce.3.24.130724 H: found=0, std=0, add=1150, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1152 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 47 ASN : amide:sc= -0.0726 K(o=-0.095,f=-1.4) USER MOD Set 1.2: A 158 GLN : amide:sc= -0.0226 K(o=-0.095,f=-1.1) USER MOD Set 2.1: A 135 LYS NZ :NH3+ 162:sc= 1.58 (180deg=-0.389) USER MOD Set 2.2: A 141 CYS SG : rot -160:sc= -1.18 USER MOD Set 2.3: A 148 SER OG : rot 38:sc= 1.11 USER MOD Set 3.1: A 115 THR OG1 : rot -50:sc= 1.14 USER MOD Set 3.2: A 120 ASN : amide:sc= -1.42! C(o=-0.28!,f=-6.3!) USER MOD Set 4.1: A 82 THR OG1 : rot -170:sc= -2.7! USER MOD Set 4.2: A 108 ASN : amide:sc= -0.916 X(o=-3.6,f=-3.4) USER MOD Set 5.1: A 60 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.146) USER MOD Set 5.2: A 62 SER OG : rot 180:sc= 0 USER MOD Set 6.1: A 25 ASN : amide:sc= -6.65 K(o=-8,f=-9!) USER MOD Set 6.2: A 29 ASN : amide:sc= 0.325 K(o=-8,f=-9.3) USER MOD Set 6.3: A 31 SER OG : rot -60:sc= -2.94! USER MOD Set 6.4: A 153 GLN : amide:sc= 1.25 K(o=-8,f=-9.3) USER MOD Set 7.1: A 13 ASN :FLIP amide:sc= -1.15 F(o=-1.2,f=-0.54) USER MOD Set 7.2: A 61 SER OG : rot 104:sc= 0.611 USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 165:sc= -0.0133 (180deg=-0.226) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= -1.45 K(o=-1.4,f=-8.4!) USER MOD Single : A 36 ASN : amide:sc= -1.51 K(o=-1.5,f=-3!) USER MOD Single : A 38 GLN : amide:sc= 0.0551 X(o=0.055,f=0) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=-0.0044) USER MOD Single : A 53 LYS NZ :NH3+ 160:sc= 1.09 (180deg=0.674) USER MOD Single : A 56 MET CE :methyl 153:sc= -2.14! (180deg=-2.77!) USER MOD Single : A 59 TYR OH : rot 150:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0507) USER MOD Single : A 67 LYS NZ :NH3+ 153:sc= 0.829 (180deg=-0.386) USER MOD Single : A 69 THR OG1 : rot -120:sc= -2.06! USER MOD Single : A 75 SER OG : rot 61:sc= 1.11 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= -0.142 USER MOD Single : A 78 GLN : amide:sc= -2.04! C(o=-2!,f=-3.2!) USER MOD Single : A 80 TYR OH : rot -30:sc= -0.323 USER MOD Single : A 84 GLN :FLIP amide:sc= -0.426 F(o=-2!,f=-0.43) USER MOD Single : A 88 GLN : amide:sc= -2.6! C(o=-2.6!,f=-2.9!) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 MET CE :methyl 134:sc= 0 (180deg=-2.08!) USER MOD Single : A 100 LYS NZ :NH3+ -178:sc= 0.821 (180deg=0.819) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot -23:sc= 0.479 USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ -174:sc= 0.825 (180deg=0.525) USER MOD Single : A 121 TYR OH : rot -124:sc= 0.0701 USER MOD Single : A 123 THR OG1 : rot -58:sc= 1.43 USER MOD Single : A 124 SER OG : rot -140:sc=-0.00187 USER MOD Single : A 127 HIS :FLIP no HD1:sc= -0.0824 F(o=-0.9,f=-0.082) USER MOD Single : A 129 ASN : amide:sc= -2.56 X(o=-2.6,f=-2.3!) USER MOD Single : A 134 THR OG1 : rot 122:sc= 0.0997 USER MOD Single : A 136 GLN :FLIP amide:sc= -0.736 F(o=-6.3!,f=-0.74) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 171:sc= -0.511 USER MOD Single : A 157 ASN : amide:sc= -2.57! C(o=-2.6!,f=-5.1!) USER MOD ----------------------------------------------------------------- ATOM 76 N ASN A 13 16.735 -5.816 0.395 1.00 1.23 N ATOM 77 CA ASN A 13 15.983 -6.040 1.602 1.00 1.00 C ATOM 78 C ASN A 13 15.084 -7.253 1.469 1.00 0.86 C ATOM 79 O ASN A 13 14.023 -7.165 0.881 1.00 1.29 O ATOM 80 CB ASN A 13 15.114 -4.802 1.886 1.00 1.76 C ATOM 81 CG ASN A 13 15.890 -3.596 2.397 1.00 2.67 C ATOM 82 OD1 ASN A 13 17.140 -3.463 1.996 1.00 3.27 O flip ATOM 83 ND2 ASN A 13 15.361 -2.788 3.152 1.00 3.42 N flip ATOM 0 HA ASN A 13 16.683 -6.216 2.419 1.00 1.00 H new ATOM 0 HB2 ASN A 13 14.591 -4.522 0.972 1.00 1.76 H new ATOM 0 HB3 ASN A 13 14.353 -5.067 2.620 1.00 1.76 H new ATOM 0 HD21 ASN A 13 14.392 -2.920 3.443 1.00 3.42 H new ATOM 0 HD22 ASN A 13 15.889 -1.983 3.489 1.00 3.42 H new ATOM 90 N PHE A 14 15.506 -8.375 2.012 1.00 0.97 N ATOM 91 CA PHE A 14 14.619 -9.442 2.484 1.00 1.06 C ATOM 92 C PHE A 14 14.258 -9.253 3.962 1.00 0.93 C ATOM 93 O PHE A 14 15.166 -9.130 4.783 1.00 1.27 O ATOM 94 CB PHE A 14 15.280 -10.807 2.266 1.00 1.64 C ATOM 95 CG PHE A 14 14.395 -11.975 2.612 1.00 2.26 C ATOM 96 CD1 PHE A 14 13.323 -12.315 1.803 1.00 3.13 C ATOM 97 CD2 PHE A 14 14.639 -12.731 3.749 1.00 2.47 C ATOM 98 CE1 PHE A 14 12.508 -13.385 2.122 1.00 4.16 C ATOM 99 CE2 PHE A 14 13.828 -13.802 4.072 1.00 3.36 C ATOM 100 CZ PHE A 14 12.763 -14.134 3.244 1.00 4.21 C ATOM 0 H PHE A 14 16.495 -8.585 2.145 1.00 0.97 H new ATOM 0 HA PHE A 14 13.695 -9.396 1.908 1.00 1.06 H new ATOM 0 HB2 PHE A 14 15.584 -10.890 1.222 1.00 1.64 H new ATOM 0 HB3 PHE A 14 16.188 -10.861 2.867 1.00 1.64 H new ATOM 0 HD1 PHE A 14 13.122 -11.737 0.913 1.00 3.13 H new ATOM 0 HD2 PHE A 14 15.472 -12.480 4.389 1.00 2.47 H new ATOM 0 HE1 PHE A 14 11.670 -13.632 1.488 1.00 4.16 H new ATOM 0 HE2 PHE A 14 14.021 -14.379 4.964 1.00 3.36 H new ATOM 0 HZ PHE A 14 12.136 -14.981 3.483 1.00 4.21 H new ATOM 110 N MET A 15 12.984 -9.208 4.337 1.00 0.73 N ATOM 111 CA MET A 15 12.652 -9.412 5.737 1.00 0.74 C ATOM 112 C MET A 15 11.927 -10.734 5.887 1.00 0.70 C ATOM 113 O MET A 15 12.459 -11.702 6.430 1.00 0.79 O ATOM 114 CB MET A 15 11.812 -8.278 6.319 1.00 0.84 C ATOM 115 CG MET A 15 11.719 -8.324 7.839 1.00 1.48 C ATOM 116 SD MET A 15 10.753 -6.966 8.527 1.00 2.32 S ATOM 117 CE MET A 15 10.849 -7.335 10.277 1.00 2.91 C ATOM 0 H MET A 15 12.193 -9.039 3.716 1.00 0.73 H new ATOM 0 HA MET A 15 13.585 -9.425 6.300 1.00 0.74 H new ATOM 0 HB2 MET A 15 12.241 -7.323 6.016 1.00 0.84 H new ATOM 0 HB3 MET A 15 10.808 -8.324 5.898 1.00 0.84 H new ATOM 0 HG2 MET A 15 11.272 -9.271 8.142 1.00 1.48 H new ATOM 0 HG3 MET A 15 12.724 -8.297 8.260 1.00 1.48 H new ATOM 0 HE1 MET A 15 10.297 -6.581 10.839 1.00 2.91 H new ATOM 0 HE2 MET A 15 10.416 -8.317 10.466 1.00 2.91 H new ATOM 0 HE3 MET A 15 11.892 -7.331 10.593 1.00 2.91 H new ATOM 127 N ARG A 16 10.705 -10.752 5.366 1.00 0.61 N ATOM 128 CA ARG A 16 9.791 -11.865 5.528 1.00 0.61 C ATOM 129 C ARG A 16 8.574 -11.717 4.608 1.00 0.56 C ATOM 130 O ARG A 16 8.156 -10.604 4.283 1.00 0.52 O ATOM 131 CB ARG A 16 9.339 -11.927 6.985 1.00 0.63 C ATOM 132 CG ARG A 16 9.005 -10.565 7.586 1.00 0.72 C ATOM 133 CD ARG A 16 7.621 -10.079 7.205 1.00 1.06 C ATOM 134 NE ARG A 16 6.571 -10.711 7.998 1.00 1.64 N ATOM 135 CZ ARG A 16 5.853 -10.081 8.925 1.00 2.09 C ATOM 136 NH1 ARG A 16 6.131 -8.826 9.259 1.00 2.43 N ATOM 137 NH2 ARG A 16 4.874 -10.721 9.542 1.00 2.73 N ATOM 0 H ARG A 16 10.322 -9.984 4.815 1.00 0.61 H new ATOM 0 HA ARG A 16 10.305 -12.787 5.257 1.00 0.61 H new ATOM 0 HB2 ARG A 16 8.462 -12.570 7.056 1.00 0.63 H new ATOM 0 HB3 ARG A 16 10.125 -12.393 7.580 1.00 0.63 H new ATOM 0 HG2 ARG A 16 9.078 -10.624 8.672 1.00 0.72 H new ATOM 0 HG3 ARG A 16 9.745 -9.836 7.256 1.00 0.72 H new ATOM 0 HD2 ARG A 16 7.570 -8.998 7.335 1.00 1.06 H new ATOM 0 HD3 ARG A 16 7.446 -10.281 6.148 1.00 1.06 H new ATOM 0 HE ARG A 16 6.375 -11.698 7.831 1.00 1.64 H new ATOM 0 HH11 ARG A 16 6.901 -8.336 8.804 1.00 2.43 H new ATOM 0 HH12 ARG A 16 5.575 -8.352 9.971 1.00 2.43 H new ATOM 0 HH21 ARG A 16 4.672 -11.693 9.307 1.00 2.73 H new ATOM 0 HH22 ARG A 16 4.321 -10.243 10.253 1.00 2.73 H new ATOM 151 N ILE A 17 8.028 -12.844 4.182 1.00 0.62 N ATOM 152 CA ILE A 17 6.801 -12.868 3.389 1.00 0.61 C ATOM 153 C ILE A 17 5.571 -12.756 4.293 1.00 0.57 C ATOM 154 O ILE A 17 5.327 -13.633 5.123 1.00 0.64 O ATOM 155 CB ILE A 17 6.709 -14.157 2.543 1.00 0.73 C ATOM 156 CG1 ILE A 17 7.932 -14.276 1.628 1.00 1.68 C ATOM 157 CG2 ILE A 17 5.424 -14.167 1.721 1.00 1.41 C ATOM 158 CD1 ILE A 17 7.965 -15.550 0.810 1.00 2.26 C ATOM 0 H ILE A 17 8.418 -13.767 4.373 1.00 0.62 H new ATOM 0 HA ILE A 17 6.828 -12.011 2.716 1.00 0.61 H new ATOM 0 HB ILE A 17 6.691 -15.015 3.216 1.00 0.73 H new ATOM 0 HG12 ILE A 17 7.952 -13.421 0.952 1.00 1.68 H new ATOM 0 HG13 ILE A 17 8.835 -14.223 2.236 1.00 1.68 H new ATOM 0 HG21 ILE A 17 5.376 -15.083 1.131 1.00 1.41 H new ATOM 0 HG22 ILE A 17 4.564 -14.121 2.389 1.00 1.41 H new ATOM 0 HG23 ILE A 17 5.412 -13.305 1.054 1.00 1.41 H new ATOM 0 HD11 ILE A 17 8.860 -15.560 0.188 1.00 2.26 H new ATOM 0 HD12 ILE A 17 7.977 -16.411 1.478 1.00 2.26 H new ATOM 0 HD13 ILE A 17 7.081 -15.597 0.174 1.00 2.26 H new ATOM 170 N ILE A 18 4.815 -11.671 4.150 1.00 0.49 N ATOM 171 CA ILE A 18 3.625 -11.458 4.971 1.00 0.48 C ATOM 172 C ILE A 18 2.387 -12.080 4.304 1.00 0.48 C ATOM 173 O ILE A 18 2.423 -13.222 3.850 1.00 0.52 O ATOM 174 CB ILE A 18 3.364 -9.955 5.273 1.00 0.44 C ATOM 175 CG1 ILE A 18 4.674 -9.222 5.553 1.00 0.44 C ATOM 176 CG2 ILE A 18 2.433 -9.805 6.479 1.00 0.50 C ATOM 177 CD1 ILE A 18 4.484 -7.763 5.916 1.00 0.94 C ATOM 0 H ILE A 18 5.003 -10.928 3.477 1.00 0.49 H new ATOM 0 HA ILE A 18 3.814 -11.953 5.924 1.00 0.48 H new ATOM 0 HB ILE A 18 2.892 -9.516 4.394 1.00 0.44 H new ATOM 0 HG12 ILE A 18 5.196 -9.726 6.366 1.00 0.44 H new ATOM 0 HG13 ILE A 18 5.314 -9.289 4.673 1.00 0.44 H new ATOM 0 HG21 ILE A 18 2.261 -8.747 6.676 1.00 0.50 H new ATOM 0 HG22 ILE A 18 1.482 -10.294 6.268 1.00 0.50 H new ATOM 0 HG23 ILE A 18 2.892 -10.267 7.353 1.00 0.50 H new ATOM 0 HD11 ILE A 18 5.455 -7.305 6.102 1.00 0.94 H new ATOM 0 HD12 ILE A 18 3.990 -7.245 5.094 1.00 0.94 H new ATOM 0 HD13 ILE A 18 3.870 -7.688 6.814 1.00 0.94 H new ATOM 189 N LYS A 19 1.305 -11.319 4.249 1.00 0.45 N ATOM 190 CA LYS A 19 0.006 -11.833 3.830 1.00 0.46 C ATOM 191 C LYS A 19 -0.370 -11.303 2.455 1.00 0.42 C ATOM 192 O LYS A 19 0.188 -10.312 1.992 1.00 0.49 O ATOM 193 CB LYS A 19 -1.068 -11.457 4.852 1.00 0.54 C ATOM 194 CG LYS A 19 -0.891 -12.125 6.207 1.00 1.13 C ATOM 195 CD LYS A 19 -0.838 -13.641 6.079 1.00 1.85 C ATOM 196 CE LYS A 19 -0.842 -14.316 7.442 1.00 2.57 C ATOM 197 NZ LYS A 19 -2.136 -14.128 8.145 1.00 2.68 N ATOM 0 H LYS A 19 1.300 -10.329 4.493 1.00 0.45 H new ATOM 0 HA LYS A 19 0.073 -12.919 3.771 1.00 0.46 H new ATOM 0 HB2 LYS A 19 -1.063 -10.376 4.988 1.00 0.54 H new ATOM 0 HB3 LYS A 19 -2.046 -11.724 4.451 1.00 0.54 H new ATOM 0 HG2 LYS A 19 0.026 -11.766 6.674 1.00 1.13 H new ATOM 0 HG3 LYS A 19 -1.714 -11.843 6.863 1.00 1.13 H new ATOM 0 HD2 LYS A 19 -1.692 -13.988 5.497 1.00 1.85 H new ATOM 0 HD3 LYS A 19 0.059 -13.930 5.531 1.00 1.85 H new ATOM 0 HE2 LYS A 19 -0.645 -15.381 7.321 1.00 2.57 H new ATOM 0 HE3 LYS A 19 -0.035 -13.910 8.051 1.00 2.57 H new ATOM 0 HZ1 LYS A 19 -2.201 -14.797 8.938 1.00 2.68 H new ATOM 0 HZ2 LYS A 19 -2.196 -13.155 8.507 1.00 2.68 H new ATOM 0 HZ3 LYS A 19 -2.919 -14.300 7.483 1.00 2.68 H new ATOM 211 N TYR A 20 -1.319 -11.967 1.808 1.00 0.37 N ATOM 212 CA TYR A 20 -1.677 -11.653 0.438 1.00 0.41 C ATOM 213 C TYR A 20 -3.132 -11.991 0.162 1.00 0.31 C ATOM 214 O TYR A 20 -3.740 -12.791 0.881 1.00 0.33 O ATOM 215 CB TYR A 20 -0.760 -12.433 -0.515 1.00 0.67 C ATOM 216 CG TYR A 20 -0.740 -13.929 -0.278 1.00 1.13 C ATOM 217 CD1 TYR A 20 0.158 -14.501 0.614 1.00 1.45 C ATOM 218 CD2 TYR A 20 -1.625 -14.768 -0.946 1.00 1.34 C ATOM 219 CE1 TYR A 20 0.176 -15.864 0.831 1.00 1.93 C ATOM 220 CE2 TYR A 20 -1.613 -16.131 -0.733 1.00 1.82 C ATOM 221 CZ TYR A 20 -0.697 -16.672 0.163 1.00 2.10 C ATOM 222 OH TYR A 20 -0.700 -18.033 0.372 1.00 2.59 O ATOM 0 H TYR A 20 -1.856 -12.732 2.217 1.00 0.37 H new ATOM 0 HA TYR A 20 -1.548 -10.583 0.277 1.00 0.41 H new ATOM 0 HB2 TYR A 20 -1.077 -12.244 -1.541 1.00 0.67 H new ATOM 0 HB3 TYR A 20 0.255 -12.048 -0.419 1.00 0.67 H new ATOM 0 HD1 TYR A 20 0.853 -13.869 1.146 1.00 1.45 H new ATOM 0 HD2 TYR A 20 -2.334 -14.346 -1.643 1.00 1.34 H new ATOM 0 HE1 TYR A 20 0.881 -16.291 1.529 1.00 1.93 H new ATOM 0 HE2 TYR A 20 -2.308 -16.771 -1.257 1.00 1.82 H new ATOM 0 HH TYR A 20 -1.389 -18.448 -0.188 1.00 2.59 H new ATOM 232 N GLU A 21 -3.672 -11.380 -0.888 1.00 0.33 N ATOM 233 CA GLU A 21 -5.046 -11.619 -1.324 1.00 0.32 C ATOM 234 C GLU A 21 -6.057 -11.306 -0.237 1.00 0.28 C ATOM 235 O GLU A 21 -7.061 -12.001 -0.074 1.00 0.30 O ATOM 236 CB GLU A 21 -5.208 -13.061 -1.779 1.00 0.35 C ATOM 237 CG GLU A 21 -4.555 -13.362 -3.118 1.00 0.98 C ATOM 238 CD GLU A 21 -4.946 -14.720 -3.658 1.00 1.16 C ATOM 239 OE1 GLU A 21 -5.994 -14.812 -4.333 1.00 1.53 O ATOM 240 OE2 GLU A 21 -4.216 -15.703 -3.408 1.00 1.73 O ATOM 0 H GLU A 21 -3.169 -10.704 -1.462 1.00 0.33 H new ATOM 0 HA GLU A 21 -5.241 -10.945 -2.158 1.00 0.32 H new ATOM 0 HB2 GLU A 21 -4.783 -13.720 -1.022 1.00 0.35 H new ATOM 0 HB3 GLU A 21 -6.271 -13.294 -1.844 1.00 0.35 H new ATOM 0 HG2 GLU A 21 -4.837 -12.593 -3.837 1.00 0.98 H new ATOM 0 HG3 GLU A 21 -3.471 -13.315 -3.009 1.00 0.98 H new ATOM 247 N PHE A 22 -5.778 -10.265 0.501 1.00 0.26 N ATOM 248 CA PHE A 22 -6.711 -9.747 1.459 1.00 0.26 C ATOM 249 C PHE A 22 -7.262 -8.479 0.883 1.00 0.24 C ATOM 250 O PHE A 22 -6.622 -7.849 0.041 1.00 0.27 O ATOM 251 CB PHE A 22 -6.048 -9.527 2.814 1.00 0.32 C ATOM 252 CG PHE A 22 -5.780 -10.817 3.530 1.00 1.08 C ATOM 253 CD1 PHE A 22 -6.811 -11.680 3.857 1.00 1.98 C ATOM 254 CD2 PHE A 22 -4.484 -11.163 3.880 1.00 1.15 C ATOM 255 CE1 PHE A 22 -6.552 -12.865 4.522 1.00 2.89 C ATOM 256 CE2 PHE A 22 -4.221 -12.343 4.545 1.00 2.05 C ATOM 257 CZ PHE A 22 -5.314 -13.218 4.848 1.00 2.92 C ATOM 0 H PHE A 22 -4.897 -9.754 0.453 1.00 0.26 H new ATOM 0 HA PHE A 22 -7.518 -10.456 1.643 1.00 0.26 H new ATOM 0 HB2 PHE A 22 -5.110 -8.989 2.675 1.00 0.32 H new ATOM 0 HB3 PHE A 22 -6.688 -8.897 3.432 1.00 0.32 H new ATOM 0 HD1 PHE A 22 -7.826 -11.426 3.591 1.00 1.98 H new ATOM 0 HD2 PHE A 22 -3.669 -10.500 3.629 1.00 1.15 H new ATOM 0 HE1 PHE A 22 -7.373 -13.516 4.781 1.00 2.89 H new ATOM 0 HE2 PHE A 22 -3.212 -12.602 4.831 1.00 2.05 H new ATOM 0 HZ PHE A 22 -5.132 -14.162 5.340 1.00 2.92 H new ATOM 267 N ILE A 23 -8.406 -8.073 1.338 1.00 0.22 N ATOM 268 CA ILE A 23 -9.068 -6.966 0.722 1.00 0.21 C ATOM 269 C ILE A 23 -8.760 -5.743 1.508 1.00 0.19 C ATOM 270 O ILE A 23 -8.763 -5.750 2.734 1.00 0.22 O ATOM 271 CB ILE A 23 -10.592 -7.152 0.671 1.00 0.28 C ATOM 272 CG1 ILE A 23 -10.938 -8.470 -0.025 1.00 0.36 C ATOM 273 CG2 ILE A 23 -11.252 -5.976 -0.040 1.00 0.36 C ATOM 274 CD1 ILE A 23 -10.365 -8.586 -1.424 1.00 0.84 C ATOM 0 H ILE A 23 -8.899 -8.488 2.129 1.00 0.22 H new ATOM 0 HA ILE A 23 -8.712 -6.886 -0.305 1.00 0.21 H new ATOM 0 HB ILE A 23 -10.975 -7.188 1.691 1.00 0.28 H new ATOM 0 HG12 ILE A 23 -10.569 -9.298 0.580 1.00 0.36 H new ATOM 0 HG13 ILE A 23 -12.022 -8.571 -0.076 1.00 0.36 H new ATOM 0 HG21 ILE A 23 -12.331 -6.126 -0.066 1.00 0.36 H new ATOM 0 HG22 ILE A 23 -11.027 -5.054 0.496 1.00 0.36 H new ATOM 0 HG23 ILE A 23 -10.871 -5.906 -1.059 1.00 0.36 H new ATOM 0 HD11 ILE A 23 -10.651 -9.545 -1.856 1.00 0.84 H new ATOM 0 HD12 ILE A 23 -10.754 -7.779 -2.045 1.00 0.84 H new ATOM 0 HD13 ILE A 23 -9.278 -8.518 -1.379 1.00 0.84 H new ATOM 286 N LEU A 24 -8.482 -4.699 0.800 1.00 0.18 N ATOM 287 CA LEU A 24 -8.090 -3.476 1.452 1.00 0.19 C ATOM 288 C LEU A 24 -9.276 -2.553 1.574 1.00 0.20 C ATOM 289 O LEU A 24 -9.920 -2.206 0.587 1.00 0.23 O ATOM 290 CB LEU A 24 -6.952 -2.790 0.691 1.00 0.23 C ATOM 291 CG LEU A 24 -6.218 -1.710 1.487 1.00 0.53 C ATOM 292 CD1 LEU A 24 -4.801 -1.527 0.965 1.00 1.32 C ATOM 293 CD2 LEU A 24 -6.956 -0.380 1.453 1.00 1.41 C ATOM 0 H LEU A 24 -8.516 -4.659 -0.219 1.00 0.18 H new ATOM 0 HA LEU A 24 -7.727 -3.719 2.451 1.00 0.19 H new ATOM 0 HB2 LEU A 24 -6.232 -3.547 0.380 1.00 0.23 H new ATOM 0 HB3 LEU A 24 -7.357 -2.343 -0.217 1.00 0.23 H new ATOM 0 HG LEU A 24 -6.179 -2.047 2.523 1.00 0.53 H new ATOM 0 HD11 LEU A 24 -4.297 -0.754 1.545 1.00 1.32 H new ATOM 0 HD12 LEU A 24 -4.255 -2.466 1.058 1.00 1.32 H new ATOM 0 HD13 LEU A 24 -4.835 -1.230 -0.083 1.00 1.32 H new ATOM 0 HD21 LEU A 24 -6.401 0.359 2.030 1.00 1.41 H new ATOM 0 HD22 LEU A 24 -7.047 -0.041 0.421 1.00 1.41 H new ATOM 0 HD23 LEU A 24 -7.950 -0.504 1.883 1.00 1.41 H new ATOM 305 N ASN A 25 -9.554 -2.175 2.806 1.00 0.19 N ATOM 306 CA ASN A 25 -10.605 -1.238 3.115 1.00 0.19 C ATOM 307 C ASN A 25 -10.007 -0.165 4.001 1.00 0.18 C ATOM 308 O ASN A 25 -9.187 -0.485 4.837 1.00 0.22 O ATOM 309 CB ASN A 25 -11.689 -1.996 3.884 1.00 0.29 C ATOM 310 CG ASN A 25 -13.050 -1.350 3.834 1.00 0.92 C ATOM 311 OD1 ASN A 25 -13.782 -1.350 4.819 1.00 1.74 O ATOM 312 ND2 ASN A 25 -13.426 -0.854 2.678 1.00 1.72 N ATOM 0 H ASN A 25 -9.050 -2.515 3.625 1.00 0.19 H new ATOM 0 HA ASN A 25 -11.032 -0.789 2.218 1.00 0.19 H new ATOM 0 HB2 ASN A 25 -11.764 -3.006 3.482 1.00 0.29 H new ATOM 0 HB3 ASN A 25 -11.382 -2.089 4.926 1.00 0.29 H new ATOM 0 HD21 ASN A 25 -14.357 -0.449 2.575 1.00 1.72 H new ATOM 0 HD22 ASN A 25 -12.787 -0.873 1.883 1.00 1.72 H new ATOM 319 N ASP A 26 -10.392 1.084 3.839 1.00 0.16 N ATOM 320 CA ASP A 26 -9.917 2.111 4.752 1.00 0.17 C ATOM 321 C ASP A 26 -10.879 2.294 5.896 1.00 0.18 C ATOM 322 O ASP A 26 -11.833 1.539 6.050 1.00 0.20 O ATOM 323 CB ASP A 26 -9.704 3.469 4.042 1.00 0.19 C ATOM 324 CG ASP A 26 -10.882 3.964 3.243 1.00 0.40 C ATOM 325 OD1 ASP A 26 -11.920 3.283 3.240 1.00 0.66 O ATOM 326 OD2 ASP A 26 -10.771 5.014 2.613 1.00 1.04 O ATOM 0 H ASP A 26 -11.018 1.411 3.103 1.00 0.16 H new ATOM 0 HA ASP A 26 -8.954 1.770 5.133 1.00 0.17 H new ATOM 0 HB2 ASP A 26 -9.453 4.218 4.793 1.00 0.19 H new ATOM 0 HB3 ASP A 26 -8.844 3.383 3.377 1.00 0.19 H new ATOM 331 N ALA A 27 -10.554 3.238 6.745 1.00 0.21 N ATOM 332 CA ALA A 27 -11.420 3.599 7.873 1.00 0.25 C ATOM 333 C ALA A 27 -12.652 4.277 7.336 1.00 0.24 C ATOM 334 O ALA A 27 -13.682 4.387 8.007 1.00 0.28 O ATOM 335 CB ALA A 27 -10.719 4.512 8.863 1.00 0.32 C ATOM 0 H ALA A 27 -9.693 3.781 6.687 1.00 0.21 H new ATOM 0 HA ALA A 27 -11.684 2.687 8.409 1.00 0.25 H new ATOM 0 HB1 ALA A 27 -11.399 4.752 9.681 1.00 0.32 H new ATOM 0 HB2 ALA A 27 -9.837 4.009 9.260 1.00 0.32 H new ATOM 0 HB3 ALA A 27 -10.417 5.431 8.360 1.00 0.32 H new ATOM 341 N LEU A 28 -12.517 4.742 6.110 1.00 0.21 N ATOM 342 CA LEU A 28 -13.669 5.273 5.363 1.00 0.24 C ATOM 343 C LEU A 28 -14.515 4.125 4.880 1.00 0.23 C ATOM 344 O LEU A 28 -15.666 4.280 4.461 1.00 0.29 O ATOM 345 CB LEU A 28 -13.229 6.109 4.163 1.00 0.25 C ATOM 346 CG LEU A 28 -12.500 7.372 4.527 1.00 0.31 C ATOM 347 CD1 LEU A 28 -12.091 8.136 3.277 1.00 0.48 C ATOM 348 CD2 LEU A 28 -13.369 8.236 5.432 1.00 0.48 C ATOM 0 H LEU A 28 -11.633 4.769 5.602 1.00 0.21 H new ATOM 0 HA LEU A 28 -14.238 5.917 6.033 1.00 0.24 H new ATOM 0 HB2 LEU A 28 -12.585 5.501 3.527 1.00 0.25 H new ATOM 0 HB3 LEU A 28 -14.108 6.367 3.572 1.00 0.25 H new ATOM 0 HG LEU A 28 -11.592 7.108 5.069 1.00 0.31 H new ATOM 0 HD11 LEU A 28 -11.565 9.047 3.563 1.00 0.48 H new ATOM 0 HD12 LEU A 28 -11.435 7.514 2.669 1.00 0.48 H new ATOM 0 HD13 LEU A 28 -12.980 8.396 2.702 1.00 0.48 H new ATOM 0 HD21 LEU A 28 -12.831 9.148 5.690 1.00 0.48 H new ATOM 0 HD22 LEU A 28 -14.292 8.493 4.913 1.00 0.48 H new ATOM 0 HD23 LEU A 28 -13.606 7.685 6.342 1.00 0.48 H new ATOM 360 N ASN A 29 -13.889 2.977 4.993 1.00 0.20 N ATOM 361 CA ASN A 29 -14.353 1.719 4.475 1.00 0.23 C ATOM 362 C ASN A 29 -14.758 1.878 3.037 1.00 0.24 C ATOM 363 O ASN A 29 -15.938 1.820 2.700 1.00 0.28 O ATOM 364 CB ASN A 29 -15.552 1.173 5.255 1.00 0.29 C ATOM 365 CG ASN A 29 -15.534 1.504 6.735 1.00 0.60 C ATOM 366 OD1 ASN A 29 -14.959 0.774 7.543 1.00 1.32 O ATOM 367 ND2 ASN A 29 -16.194 2.588 7.108 1.00 1.30 N ATOM 0 H ASN A 29 -12.994 2.895 5.476 1.00 0.20 H new ATOM 0 HA ASN A 29 -13.528 1.013 4.574 1.00 0.23 H new ATOM 0 HB2 ASN A 29 -16.468 1.570 4.817 1.00 0.29 H new ATOM 0 HB3 ASN A 29 -15.585 0.090 5.137 1.00 0.29 H new ATOM 0 HD21 ASN A 29 -16.239 2.844 8.094 1.00 1.30 H new ATOM 0 HD22 ASN A 29 -16.658 3.168 6.409 1.00 1.30 H new ATOM 374 N GLN A 30 -13.773 2.018 2.184 1.00 0.23 N ATOM 375 CA GLN A 30 -13.987 1.908 0.783 1.00 0.24 C ATOM 376 C GLN A 30 -12.909 0.989 0.293 1.00 0.22 C ATOM 377 O GLN A 30 -11.729 1.320 0.362 1.00 0.28 O ATOM 378 CB GLN A 30 -13.887 3.284 0.117 1.00 0.36 C ATOM 379 CG GLN A 30 -14.722 4.355 0.803 1.00 0.98 C ATOM 380 CD GLN A 30 -16.215 4.177 0.605 1.00 1.41 C ATOM 381 OE1 GLN A 30 -16.673 3.749 -0.456 1.00 2.21 O ATOM 382 NE2 GLN A 30 -16.986 4.478 1.637 1.00 1.84 N ATOM 0 H GLN A 30 -12.808 2.211 2.452 1.00 0.23 H new ATOM 0 HA GLN A 30 -14.979 1.523 0.545 1.00 0.24 H new ATOM 0 HB2 GLN A 30 -12.844 3.599 0.108 1.00 0.36 H new ATOM 0 HB3 GLN A 30 -14.203 3.199 -0.923 1.00 0.36 H new ATOM 0 HG2 GLN A 30 -14.502 4.348 1.870 1.00 0.98 H new ATOM 0 HG3 GLN A 30 -14.427 5.333 0.423 1.00 0.98 H new ATOM 0 HE21 GLN A 30 -16.570 4.830 2.499 1.00 1.84 H new ATOM 0 HE22 GLN A 30 -17.997 4.358 1.571 1.00 1.84 H new ATOM 391 N SER A 31 -13.291 -0.188 -0.148 1.00 0.23 N ATOM 392 CA SER A 31 -12.315 -1.129 -0.585 1.00 0.26 C ATOM 393 C SER A 31 -11.692 -0.589 -1.856 1.00 0.21 C ATOM 394 O SER A 31 -12.380 -0.311 -2.832 1.00 0.21 O ATOM 395 CB SER A 31 -12.975 -2.485 -0.787 1.00 0.36 C ATOM 396 OG SER A 31 -13.679 -2.876 0.382 1.00 1.23 O ATOM 0 H SER A 31 -14.259 -0.503 -0.209 1.00 0.23 H new ATOM 0 HA SER A 31 -11.527 -1.269 0.155 1.00 0.26 H new ATOM 0 HB2 SER A 31 -13.661 -2.440 -1.633 1.00 0.36 H new ATOM 0 HB3 SER A 31 -12.219 -3.231 -1.029 1.00 0.36 H new ATOM 0 HG SER A 31 -13.055 -2.937 1.135 1.00 1.23 H new ATOM 402 N ILE A 32 -10.394 -0.438 -1.827 1.00 0.21 N ATOM 403 CA ILE A 32 -9.695 0.263 -2.875 1.00 0.20 C ATOM 404 C ILE A 32 -9.631 -0.578 -4.158 1.00 0.21 C ATOM 405 O ILE A 32 -8.899 -1.556 -4.233 1.00 0.24 O ATOM 406 CB ILE A 32 -8.275 0.660 -2.415 1.00 0.24 C ATOM 407 CG1 ILE A 32 -7.464 1.265 -3.560 1.00 1.11 C ATOM 408 CG2 ILE A 32 -7.552 -0.536 -1.823 1.00 1.23 C ATOM 409 CD1 ILE A 32 -6.060 1.662 -3.148 1.00 1.72 C ATOM 0 H ILE A 32 -9.794 -0.794 -1.083 1.00 0.21 H new ATOM 0 HA ILE A 32 -10.253 1.173 -3.097 1.00 0.20 H new ATOM 0 HB ILE A 32 -8.378 1.423 -1.643 1.00 0.24 H new ATOM 0 HG12 ILE A 32 -7.407 0.546 -4.377 1.00 1.11 H new ATOM 0 HG13 ILE A 32 -7.986 2.142 -3.943 1.00 1.11 H new ATOM 0 HG21 ILE A 32 -6.553 -0.237 -1.505 1.00 1.23 H new ATOM 0 HG22 ILE A 32 -8.110 -0.910 -0.964 1.00 1.23 H new ATOM 0 HG23 ILE A 32 -7.473 -1.322 -2.574 1.00 1.23 H new ATOM 0 HD11 ILE A 32 -5.535 2.085 -4.005 1.00 1.72 H new ATOM 0 HD12 ILE A 32 -6.111 2.404 -2.351 1.00 1.72 H new ATOM 0 HD13 ILE A 32 -5.523 0.783 -2.792 1.00 1.72 H new ATOM 421 N ILE A 33 -10.461 -0.239 -5.134 1.00 0.21 N ATOM 422 CA ILE A 33 -10.507 -0.982 -6.397 1.00 0.24 C ATOM 423 C ILE A 33 -9.719 -0.233 -7.477 1.00 0.24 C ATOM 424 O ILE A 33 -9.497 0.976 -7.376 1.00 0.24 O ATOM 425 CB ILE A 33 -11.959 -1.165 -6.900 1.00 0.28 C ATOM 426 CG1 ILE A 33 -12.922 -1.397 -5.732 1.00 0.80 C ATOM 427 CG2 ILE A 33 -12.037 -2.332 -7.877 1.00 0.77 C ATOM 428 CD1 ILE A 33 -14.372 -1.522 -6.152 1.00 0.91 C ATOM 0 H ILE A 33 -11.113 0.544 -5.081 1.00 0.21 H new ATOM 0 HA ILE A 33 -10.068 -1.962 -6.209 1.00 0.24 H new ATOM 0 HB ILE A 33 -12.255 -0.249 -7.412 1.00 0.28 H new ATOM 0 HG12 ILE A 33 -12.627 -2.304 -5.204 1.00 0.80 H new ATOM 0 HG13 ILE A 33 -12.828 -0.572 -5.026 1.00 0.80 H new ATOM 0 HG21 ILE A 33 -13.064 -2.449 -8.223 1.00 0.77 H new ATOM 0 HG22 ILE A 33 -11.387 -2.136 -8.730 1.00 0.77 H new ATOM 0 HG23 ILE A 33 -11.716 -3.246 -7.378 1.00 0.77 H new ATOM 0 HD11 ILE A 33 -14.993 -1.685 -5.271 1.00 0.91 H new ATOM 0 HD12 ILE A 33 -14.686 -0.606 -6.653 1.00 0.91 H new ATOM 0 HD13 ILE A 33 -14.482 -2.365 -6.834 1.00 0.91 H new ATOM 440 N ARG A 34 -9.282 -0.951 -8.501 1.00 0.31 N ATOM 441 CA ARG A 34 -8.593 -0.328 -9.621 1.00 0.35 C ATOM 442 C ARG A 34 -9.598 0.356 -10.547 1.00 0.36 C ATOM 443 O ARG A 34 -10.451 -0.293 -11.154 1.00 0.42 O ATOM 444 CB ARG A 34 -7.751 -1.358 -10.391 1.00 0.48 C ATOM 445 CG ARG A 34 -8.551 -2.521 -10.958 1.00 1.04 C ATOM 446 CD ARG A 34 -7.666 -3.492 -11.725 1.00 1.16 C ATOM 447 NE ARG A 34 -6.930 -2.834 -12.806 1.00 1.48 N ATOM 448 CZ ARG A 34 -7.408 -2.666 -14.039 1.00 1.79 C ATOM 449 NH1 ARG A 34 -8.628 -3.092 -14.348 1.00 2.09 N ATOM 450 NH2 ARG A 34 -6.662 -2.074 -14.962 1.00 2.47 N ATOM 0 H ARG A 34 -9.392 -1.962 -8.580 1.00 0.31 H new ATOM 0 HA ARG A 34 -7.914 0.429 -9.229 1.00 0.35 H new ATOM 0 HB2 ARG A 34 -7.238 -0.852 -11.209 1.00 0.48 H new ATOM 0 HB3 ARG A 34 -6.982 -1.751 -9.726 1.00 0.48 H new ATOM 0 HG2 ARG A 34 -9.052 -3.049 -10.146 1.00 1.04 H new ATOM 0 HG3 ARG A 34 -9.330 -2.139 -11.618 1.00 1.04 H new ATOM 0 HD2 ARG A 34 -6.960 -3.958 -11.038 1.00 1.16 H new ATOM 0 HD3 ARG A 34 -8.281 -4.291 -12.140 1.00 1.16 H new ATOM 0 HE ARG A 34 -5.994 -2.483 -12.603 1.00 1.48 H new ATOM 0 HH11 ARG A 34 -9.203 -3.550 -13.640 1.00 2.09 H new ATOM 0 HH12 ARG A 34 -8.990 -2.961 -15.293 1.00 2.09 H new ATOM 0 HH21 ARG A 34 -5.724 -1.748 -14.728 1.00 2.47 H new ATOM 0 HH22 ARG A 34 -7.026 -1.945 -15.906 1.00 2.47 H new ATOM 464 N ALA A 35 -9.499 1.676 -10.638 1.00 0.37 N ATOM 465 CA ALA A 35 -10.410 2.448 -11.469 1.00 0.46 C ATOM 466 C ALA A 35 -9.816 2.580 -12.853 1.00 0.53 C ATOM 467 O ALA A 35 -10.520 2.609 -13.861 1.00 0.63 O ATOM 468 CB ALA A 35 -10.665 3.814 -10.859 1.00 0.54 C ATOM 0 H ALA A 35 -8.799 2.232 -10.148 1.00 0.37 H new ATOM 0 HA ALA A 35 -11.369 1.933 -11.534 1.00 0.46 H new ATOM 0 HB1 ALA A 35 -11.349 4.375 -11.496 1.00 0.54 H new ATOM 0 HB2 ALA A 35 -11.107 3.694 -9.870 1.00 0.54 H new ATOM 0 HB3 ALA A 35 -9.723 4.355 -10.772 1.00 0.54 H new ATOM 474 N ASN A 36 -8.501 2.676 -12.870 1.00 0.53 N ATOM 475 CA ASN A 36 -7.730 2.693 -14.091 1.00 0.66 C ATOM 476 C ASN A 36 -6.396 2.013 -13.807 1.00 0.65 C ATOM 477 O ASN A 36 -6.062 1.777 -12.647 1.00 0.55 O ATOM 478 CB ASN A 36 -7.527 4.131 -14.580 1.00 0.76 C ATOM 479 CG ASN A 36 -7.013 4.188 -16.003 1.00 1.43 C ATOM 480 OD1 ASN A 36 -7.279 3.292 -16.803 1.00 2.25 O ATOM 481 ND2 ASN A 36 -6.291 5.244 -16.331 1.00 1.93 N ATOM 0 H ASN A 36 -7.934 2.745 -12.025 1.00 0.53 H new ATOM 0 HA ASN A 36 -8.256 2.159 -14.882 1.00 0.66 H new ATOM 0 HB2 ASN A 36 -8.472 4.671 -14.516 1.00 0.76 H new ATOM 0 HB3 ASN A 36 -6.823 4.640 -13.921 1.00 0.76 H new ATOM 0 HD21 ASN A 36 -5.930 5.340 -17.280 1.00 1.93 H new ATOM 0 HD22 ASN A 36 -6.095 5.964 -15.635 1.00 1.93 H new ATOM 488 N ASP A 37 -5.644 1.684 -14.845 1.00 0.81 N ATOM 489 CA ASP A 37 -4.377 0.975 -14.671 1.00 0.88 C ATOM 490 C ASP A 37 -3.291 1.900 -14.122 1.00 0.79 C ATOM 491 O ASP A 37 -2.180 1.461 -13.830 1.00 0.88 O ATOM 492 CB ASP A 37 -3.920 0.353 -15.996 1.00 1.10 C ATOM 493 CG ASP A 37 -3.542 1.388 -17.037 1.00 1.76 C ATOM 494 OD1 ASP A 37 -4.422 2.173 -17.447 1.00 2.10 O ATOM 495 OD2 ASP A 37 -2.368 1.415 -17.452 1.00 2.51 O ATOM 0 H ASP A 37 -5.883 1.893 -15.814 1.00 0.81 H new ATOM 0 HA ASP A 37 -4.542 0.179 -13.945 1.00 0.88 H new ATOM 0 HB2 ASP A 37 -3.065 -0.297 -15.810 1.00 1.10 H new ATOM 0 HB3 ASP A 37 -4.718 -0.276 -16.390 1.00 1.10 H new ATOM 500 N GLN A 38 -3.610 3.183 -14.003 1.00 0.68 N ATOM 501 CA GLN A 38 -2.669 4.152 -13.458 1.00 0.60 C ATOM 502 C GLN A 38 -3.263 4.899 -12.262 1.00 0.44 C ATOM 503 O GLN A 38 -2.530 5.473 -11.460 1.00 0.39 O ATOM 504 CB GLN A 38 -2.200 5.130 -14.539 1.00 0.71 C ATOM 505 CG GLN A 38 -3.318 5.905 -15.211 1.00 1.53 C ATOM 506 CD GLN A 38 -2.820 6.752 -16.366 1.00 2.01 C ATOM 507 OE1 GLN A 38 -2.775 6.299 -17.508 1.00 2.57 O ATOM 508 NE2 GLN A 38 -2.440 7.986 -16.079 1.00 2.58 N ATOM 0 H GLN A 38 -4.511 3.575 -14.276 1.00 0.68 H new ATOM 0 HA GLN A 38 -1.799 3.600 -13.101 1.00 0.60 H new ATOM 0 HB2 GLN A 38 -1.501 5.838 -14.093 1.00 0.71 H new ATOM 0 HB3 GLN A 38 -1.650 4.576 -15.300 1.00 0.71 H new ATOM 0 HG2 GLN A 38 -4.073 5.208 -15.574 1.00 1.53 H new ATOM 0 HG3 GLN A 38 -3.804 6.547 -14.476 1.00 1.53 H new ATOM 0 HE21 GLN A 38 -2.492 8.325 -15.119 1.00 2.58 H new ATOM 0 HE22 GLN A 38 -2.095 8.598 -16.818 1.00 2.58 H new ATOM 517 N TYR A 39 -4.591 4.896 -12.150 1.00 0.43 N ATOM 518 CA TYR A 39 -5.269 5.595 -11.060 1.00 0.41 C ATOM 519 C TYR A 39 -6.171 4.645 -10.287 1.00 0.34 C ATOM 520 O TYR A 39 -6.832 3.785 -10.870 1.00 0.36 O ATOM 521 CB TYR A 39 -6.085 6.780 -11.585 1.00 0.64 C ATOM 522 CG TYR A 39 -5.238 7.916 -12.117 1.00 0.92 C ATOM 523 CD1 TYR A 39 -4.327 8.572 -11.295 1.00 1.50 C ATOM 524 CD2 TYR A 39 -5.353 8.338 -13.435 1.00 1.31 C ATOM 525 CE1 TYR A 39 -3.554 9.614 -11.774 1.00 2.23 C ATOM 526 CE2 TYR A 39 -4.584 9.379 -13.921 1.00 1.97 C ATOM 527 CZ TYR A 39 -3.686 10.014 -13.087 1.00 2.39 C ATOM 528 OH TYR A 39 -2.917 11.047 -13.571 1.00 3.17 O ATOM 0 H TYR A 39 -5.217 4.419 -12.799 1.00 0.43 H new ATOM 0 HA TYR A 39 -4.501 5.977 -10.387 1.00 0.41 H new ATOM 0 HB2 TYR A 39 -6.747 6.431 -12.377 1.00 0.64 H new ATOM 0 HB3 TYR A 39 -6.719 7.157 -10.782 1.00 0.64 H new ATOM 0 HD1 TYR A 39 -4.222 8.262 -10.266 1.00 1.50 H new ATOM 0 HD2 TYR A 39 -6.055 7.845 -14.091 1.00 1.31 H new ATOM 0 HE1 TYR A 39 -2.851 10.112 -11.123 1.00 2.23 H new ATOM 0 HE2 TYR A 39 -4.685 9.694 -14.949 1.00 1.97 H new ATOM 0 HH TYR A 39 -3.133 11.201 -14.514 1.00 3.17 H new ATOM 538 N LEU A 40 -6.208 4.815 -8.977 1.00 0.31 N ATOM 539 CA LEU A 40 -6.980 3.936 -8.107 1.00 0.28 C ATOM 540 C LEU A 40 -7.997 4.717 -7.288 1.00 0.25 C ATOM 541 O LEU A 40 -7.703 5.792 -6.771 1.00 0.29 O ATOM 542 CB LEU A 40 -6.043 3.159 -7.182 1.00 0.30 C ATOM 543 CG LEU A 40 -6.163 1.642 -7.294 1.00 0.51 C ATOM 544 CD1 LEU A 40 -5.886 1.194 -8.719 1.00 1.21 C ATOM 545 CD2 LEU A 40 -5.205 0.951 -6.341 1.00 1.31 C ATOM 0 H LEU A 40 -5.710 5.558 -8.487 1.00 0.31 H new ATOM 0 HA LEU A 40 -7.527 3.235 -8.737 1.00 0.28 H new ATOM 0 HB2 LEU A 40 -5.015 3.447 -7.401 1.00 0.30 H new ATOM 0 HB3 LEU A 40 -6.244 3.452 -6.152 1.00 0.30 H new ATOM 0 HG LEU A 40 -7.182 1.363 -7.024 1.00 0.51 H new ATOM 0 HD11 LEU A 40 -5.975 0.110 -8.783 1.00 1.21 H new ATOM 0 HD12 LEU A 40 -6.606 1.658 -9.393 1.00 1.21 H new ATOM 0 HD13 LEU A 40 -4.877 1.493 -9.005 1.00 1.21 H new ATOM 0 HD21 LEU A 40 -5.310 -0.129 -6.440 1.00 1.31 H new ATOM 0 HD22 LEU A 40 -4.182 1.240 -6.581 1.00 1.31 H new ATOM 0 HD23 LEU A 40 -5.435 1.246 -5.317 1.00 1.31 H new ATOM 557 N THR A 41 -9.199 4.173 -7.194 1.00 0.24 N ATOM 558 CA THR A 41 -10.266 4.793 -6.435 1.00 0.22 C ATOM 559 C THR A 41 -10.909 3.753 -5.522 1.00 0.19 C ATOM 560 O THR A 41 -11.178 2.624 -5.931 1.00 0.21 O ATOM 561 CB THR A 41 -11.323 5.404 -7.376 1.00 0.27 C ATOM 562 OG1 THR A 41 -10.674 6.251 -8.338 1.00 1.36 O ATOM 563 CG2 THR A 41 -12.348 6.216 -6.598 1.00 1.28 C ATOM 0 H THR A 41 -9.459 3.293 -7.640 1.00 0.24 H new ATOM 0 HA THR A 41 -9.848 5.598 -5.830 1.00 0.22 H new ATOM 0 HB THR A 41 -11.842 4.590 -7.882 1.00 0.27 H new ATOM 0 HG1 THR A 41 -11.345 6.639 -8.938 1.00 1.36 H new ATOM 0 HG21 THR A 41 -13.080 6.634 -7.288 1.00 1.28 H new ATOM 0 HG22 THR A 41 -12.854 5.571 -5.879 1.00 1.28 H new ATOM 0 HG23 THR A 41 -11.845 7.025 -6.068 1.00 1.28 H new ATOM 571 N ALA A 42 -11.141 4.143 -4.292 1.00 0.19 N ATOM 572 CA ALA A 42 -11.685 3.246 -3.287 1.00 0.20 C ATOM 573 C ALA A 42 -13.209 3.295 -3.258 1.00 0.20 C ATOM 574 O ALA A 42 -13.814 4.355 -3.417 1.00 0.27 O ATOM 575 CB ALA A 42 -11.108 3.577 -1.923 1.00 0.26 C ATOM 0 H ALA A 42 -10.960 5.088 -3.954 1.00 0.19 H new ATOM 0 HA ALA A 42 -11.398 2.228 -3.552 1.00 0.20 H new ATOM 0 HB1 ALA A 42 -11.523 2.898 -1.178 1.00 0.26 H new ATOM 0 HB2 ALA A 42 -10.024 3.467 -1.950 1.00 0.26 H new ATOM 0 HB3 ALA A 42 -11.362 4.604 -1.660 1.00 0.26 H new ATOM 581 N ALA A 43 -13.817 2.132 -3.073 1.00 0.20 N ATOM 582 CA ALA A 43 -15.276 2.023 -3.003 1.00 0.29 C ATOM 583 C ALA A 43 -15.685 0.882 -2.072 1.00 0.35 C ATOM 584 O ALA A 43 -15.139 -0.219 -2.153 1.00 0.40 O ATOM 585 CB ALA A 43 -15.851 1.800 -4.395 1.00 0.38 C ATOM 0 H ALA A 43 -13.325 1.245 -2.968 1.00 0.20 H new ATOM 0 HA ALA A 43 -15.675 2.954 -2.601 1.00 0.29 H new ATOM 0 HB1 ALA A 43 -16.936 1.720 -4.332 1.00 0.38 H new ATOM 0 HB2 ALA A 43 -15.586 2.640 -5.037 1.00 0.38 H new ATOM 0 HB3 ALA A 43 -15.443 0.880 -4.814 1.00 0.38 H new ATOM 591 N ALA A 44 -16.651 1.153 -1.193 1.00 0.63 N ATOM 592 CA ALA A 44 -17.068 0.195 -0.177 1.00 0.65 C ATOM 593 C ALA A 44 -17.566 -1.110 -0.779 1.00 0.46 C ATOM 594 O ALA A 44 -18.515 -1.142 -1.562 1.00 0.79 O ATOM 595 CB ALA A 44 -18.152 0.807 0.694 1.00 1.13 C ATOM 0 H ALA A 44 -17.161 2.036 -1.168 1.00 0.63 H new ATOM 0 HA ALA A 44 -16.191 -0.040 0.427 1.00 0.65 H new ATOM 0 HB1 ALA A 44 -18.460 0.086 1.452 1.00 1.13 H new ATOM 0 HB2 ALA A 44 -17.765 1.702 1.181 1.00 1.13 H new ATOM 0 HB3 ALA A 44 -19.010 1.072 0.075 1.00 1.13 H new ATOM 601 N LEU A 45 -16.896 -2.182 -0.393 1.00 0.47 N ATOM 602 CA LEU A 45 -17.263 -3.519 -0.778 1.00 0.66 C ATOM 603 C LEU A 45 -18.432 -4.054 0.033 1.00 0.62 C ATOM 604 O LEU A 45 -18.694 -3.617 1.151 1.00 0.88 O ATOM 605 CB LEU A 45 -16.068 -4.457 -0.678 1.00 1.23 C ATOM 606 CG LEU A 45 -15.675 -5.093 -2.006 1.00 2.25 C ATOM 607 CD1 LEU A 45 -16.817 -5.941 -2.529 1.00 2.87 C ATOM 608 CD2 LEU A 45 -15.305 -4.020 -3.020 1.00 2.93 C ATOM 0 H LEU A 45 -16.071 -2.139 0.205 1.00 0.47 H new ATOM 0 HA LEU A 45 -17.588 -3.472 -1.817 1.00 0.66 H new ATOM 0 HB2 LEU A 45 -15.215 -3.904 -0.284 1.00 1.23 H new ATOM 0 HB3 LEU A 45 -16.296 -5.246 0.039 1.00 1.23 H new ATOM 0 HG LEU A 45 -14.805 -5.730 -1.848 1.00 2.25 H new ATOM 0 HD11 LEU A 45 -16.530 -6.393 -3.478 1.00 2.87 H new ATOM 0 HD12 LEU A 45 -17.047 -6.726 -1.809 1.00 2.87 H new ATOM 0 HD13 LEU A 45 -17.697 -5.315 -2.677 1.00 2.87 H new ATOM 0 HD21 LEU A 45 -15.027 -4.491 -3.963 1.00 2.93 H new ATOM 0 HD22 LEU A 45 -16.159 -3.362 -3.181 1.00 2.93 H new ATOM 0 HD23 LEU A 45 -14.464 -3.438 -2.643 1.00 2.93 H new ATOM 620 N HIS A 46 -19.115 -5.013 -0.563 1.00 0.61 N ATOM 621 CA HIS A 46 -20.235 -5.693 0.063 1.00 0.80 C ATOM 622 C HIS A 46 -20.126 -7.192 -0.218 1.00 0.76 C ATOM 623 O HIS A 46 -20.786 -8.006 0.419 1.00 0.94 O ATOM 624 CB HIS A 46 -21.578 -5.143 -0.444 1.00 1.06 C ATOM 625 CG HIS A 46 -21.686 -5.051 -1.941 1.00 1.87 C ATOM 626 ND1 HIS A 46 -22.096 -6.095 -2.740 1.00 2.69 N ATOM 627 CD2 HIS A 46 -21.432 -4.018 -2.779 1.00 2.79 C ATOM 628 CE1 HIS A 46 -22.090 -5.709 -4.004 1.00 3.63 C ATOM 629 NE2 HIS A 46 -21.692 -4.452 -4.055 1.00 3.71 N ATOM 0 H HIS A 46 -18.907 -5.346 -1.504 1.00 0.61 H new ATOM 0 HA HIS A 46 -20.200 -5.517 1.138 1.00 0.80 H new ATOM 0 HB2 HIS A 46 -22.381 -5.780 -0.072 1.00 1.06 H new ATOM 0 HB3 HIS A 46 -21.735 -4.152 -0.019 1.00 1.06 H new ATOM 0 HD2 HIS A 46 -21.088 -3.034 -2.496 1.00 2.79 H new ATOM 0 HE1 HIS A 46 -22.364 -6.319 -4.852 1.00 3.63 H new ATOM 0 HE2 HIS A 46 -21.594 -3.894 -4.903 1.00 3.71 H new ATOM 638 N ASN A 47 -19.283 -7.547 -1.187 1.00 0.66 N ATOM 639 CA ASN A 47 -18.886 -8.942 -1.390 1.00 0.71 C ATOM 640 C ASN A 47 -17.565 -9.201 -0.678 1.00 0.76 C ATOM 641 O ASN A 47 -17.057 -10.318 -0.671 1.00 0.88 O ATOM 642 CB ASN A 47 -18.678 -9.230 -2.871 1.00 0.74 C ATOM 643 CG ASN A 47 -18.679 -10.715 -3.188 1.00 1.42 C ATOM 644 OD1 ASN A 47 -19.346 -11.504 -2.521 1.00 2.21 O ATOM 645 ND2 ASN A 47 -17.934 -11.103 -4.210 1.00 1.94 N ATOM 0 H ASN A 47 -18.862 -6.890 -1.844 1.00 0.66 H new ATOM 0 HA ASN A 47 -19.676 -9.581 -0.995 1.00 0.71 H new ATOM 0 HB2 ASN A 47 -19.464 -8.740 -3.446 1.00 0.74 H new ATOM 0 HB3 ASN A 47 -17.731 -8.795 -3.191 1.00 0.74 H new ATOM 0 HD21 ASN A 47 -17.898 -12.089 -4.470 1.00 1.94 H new ATOM 0 HD22 ASN A 47 -17.395 -10.416 -4.738 1.00 1.94 H new ATOM 652 N LEU A 48 -17.033 -8.142 -0.070 1.00 0.77 N ATOM 653 CA LEU A 48 -15.704 -8.137 0.530 1.00 0.89 C ATOM 654 C LEU A 48 -14.604 -8.289 -0.534 1.00 0.81 C ATOM 655 O LEU A 48 -13.905 -7.325 -0.839 1.00 0.78 O ATOM 656 CB LEU A 48 -15.621 -9.216 1.611 1.00 1.15 C ATOM 657 CG LEU A 48 -16.497 -8.938 2.840 1.00 1.37 C ATOM 658 CD1 LEU A 48 -16.816 -10.223 3.590 1.00 1.71 C ATOM 659 CD2 LEU A 48 -15.810 -7.938 3.758 1.00 1.66 C ATOM 0 H LEU A 48 -17.522 -7.251 0.020 1.00 0.77 H new ATOM 0 HA LEU A 48 -15.534 -7.171 1.005 1.00 0.89 H new ATOM 0 HB2 LEU A 48 -15.914 -10.173 1.178 1.00 1.15 H new ATOM 0 HB3 LEU A 48 -14.584 -9.315 1.932 1.00 1.15 H new ATOM 0 HG LEU A 48 -17.439 -8.511 2.497 1.00 1.37 H new ATOM 0 HD11 LEU A 48 -17.438 -9.994 4.456 1.00 1.71 H new ATOM 0 HD12 LEU A 48 -17.350 -10.907 2.930 1.00 1.71 H new ATOM 0 HD13 LEU A 48 -15.889 -10.690 3.923 1.00 1.71 H new ATOM 0 HD21 LEU A 48 -16.441 -7.748 4.627 1.00 1.66 H new ATOM 0 HD22 LEU A 48 -14.853 -8.343 4.086 1.00 1.66 H new ATOM 0 HD23 LEU A 48 -15.644 -7.005 3.220 1.00 1.66 H new ATOM 671 N ASP A 49 -14.481 -9.466 -1.126 1.00 0.83 N ATOM 672 CA ASP A 49 -13.464 -9.709 -2.162 1.00 0.83 C ATOM 673 C ASP A 49 -13.983 -9.298 -3.542 1.00 0.75 C ATOM 674 O ASP A 49 -14.569 -10.100 -4.272 1.00 0.83 O ATOM 675 CB ASP A 49 -13.033 -11.184 -2.157 1.00 1.00 C ATOM 676 CG ASP A 49 -12.159 -11.581 -3.340 1.00 1.20 C ATOM 677 OD1 ASP A 49 -11.040 -11.031 -3.469 1.00 1.87 O ATOM 678 OD2 ASP A 49 -12.591 -12.405 -4.163 1.00 1.53 O ATOM 0 H ASP A 49 -15.067 -10.273 -0.914 1.00 0.83 H new ATOM 0 HA ASP A 49 -12.591 -9.096 -1.936 1.00 0.83 H new ATOM 0 HB2 ASP A 49 -12.491 -11.390 -1.234 1.00 1.00 H new ATOM 0 HB3 ASP A 49 -13.924 -11.812 -2.151 1.00 1.00 H new ATOM 683 N GLU A 50 -13.820 -8.026 -3.860 1.00 0.66 N ATOM 684 CA GLU A 50 -14.191 -7.498 -5.171 1.00 0.72 C ATOM 685 C GLU A 50 -13.299 -6.312 -5.509 1.00 0.62 C ATOM 686 O GLU A 50 -13.038 -6.023 -6.677 1.00 0.68 O ATOM 687 CB GLU A 50 -15.668 -7.107 -5.209 1.00 0.94 C ATOM 688 CG GLU A 50 -16.169 -6.671 -6.577 1.00 1.25 C ATOM 689 CD GLU A 50 -17.628 -6.268 -6.553 1.00 1.93 C ATOM 690 OE1 GLU A 50 -18.495 -7.163 -6.603 1.00 2.35 O ATOM 691 OE2 GLU A 50 -17.914 -5.055 -6.481 1.00 2.66 O ATOM 0 H GLU A 50 -13.430 -7.330 -3.225 1.00 0.66 H new ATOM 0 HA GLU A 50 -14.045 -8.275 -5.921 1.00 0.72 H new ATOM 0 HB2 GLU A 50 -16.264 -7.955 -4.871 1.00 0.94 H new ATOM 0 HB3 GLU A 50 -15.835 -6.297 -4.500 1.00 0.94 H new ATOM 0 HG2 GLU A 50 -15.569 -5.833 -6.931 1.00 1.25 H new ATOM 0 HG3 GLU A 50 -16.031 -7.485 -7.288 1.00 1.25 H new ATOM 698 N ALA A 51 -12.820 -5.633 -4.473 1.00 0.52 N ATOM 699 CA ALA A 51 -11.803 -4.614 -4.639 1.00 0.43 C ATOM 700 C ALA A 51 -10.465 -5.299 -4.809 1.00 0.32 C ATOM 701 O ALA A 51 -10.323 -6.474 -4.463 1.00 0.33 O ATOM 702 CB ALA A 51 -11.760 -3.711 -3.430 1.00 0.50 C ATOM 0 H ALA A 51 -13.123 -5.774 -3.509 1.00 0.52 H new ATOM 0 HA ALA A 51 -12.033 -4.006 -5.514 1.00 0.43 H new ATOM 0 HB1 ALA A 51 -10.991 -2.951 -3.570 1.00 0.50 H new ATOM 0 HB2 ALA A 51 -12.729 -3.228 -3.302 1.00 0.50 H new ATOM 0 HB3 ALA A 51 -11.529 -4.301 -2.543 1.00 0.50 H new ATOM 708 N VAL A 52 -9.490 -4.591 -5.342 1.00 0.28 N ATOM 709 CA VAL A 52 -8.221 -5.210 -5.634 1.00 0.26 C ATOM 710 C VAL A 52 -7.481 -5.523 -4.347 1.00 0.22 C ATOM 711 O VAL A 52 -7.324 -4.688 -3.459 1.00 0.23 O ATOM 712 CB VAL A 52 -7.335 -4.369 -6.583 1.00 0.29 C ATOM 713 CG1 VAL A 52 -7.956 -4.306 -7.967 1.00 0.38 C ATOM 714 CG2 VAL A 52 -7.099 -2.969 -6.041 1.00 0.31 C ATOM 0 H VAL A 52 -9.553 -3.601 -5.578 1.00 0.28 H new ATOM 0 HA VAL A 52 -8.439 -6.138 -6.163 1.00 0.26 H new ATOM 0 HB VAL A 52 -6.365 -4.861 -6.652 1.00 0.29 H new ATOM 0 HG11 VAL A 52 -7.321 -3.711 -8.624 1.00 0.38 H new ATOM 0 HG12 VAL A 52 -8.050 -5.314 -8.370 1.00 0.38 H new ATOM 0 HG13 VAL A 52 -8.943 -3.847 -7.903 1.00 0.38 H new ATOM 0 HG21 VAL A 52 -6.472 -2.410 -6.736 1.00 0.31 H new ATOM 0 HG22 VAL A 52 -8.055 -2.458 -5.923 1.00 0.31 H new ATOM 0 HG23 VAL A 52 -6.600 -3.033 -5.074 1.00 0.31 H new ATOM 724 N LYS A 53 -7.070 -6.761 -4.272 1.00 0.22 N ATOM 725 CA LYS A 53 -6.454 -7.329 -3.081 1.00 0.22 C ATOM 726 C LYS A 53 -4.959 -7.275 -3.174 1.00 0.18 C ATOM 727 O LYS A 53 -4.357 -7.653 -4.180 1.00 0.24 O ATOM 728 CB LYS A 53 -6.947 -8.758 -2.854 1.00 0.35 C ATOM 729 CG LYS A 53 -7.070 -9.590 -4.117 1.00 0.78 C ATOM 730 CD LYS A 53 -7.868 -10.848 -3.843 1.00 1.12 C ATOM 731 CE LYS A 53 -8.255 -11.567 -5.121 1.00 1.37 C ATOM 732 NZ LYS A 53 -9.273 -12.617 -4.863 1.00 1.59 N ATOM 0 H LYS A 53 -7.151 -7.422 -5.045 1.00 0.22 H new ATOM 0 HA LYS A 53 -6.751 -6.730 -2.220 1.00 0.22 H new ATOM 0 HB2 LYS A 53 -6.264 -9.260 -2.169 1.00 0.35 H new ATOM 0 HB3 LYS A 53 -7.920 -8.720 -2.363 1.00 0.35 H new ATOM 0 HG2 LYS A 53 -7.556 -9.006 -4.899 1.00 0.78 H new ATOM 0 HG3 LYS A 53 -6.078 -9.853 -4.485 1.00 0.78 H new ATOM 0 HD2 LYS A 53 -7.283 -11.518 -3.213 1.00 1.12 H new ATOM 0 HD3 LYS A 53 -8.768 -10.591 -3.285 1.00 1.12 H new ATOM 0 HE2 LYS A 53 -8.646 -10.848 -5.841 1.00 1.37 H new ATOM 0 HE3 LYS A 53 -7.370 -12.018 -5.569 1.00 1.37 H new ATOM 0 HZ1 LYS A 53 -9.761 -12.853 -5.751 1.00 1.59 H new ATOM 0 HZ2 LYS A 53 -8.807 -13.467 -4.487 1.00 1.59 H new ATOM 0 HZ3 LYS A 53 -9.965 -12.267 -4.170 1.00 1.59 H new ATOM 746 N PHE A 54 -4.381 -6.774 -2.107 1.00 0.18 N ATOM 747 CA PHE A 54 -2.994 -6.468 -2.066 1.00 0.19 C ATOM 748 C PHE A 54 -2.251 -7.556 -1.344 1.00 0.20 C ATOM 749 O PHE A 54 -2.840 -8.374 -0.633 1.00 0.23 O ATOM 750 CB PHE A 54 -2.761 -5.129 -1.359 1.00 0.25 C ATOM 751 CG PHE A 54 -3.228 -3.927 -2.133 1.00 1.22 C ATOM 752 CD1 PHE A 54 -4.566 -3.566 -2.132 1.00 1.57 C ATOM 753 CD2 PHE A 54 -2.336 -3.164 -2.869 1.00 1.95 C ATOM 754 CE1 PHE A 54 -5.006 -2.471 -2.849 1.00 2.60 C ATOM 755 CE2 PHE A 54 -2.770 -2.067 -3.585 1.00 2.98 C ATOM 756 CZ PHE A 54 -4.076 -1.693 -3.555 1.00 3.31 C ATOM 0 H PHE A 54 -4.878 -6.570 -1.240 1.00 0.18 H new ATOM 0 HA PHE A 54 -2.625 -6.395 -3.089 1.00 0.19 H new ATOM 0 HB2 PHE A 54 -3.272 -5.147 -0.396 1.00 0.25 H new ATOM 0 HB3 PHE A 54 -1.696 -5.022 -1.153 1.00 0.25 H new ATOM 0 HD1 PHE A 54 -5.274 -4.149 -1.562 1.00 1.57 H new ATOM 0 HD2 PHE A 54 -1.290 -3.431 -2.883 1.00 1.95 H new ATOM 0 HE1 PHE A 54 -6.055 -2.216 -2.866 1.00 2.60 H new ATOM 0 HE2 PHE A 54 -2.065 -1.500 -4.175 1.00 2.98 H new ATOM 0 HZ PHE A 54 -4.397 -0.801 -4.072 1.00 3.31 H new ATOM 766 N ASP A 55 -0.952 -7.519 -1.502 1.00 0.21 N ATOM 767 CA ASP A 55 -0.070 -8.460 -0.845 1.00 0.22 C ATOM 768 C ASP A 55 1.103 -7.683 -0.292 1.00 0.23 C ATOM 769 O ASP A 55 1.734 -6.898 -1.002 1.00 0.27 O ATOM 770 CB ASP A 55 0.487 -9.501 -1.834 1.00 0.24 C ATOM 771 CG ASP A 55 -0.549 -10.191 -2.711 1.00 1.33 C ATOM 772 OD1 ASP A 55 -1.741 -10.171 -2.334 1.00 1.89 O ATOM 773 OD2 ASP A 55 -0.201 -10.730 -3.773 1.00 1.93 O ATOM 0 H ASP A 55 -0.472 -6.837 -2.089 1.00 0.21 H new ATOM 0 HA ASP A 55 -0.632 -8.979 -0.068 1.00 0.22 H new ATOM 0 HB2 ASP A 55 1.215 -9.010 -2.480 1.00 0.24 H new ATOM 0 HB3 ASP A 55 1.024 -10.262 -1.269 1.00 0.24 H new ATOM 778 N MET A 56 1.363 -7.886 0.986 1.00 0.24 N ATOM 779 CA MET A 56 2.425 -7.199 1.689 1.00 0.25 C ATOM 780 C MET A 56 3.533 -8.163 2.053 1.00 0.25 C ATOM 781 O MET A 56 3.290 -9.301 2.445 1.00 0.30 O ATOM 782 CB MET A 56 1.885 -6.550 2.963 1.00 0.33 C ATOM 783 CG MET A 56 0.853 -5.465 2.720 1.00 0.97 C ATOM 784 SD MET A 56 -0.018 -4.995 4.228 1.00 1.19 S ATOM 785 CE MET A 56 1.349 -4.592 5.315 1.00 1.85 C ATOM 0 H MET A 56 0.838 -8.538 1.568 1.00 0.24 H new ATOM 0 HA MET A 56 2.823 -6.428 1.029 1.00 0.25 H new ATOM 0 HB2 MET A 56 1.442 -7.323 3.591 1.00 0.33 H new ATOM 0 HB3 MET A 56 2.719 -6.124 3.522 1.00 0.33 H new ATOM 0 HG2 MET A 56 1.344 -4.588 2.299 1.00 0.97 H new ATOM 0 HG3 MET A 56 0.132 -5.812 1.980 1.00 0.97 H new ATOM 0 HE1 MET A 56 1.021 -3.866 6.058 1.00 1.85 H new ATOM 0 HE2 MET A 56 1.693 -5.496 5.818 1.00 1.85 H new ATOM 0 HE3 MET A 56 2.166 -4.169 4.731 1.00 1.85 H new ATOM 795 N GLY A 57 4.737 -7.698 1.895 1.00 0.26 N ATOM 796 CA GLY A 57 5.897 -8.403 2.340 1.00 0.32 C ATOM 797 C GLY A 57 6.839 -7.416 2.960 1.00 0.31 C ATOM 798 O GLY A 57 7.103 -6.377 2.360 1.00 0.35 O ATOM 0 H GLY A 57 4.941 -6.805 1.446 1.00 0.26 H new ATOM 0 HA2 GLY A 57 5.621 -9.170 3.063 1.00 0.32 H new ATOM 0 HA3 GLY A 57 6.376 -8.911 1.503 1.00 0.32 H new ATOM 802 N ALA A 58 7.322 -7.671 4.150 1.00 0.37 N ATOM 803 CA ALA A 58 8.200 -6.712 4.770 1.00 0.38 C ATOM 804 C ALA A 58 9.596 -6.993 4.292 1.00 0.42 C ATOM 805 O ALA A 58 9.964 -8.149 4.103 1.00 0.61 O ATOM 806 CB ALA A 58 8.113 -6.785 6.285 1.00 0.51 C ATOM 0 H ALA A 58 7.129 -8.511 4.696 1.00 0.37 H new ATOM 0 HA ALA A 58 7.905 -5.700 4.491 1.00 0.38 H new ATOM 0 HB1 ALA A 58 8.787 -6.049 6.724 1.00 0.51 H new ATOM 0 HB2 ALA A 58 7.091 -6.575 6.601 1.00 0.51 H new ATOM 0 HB3 ALA A 58 8.398 -7.783 6.618 1.00 0.51 H new ATOM 812 N TYR A 59 10.356 -5.956 4.028 1.00 0.45 N ATOM 813 CA TYR A 59 11.712 -6.158 3.546 1.00 0.61 C ATOM 814 C TYR A 59 12.697 -5.364 4.384 1.00 0.72 C ATOM 815 O TYR A 59 12.342 -4.326 4.935 1.00 0.81 O ATOM 816 CB TYR A 59 11.774 -5.822 2.060 1.00 0.93 C ATOM 817 CG TYR A 59 10.959 -6.803 1.238 1.00 1.64 C ATOM 818 CD1 TYR A 59 11.297 -8.153 1.213 1.00 2.54 C ATOM 819 CD2 TYR A 59 9.839 -6.398 0.530 1.00 2.01 C ATOM 820 CE1 TYR A 59 10.548 -9.067 0.499 1.00 3.70 C ATOM 821 CE2 TYR A 59 9.080 -7.310 -0.181 1.00 3.08 C ATOM 822 CZ TYR A 59 9.440 -8.642 -0.194 1.00 3.92 C ATOM 823 OH TYR A 59 8.681 -9.556 -0.896 1.00 5.11 O ATOM 0 H TYR A 59 10.072 -4.982 4.134 1.00 0.45 H new ATOM 0 HA TYR A 59 12.000 -7.204 3.653 1.00 0.61 H new ATOM 0 HB2 TYR A 59 11.401 -4.811 1.898 1.00 0.93 H new ATOM 0 HB3 TYR A 59 12.811 -5.837 1.725 1.00 0.93 H new ATOM 0 HD1 TYR A 59 12.162 -8.492 1.763 1.00 2.54 H new ATOM 0 HD2 TYR A 59 9.555 -5.356 0.533 1.00 2.01 H new ATOM 0 HE1 TYR A 59 10.831 -10.109 0.485 1.00 3.70 H new ATOM 0 HE2 TYR A 59 8.207 -6.980 -0.725 1.00 3.08 H new ATOM 0 HH TYR A 59 7.748 -9.257 -0.920 1.00 5.11 H new ATOM 833 N LYS A 60 13.929 -5.863 4.509 1.00 0.92 N ATOM 834 CA LYS A 60 14.776 -5.379 5.595 1.00 1.13 C ATOM 835 C LYS A 60 16.251 -5.200 5.250 1.00 1.50 C ATOM 836 O LYS A 60 16.915 -6.108 4.748 1.00 1.77 O ATOM 837 CB LYS A 60 14.671 -6.316 6.795 1.00 1.30 C ATOM 838 CG LYS A 60 15.274 -5.729 8.059 1.00 1.66 C ATOM 839 CD LYS A 60 14.526 -4.481 8.503 1.00 2.14 C ATOM 840 CE LYS A 60 15.380 -3.607 9.409 1.00 2.79 C ATOM 841 NZ LYS A 60 15.959 -4.372 10.545 1.00 3.47 N ATOM 0 H LYS A 60 14.346 -6.569 3.902 1.00 0.92 H new ATOM 0 HA LYS A 60 14.393 -4.383 5.816 1.00 1.13 H new ATOM 0 HB2 LYS A 60 13.622 -6.552 6.975 1.00 1.30 H new ATOM 0 HB3 LYS A 60 15.173 -7.255 6.561 1.00 1.30 H new ATOM 0 HG2 LYS A 60 15.249 -6.473 8.855 1.00 1.66 H new ATOM 0 HG3 LYS A 60 16.322 -5.484 7.884 1.00 1.66 H new ATOM 0 HD2 LYS A 60 14.221 -3.909 7.627 1.00 2.14 H new ATOM 0 HD3 LYS A 60 13.616 -4.770 9.028 1.00 2.14 H new ATOM 0 HE2 LYS A 60 16.185 -3.160 8.826 1.00 2.79 H new ATOM 0 HE3 LYS A 60 14.775 -2.787 9.796 1.00 2.79 H new ATOM 0 HZ1 LYS A 60 16.404 -3.714 11.216 1.00 3.47 H new ATOM 0 HZ2 LYS A 60 15.205 -4.901 11.027 1.00 3.47 H new ATOM 0 HZ3 LYS A 60 16.674 -5.037 10.187 1.00 3.47 H new ATOM 855 N SER A 61 16.719 -3.990 5.487 1.00 1.67 N ATOM 856 CA SER A 61 18.101 -3.710 5.835 1.00 2.15 C ATOM 857 C SER A 61 18.050 -2.587 6.853 1.00 2.02 C ATOM 858 O SER A 61 17.071 -1.858 6.878 1.00 1.72 O ATOM 859 CB SER A 61 18.929 -3.315 4.613 1.00 2.67 C ATOM 860 OG SER A 61 19.159 -4.436 3.774 1.00 3.06 O ATOM 0 H SER A 61 16.136 -3.154 5.442 1.00 1.67 H new ATOM 0 HA SER A 61 18.589 -4.597 6.240 1.00 2.15 H new ATOM 0 HB2 SER A 61 18.410 -2.537 4.053 1.00 2.67 H new ATOM 0 HB3 SER A 61 19.882 -2.895 4.935 1.00 2.67 H new ATOM 0 HG SER A 61 18.572 -4.384 2.991 1.00 3.06 H new ATOM 866 N SER A 62 19.064 -2.410 7.683 1.00 2.37 N ATOM 867 CA SER A 62 18.989 -1.347 8.675 1.00 2.25 C ATOM 868 C SER A 62 19.514 -0.042 8.088 1.00 2.37 C ATOM 869 O SER A 62 20.306 0.673 8.704 1.00 2.59 O ATOM 870 CB SER A 62 19.785 -1.736 9.923 1.00 2.65 C ATOM 871 OG SER A 62 19.372 -3.002 10.417 1.00 2.99 O ATOM 0 H SER A 62 19.920 -2.965 7.694 1.00 2.37 H new ATOM 0 HA SER A 62 17.947 -1.201 8.961 1.00 2.25 H new ATOM 0 HB2 SER A 62 20.849 -1.764 9.686 1.00 2.65 H new ATOM 0 HB3 SER A 62 19.650 -0.979 10.695 1.00 2.65 H new ATOM 0 HG SER A 62 19.896 -3.229 11.213 1.00 2.99 H new ATOM 877 N LYS A 63 19.059 0.255 6.879 1.00 2.37 N ATOM 878 CA LYS A 63 19.330 1.529 6.244 1.00 2.64 C ATOM 879 C LYS A 63 18.014 2.189 5.843 1.00 2.48 C ATOM 880 O LYS A 63 17.927 2.830 4.796 1.00 2.87 O ATOM 881 CB LYS A 63 20.267 1.350 5.041 1.00 3.20 C ATOM 882 CG LYS A 63 21.321 2.448 4.930 1.00 3.62 C ATOM 883 CD LYS A 63 20.749 3.740 4.364 1.00 4.18 C ATOM 884 CE LYS A 63 21.587 4.946 4.756 1.00 4.77 C ATOM 885 NZ LYS A 63 21.371 5.329 6.177 1.00 5.27 N ATOM 0 H LYS A 63 18.494 -0.380 6.316 1.00 2.37 H new ATOM 0 HA LYS A 63 19.840 2.183 6.951 1.00 2.64 H new ATOM 0 HB2 LYS A 63 20.765 0.384 5.118 1.00 3.20 H new ATOM 0 HB3 LYS A 63 19.674 1.331 4.127 1.00 3.20 H new ATOM 0 HG2 LYS A 63 21.746 2.642 5.915 1.00 3.62 H new ATOM 0 HG3 LYS A 63 22.136 2.104 4.293 1.00 3.62 H new ATOM 0 HD2 LYS A 63 20.698 3.670 3.277 1.00 4.18 H new ATOM 0 HD3 LYS A 63 19.729 3.874 4.723 1.00 4.18 H new ATOM 0 HE2 LYS A 63 22.642 4.723 4.596 1.00 4.77 H new ATOM 0 HE3 LYS A 63 21.337 5.788 4.110 1.00 4.77 H new ATOM 0 HZ1 LYS A 63 21.808 6.255 6.357 1.00 5.27 H new ATOM 0 HZ2 LYS A 63 20.351 5.384 6.370 1.00 5.27 H new ATOM 0 HZ3 LYS A 63 21.803 4.616 6.798 1.00 5.27 H new ATOM 899 N ASP A 64 16.980 1.995 6.657 1.00 2.02 N ATOM 900 CA ASP A 64 15.660 2.541 6.350 1.00 2.02 C ATOM 901 C ASP A 64 15.656 4.049 6.609 1.00 2.36 C ATOM 902 O ASP A 64 16.483 4.788 6.071 1.00 2.81 O ATOM 903 CB ASP A 64 14.609 1.885 7.247 1.00 1.53 C ATOM 904 CG ASP A 64 14.772 0.384 7.398 1.00 1.63 C ATOM 905 OD1 ASP A 64 14.191 -0.366 6.593 1.00 1.88 O ATOM 906 OD2 ASP A 64 15.473 -0.038 8.348 1.00 1.89 O ATOM 0 H ASP A 64 17.029 1.468 7.529 1.00 2.02 H new ATOM 0 HA ASP A 64 15.428 2.343 5.303 1.00 2.02 H new ATOM 0 HB2 ASP A 64 14.651 2.345 8.234 1.00 1.53 H new ATOM 0 HB3 ASP A 64 13.619 2.093 6.840 1.00 1.53 H new ATOM 911 N ASP A 65 14.736 4.514 7.439 1.00 2.27 N ATOM 912 CA ASP A 65 14.831 5.860 7.989 1.00 2.65 C ATOM 913 C ASP A 65 14.774 5.797 9.515 1.00 2.35 C ATOM 914 O ASP A 65 15.799 5.791 10.197 1.00 2.28 O ATOM 915 CB ASP A 65 13.691 6.720 7.422 1.00 3.22 C ATOM 916 CG ASP A 65 13.577 8.090 8.062 1.00 3.59 C ATOM 917 OD1 ASP A 65 14.299 9.015 7.638 1.00 4.06 O ATOM 918 OD2 ASP A 65 12.731 8.252 8.969 1.00 3.75 O ATOM 0 H ASP A 65 13.920 3.985 7.746 1.00 2.27 H new ATOM 0 HA ASP A 65 15.780 6.315 7.706 1.00 2.65 H new ATOM 0 HB2 ASP A 65 13.841 6.842 6.349 1.00 3.22 H new ATOM 0 HB3 ASP A 65 12.748 6.189 7.554 1.00 3.22 H new ATOM 923 N ALA A 66 13.555 5.743 10.030 1.00 2.40 N ATOM 924 CA ALA A 66 13.268 5.338 11.398 1.00 2.34 C ATOM 925 C ALA A 66 12.137 4.326 11.357 1.00 2.24 C ATOM 926 O ALA A 66 11.455 4.076 12.348 1.00 2.63 O ATOM 927 CB ALA A 66 12.899 6.543 12.248 1.00 2.98 C ATOM 0 H ALA A 66 12.720 5.985 9.497 1.00 2.40 H new ATOM 0 HA ALA A 66 14.150 4.887 11.853 1.00 2.34 H new ATOM 0 HB1 ALA A 66 12.688 6.219 13.267 1.00 2.98 H new ATOM 0 HB2 ALA A 66 13.729 7.250 12.257 1.00 2.98 H new ATOM 0 HB3 ALA A 66 12.015 7.026 11.831 1.00 2.98 H new ATOM 933 N LYS A 67 11.953 3.755 10.176 1.00 1.96 N ATOM 934 CA LYS A 67 10.699 3.123 9.788 1.00 1.89 C ATOM 935 C LYS A 67 10.980 1.921 8.904 1.00 1.44 C ATOM 936 O LYS A 67 11.875 1.969 8.078 1.00 1.95 O ATOM 937 CB LYS A 67 9.856 4.135 9.002 1.00 2.82 C ATOM 938 CG LYS A 67 9.648 5.463 9.717 1.00 3.45 C ATOM 939 CD LYS A 67 9.284 6.577 8.745 1.00 4.32 C ATOM 940 CE LYS A 67 9.154 7.919 9.450 1.00 5.01 C ATOM 941 NZ LYS A 67 10.365 8.255 10.246 1.00 5.31 N ATOM 0 H LYS A 67 12.673 3.716 9.455 1.00 1.96 H new ATOM 0 HA LYS A 67 10.164 2.798 10.680 1.00 1.89 H new ATOM 0 HB2 LYS A 67 10.337 4.323 8.042 1.00 2.82 H new ATOM 0 HB3 LYS A 67 8.882 3.693 8.790 1.00 2.82 H new ATOM 0 HG2 LYS A 67 8.858 5.356 10.460 1.00 3.45 H new ATOM 0 HG3 LYS A 67 10.557 5.732 10.255 1.00 3.45 H new ATOM 0 HD2 LYS A 67 10.046 6.646 7.969 1.00 4.32 H new ATOM 0 HD3 LYS A 67 8.344 6.334 8.249 1.00 4.32 H new ATOM 0 HE2 LYS A 67 8.979 8.700 8.711 1.00 5.01 H new ATOM 0 HE3 LYS A 67 8.284 7.900 10.106 1.00 5.01 H new ATOM 0 HZ1 LYS A 67 10.454 9.288 10.324 1.00 5.31 H new ATOM 0 HZ2 LYS A 67 10.281 7.842 11.197 1.00 5.31 H new ATOM 0 HZ3 LYS A 67 11.208 7.870 9.775 1.00 5.31 H new ATOM 955 N ILE A 68 10.203 0.864 9.069 1.00 0.88 N ATOM 956 CA ILE A 68 10.440 -0.385 8.362 1.00 0.76 C ATOM 957 C ILE A 68 9.441 -0.541 7.247 1.00 0.43 C ATOM 958 O ILE A 68 8.296 -0.097 7.365 1.00 0.37 O ATOM 959 CB ILE A 68 10.383 -1.611 9.294 1.00 0.97 C ATOM 960 CG1 ILE A 68 9.170 -1.530 10.229 1.00 1.07 C ATOM 961 CG2 ILE A 68 11.678 -1.728 10.089 1.00 1.51 C ATOM 962 CD1 ILE A 68 9.069 -2.689 11.200 1.00 1.66 C ATOM 0 H ILE A 68 9.396 0.846 9.692 1.00 0.88 H new ATOM 0 HA ILE A 68 11.449 -0.338 7.953 1.00 0.76 H new ATOM 0 HB ILE A 68 10.272 -2.507 8.683 1.00 0.97 H new ATOM 0 HG12 ILE A 68 9.219 -0.599 10.793 1.00 1.07 H new ATOM 0 HG13 ILE A 68 8.261 -1.491 9.628 1.00 1.07 H new ATOM 0 HG21 ILE A 68 11.626 -2.598 10.744 1.00 1.51 H new ATOM 0 HG22 ILE A 68 12.517 -1.840 9.403 1.00 1.51 H new ATOM 0 HG23 ILE A 68 11.818 -0.829 10.690 1.00 1.51 H new ATOM 0 HD11 ILE A 68 8.187 -2.562 11.828 1.00 1.66 H new ATOM 0 HD12 ILE A 68 8.987 -3.623 10.644 1.00 1.66 H new ATOM 0 HD13 ILE A 68 9.960 -2.717 11.827 1.00 1.66 H new ATOM 974 N THR A 69 9.865 -1.185 6.178 1.00 0.47 N ATOM 975 CA THR A 69 9.133 -1.127 4.942 1.00 0.38 C ATOM 976 C THR A 69 8.458 -2.447 4.585 1.00 0.34 C ATOM 977 O THR A 69 9.029 -3.532 4.724 1.00 0.46 O ATOM 978 CB THR A 69 10.046 -0.690 3.782 1.00 0.55 C ATOM 979 OG1 THR A 69 9.305 -0.701 2.561 1.00 1.50 O ATOM 980 CG2 THR A 69 11.268 -1.593 3.654 1.00 1.23 C ATOM 0 H THR A 69 10.712 -1.752 6.147 1.00 0.47 H new ATOM 0 HA THR A 69 8.348 -0.386 5.094 1.00 0.38 H new ATOM 0 HB THR A 69 10.400 0.319 3.994 1.00 0.55 H new ATOM 0 HG1 THR A 69 9.723 -1.324 1.930 1.00 1.50 H new ATOM 0 HG21 THR A 69 11.887 -1.252 2.824 1.00 1.23 H new ATOM 0 HG22 THR A 69 11.846 -1.556 4.577 1.00 1.23 H new ATOM 0 HG23 THR A 69 10.945 -2.618 3.469 1.00 1.23 H new ATOM 988 N VAL A 70 7.221 -2.320 4.136 1.00 0.27 N ATOM 989 CA VAL A 70 6.468 -3.416 3.561 1.00 0.28 C ATOM 990 C VAL A 70 6.065 -3.026 2.153 1.00 0.26 C ATOM 991 O VAL A 70 6.109 -1.841 1.804 1.00 0.29 O ATOM 992 CB VAL A 70 5.197 -3.754 4.372 1.00 0.33 C ATOM 993 CG1 VAL A 70 5.561 -4.332 5.724 1.00 0.98 C ATOM 994 CG2 VAL A 70 4.311 -2.527 4.534 1.00 1.06 C ATOM 0 H VAL A 70 6.706 -1.440 4.162 1.00 0.27 H new ATOM 0 HA VAL A 70 7.102 -4.303 3.569 1.00 0.28 H new ATOM 0 HB VAL A 70 4.635 -4.506 3.818 1.00 0.33 H new ATOM 0 HG11 VAL A 70 4.651 -4.563 6.278 1.00 0.98 H new ATOM 0 HG12 VAL A 70 6.142 -5.244 5.585 1.00 0.98 H new ATOM 0 HG13 VAL A 70 6.152 -3.606 6.283 1.00 0.98 H new ATOM 0 HG21 VAL A 70 3.423 -2.792 5.108 1.00 1.06 H new ATOM 0 HG22 VAL A 70 4.863 -1.747 5.058 1.00 1.06 H new ATOM 0 HG23 VAL A 70 4.012 -2.162 3.551 1.00 1.06 H new ATOM 1004 N ILE A 71 5.686 -4.008 1.355 1.00 0.25 N ATOM 1005 CA ILE A 71 5.303 -3.762 -0.023 1.00 0.28 C ATOM 1006 C ILE A 71 3.802 -3.831 -0.207 1.00 0.28 C ATOM 1007 O ILE A 71 3.150 -4.731 0.311 1.00 0.33 O ATOM 1008 CB ILE A 71 5.959 -4.756 -0.993 1.00 0.39 C ATOM 1009 CG1 ILE A 71 5.872 -6.190 -0.483 1.00 1.29 C ATOM 1010 CG2 ILE A 71 7.404 -4.371 -1.268 1.00 1.34 C ATOM 1011 CD1 ILE A 71 4.859 -7.032 -1.229 1.00 2.12 C ATOM 0 H ILE A 71 5.635 -4.986 1.639 1.00 0.25 H new ATOM 0 HA ILE A 71 5.654 -2.756 -0.252 1.00 0.28 H new ATOM 0 HB ILE A 71 5.403 -4.708 -1.929 1.00 0.39 H new ATOM 0 HG12 ILE A 71 6.853 -6.657 -0.565 1.00 1.29 H new ATOM 0 HG13 ILE A 71 5.613 -6.176 0.576 1.00 1.29 H new ATOM 0 HG21 ILE A 71 7.847 -5.090 -1.957 1.00 1.34 H new ATOM 0 HG22 ILE A 71 7.437 -3.375 -1.711 1.00 1.34 H new ATOM 0 HG23 ILE A 71 7.965 -4.371 -0.333 1.00 1.34 H new ATOM 0 HD11 ILE A 71 4.849 -8.040 -0.815 1.00 2.12 H new ATOM 0 HD12 ILE A 71 3.869 -6.587 -1.126 1.00 2.12 H new ATOM 0 HD13 ILE A 71 5.129 -7.076 -2.284 1.00 2.12 H new ATOM 1023 N LEU A 72 3.248 -2.858 -0.906 1.00 0.28 N ATOM 1024 CA LEU A 72 1.852 -2.928 -1.300 1.00 0.29 C ATOM 1025 C LEU A 72 1.743 -3.251 -2.798 1.00 0.27 C ATOM 1026 O LEU A 72 2.155 -2.464 -3.653 1.00 0.30 O ATOM 1027 CB LEU A 72 1.145 -1.611 -0.967 1.00 0.33 C ATOM 1028 CG LEU A 72 -0.358 -1.721 -0.703 1.00 0.37 C ATOM 1029 CD1 LEU A 72 -0.620 -2.563 0.539 1.00 0.79 C ATOM 1030 CD2 LEU A 72 -0.976 -0.337 -0.554 1.00 0.88 C ATOM 0 H LEU A 72 3.737 -2.017 -1.211 1.00 0.28 H new ATOM 0 HA LEU A 72 1.361 -3.727 -0.744 1.00 0.29 H new ATOM 0 HB2 LEU A 72 1.620 -1.176 -0.088 1.00 0.33 H new ATOM 0 HB3 LEU A 72 1.302 -0.916 -1.792 1.00 0.33 H new ATOM 0 HG LEU A 72 -0.824 -2.214 -1.556 1.00 0.37 H new ATOM 0 HD11 LEU A 72 -1.694 -2.631 0.712 1.00 0.79 H new ATOM 0 HD12 LEU A 72 -0.212 -3.563 0.393 1.00 0.79 H new ATOM 0 HD13 LEU A 72 -0.142 -2.098 1.401 1.00 0.79 H new ATOM 0 HD21 LEU A 72 -2.045 -0.434 -0.367 1.00 0.88 H new ATOM 0 HD22 LEU A 72 -0.507 0.183 0.281 1.00 0.88 H new ATOM 0 HD23 LEU A 72 -0.818 0.232 -1.470 1.00 0.88 H new ATOM 1042 N ARG A 73 1.186 -4.407 -3.109 1.00 0.24 N ATOM 1043 CA ARG A 73 1.005 -4.838 -4.496 1.00 0.24 C ATOM 1044 C ARG A 73 -0.387 -5.407 -4.644 1.00 0.21 C ATOM 1045 O ARG A 73 -0.888 -5.977 -3.695 1.00 0.24 O ATOM 1046 CB ARG A 73 2.019 -5.937 -4.834 1.00 0.28 C ATOM 1047 CG ARG A 73 1.430 -7.347 -4.766 1.00 0.43 C ATOM 1048 CD ARG A 73 2.517 -8.408 -4.793 1.00 0.58 C ATOM 1049 NE ARG A 73 1.970 -9.754 -4.965 1.00 0.91 N ATOM 1050 CZ ARG A 73 2.538 -10.706 -5.702 1.00 1.04 C ATOM 1051 NH1 ARG A 73 3.679 -10.462 -6.339 1.00 1.27 N ATOM 1052 NH2 ARG A 73 1.967 -11.900 -5.796 1.00 1.67 N ATOM 0 H ARG A 73 0.846 -5.075 -2.417 1.00 0.24 H new ATOM 0 HA ARG A 73 1.150 -3.989 -5.164 1.00 0.24 H new ATOM 0 HB2 ARG A 73 2.412 -5.763 -5.836 1.00 0.28 H new ATOM 0 HB3 ARG A 73 2.861 -5.869 -4.145 1.00 0.28 H new ATOM 0 HG2 ARG A 73 0.840 -7.452 -3.855 1.00 0.43 H new ATOM 0 HG3 ARG A 73 0.751 -7.499 -5.605 1.00 0.43 H new ATOM 0 HD2 ARG A 73 3.212 -8.193 -5.605 1.00 0.58 H new ATOM 0 HD3 ARG A 73 3.088 -8.365 -3.865 1.00 0.58 H new ATOM 0 HE ARG A 73 1.096 -9.978 -4.489 1.00 0.91 H new ATOM 0 HH11 ARG A 73 4.119 -9.545 -6.263 1.00 1.27 H new ATOM 0 HH12 ARG A 73 4.114 -11.192 -6.904 1.00 1.27 H new ATOM 0 HH21 ARG A 73 1.094 -12.088 -5.304 1.00 1.67 H new ATOM 0 HH22 ARG A 73 2.401 -12.630 -6.360 1.00 1.67 H new ATOM 1066 N ILE A 74 -1.034 -5.265 -5.788 1.00 0.22 N ATOM 1067 CA ILE A 74 -2.242 -6.026 -5.997 1.00 0.24 C ATOM 1068 C ILE A 74 -1.888 -7.392 -6.562 1.00 0.27 C ATOM 1069 O ILE A 74 -1.163 -7.499 -7.540 1.00 0.30 O ATOM 1070 CB ILE A 74 -3.279 -5.311 -6.876 1.00 0.31 C ATOM 1071 CG1 ILE A 74 -2.731 -4.988 -8.264 1.00 1.14 C ATOM 1072 CG2 ILE A 74 -3.754 -4.042 -6.189 1.00 1.30 C ATOM 1073 CD1 ILE A 74 -3.743 -4.296 -9.150 1.00 1.81 C ATOM 0 H ILE A 74 -0.754 -4.654 -6.556 1.00 0.22 H new ATOM 0 HA ILE A 74 -2.722 -6.141 -5.025 1.00 0.24 H new ATOM 0 HB ILE A 74 -4.121 -5.990 -7.011 1.00 0.31 H new ATOM 0 HG12 ILE A 74 -1.850 -4.354 -8.163 1.00 1.14 H new ATOM 0 HG13 ILE A 74 -2.406 -5.911 -8.744 1.00 1.14 H new ATOM 0 HG21 ILE A 74 -4.489 -3.541 -6.819 1.00 1.30 H new ATOM 0 HG22 ILE A 74 -4.209 -4.295 -5.231 1.00 1.30 H new ATOM 0 HG23 ILE A 74 -2.905 -3.378 -6.023 1.00 1.30 H new ATOM 0 HD11 ILE A 74 -3.296 -4.092 -10.123 1.00 1.81 H new ATOM 0 HD12 ILE A 74 -4.614 -4.939 -9.279 1.00 1.81 H new ATOM 0 HD13 ILE A 74 -4.050 -3.358 -8.688 1.00 1.81 H new ATOM 1085 N SER A 75 -2.368 -8.425 -5.890 1.00 0.30 N ATOM 1086 CA SER A 75 -2.078 -9.820 -6.224 1.00 0.38 C ATOM 1087 C SER A 75 -2.299 -10.136 -7.709 1.00 0.44 C ATOM 1088 O SER A 75 -1.714 -11.076 -8.248 1.00 0.50 O ATOM 1089 CB SER A 75 -2.958 -10.732 -5.367 1.00 0.47 C ATOM 1090 OG SER A 75 -2.294 -11.945 -5.069 1.00 1.16 O ATOM 0 H SER A 75 -2.982 -8.322 -5.082 1.00 0.30 H new ATOM 0 HA SER A 75 -1.022 -9.994 -6.017 1.00 0.38 H new ATOM 0 HB2 SER A 75 -3.223 -10.222 -4.441 1.00 0.47 H new ATOM 0 HB3 SER A 75 -3.889 -10.943 -5.893 1.00 0.47 H new ATOM 0 HG SER A 75 -1.475 -11.755 -4.565 1.00 1.16 H new ATOM 1096 N LYS A 76 -3.145 -9.350 -8.359 1.00 0.45 N ATOM 1097 CA LYS A 76 -3.659 -9.693 -9.676 1.00 0.54 C ATOM 1098 C LYS A 76 -2.687 -9.330 -10.807 1.00 0.55 C ATOM 1099 O LYS A 76 -2.265 -10.192 -11.579 1.00 0.61 O ATOM 1100 CB LYS A 76 -4.953 -8.908 -9.850 1.00 0.60 C ATOM 1101 CG LYS A 76 -5.771 -9.293 -11.071 1.00 1.21 C ATOM 1102 CD LYS A 76 -7.145 -8.641 -11.037 1.00 1.70 C ATOM 1103 CE LYS A 76 -8.063 -9.192 -12.117 1.00 2.16 C ATOM 1104 NZ LYS A 76 -7.579 -8.876 -13.486 1.00 2.51 N ATOM 0 H LYS A 76 -3.492 -8.464 -7.992 1.00 0.45 H new ATOM 0 HA LYS A 76 -3.809 -10.771 -9.735 1.00 0.54 H new ATOM 0 HB2 LYS A 76 -5.567 -9.045 -8.960 1.00 0.60 H new ATOM 0 HB3 LYS A 76 -4.713 -7.847 -9.911 1.00 0.60 H new ATOM 0 HG2 LYS A 76 -5.244 -8.991 -11.976 1.00 1.21 H new ATOM 0 HG3 LYS A 76 -5.880 -10.377 -11.113 1.00 1.21 H new ATOM 0 HD2 LYS A 76 -7.599 -8.802 -10.059 1.00 1.70 H new ATOM 0 HD3 LYS A 76 -7.039 -7.564 -11.166 1.00 1.70 H new ATOM 0 HE2 LYS A 76 -8.145 -10.273 -12.004 1.00 2.16 H new ATOM 0 HE3 LYS A 76 -9.064 -8.781 -11.984 1.00 2.16 H new ATOM 0 HZ1 LYS A 76 -8.237 -9.272 -14.187 1.00 2.51 H new ATOM 0 HZ2 LYS A 76 -7.525 -7.844 -13.606 1.00 2.51 H new ATOM 0 HZ3 LYS A 76 -6.635 -9.290 -13.625 1.00 2.51 H new ATOM 1118 N THR A 77 -2.347 -8.057 -10.895 1.00 0.51 N ATOM 1119 CA THR A 77 -1.365 -7.567 -11.860 1.00 0.53 C ATOM 1120 C THR A 77 -0.158 -7.019 -11.107 1.00 0.47 C ATOM 1121 O THR A 77 -0.213 -6.885 -9.890 1.00 0.46 O ATOM 1122 CB THR A 77 -1.968 -6.500 -12.807 1.00 0.62 C ATOM 1123 OG1 THR A 77 -1.001 -6.088 -13.778 1.00 1.45 O ATOM 1124 CG2 THR A 77 -2.460 -5.288 -12.041 1.00 1.29 C ATOM 0 H THR A 77 -2.742 -7.328 -10.301 1.00 0.51 H new ATOM 0 HA THR A 77 -1.051 -8.398 -12.492 1.00 0.53 H new ATOM 0 HB THR A 77 -2.819 -6.958 -13.311 1.00 0.62 H new ATOM 0 HG1 THR A 77 -1.398 -5.415 -14.370 1.00 1.45 H new ATOM 0 HG21 THR A 77 -2.876 -4.561 -12.738 1.00 1.29 H new ATOM 0 HG22 THR A 77 -3.230 -5.593 -11.333 1.00 1.29 H new ATOM 0 HG23 THR A 77 -1.628 -4.837 -11.500 1.00 1.29 H new ATOM 1132 N GLN A 78 0.918 -6.666 -11.796 1.00 0.50 N ATOM 1133 CA GLN A 78 2.097 -6.203 -11.084 1.00 0.49 C ATOM 1134 C GLN A 78 2.117 -4.676 -11.064 1.00 0.46 C ATOM 1135 O GLN A 78 2.928 -3.999 -11.707 1.00 0.48 O ATOM 1136 CB GLN A 78 3.392 -6.772 -11.702 1.00 0.59 C ATOM 1137 CG GLN A 78 3.676 -6.350 -13.144 1.00 1.49 C ATOM 1138 CD GLN A 78 2.714 -6.943 -14.153 1.00 2.14 C ATOM 1139 OE1 GLN A 78 2.208 -8.049 -13.975 1.00 2.69 O ATOM 1140 NE2 GLN A 78 2.445 -6.205 -15.216 1.00 2.90 N ATOM 0 H GLN A 78 0.999 -6.690 -12.813 1.00 0.50 H new ATOM 0 HA GLN A 78 2.049 -6.568 -10.058 1.00 0.49 H new ATOM 0 HB2 GLN A 78 4.234 -6.468 -11.081 1.00 0.59 H new ATOM 0 HB3 GLN A 78 3.344 -7.860 -11.663 1.00 0.59 H new ATOM 0 HG2 GLN A 78 3.633 -5.263 -13.210 1.00 1.49 H new ATOM 0 HG3 GLN A 78 4.692 -6.646 -13.406 1.00 1.49 H new ATOM 0 HE21 GLN A 78 2.885 -5.292 -15.328 1.00 2.90 H new ATOM 0 HE22 GLN A 78 1.797 -6.549 -15.925 1.00 2.90 H new ATOM 1149 N LEU A 79 1.216 -4.157 -10.247 1.00 0.46 N ATOM 1150 CA LEU A 79 1.130 -2.744 -9.975 1.00 0.45 C ATOM 1151 C LEU A 79 1.831 -2.442 -8.670 1.00 0.42 C ATOM 1152 O LEU A 79 1.513 -3.024 -7.626 1.00 0.54 O ATOM 1153 CB LEU A 79 -0.323 -2.261 -9.942 1.00 0.59 C ATOM 1154 CG LEU A 79 -1.014 -2.194 -11.307 1.00 0.95 C ATOM 1155 CD1 LEU A 79 -2.421 -1.640 -11.164 1.00 1.95 C ATOM 1156 CD2 LEU A 79 -0.205 -1.343 -12.275 1.00 1.61 C ATOM 0 H LEU A 79 0.520 -4.715 -9.752 1.00 0.46 H new ATOM 0 HA LEU A 79 1.624 -2.204 -10.783 1.00 0.45 H new ATOM 0 HB2 LEU A 79 -0.896 -2.924 -9.294 1.00 0.59 H new ATOM 0 HB3 LEU A 79 -0.350 -1.270 -9.489 1.00 0.59 H new ATOM 0 HG LEU A 79 -1.079 -3.205 -11.708 1.00 0.95 H new ATOM 0 HD11 LEU A 79 -2.897 -1.599 -12.144 1.00 1.95 H new ATOM 0 HD12 LEU A 79 -3.001 -2.286 -10.505 1.00 1.95 H new ATOM 0 HD13 LEU A 79 -2.376 -0.637 -10.741 1.00 1.95 H new ATOM 0 HD21 LEU A 79 -0.712 -1.307 -13.239 1.00 1.61 H new ATOM 0 HD22 LEU A 79 -0.109 -0.332 -11.878 1.00 1.61 H new ATOM 0 HD23 LEU A 79 0.786 -1.779 -12.402 1.00 1.61 H new ATOM 1168 N TYR A 80 2.779 -1.539 -8.747 1.00 0.34 N ATOM 1169 CA TYR A 80 3.605 -1.177 -7.624 1.00 0.38 C ATOM 1170 C TYR A 80 3.052 0.137 -7.096 1.00 0.34 C ATOM 1171 O TYR A 80 2.627 0.983 -7.879 1.00 0.45 O ATOM 1172 CB TYR A 80 5.026 -0.973 -8.174 1.00 0.60 C ATOM 1173 CG TYR A 80 6.195 -1.374 -7.317 1.00 1.27 C ATOM 1174 CD1 TYR A 80 6.396 -2.707 -6.990 1.00 2.27 C ATOM 1175 CD2 TYR A 80 7.046 -0.423 -6.772 1.00 1.56 C ATOM 1176 CE1 TYR A 80 7.415 -3.085 -6.143 1.00 3.30 C ATOM 1177 CE2 TYR A 80 8.079 -0.796 -5.934 1.00 2.49 C ATOM 1178 CZ TYR A 80 8.438 -2.100 -5.858 1.00 3.33 C ATOM 1179 OH TYR A 80 9.270 -2.505 -4.780 1.00 4.39 O ATOM 0 H TYR A 80 3.000 -1.030 -9.603 1.00 0.34 H new ATOM 0 HA TYR A 80 3.618 -1.925 -6.831 1.00 0.38 H new ATOM 0 HB2 TYR A 80 5.100 -1.523 -9.112 1.00 0.60 H new ATOM 0 HB3 TYR A 80 5.139 0.084 -8.414 1.00 0.60 H new ATOM 0 HD1 TYR A 80 5.743 -3.460 -7.406 1.00 2.27 H new ATOM 0 HD2 TYR A 80 6.899 0.621 -7.006 1.00 1.56 H new ATOM 0 HE1 TYR A 80 7.449 -4.074 -5.710 1.00 3.30 H new ATOM 0 HE2 TYR A 80 8.596 -0.054 -5.344 1.00 2.49 H new ATOM 0 HH TYR A 80 8.755 -3.065 -4.162 1.00 4.39 H new ATOM 1189 N VAL A 81 3.035 0.318 -5.799 1.00 0.32 N ATOM 1190 CA VAL A 81 2.558 1.576 -5.250 1.00 0.32 C ATOM 1191 C VAL A 81 3.701 2.560 -5.163 1.00 0.32 C ATOM 1192 O VAL A 81 4.698 2.291 -4.509 1.00 0.36 O ATOM 1193 CB VAL A 81 1.903 1.422 -3.863 1.00 0.36 C ATOM 1194 CG1 VAL A 81 1.317 2.749 -3.399 1.00 0.46 C ATOM 1195 CG2 VAL A 81 0.822 0.352 -3.899 1.00 0.38 C ATOM 0 H VAL A 81 3.338 -0.370 -5.110 1.00 0.32 H new ATOM 0 HA VAL A 81 1.787 1.943 -5.927 1.00 0.32 H new ATOM 0 HB VAL A 81 2.672 1.115 -3.154 1.00 0.36 H new ATOM 0 HG11 VAL A 81 0.859 2.621 -2.418 1.00 0.46 H new ATOM 0 HG12 VAL A 81 2.110 3.494 -3.335 1.00 0.46 H new ATOM 0 HG13 VAL A 81 0.562 3.082 -4.111 1.00 0.46 H new ATOM 0 HG21 VAL A 81 0.371 0.257 -2.911 1.00 0.38 H new ATOM 0 HG22 VAL A 81 0.056 0.633 -4.622 1.00 0.38 H new ATOM 0 HG23 VAL A 81 1.263 -0.601 -4.189 1.00 0.38 H new ATOM 1205 N THR A 82 3.584 3.673 -5.861 1.00 0.32 N ATOM 1206 CA THR A 82 4.624 4.672 -5.819 1.00 0.32 C ATOM 1207 C THR A 82 4.228 5.772 -4.862 1.00 0.31 C ATOM 1208 O THR A 82 3.049 6.106 -4.714 1.00 0.32 O ATOM 1209 CB THR A 82 4.932 5.282 -7.210 1.00 0.32 C ATOM 1210 OG1 THR A 82 6.305 5.676 -7.294 1.00 1.22 O ATOM 1211 CG2 THR A 82 4.086 6.504 -7.492 1.00 1.37 C ATOM 0 H THR A 82 2.788 3.903 -6.456 1.00 0.32 H new ATOM 0 HA THR A 82 5.533 4.175 -5.479 1.00 0.32 H new ATOM 0 HB THR A 82 4.706 4.508 -7.943 1.00 0.32 H new ATOM 0 HG1 THR A 82 6.446 6.199 -8.111 1.00 1.22 H new ATOM 0 HG21 THR A 82 4.335 6.899 -8.477 1.00 1.37 H new ATOM 0 HG22 THR A 82 3.031 6.230 -7.466 1.00 1.37 H new ATOM 0 HG23 THR A 82 4.282 7.264 -6.736 1.00 1.37 H new ATOM 1219 N ALA A 83 5.212 6.291 -4.186 1.00 0.33 N ATOM 1220 CA ALA A 83 4.993 7.403 -3.276 1.00 0.32 C ATOM 1221 C ALA A 83 5.410 8.729 -3.916 1.00 0.27 C ATOM 1222 O ALA A 83 6.559 8.896 -4.329 1.00 0.31 O ATOM 1223 CB ALA A 83 5.732 7.166 -1.970 1.00 0.41 C ATOM 0 H ALA A 83 6.178 5.969 -4.240 1.00 0.33 H new ATOM 0 HA ALA A 83 3.927 7.467 -3.060 1.00 0.32 H new ATOM 0 HB1 ALA A 83 5.560 8.006 -1.297 1.00 0.41 H new ATOM 0 HB2 ALA A 83 5.367 6.249 -1.507 1.00 0.41 H new ATOM 0 HB3 ALA A 83 6.800 7.073 -2.168 1.00 0.41 H new ATOM 1229 N GLN A 84 4.456 9.655 -4.022 1.00 0.25 N ATOM 1230 CA GLN A 84 4.707 10.957 -4.635 1.00 0.26 C ATOM 1231 C GLN A 84 5.027 12.010 -3.567 1.00 0.25 C ATOM 1232 O GLN A 84 6.049 11.917 -2.903 1.00 0.28 O ATOM 1233 CB GLN A 84 3.530 11.399 -5.515 1.00 0.33 C ATOM 1234 CG GLN A 84 3.838 12.622 -6.372 1.00 0.77 C ATOM 1235 CD GLN A 84 5.049 12.419 -7.259 1.00 1.32 C ATOM 1236 OE1 GLN A 84 4.818 11.971 -8.477 1.00 2.05 O flip ATOM 1237 NE2 GLN A 84 6.181 12.694 -6.862 1.00 2.02 N flip ATOM 0 H GLN A 84 3.500 9.525 -3.690 1.00 0.25 H new ATOM 0 HA GLN A 84 5.578 10.858 -5.282 1.00 0.26 H new ATOM 0 HB2 GLN A 84 3.242 10.573 -6.165 1.00 0.33 H new ATOM 0 HB3 GLN A 84 2.673 11.618 -4.879 1.00 0.33 H new ATOM 0 HG2 GLN A 84 2.972 12.854 -6.992 1.00 0.77 H new ATOM 0 HG3 GLN A 84 4.006 13.482 -5.724 1.00 0.77 H new ATOM 0 HE21 GLN A 84 6.319 13.038 -5.912 1.00 2.02 H new ATOM 0 HE22 GLN A 84 6.982 12.578 -7.483 1.00 2.02 H new ATOM 1246 N ASP A 85 4.182 13.031 -3.423 1.00 0.24 N ATOM 1247 CA ASP A 85 4.439 14.081 -2.433 1.00 0.28 C ATOM 1248 C ASP A 85 3.148 14.637 -1.835 1.00 0.26 C ATOM 1249 O ASP A 85 2.391 15.325 -2.520 1.00 0.27 O ATOM 1250 CB ASP A 85 5.251 15.223 -3.052 1.00 0.34 C ATOM 1251 CG ASP A 85 5.699 16.246 -2.022 1.00 0.44 C ATOM 1252 OD1 ASP A 85 6.688 15.982 -1.306 1.00 0.53 O ATOM 1253 OD2 ASP A 85 5.079 17.329 -1.936 1.00 0.56 O ATOM 0 H ASP A 85 3.328 13.155 -3.967 1.00 0.24 H new ATOM 0 HA ASP A 85 5.013 13.621 -1.628 1.00 0.28 H new ATOM 0 HB2 ASP A 85 6.126 14.811 -3.554 1.00 0.34 H new ATOM 0 HB3 ASP A 85 4.650 15.719 -3.814 1.00 0.34 H new ATOM 1258 N GLU A 86 2.916 14.334 -0.556 1.00 0.27 N ATOM 1259 CA GLU A 86 1.784 14.880 0.208 1.00 0.29 C ATOM 1260 C GLU A 86 0.476 14.615 -0.539 1.00 0.22 C ATOM 1261 O GLU A 86 0.358 13.556 -1.122 1.00 0.19 O ATOM 1262 CB GLU A 86 2.061 16.369 0.454 1.00 0.40 C ATOM 1263 CG GLU A 86 0.985 17.170 1.181 1.00 0.51 C ATOM 1264 CD GLU A 86 1.077 17.056 2.681 1.00 0.78 C ATOM 1265 OE1 GLU A 86 2.105 17.463 3.251 1.00 1.04 O ATOM 1266 OE2 GLU A 86 0.129 16.532 3.298 1.00 1.62 O ATOM 0 H GLU A 86 3.507 13.702 -0.016 1.00 0.27 H new ATOM 0 HA GLU A 86 1.675 14.393 1.177 1.00 0.29 H new ATOM 0 HB2 GLU A 86 2.986 16.450 1.025 1.00 0.40 H new ATOM 0 HB3 GLU A 86 2.240 16.843 -0.511 1.00 0.40 H new ATOM 0 HG2 GLU A 86 1.067 18.219 0.896 1.00 0.51 H new ATOM 0 HG3 GLU A 86 0.003 16.827 0.856 1.00 0.51 H new ATOM 1273 N ASP A 87 -0.470 15.553 -0.598 1.00 0.22 N ATOM 1274 CA ASP A 87 -1.743 15.264 -1.231 1.00 0.20 C ATOM 1275 C ASP A 87 -1.575 15.259 -2.731 1.00 0.23 C ATOM 1276 O ASP A 87 -1.867 16.225 -3.437 1.00 0.30 O ATOM 1277 CB ASP A 87 -2.845 16.231 -0.799 1.00 0.28 C ATOM 1278 CG ASP A 87 -4.225 15.746 -1.227 1.00 0.33 C ATOM 1279 OD1 ASP A 87 -4.498 14.542 -1.081 1.00 0.56 O ATOM 1280 OD2 ASP A 87 -5.041 16.571 -1.709 1.00 0.61 O ATOM 0 H ASP A 87 -0.377 16.497 -0.222 1.00 0.22 H new ATOM 0 HA ASP A 87 -2.063 14.275 -0.903 1.00 0.20 H new ATOM 0 HB2 ASP A 87 -2.821 16.348 0.284 1.00 0.28 H new ATOM 0 HB3 ASP A 87 -2.655 17.214 -1.230 1.00 0.28 H new ATOM 1285 N GLN A 88 -1.044 14.153 -3.180 1.00 0.19 N ATOM 1286 CA GLN A 88 -0.915 13.838 -4.575 1.00 0.24 C ATOM 1287 C GLN A 88 -1.017 12.342 -4.654 1.00 0.21 C ATOM 1288 O GLN A 88 -0.230 11.646 -4.018 1.00 0.19 O ATOM 1289 CB GLN A 88 0.432 14.329 -5.112 1.00 0.32 C ATOM 1290 CG GLN A 88 0.650 14.042 -6.588 1.00 1.03 C ATOM 1291 CD GLN A 88 -0.373 14.714 -7.482 1.00 1.28 C ATOM 1292 OE1 GLN A 88 -0.899 15.779 -7.163 1.00 1.89 O ATOM 1293 NE2 GLN A 88 -0.660 14.090 -8.612 1.00 1.93 N ATOM 0 H GLN A 88 -0.679 13.426 -2.565 1.00 0.19 H new ATOM 0 HA GLN A 88 -1.682 14.323 -5.179 1.00 0.24 H new ATOM 0 HB2 GLN A 88 0.508 15.404 -4.946 1.00 0.32 H new ATOM 0 HB3 GLN A 88 1.232 13.861 -4.539 1.00 0.32 H new ATOM 0 HG2 GLN A 88 1.648 14.375 -6.873 1.00 1.03 H new ATOM 0 HG3 GLN A 88 0.615 12.965 -6.752 1.00 1.03 H new ATOM 0 HE21 GLN A 88 -0.201 13.208 -8.838 1.00 1.93 H new ATOM 0 HE22 GLN A 88 -1.341 14.491 -9.257 1.00 1.93 H new ATOM 1302 N PRO A 89 -1.987 11.819 -5.404 1.00 0.24 N ATOM 1303 CA PRO A 89 -2.371 10.423 -5.276 1.00 0.24 C ATOM 1304 C PRO A 89 -1.220 9.485 -5.563 1.00 0.21 C ATOM 1305 O PRO A 89 -0.337 9.782 -6.368 1.00 0.22 O ATOM 1306 CB PRO A 89 -3.475 10.248 -6.328 1.00 0.33 C ATOM 1307 CG PRO A 89 -3.332 11.412 -7.249 1.00 0.58 C ATOM 1308 CD PRO A 89 -2.785 12.530 -6.412 1.00 0.33 C ATOM 0 HA PRO A 89 -2.693 10.185 -4.262 1.00 0.24 H new ATOM 0 HB2 PRO A 89 -3.361 9.306 -6.865 1.00 0.33 H new ATOM 0 HB3 PRO A 89 -4.461 10.233 -5.864 1.00 0.33 H new ATOM 0 HG2 PRO A 89 -2.661 11.177 -8.075 1.00 0.58 H new ATOM 0 HG3 PRO A 89 -4.292 11.685 -7.687 1.00 0.58 H new ATOM 0 HD2 PRO A 89 -2.176 13.216 -7.001 1.00 0.33 H new ATOM 0 HD3 PRO A 89 -3.580 13.121 -5.956 1.00 0.33 H new ATOM 1316 N VAL A 90 -1.236 8.359 -4.875 1.00 0.23 N ATOM 1317 CA VAL A 90 -0.254 7.328 -5.094 1.00 0.24 C ATOM 1318 C VAL A 90 -0.364 6.832 -6.534 1.00 0.24 C ATOM 1319 O VAL A 90 -1.446 6.495 -7.016 1.00 0.28 O ATOM 1320 CB VAL A 90 -0.435 6.173 -4.076 1.00 0.36 C ATOM 1321 CG1 VAL A 90 -0.418 6.729 -2.663 1.00 1.31 C ATOM 1322 CG2 VAL A 90 -1.723 5.397 -4.322 1.00 1.10 C ATOM 0 H VAL A 90 -1.926 8.140 -4.156 1.00 0.23 H new ATOM 0 HA VAL A 90 0.745 7.735 -4.940 1.00 0.24 H new ATOM 0 HB VAL A 90 0.394 5.477 -4.206 1.00 0.36 H new ATOM 0 HG11 VAL A 90 -0.545 5.915 -1.950 1.00 1.31 H new ATOM 0 HG12 VAL A 90 0.534 7.226 -2.479 1.00 1.31 H new ATOM 0 HG13 VAL A 90 -1.231 7.446 -2.544 1.00 1.31 H new ATOM 0 HG21 VAL A 90 -1.812 4.597 -3.587 1.00 1.10 H new ATOM 0 HG22 VAL A 90 -2.576 6.069 -4.231 1.00 1.10 H new ATOM 0 HG23 VAL A 90 -1.704 4.969 -5.324 1.00 1.10 H new ATOM 1332 N LEU A 91 0.759 6.826 -7.229 1.00 0.22 N ATOM 1333 CA LEU A 91 0.763 6.612 -8.658 1.00 0.24 C ATOM 1334 C LEU A 91 1.095 5.165 -8.926 1.00 0.26 C ATOM 1335 O LEU A 91 1.852 4.553 -8.173 1.00 0.33 O ATOM 1336 CB LEU A 91 1.762 7.542 -9.349 1.00 0.30 C ATOM 1337 CG LEU A 91 1.605 9.033 -9.029 1.00 0.31 C ATOM 1338 CD1 LEU A 91 2.700 9.827 -9.715 1.00 0.42 C ATOM 1339 CD2 LEU A 91 0.236 9.532 -9.469 1.00 0.34 C ATOM 0 H LEU A 91 1.683 6.968 -6.821 1.00 0.22 H new ATOM 0 HA LEU A 91 -0.222 6.842 -9.065 1.00 0.24 H new ATOM 0 HB2 LEU A 91 2.770 7.233 -9.073 1.00 0.30 H new ATOM 0 HB3 LEU A 91 1.671 7.408 -10.427 1.00 0.30 H new ATOM 0 HG LEU A 91 1.690 9.171 -7.951 1.00 0.31 H new ATOM 0 HD11 LEU A 91 2.582 10.885 -9.483 1.00 0.42 H new ATOM 0 HD12 LEU A 91 3.673 9.485 -9.363 1.00 0.42 H new ATOM 0 HD13 LEU A 91 2.633 9.682 -10.793 1.00 0.42 H new ATOM 0 HD21 LEU A 91 0.142 10.592 -9.234 1.00 0.34 H new ATOM 0 HD22 LEU A 91 0.124 9.387 -10.544 1.00 0.34 H new ATOM 0 HD23 LEU A 91 -0.540 8.974 -8.945 1.00 0.34 H new ATOM 1351 N LEU A 92 0.535 4.596 -9.970 1.00 0.27 N ATOM 1352 CA LEU A 92 0.676 3.177 -10.164 1.00 0.28 C ATOM 1353 C LEU A 92 1.877 2.927 -11.046 1.00 0.29 C ATOM 1354 O LEU A 92 1.865 3.105 -12.265 1.00 0.31 O ATOM 1355 CB LEU A 92 -0.589 2.569 -10.770 1.00 0.32 C ATOM 1356 CG LEU A 92 -1.824 2.612 -9.867 1.00 0.76 C ATOM 1357 CD1 LEU A 92 -2.998 1.926 -10.541 1.00 1.15 C ATOM 1358 CD2 LEU A 92 -1.529 1.962 -8.523 1.00 1.30 C ATOM 0 H LEU A 92 -0.010 5.084 -10.681 1.00 0.27 H new ATOM 0 HA LEU A 92 0.825 2.694 -9.198 1.00 0.28 H new ATOM 0 HB2 LEU A 92 -0.817 3.093 -11.698 1.00 0.32 H new ATOM 0 HB3 LEU A 92 -0.385 1.531 -11.032 1.00 0.32 H new ATOM 0 HG LEU A 92 -2.085 3.656 -9.693 1.00 0.76 H new ATOM 0 HD11 LEU A 92 -3.868 1.966 -9.885 1.00 1.15 H new ATOM 0 HD12 LEU A 92 -3.227 2.433 -11.478 1.00 1.15 H new ATOM 0 HD13 LEU A 92 -2.744 0.886 -10.744 1.00 1.15 H new ATOM 0 HD21 LEU A 92 -2.420 2.003 -7.896 1.00 1.30 H new ATOM 0 HD22 LEU A 92 -1.241 0.922 -8.677 1.00 1.30 H new ATOM 0 HD23 LEU A 92 -0.715 2.495 -8.032 1.00 1.30 H new ATOM 1370 N LYS A 93 2.923 2.530 -10.346 1.00 0.31 N ATOM 1371 CA LYS A 93 4.243 2.334 -10.881 1.00 0.37 C ATOM 1372 C LYS A 93 4.319 0.883 -11.316 1.00 0.38 C ATOM 1373 O LYS A 93 4.060 0.001 -10.528 1.00 0.39 O ATOM 1374 CB LYS A 93 5.284 2.627 -9.762 1.00 0.46 C ATOM 1375 CG LYS A 93 6.728 2.613 -10.209 1.00 1.29 C ATOM 1376 CD LYS A 93 7.000 3.645 -11.297 1.00 2.11 C ATOM 1377 CE LYS A 93 6.727 5.063 -10.812 1.00 2.85 C ATOM 1378 NZ LYS A 93 7.080 6.079 -11.838 1.00 3.26 N ATOM 0 H LYS A 93 2.866 2.329 -9.348 1.00 0.31 H new ATOM 0 HA LYS A 93 4.451 2.995 -11.722 1.00 0.37 H new ATOM 0 HB2 LYS A 93 5.064 3.603 -9.329 1.00 0.46 H new ATOM 0 HB3 LYS A 93 5.158 1.890 -8.969 1.00 0.46 H new ATOM 0 HG2 LYS A 93 7.374 2.810 -9.353 1.00 1.29 H new ATOM 0 HG3 LYS A 93 6.983 1.620 -10.579 1.00 1.29 H new ATOM 0 HD2 LYS A 93 8.037 3.565 -11.622 1.00 2.11 H new ATOM 0 HD3 LYS A 93 6.376 3.431 -12.165 1.00 2.11 H new ATOM 0 HE2 LYS A 93 5.673 5.161 -10.552 1.00 2.85 H new ATOM 0 HE3 LYS A 93 7.298 5.252 -9.903 1.00 2.85 H new ATOM 0 HZ1 LYS A 93 6.879 7.030 -11.468 1.00 3.26 H new ATOM 0 HZ2 LYS A 93 8.091 6.003 -12.068 1.00 3.26 H new ATOM 0 HZ3 LYS A 93 6.517 5.915 -12.697 1.00 3.26 H new ATOM 1392 N GLU A 94 4.589 0.611 -12.571 1.00 0.43 N ATOM 1393 CA GLU A 94 4.520 -0.767 -13.015 1.00 0.47 C ATOM 1394 C GLU A 94 5.904 -1.379 -12.954 1.00 0.52 C ATOM 1395 O GLU A 94 6.716 -1.246 -13.870 1.00 0.62 O ATOM 1396 CB GLU A 94 3.958 -0.861 -14.438 1.00 0.56 C ATOM 1397 CG GLU A 94 3.855 -2.290 -14.952 1.00 1.38 C ATOM 1398 CD GLU A 94 3.460 -2.363 -16.410 1.00 1.76 C ATOM 1399 OE1 GLU A 94 4.283 -1.995 -17.275 1.00 2.33 O ATOM 1400 OE2 GLU A 94 2.312 -2.769 -16.694 1.00 2.05 O ATOM 0 H GLU A 94 4.849 1.294 -13.282 1.00 0.43 H new ATOM 0 HA GLU A 94 3.847 -1.316 -12.357 1.00 0.47 H new ATOM 0 HB2 GLU A 94 2.970 -0.402 -14.462 1.00 0.56 H new ATOM 0 HB3 GLU A 94 4.593 -0.285 -15.111 1.00 0.56 H new ATOM 0 HG2 GLU A 94 4.814 -2.790 -14.815 1.00 1.38 H new ATOM 0 HG3 GLU A 94 3.123 -2.834 -14.355 1.00 1.38 H new ATOM 1407 N MET A 95 6.157 -2.038 -11.834 1.00 0.50 N ATOM 1408 CA MET A 95 7.428 -2.681 -11.595 1.00 0.59 C ATOM 1409 C MET A 95 7.217 -4.173 -11.459 1.00 0.66 C ATOM 1410 O MET A 95 6.532 -4.631 -10.544 1.00 0.65 O ATOM 1411 CB MET A 95 8.110 -2.117 -10.345 1.00 0.60 C ATOM 1412 CG MET A 95 9.446 -2.780 -10.048 1.00 1.21 C ATOM 1413 SD MET A 95 10.629 -2.575 -11.395 1.00 1.67 S ATOM 1414 CE MET A 95 11.889 -3.757 -10.923 1.00 2.39 C ATOM 0 H MET A 95 5.487 -2.139 -11.072 1.00 0.50 H new ATOM 0 HA MET A 95 8.085 -2.483 -12.442 1.00 0.59 H new ATOM 0 HB2 MET A 95 8.263 -1.045 -10.473 1.00 0.60 H new ATOM 0 HB3 MET A 95 7.449 -2.244 -9.488 1.00 0.60 H new ATOM 0 HG2 MET A 95 9.863 -2.357 -9.134 1.00 1.21 H new ATOM 0 HG3 MET A 95 9.288 -3.843 -9.865 1.00 1.21 H new ATOM 0 HE1 MET A 95 12.176 -4.349 -11.792 1.00 2.39 H new ATOM 0 HE2 MET A 95 12.761 -3.226 -10.541 1.00 2.39 H new ATOM 0 HE3 MET A 95 11.498 -4.416 -10.148 1.00 2.39 H new ATOM 1424 N PRO A 96 7.784 -4.948 -12.377 1.00 0.82 N ATOM 1425 CA PRO A 96 7.632 -6.394 -12.369 1.00 0.95 C ATOM 1426 C PRO A 96 8.394 -7.058 -11.225 1.00 0.93 C ATOM 1427 O PRO A 96 9.584 -6.802 -11.022 1.00 0.98 O ATOM 1428 CB PRO A 96 8.191 -6.808 -13.728 1.00 1.19 C ATOM 1429 CG PRO A 96 9.176 -5.747 -14.067 1.00 1.26 C ATOM 1430 CD PRO A 96 8.618 -4.476 -13.497 1.00 0.99 C ATOM 0 HA PRO A 96 6.598 -6.701 -12.213 1.00 0.95 H new ATOM 0 HB2 PRO A 96 8.665 -7.788 -13.680 1.00 1.19 H new ATOM 0 HB3 PRO A 96 7.403 -6.872 -14.478 1.00 1.19 H new ATOM 0 HG2 PRO A 96 10.154 -5.971 -13.641 1.00 1.26 H new ATOM 0 HG3 PRO A 96 9.309 -5.667 -15.146 1.00 1.26 H new ATOM 0 HD2 PRO A 96 9.408 -3.806 -13.157 1.00 0.99 H new ATOM 0 HD3 PRO A 96 8.031 -3.928 -14.234 1.00 0.99 H new ATOM 1438 N GLU A 97 7.678 -7.910 -10.497 1.00 0.98 N ATOM 1439 CA GLU A 97 8.209 -8.656 -9.354 1.00 1.06 C ATOM 1440 C GLU A 97 8.488 -7.773 -8.140 1.00 0.90 C ATOM 1441 O GLU A 97 9.064 -6.688 -8.230 1.00 0.88 O ATOM 1442 CB GLU A 97 9.468 -9.438 -9.751 1.00 1.32 C ATOM 1443 CG GLU A 97 10.458 -9.658 -8.614 1.00 1.84 C ATOM 1444 CD GLU A 97 11.800 -10.162 -9.097 1.00 2.42 C ATOM 1445 OE1 GLU A 97 12.466 -9.453 -9.879 1.00 3.15 O ATOM 1446 OE2 GLU A 97 12.197 -11.277 -8.701 1.00 2.74 O ATOM 0 H GLU A 97 6.695 -8.107 -10.686 1.00 0.98 H new ATOM 0 HA GLU A 97 7.430 -9.359 -9.057 1.00 1.06 H new ATOM 0 HB2 GLU A 97 9.168 -10.408 -10.148 1.00 1.32 H new ATOM 0 HB3 GLU A 97 9.972 -8.906 -10.557 1.00 1.32 H new ATOM 0 HG2 GLU A 97 10.599 -8.721 -8.074 1.00 1.84 H new ATOM 0 HG3 GLU A 97 10.039 -10.374 -7.906 1.00 1.84 H new ATOM 1453 N ILE A 98 8.047 -8.280 -7.000 1.00 1.08 N ATOM 1454 CA ILE A 98 8.298 -7.663 -5.706 1.00 1.17 C ATOM 1455 C ILE A 98 9.717 -7.973 -5.248 1.00 1.10 C ATOM 1456 O ILE A 98 10.132 -9.135 -5.238 1.00 1.29 O ATOM 1457 CB ILE A 98 7.278 -8.141 -4.655 1.00 1.61 C ATOM 1458 CG1 ILE A 98 5.861 -7.749 -5.082 1.00 2.25 C ATOM 1459 CG2 ILE A 98 7.600 -7.564 -3.288 1.00 2.35 C ATOM 1460 CD1 ILE A 98 5.664 -6.257 -5.266 1.00 3.20 C ATOM 0 H ILE A 98 7.500 -9.139 -6.946 1.00 1.08 H new ATOM 0 HA ILE A 98 8.186 -6.584 -5.814 1.00 1.17 H new ATOM 0 HB ILE A 98 7.337 -9.227 -4.585 1.00 1.61 H new ATOM 0 HG12 ILE A 98 5.621 -8.255 -6.017 1.00 2.25 H new ATOM 0 HG13 ILE A 98 5.154 -8.109 -4.334 1.00 2.25 H new ATOM 0 HG21 ILE A 98 6.866 -7.916 -2.563 1.00 2.35 H new ATOM 0 HG22 ILE A 98 8.595 -7.886 -2.982 1.00 2.35 H new ATOM 0 HG23 ILE A 98 7.570 -6.475 -3.336 1.00 2.35 H new ATOM 0 HD11 ILE A 98 4.635 -6.060 -5.568 1.00 3.20 H new ATOM 0 HD12 ILE A 98 5.870 -5.744 -4.327 1.00 3.20 H new ATOM 0 HD13 ILE A 98 6.344 -5.892 -6.036 1.00 3.20 H new ATOM 1472 N PRO A 99 10.487 -6.944 -4.883 1.00 1.08 N ATOM 1473 CA PRO A 99 11.902 -7.106 -4.573 1.00 1.14 C ATOM 1474 C PRO A 99 12.187 -7.842 -3.262 1.00 1.08 C ATOM 1475 O PRO A 99 11.519 -7.658 -2.251 1.00 1.15 O ATOM 1476 CB PRO A 99 12.410 -5.667 -4.482 1.00 1.38 C ATOM 1477 CG PRO A 99 11.218 -4.875 -4.086 1.00 1.61 C ATOM 1478 CD PRO A 99 10.047 -5.545 -4.749 1.00 1.28 C ATOM 0 HA PRO A 99 12.389 -7.721 -5.330 1.00 1.14 H new ATOM 0 HB2 PRO A 99 13.210 -5.574 -3.747 1.00 1.38 H new ATOM 0 HB3 PRO A 99 12.813 -5.327 -5.436 1.00 1.38 H new ATOM 0 HG2 PRO A 99 11.099 -4.861 -3.003 1.00 1.61 H new ATOM 0 HG3 PRO A 99 11.311 -3.838 -4.410 1.00 1.61 H new ATOM 0 HD2 PRO A 99 9.143 -5.464 -4.146 1.00 1.28 H new ATOM 0 HD3 PRO A 99 9.824 -5.099 -5.718 1.00 1.28 H new ATOM 1486 N LYS A 100 13.227 -8.649 -3.326 1.00 1.10 N ATOM 1487 CA LYS A 100 13.862 -9.294 -2.178 1.00 1.07 C ATOM 1488 C LYS A 100 15.079 -8.454 -1.821 1.00 1.03 C ATOM 1489 O LYS A 100 15.763 -8.646 -0.819 1.00 0.99 O ATOM 1490 CB LYS A 100 14.261 -10.748 -2.504 1.00 1.15 C ATOM 1491 CG LYS A 100 15.152 -10.917 -3.737 1.00 1.99 C ATOM 1492 CD LYS A 100 14.384 -10.706 -5.039 1.00 2.34 C ATOM 1493 CE LYS A 100 15.283 -10.845 -6.255 1.00 3.09 C ATOM 1494 NZ LYS A 100 14.597 -10.416 -7.507 1.00 3.70 N ATOM 0 H LYS A 100 13.676 -8.887 -4.210 1.00 1.10 H new ATOM 0 HA LYS A 100 13.172 -9.350 -1.336 1.00 1.07 H new ATOM 0 HB2 LYS A 100 14.778 -11.168 -1.641 1.00 1.15 H new ATOM 0 HB3 LYS A 100 13.353 -11.334 -2.648 1.00 1.15 H new ATOM 0 HG2 LYS A 100 15.978 -10.208 -3.686 1.00 1.99 H new ATOM 0 HG3 LYS A 100 15.589 -11.916 -3.733 1.00 1.99 H new ATOM 0 HD2 LYS A 100 13.572 -11.430 -5.103 1.00 2.34 H new ATOM 0 HD3 LYS A 100 13.928 -9.716 -5.035 1.00 2.34 H new ATOM 0 HE2 LYS A 100 16.183 -10.247 -6.111 1.00 3.09 H new ATOM 0 HE3 LYS A 100 15.602 -11.883 -6.353 1.00 3.09 H new ATOM 0 HZ1 LYS A 100 15.233 -10.558 -8.318 1.00 3.70 H new ATOM 0 HZ2 LYS A 100 13.734 -10.980 -7.641 1.00 3.70 H new ATOM 0 HZ3 LYS A 100 14.345 -9.409 -7.437 1.00 3.70 H new ATOM 1508 N THR A 101 15.379 -7.614 -2.779 1.00 1.10 N ATOM 1509 CA THR A 101 16.489 -6.709 -2.791 1.00 1.11 C ATOM 1510 C THR A 101 15.981 -5.352 -3.311 1.00 1.16 C ATOM 1511 O THR A 101 15.607 -5.245 -4.477 1.00 1.30 O ATOM 1512 CB THR A 101 17.567 -7.309 -3.720 1.00 1.30 C ATOM 1513 OG1 THR A 101 18.128 -8.477 -3.105 1.00 1.73 O ATOM 1514 CG2 THR A 101 18.666 -6.322 -4.072 1.00 1.92 C ATOM 0 H THR A 101 14.814 -7.544 -3.625 1.00 1.10 H new ATOM 0 HA THR A 101 16.922 -6.561 -1.801 1.00 1.11 H new ATOM 0 HB THR A 101 17.077 -7.572 -4.658 1.00 1.30 H new ATOM 0 HG1 THR A 101 18.811 -8.860 -3.694 1.00 1.73 H new ATOM 0 HG21 THR A 101 19.392 -6.804 -4.727 1.00 1.92 H new ATOM 0 HG22 THR A 101 18.233 -5.462 -4.582 1.00 1.92 H new ATOM 0 HG23 THR A 101 19.163 -5.991 -3.160 1.00 1.92 H new ATOM 1522 N ILE A 102 15.938 -4.329 -2.455 1.00 1.14 N ATOM 1523 CA ILE A 102 15.318 -3.067 -2.833 1.00 1.18 C ATOM 1524 C ILE A 102 16.411 -2.070 -3.148 1.00 1.22 C ATOM 1525 O ILE A 102 17.100 -1.568 -2.266 1.00 1.37 O ATOM 1526 CB ILE A 102 14.339 -2.536 -1.737 1.00 1.31 C ATOM 1527 CG1 ILE A 102 13.530 -1.319 -2.229 1.00 2.08 C ATOM 1528 CG2 ILE A 102 15.054 -2.207 -0.437 1.00 1.98 C ATOM 1529 CD1 ILE A 102 14.274 0.005 -2.219 1.00 2.69 C ATOM 0 H ILE A 102 16.320 -4.352 -1.510 1.00 1.14 H new ATOM 0 HA ILE A 102 14.703 -3.223 -3.720 1.00 1.18 H new ATOM 0 HB ILE A 102 13.641 -3.348 -1.536 1.00 1.31 H new ATOM 0 HG12 ILE A 102 13.189 -1.517 -3.245 1.00 2.08 H new ATOM 0 HG13 ILE A 102 12.640 -1.221 -1.608 1.00 2.08 H new ATOM 0 HG21 ILE A 102 14.332 -1.842 0.293 1.00 1.98 H new ATOM 0 HG22 ILE A 102 15.538 -3.104 -0.051 1.00 1.98 H new ATOM 0 HG23 ILE A 102 15.805 -1.439 -0.619 1.00 1.98 H new ATOM 0 HD11 ILE A 102 13.616 0.795 -2.583 1.00 2.69 H new ATOM 0 HD12 ILE A 102 14.591 0.237 -1.202 1.00 2.69 H new ATOM 0 HD13 ILE A 102 15.149 -0.065 -2.865 1.00 2.69 H new ATOM 1541 N THR A 103 16.565 -1.773 -4.405 1.00 1.15 N ATOM 1542 CA THR A 103 17.708 -1.023 -4.844 1.00 1.20 C ATOM 1543 C THR A 103 17.253 0.162 -5.657 1.00 1.08 C ATOM 1544 O THR A 103 16.525 0.003 -6.629 1.00 1.05 O ATOM 1545 CB THR A 103 18.691 -1.916 -5.647 1.00 1.39 C ATOM 1546 OG1 THR A 103 19.809 -1.149 -6.109 1.00 1.58 O ATOM 1547 CG2 THR A 103 18.004 -2.590 -6.828 1.00 1.57 C ATOM 0 H THR A 103 15.915 -2.038 -5.145 1.00 1.15 H new ATOM 0 HA THR A 103 18.249 -0.660 -3.970 1.00 1.20 H new ATOM 0 HB THR A 103 19.045 -2.695 -4.971 1.00 1.39 H new ATOM 0 HG1 THR A 103 20.418 -1.729 -6.611 1.00 1.58 H new ATOM 0 HG21 THR A 103 18.725 -3.206 -7.365 1.00 1.57 H new ATOM 0 HG22 THR A 103 17.189 -3.217 -6.466 1.00 1.57 H new ATOM 0 HG23 THR A 103 17.605 -1.830 -7.499 1.00 1.57 H new ATOM 1555 N GLY A 104 17.761 1.329 -5.268 1.00 1.08 N ATOM 1556 CA GLY A 104 17.259 2.627 -5.724 1.00 1.03 C ATOM 1557 C GLY A 104 15.792 2.669 -6.158 1.00 0.92 C ATOM 1558 O GLY A 104 14.945 3.132 -5.401 1.00 0.84 O ATOM 0 H GLY A 104 18.544 1.403 -4.618 1.00 1.08 H new ATOM 0 HA2 GLY A 104 17.400 3.350 -4.921 1.00 1.03 H new ATOM 0 HA3 GLY A 104 17.874 2.957 -6.561 1.00 1.03 H new ATOM 1562 N SER A 105 15.496 2.203 -7.360 1.00 0.96 N ATOM 1563 CA SER A 105 14.220 2.463 -8.028 1.00 0.92 C ATOM 1564 C SER A 105 12.987 1.843 -7.338 1.00 0.81 C ATOM 1565 O SER A 105 11.874 2.300 -7.573 1.00 0.77 O ATOM 1566 CB SER A 105 14.310 1.974 -9.477 1.00 1.05 C ATOM 1567 OG SER A 105 13.148 2.305 -10.223 1.00 1.47 O ATOM 0 H SER A 105 16.136 1.628 -7.909 1.00 0.96 H new ATOM 0 HA SER A 105 14.062 3.540 -7.977 1.00 0.92 H new ATOM 0 HB2 SER A 105 15.185 2.414 -9.955 1.00 1.05 H new ATOM 0 HB3 SER A 105 14.452 0.893 -9.487 1.00 1.05 H new ATOM 0 HG SER A 105 13.245 1.978 -11.142 1.00 1.47 H new ATOM 1573 N GLU A 106 13.154 0.835 -6.486 1.00 0.79 N ATOM 1574 CA GLU A 106 12.008 0.137 -5.894 1.00 0.72 C ATOM 1575 C GLU A 106 11.447 0.937 -4.723 1.00 0.56 C ATOM 1576 O GLU A 106 10.515 0.508 -4.045 1.00 0.51 O ATOM 1577 CB GLU A 106 12.435 -1.250 -5.409 1.00 0.82 C ATOM 1578 CG GLU A 106 13.379 -1.979 -6.352 1.00 1.28 C ATOM 1579 CD GLU A 106 12.720 -2.390 -7.650 1.00 1.74 C ATOM 1580 OE1 GLU A 106 12.524 -1.518 -8.523 1.00 2.11 O ATOM 1581 OE2 GLU A 106 12.413 -3.591 -7.802 1.00 2.39 O ATOM 0 H GLU A 106 14.064 0.482 -6.189 1.00 0.79 H new ATOM 0 HA GLU A 106 11.234 0.032 -6.655 1.00 0.72 H new ATOM 0 HB2 GLU A 106 12.917 -1.150 -4.437 1.00 0.82 H new ATOM 0 HB3 GLU A 106 11.544 -1.861 -5.261 1.00 0.82 H new ATOM 0 HG2 GLU A 106 14.232 -1.336 -6.572 1.00 1.28 H new ATOM 0 HG3 GLU A 106 13.769 -2.866 -5.852 1.00 1.28 H new ATOM 1588 N THR A 107 12.016 2.114 -4.518 1.00 0.55 N ATOM 1589 CA THR A 107 11.759 2.923 -3.351 1.00 0.49 C ATOM 1590 C THR A 107 10.331 3.451 -3.323 1.00 0.37 C ATOM 1591 O THR A 107 9.904 4.000 -2.305 1.00 0.38 O ATOM 1592 CB THR A 107 12.746 4.111 -3.273 1.00 0.62 C ATOM 1593 OG1 THR A 107 12.566 4.833 -2.045 1.00 1.41 O ATOM 1594 CG2 THR A 107 12.559 5.061 -4.451 1.00 1.27 C ATOM 0 H THR A 107 12.678 2.535 -5.170 1.00 0.55 H new ATOM 0 HA THR A 107 11.901 2.275 -2.486 1.00 0.49 H new ATOM 0 HB THR A 107 13.756 3.703 -3.310 1.00 0.62 H new ATOM 0 HG1 THR A 107 11.664 4.669 -1.698 1.00 1.41 H new ATOM 0 HG21 THR A 107 13.266 5.886 -4.369 1.00 1.27 H new ATOM 0 HG22 THR A 107 12.735 4.524 -5.383 1.00 1.27 H new ATOM 0 HG23 THR A 107 11.542 5.453 -4.444 1.00 1.27 H new ATOM 1602 N ASN A 108 9.586 3.304 -4.423 1.00 0.34 N ATOM 1603 CA ASN A 108 8.243 3.799 -4.462 1.00 0.29 C ATOM 1604 C ASN A 108 7.386 3.020 -3.490 1.00 0.25 C ATOM 1605 O ASN A 108 6.535 3.581 -2.804 1.00 0.27 O ATOM 1606 CB ASN A 108 7.693 3.590 -5.871 1.00 0.40 C ATOM 1607 CG ASN A 108 8.742 3.734 -6.954 1.00 0.58 C ATOM 1608 OD1 ASN A 108 9.073 4.839 -7.380 1.00 1.39 O ATOM 1609 ND2 ASN A 108 9.244 2.609 -7.432 1.00 1.22 N ATOM 0 H ASN A 108 9.902 2.849 -5.279 1.00 0.34 H new ATOM 0 HA ASN A 108 8.231 4.856 -4.194 1.00 0.29 H new ATOM 0 HB2 ASN A 108 7.249 2.597 -5.936 1.00 0.40 H new ATOM 0 HB3 ASN A 108 6.894 4.309 -6.051 1.00 0.40 H new ATOM 0 HD21 ASN A 108 9.934 2.637 -8.183 1.00 1.22 H new ATOM 0 HD22 ASN A 108 8.942 1.713 -7.050 1.00 1.22 H new ATOM 1616 N LEU A 109 7.656 1.722 -3.423 1.00 0.25 N ATOM 1617 CA LEU A 109 6.863 0.809 -2.626 1.00 0.26 C ATOM 1618 C LEU A 109 7.409 0.592 -1.222 1.00 0.21 C ATOM 1619 O LEU A 109 7.332 -0.529 -0.709 1.00 0.23 O ATOM 1620 CB LEU A 109 6.759 -0.537 -3.336 1.00 0.41 C ATOM 1621 CG LEU A 109 5.622 -1.425 -2.852 1.00 0.54 C ATOM 1622 CD1 LEU A 109 4.321 -0.677 -2.986 1.00 0.83 C ATOM 1623 CD2 LEU A 109 5.566 -2.715 -3.650 1.00 0.95 C ATOM 0 H LEU A 109 8.429 1.279 -3.920 1.00 0.25 H new ATOM 0 HA LEU A 109 5.882 1.271 -2.517 1.00 0.26 H new ATOM 0 HB2 LEU A 109 6.634 -0.360 -4.404 1.00 0.41 H new ATOM 0 HB3 LEU A 109 7.700 -1.073 -3.209 1.00 0.41 H new ATOM 0 HG LEU A 109 5.794 -1.683 -1.807 1.00 0.54 H new ATOM 0 HD11 LEU A 109 3.502 -1.308 -2.641 1.00 0.83 H new ATOM 0 HD12 LEU A 109 4.359 0.230 -2.383 1.00 0.83 H new ATOM 0 HD13 LEU A 109 4.160 -0.412 -4.031 1.00 0.83 H new ATOM 0 HD21 LEU A 109 4.745 -3.333 -3.286 1.00 0.95 H new ATOM 0 HD22 LEU A 109 5.407 -2.485 -4.703 1.00 0.95 H new ATOM 0 HD23 LEU A 109 6.506 -3.255 -3.535 1.00 0.95 H new ATOM 1635 N LEU A 110 7.939 1.611 -0.573 1.00 0.20 N ATOM 1636 CA LEU A 110 8.350 1.407 0.806 1.00 0.21 C ATOM 1637 C LEU A 110 7.284 1.960 1.738 1.00 0.23 C ATOM 1638 O LEU A 110 6.875 3.110 1.591 1.00 0.31 O ATOM 1639 CB LEU A 110 9.686 2.108 1.075 1.00 0.28 C ATOM 1640 CG LEU A 110 10.824 1.754 0.111 1.00 0.81 C ATOM 1641 CD1 LEU A 110 12.093 2.497 0.497 1.00 1.71 C ATOM 1642 CD2 LEU A 110 11.074 0.252 0.087 1.00 1.64 C ATOM 0 H LEU A 110 8.091 2.545 -0.953 1.00 0.20 H new ATOM 0 HA LEU A 110 8.475 0.339 0.984 1.00 0.21 H new ATOM 0 HB2 LEU A 110 9.525 3.185 1.039 1.00 0.28 H new ATOM 0 HB3 LEU A 110 10.005 1.867 2.089 1.00 0.28 H new ATOM 0 HG LEU A 110 10.527 2.062 -0.892 1.00 0.81 H new ATOM 0 HD11 LEU A 110 12.893 2.236 -0.196 1.00 1.71 H new ATOM 0 HD12 LEU A 110 11.913 3.571 0.455 1.00 1.71 H new ATOM 0 HD13 LEU A 110 12.385 2.217 1.509 1.00 1.71 H new ATOM 0 HD21 LEU A 110 11.886 0.029 -0.605 1.00 1.64 H new ATOM 0 HD22 LEU A 110 11.345 -0.088 1.087 1.00 1.64 H new ATOM 0 HD23 LEU A 110 10.169 -0.262 -0.238 1.00 1.64 H new ATOM 1654 N PHE A 111 6.915 1.182 2.759 1.00 0.22 N ATOM 1655 CA PHE A 111 5.761 1.533 3.598 1.00 0.25 C ATOM 1656 C PHE A 111 5.954 1.177 5.062 1.00 0.23 C ATOM 1657 O PHE A 111 6.232 0.033 5.409 1.00 0.27 O ATOM 1658 CB PHE A 111 4.483 0.872 3.080 1.00 0.42 C ATOM 1659 CG PHE A 111 4.075 1.367 1.728 1.00 0.91 C ATOM 1660 CD1 PHE A 111 4.108 2.719 1.438 1.00 1.64 C ATOM 1661 CD2 PHE A 111 3.679 0.486 0.744 1.00 1.18 C ATOM 1662 CE1 PHE A 111 3.763 3.183 0.190 1.00 2.38 C ATOM 1663 CE2 PHE A 111 3.323 0.946 -0.504 1.00 1.90 C ATOM 1664 CZ PHE A 111 3.367 2.295 -0.782 1.00 2.46 C ATOM 0 H PHE A 111 7.388 0.318 3.024 1.00 0.22 H new ATOM 0 HA PHE A 111 5.669 2.617 3.533 1.00 0.25 H new ATOM 0 HB2 PHE A 111 4.631 -0.207 3.036 1.00 0.42 H new ATOM 0 HB3 PHE A 111 3.674 1.055 3.787 1.00 0.42 H new ATOM 0 HD1 PHE A 111 4.409 3.420 2.202 1.00 1.64 H new ATOM 0 HD2 PHE A 111 3.648 -0.573 0.954 1.00 1.18 H new ATOM 0 HE1 PHE A 111 3.803 4.241 -0.025 1.00 2.38 H new ATOM 0 HE2 PHE A 111 3.009 0.248 -1.266 1.00 1.90 H new ATOM 0 HZ PHE A 111 3.091 2.654 -1.762 1.00 2.46 H new ATOM 1674 N PHE A 112 5.796 2.184 5.905 1.00 0.21 N ATOM 1675 CA PHE A 112 5.928 2.037 7.350 1.00 0.25 C ATOM 1676 C PHE A 112 4.603 1.584 7.923 1.00 0.25 C ATOM 1677 O PHE A 112 3.644 2.356 7.985 1.00 0.26 O ATOM 1678 CB PHE A 112 6.384 3.340 8.014 1.00 0.30 C ATOM 1679 CG PHE A 112 6.472 3.261 9.514 1.00 0.57 C ATOM 1680 CD1 PHE A 112 7.227 2.272 10.123 1.00 0.79 C ATOM 1681 CD2 PHE A 112 5.790 4.165 10.314 1.00 0.95 C ATOM 1682 CE1 PHE A 112 7.305 2.188 11.500 1.00 1.21 C ATOM 1683 CE2 PHE A 112 5.862 4.085 11.691 1.00 1.43 C ATOM 1684 CZ PHE A 112 6.651 3.133 12.285 1.00 1.50 C ATOM 0 H PHE A 112 5.571 3.133 5.607 1.00 0.21 H new ATOM 0 HA PHE A 112 6.694 1.290 7.555 1.00 0.25 H new ATOM 0 HB2 PHE A 112 7.361 3.617 7.617 1.00 0.30 H new ATOM 0 HB3 PHE A 112 5.692 4.137 7.742 1.00 0.30 H new ATOM 0 HD1 PHE A 112 7.761 1.558 9.514 1.00 0.79 H new ATOM 0 HD2 PHE A 112 5.195 4.941 9.855 1.00 0.95 H new ATOM 0 HE1 PHE A 112 7.870 1.394 11.964 1.00 1.21 H new ATOM 0 HE2 PHE A 112 5.296 4.773 12.301 1.00 1.43 H new ATOM 0 HZ PHE A 112 6.764 3.117 13.359 1.00 1.50 H new ATOM 1694 N TRP A 113 4.555 0.335 8.328 1.00 0.31 N ATOM 1695 CA TRP A 113 3.287 -0.303 8.656 1.00 0.35 C ATOM 1696 C TRP A 113 2.958 -0.186 10.145 1.00 0.33 C ATOM 1697 O TRP A 113 3.622 -0.763 11.007 1.00 0.37 O ATOM 1698 CB TRP A 113 3.297 -1.774 8.211 1.00 0.48 C ATOM 1699 CG TRP A 113 4.454 -2.578 8.733 1.00 1.08 C ATOM 1700 CD1 TRP A 113 5.770 -2.440 8.396 1.00 2.30 C ATOM 1701 CD2 TRP A 113 4.392 -3.661 9.667 1.00 1.17 C ATOM 1702 NE1 TRP A 113 6.529 -3.364 9.067 1.00 3.02 N ATOM 1703 CE2 TRP A 113 5.707 -4.124 9.855 1.00 2.29 C ATOM 1704 CE3 TRP A 113 3.353 -4.281 10.366 1.00 1.12 C ATOM 1705 CZ2 TRP A 113 6.010 -5.180 10.710 1.00 2.67 C ATOM 1706 CZ3 TRP A 113 3.655 -5.329 11.215 1.00 1.47 C ATOM 1707 CH2 TRP A 113 4.973 -5.769 11.381 1.00 2.02 C ATOM 0 H TRP A 113 5.374 -0.263 8.440 1.00 0.31 H new ATOM 0 HA TRP A 113 2.502 0.222 8.112 1.00 0.35 H new ATOM 0 HB2 TRP A 113 2.369 -2.244 8.536 1.00 0.48 H new ATOM 0 HB3 TRP A 113 3.309 -1.810 7.122 1.00 0.48 H new ATOM 0 HD1 TRP A 113 6.157 -1.709 7.702 1.00 2.30 H new ATOM 0 HE1 TRP A 113 7.541 -3.468 8.991 1.00 3.02 H new ATOM 0 HE3 TRP A 113 2.333 -3.947 10.245 1.00 1.12 H new ATOM 0 HZ2 TRP A 113 7.026 -5.522 10.839 1.00 2.67 H new ATOM 0 HZ3 TRP A 113 2.860 -5.817 11.760 1.00 1.47 H new ATOM 0 HH2 TRP A 113 5.176 -6.590 12.052 1.00 2.02 H new ATOM 1718 N GLU A 114 1.932 0.603 10.417 1.00 0.32 N ATOM 1719 CA GLU A 114 1.424 0.812 11.765 1.00 0.37 C ATOM 1720 C GLU A 114 0.146 0.015 11.973 1.00 0.39 C ATOM 1721 O GLU A 114 -0.882 0.325 11.372 1.00 0.42 O ATOM 1722 CB GLU A 114 1.148 2.299 12.003 1.00 0.43 C ATOM 1723 CG GLU A 114 2.397 3.119 12.273 1.00 0.96 C ATOM 1724 CD GLU A 114 2.989 2.828 13.635 1.00 1.50 C ATOM 1725 OE1 GLU A 114 3.793 1.882 13.758 1.00 2.32 O ATOM 1726 OE2 GLU A 114 2.643 3.539 14.600 1.00 1.90 O ATOM 0 H GLU A 114 1.422 1.122 9.702 1.00 0.32 H new ATOM 0 HA GLU A 114 2.177 0.472 12.476 1.00 0.37 H new ATOM 0 HB2 GLU A 114 0.638 2.708 11.131 1.00 0.43 H new ATOM 0 HB3 GLU A 114 0.467 2.402 12.848 1.00 0.43 H new ATOM 0 HG2 GLU A 114 3.140 2.910 11.504 1.00 0.96 H new ATOM 0 HG3 GLU A 114 2.155 4.180 12.203 1.00 0.96 H new ATOM 1733 N THR A 115 0.203 -1.006 12.815 1.00 0.47 N ATOM 1734 CA THR A 115 -0.945 -1.871 13.021 1.00 0.49 C ATOM 1735 C THR A 115 -1.709 -1.454 14.271 1.00 0.52 C ATOM 1736 O THR A 115 -1.160 -1.448 15.373 1.00 0.64 O ATOM 1737 CB THR A 115 -0.501 -3.344 13.167 1.00 0.67 C ATOM 1738 OG1 THR A 115 0.278 -3.734 12.025 1.00 1.38 O ATOM 1739 CG2 THR A 115 -1.700 -4.271 13.307 1.00 1.39 C ATOM 0 H THR A 115 1.027 -1.253 13.363 1.00 0.47 H new ATOM 0 HA THR A 115 -1.594 -1.777 12.150 1.00 0.49 H new ATOM 0 HB THR A 115 0.103 -3.426 14.071 1.00 0.67 H new ATOM 0 HG1 THR A 115 -0.202 -3.495 11.205 1.00 1.38 H new ATOM 0 HG21 THR A 115 -1.355 -5.300 13.408 1.00 1.39 H new ATOM 0 HG22 THR A 115 -2.274 -3.993 14.191 1.00 1.39 H new ATOM 0 HG23 THR A 115 -2.331 -4.185 12.423 1.00 1.39 H new ATOM 1747 N HIS A 116 -2.973 -1.097 14.091 1.00 0.47 N ATOM 1748 CA HIS A 116 -3.801 -0.654 15.198 1.00 0.56 C ATOM 1749 C HIS A 116 -5.156 -1.355 15.152 1.00 0.56 C ATOM 1750 O HIS A 116 -6.070 -0.919 14.448 1.00 0.55 O ATOM 1751 CB HIS A 116 -3.972 0.867 15.104 1.00 0.66 C ATOM 1752 CG HIS A 116 -4.498 1.521 16.347 1.00 1.29 C ATOM 1753 ND1 HIS A 116 -3.718 1.755 17.456 1.00 1.88 N ATOM 1754 CD2 HIS A 116 -5.716 2.030 16.635 1.00 2.27 C ATOM 1755 CE1 HIS A 116 -4.432 2.379 18.372 1.00 2.63 C ATOM 1756 NE2 HIS A 116 -5.652 2.562 17.901 1.00 2.89 N ATOM 0 H HIS A 116 -3.446 -1.106 13.187 1.00 0.47 H new ATOM 0 HA HIS A 116 -3.325 -0.906 16.146 1.00 0.56 H new ATOM 0 HB2 HIS A 116 -3.008 1.312 14.857 1.00 0.66 H new ATOM 0 HB3 HIS A 116 -4.648 1.092 14.279 1.00 0.66 H new ATOM 0 HD2 HIS A 116 -6.581 2.021 15.989 1.00 2.27 H new ATOM 0 HE1 HIS A 116 -4.078 2.689 19.344 1.00 2.63 H new ATOM 0 HE2 HIS A 116 -6.418 3.021 18.394 1.00 2.89 H new ATOM 1765 N GLY A 117 -5.279 -2.432 15.915 1.00 0.64 N ATOM 1766 CA GLY A 117 -6.526 -3.173 15.971 1.00 0.71 C ATOM 1767 C GLY A 117 -6.778 -3.958 14.699 1.00 0.69 C ATOM 1768 O GLY A 117 -6.140 -4.982 14.444 1.00 0.74 O ATOM 0 H GLY A 117 -4.533 -2.809 16.500 1.00 0.64 H new ATOM 0 HA2 GLY A 117 -6.504 -3.856 16.820 1.00 0.71 H new ATOM 0 HA3 GLY A 117 -7.351 -2.481 16.140 1.00 0.71 H new ATOM 1772 N THR A 118 -7.695 -3.457 13.888 1.00 0.66 N ATOM 1773 CA THR A 118 -7.987 -4.052 12.595 1.00 0.69 C ATOM 1774 C THR A 118 -7.356 -3.212 11.488 1.00 0.56 C ATOM 1775 O THR A 118 -6.757 -3.738 10.551 1.00 0.57 O ATOM 1776 CB THR A 118 -9.508 -4.151 12.365 1.00 0.81 C ATOM 1777 OG1 THR A 118 -10.136 -4.733 13.516 1.00 1.60 O ATOM 1778 CG2 THR A 118 -9.824 -4.988 11.132 1.00 1.39 C ATOM 0 H THR A 118 -8.254 -2.632 14.105 1.00 0.66 H new ATOM 0 HA THR A 118 -7.569 -5.058 12.578 1.00 0.69 H new ATOM 0 HB THR A 118 -9.894 -3.144 12.204 1.00 0.81 H new ATOM 0 HG1 THR A 118 -11.103 -4.792 13.366 1.00 1.60 H new ATOM 0 HG21 THR A 118 -10.904 -5.040 10.995 1.00 1.39 H new ATOM 0 HG22 THR A 118 -9.369 -4.529 10.254 1.00 1.39 H new ATOM 0 HG23 THR A 118 -9.426 -5.994 11.263 1.00 1.39 H new ATOM 1786 N LYS A 119 -7.461 -1.901 11.639 1.00 0.50 N ATOM 1787 CA LYS A 119 -6.951 -0.954 10.663 1.00 0.41 C ATOM 1788 C LYS A 119 -5.425 -0.806 10.804 1.00 0.35 C ATOM 1789 O LYS A 119 -4.828 -1.249 11.787 1.00 0.40 O ATOM 1790 CB LYS A 119 -7.635 0.398 10.883 1.00 0.46 C ATOM 1791 CG LYS A 119 -9.145 0.337 10.704 1.00 0.98 C ATOM 1792 CD LYS A 119 -9.897 0.987 11.861 1.00 1.36 C ATOM 1793 CE LYS A 119 -9.956 2.506 11.745 1.00 1.79 C ATOM 1794 NZ LYS A 119 -8.669 3.167 12.094 1.00 2.49 N ATOM 0 H LYS A 119 -7.905 -1.463 12.446 1.00 0.50 H new ATOM 0 HA LYS A 119 -7.165 -1.317 9.658 1.00 0.41 H new ATOM 0 HB2 LYS A 119 -7.408 0.754 11.888 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -7.221 1.126 10.185 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -9.418 0.834 9.773 1.00 0.98 H new ATOM 0 HG3 LYS A 119 -9.455 -0.704 10.612 1.00 0.98 H new ATOM 0 HD2 LYS A 119 -10.911 0.590 11.898 1.00 1.36 H new ATOM 0 HD3 LYS A 119 -9.414 0.717 12.800 1.00 1.36 H new ATOM 0 HE2 LYS A 119 -10.232 2.776 10.726 1.00 1.79 H new ATOM 0 HE3 LYS A 119 -10.741 2.884 12.399 1.00 1.79 H new ATOM 0 HZ1 LYS A 119 -8.798 4.199 12.096 1.00 2.49 H new ATOM 0 HZ2 LYS A 119 -8.363 2.855 13.038 1.00 2.49 H new ATOM 0 HZ3 LYS A 119 -7.945 2.910 11.393 1.00 2.49 H new ATOM 1808 N ASN A 120 -4.823 -0.169 9.818 1.00 0.30 N ATOM 1809 CA ASN A 120 -3.375 -0.017 9.707 1.00 0.28 C ATOM 1810 C ASN A 120 -3.072 1.244 8.909 1.00 0.28 C ATOM 1811 O ASN A 120 -3.854 1.625 8.040 1.00 0.32 O ATOM 1812 CB ASN A 120 -2.749 -1.205 8.958 1.00 0.36 C ATOM 1813 CG ASN A 120 -2.659 -2.490 9.760 1.00 1.26 C ATOM 1814 OD1 ASN A 120 -1.635 -2.776 10.370 1.00 2.08 O ATOM 1815 ND2 ASN A 120 -3.717 -3.285 9.741 1.00 2.07 N ATOM 0 H ASN A 120 -5.334 0.269 9.052 1.00 0.30 H new ATOM 0 HA ASN A 120 -2.960 0.035 10.714 1.00 0.28 H new ATOM 0 HB2 ASN A 120 -3.332 -1.396 8.057 1.00 0.36 H new ATOM 0 HB3 ASN A 120 -1.746 -0.925 8.635 1.00 0.36 H new ATOM 0 HD21 ASN A 120 -3.698 -4.171 10.246 1.00 2.07 H new ATOM 0 HD22 ASN A 120 -4.551 -3.012 9.221 1.00 2.07 H new ATOM 1822 N TYR A 121 -1.952 1.885 9.203 1.00 0.31 N ATOM 1823 CA TYR A 121 -1.502 3.043 8.434 1.00 0.37 C ATOM 1824 C TYR A 121 -0.226 2.697 7.672 1.00 0.30 C ATOM 1825 O TYR A 121 0.483 1.766 8.061 1.00 0.34 O ATOM 1826 CB TYR A 121 -1.248 4.220 9.379 1.00 0.66 C ATOM 1827 CG TYR A 121 -2.486 4.673 10.120 1.00 1.06 C ATOM 1828 CD1 TYR A 121 -2.877 4.051 11.294 1.00 1.46 C ATOM 1829 CD2 TYR A 121 -3.255 5.734 9.654 1.00 1.41 C ATOM 1830 CE1 TYR A 121 -3.997 4.466 11.984 1.00 1.98 C ATOM 1831 CE2 TYR A 121 -4.377 6.158 10.341 1.00 2.01 C ATOM 1832 CZ TYR A 121 -4.780 5.489 11.461 1.00 2.23 C ATOM 1833 OH TYR A 121 -5.850 5.945 12.202 1.00 2.84 O ATOM 0 H TYR A 121 -1.333 1.625 9.971 1.00 0.31 H new ATOM 0 HA TYR A 121 -2.274 3.322 7.717 1.00 0.37 H new ATOM 0 HB2 TYR A 121 -0.484 3.937 10.103 1.00 0.66 H new ATOM 0 HB3 TYR A 121 -0.850 5.057 8.806 1.00 0.66 H new ATOM 0 HD1 TYR A 121 -2.294 3.226 11.676 1.00 1.46 H new ATOM 0 HD2 TYR A 121 -2.971 6.235 8.740 1.00 1.41 H new ATOM 0 HE1 TYR A 121 -4.263 4.001 12.922 1.00 1.98 H new ATOM 0 HE2 TYR A 121 -4.933 7.016 9.993 1.00 2.01 H new ATOM 0 HH TYR A 121 -6.671 5.872 11.671 1.00 2.84 H new ATOM 1843 N PHE A 122 0.091 3.437 6.602 1.00 0.30 N ATOM 1844 CA PHE A 122 1.350 3.217 5.907 1.00 0.29 C ATOM 1845 C PHE A 122 2.069 4.534 5.665 1.00 0.26 C ATOM 1846 O PHE A 122 1.756 5.253 4.732 1.00 0.32 O ATOM 1847 CB PHE A 122 1.131 2.499 4.572 1.00 0.34 C ATOM 1848 CG PHE A 122 0.487 1.149 4.700 1.00 1.05 C ATOM 1849 CD1 PHE A 122 1.211 0.065 5.167 1.00 1.45 C ATOM 1850 CD2 PHE A 122 -0.841 0.968 4.358 1.00 1.56 C ATOM 1851 CE1 PHE A 122 0.620 -1.177 5.288 1.00 2.18 C ATOM 1852 CE2 PHE A 122 -1.437 -0.271 4.478 1.00 2.27 C ATOM 1853 CZ PHE A 122 -0.699 -1.349 4.929 1.00 2.54 C ATOM 0 H PHE A 122 -0.496 4.174 6.212 1.00 0.30 H new ATOM 0 HA PHE A 122 1.967 2.584 6.545 1.00 0.29 H new ATOM 0 HB2 PHE A 122 0.511 3.126 3.932 1.00 0.34 H new ATOM 0 HB3 PHE A 122 2.092 2.385 4.071 1.00 0.34 H new ATOM 0 HD1 PHE A 122 2.248 0.192 5.439 1.00 1.45 H new ATOM 0 HD2 PHE A 122 -1.418 1.805 3.993 1.00 1.56 H new ATOM 0 HE1 PHE A 122 1.191 -2.013 5.664 1.00 2.18 H new ATOM 0 HE2 PHE A 122 -2.478 -0.398 4.220 1.00 2.27 H new ATOM 0 HZ PHE A 122 -1.156 -2.325 5.000 1.00 2.54 H new ATOM 1863 N THR A 123 3.051 4.837 6.489 1.00 0.22 N ATOM 1864 CA THR A 123 3.824 6.047 6.320 1.00 0.22 C ATOM 1865 C THR A 123 4.985 5.726 5.404 1.00 0.20 C ATOM 1866 O THR A 123 5.603 4.689 5.546 1.00 0.19 O ATOM 1867 CB THR A 123 4.370 6.520 7.680 1.00 0.24 C ATOM 1868 OG1 THR A 123 3.323 6.486 8.655 1.00 0.32 O ATOM 1869 CG2 THR A 123 4.929 7.929 7.581 1.00 0.33 C ATOM 0 H THR A 123 3.332 4.261 7.282 1.00 0.22 H new ATOM 0 HA THR A 123 3.200 6.836 5.900 1.00 0.22 H new ATOM 0 HB THR A 123 5.176 5.850 7.980 1.00 0.24 H new ATOM 0 HG1 THR A 123 2.579 7.049 8.355 1.00 0.32 H new ATOM 0 HG21 THR A 123 5.308 8.239 8.555 1.00 0.33 H new ATOM 0 HG22 THR A 123 5.740 7.948 6.853 1.00 0.33 H new ATOM 0 HG23 THR A 123 4.141 8.612 7.264 1.00 0.33 H new ATOM 1877 N SER A 124 5.282 6.577 4.448 1.00 0.21 N ATOM 1878 CA SER A 124 6.299 6.223 3.485 1.00 0.23 C ATOM 1879 C SER A 124 7.659 6.276 4.153 1.00 0.29 C ATOM 1880 O SER A 124 8.038 7.285 4.742 1.00 0.34 O ATOM 1881 CB SER A 124 6.240 7.141 2.269 1.00 0.26 C ATOM 1882 OG SER A 124 4.968 7.061 1.647 1.00 1.17 O ATOM 0 H SER A 124 4.849 7.491 4.318 1.00 0.21 H new ATOM 0 HA SER A 124 6.121 5.208 3.129 1.00 0.23 H new ATOM 0 HB2 SER A 124 6.439 8.169 2.572 1.00 0.26 H new ATOM 0 HB3 SER A 124 7.017 6.862 1.558 1.00 0.26 H new ATOM 0 HG SER A 124 5.079 7.071 0.673 1.00 1.17 H new ATOM 1888 N VAL A 125 8.376 5.164 4.075 1.00 0.33 N ATOM 1889 CA VAL A 125 9.620 5.005 4.801 1.00 0.43 C ATOM 1890 C VAL A 125 10.727 5.835 4.163 1.00 0.53 C ATOM 1891 O VAL A 125 11.675 6.241 4.836 1.00 0.65 O ATOM 1892 CB VAL A 125 10.008 3.506 4.860 1.00 0.48 C ATOM 1893 CG1 VAL A 125 11.471 3.304 5.220 1.00 0.81 C ATOM 1894 CG2 VAL A 125 9.125 2.777 5.852 1.00 0.47 C ATOM 0 H VAL A 125 8.112 4.356 3.511 1.00 0.33 H new ATOM 0 HA VAL A 125 9.483 5.367 5.820 1.00 0.43 H new ATOM 0 HB VAL A 125 9.857 3.093 3.863 1.00 0.48 H new ATOM 0 HG11 VAL A 125 11.695 2.238 5.249 1.00 0.81 H new ATOM 0 HG12 VAL A 125 12.100 3.786 4.472 1.00 0.81 H new ATOM 0 HG13 VAL A 125 11.669 3.743 6.198 1.00 0.81 H new ATOM 0 HG21 VAL A 125 9.407 1.725 5.885 1.00 0.47 H new ATOM 0 HG22 VAL A 125 9.249 3.217 6.841 1.00 0.47 H new ATOM 0 HG23 VAL A 125 8.083 2.864 5.544 1.00 0.47 H new ATOM 1904 N ALA A 126 10.586 6.132 2.881 1.00 0.53 N ATOM 1905 CA ALA A 126 11.521 7.035 2.231 1.00 0.63 C ATOM 1906 C ALA A 126 11.295 8.468 2.714 1.00 0.63 C ATOM 1907 O ALA A 126 12.240 9.176 3.066 1.00 0.72 O ATOM 1908 CB ALA A 126 11.372 6.946 0.720 1.00 0.68 C ATOM 0 H ALA A 126 9.847 5.768 2.279 1.00 0.53 H new ATOM 0 HA ALA A 126 12.537 6.741 2.494 1.00 0.63 H new ATOM 0 HB1 ALA A 126 12.078 7.627 0.244 1.00 0.68 H new ATOM 0 HB2 ALA A 126 11.576 5.926 0.394 1.00 0.68 H new ATOM 0 HB3 ALA A 126 10.356 7.221 0.438 1.00 0.68 H new ATOM 1914 N HIS A 127 10.032 8.885 2.741 1.00 0.56 N ATOM 1915 CA HIS A 127 9.667 10.202 3.234 1.00 0.58 C ATOM 1916 C HIS A 127 8.281 10.133 3.885 1.00 0.47 C ATOM 1917 O HIS A 127 7.293 9.885 3.204 1.00 0.44 O ATOM 1918 CB HIS A 127 9.683 11.217 2.084 1.00 0.72 C ATOM 1919 CG HIS A 127 9.842 12.637 2.536 1.00 1.15 C ATOM 1920 ND1 HIS A 127 10.480 13.155 3.610 1.00 1.70 N flip ATOM 1921 CD2 HIS A 127 9.324 13.712 1.847 1.00 1.99 C flip ATOM 1922 CE1 HIS A 127 10.336 14.517 3.549 1.00 2.29 C flip ATOM 1923 NE2 HIS A 127 9.635 14.828 2.480 1.00 2.47 N flip ATOM 0 H HIS A 127 9.242 8.323 2.424 1.00 0.56 H new ATOM 0 HA HIS A 127 10.390 10.528 3.982 1.00 0.58 H new ATOM 0 HB2 HIS A 127 10.497 10.968 1.403 1.00 0.72 H new ATOM 0 HB3 HIS A 127 8.756 11.127 1.518 1.00 0.72 H new ATOM 0 HD2 HIS A 127 8.753 13.651 0.932 1.00 1.99 H new ATOM 0 HE1 HIS A 127 10.734 15.222 4.264 1.00 2.29 H new ATOM 0 HE2 HIS A 127 9.376 15.771 2.190 1.00 2.47 H new ATOM 1932 N PRO A 128 8.196 10.360 5.206 1.00 0.47 N ATOM 1933 CA PRO A 128 6.945 10.256 5.986 1.00 0.43 C ATOM 1934 C PRO A 128 5.825 11.153 5.477 1.00 0.40 C ATOM 1935 O PRO A 128 4.650 10.817 5.616 1.00 0.39 O ATOM 1936 CB PRO A 128 7.330 10.664 7.393 1.00 0.53 C ATOM 1937 CG PRO A 128 8.622 11.394 7.245 1.00 0.79 C ATOM 1938 CD PRO A 128 9.318 10.759 6.072 1.00 0.60 C ATOM 0 HA PRO A 128 6.547 9.244 5.913 1.00 0.43 H new ATOM 0 HB2 PRO A 128 6.567 11.300 7.842 1.00 0.53 H new ATOM 0 HB3 PRO A 128 7.441 9.794 8.040 1.00 0.53 H new ATOM 0 HG2 PRO A 128 8.453 12.457 7.071 1.00 0.79 H new ATOM 0 HG3 PRO A 128 9.224 11.310 8.150 1.00 0.79 H new ATOM 0 HD2 PRO A 128 9.987 11.459 5.571 1.00 0.60 H new ATOM 0 HD3 PRO A 128 9.921 9.902 6.374 1.00 0.60 H new ATOM 1946 N ASN A 129 6.180 12.342 4.988 1.00 0.44 N ATOM 1947 CA ASN A 129 5.195 13.307 4.523 1.00 0.47 C ATOM 1948 C ASN A 129 4.484 12.772 3.280 1.00 0.39 C ATOM 1949 O ASN A 129 3.588 13.395 2.721 1.00 0.44 O ATOM 1950 CB ASN A 129 5.891 14.624 4.217 1.00 0.57 C ATOM 1951 CG ASN A 129 4.922 15.773 3.991 1.00 1.07 C ATOM 1952 OD1 ASN A 129 4.493 16.426 4.940 1.00 1.84 O ATOM 1953 ND2 ASN A 129 4.587 16.044 2.744 1.00 1.44 N ATOM 0 H ASN A 129 7.147 12.656 4.905 1.00 0.44 H new ATOM 0 HA ASN A 129 4.447 13.471 5.299 1.00 0.47 H new ATOM 0 HB2 ASN A 129 6.558 14.876 5.042 1.00 0.57 H new ATOM 0 HB3 ASN A 129 6.513 14.502 3.330 1.00 0.57 H new ATOM 0 HD21 ASN A 129 3.953 16.817 2.543 1.00 1.44 H new ATOM 0 HD22 ASN A 129 4.962 15.481 1.981 1.00 1.44 H new ATOM 1960 N LEU A 130 4.942 11.628 2.832 1.00 0.32 N ATOM 1961 CA LEU A 130 4.182 10.796 1.938 1.00 0.26 C ATOM 1962 C LEU A 130 3.498 9.770 2.826 1.00 0.24 C ATOM 1963 O LEU A 130 4.149 9.124 3.646 1.00 0.26 O ATOM 1964 CB LEU A 130 5.121 10.073 0.957 1.00 0.30 C ATOM 1965 CG LEU A 130 5.831 10.917 -0.118 1.00 0.58 C ATOM 1966 CD1 LEU A 130 6.391 12.216 0.435 1.00 1.38 C ATOM 1967 CD2 LEU A 130 6.961 10.104 -0.730 1.00 1.28 C ATOM 0 H LEU A 130 5.856 11.249 3.080 1.00 0.32 H new ATOM 0 HA LEU A 130 3.472 11.380 1.352 1.00 0.26 H new ATOM 0 HB2 LEU A 130 5.887 9.564 1.542 1.00 0.30 H new ATOM 0 HB3 LEU A 130 4.543 9.302 0.448 1.00 0.30 H new ATOM 0 HG LEU A 130 5.088 11.177 -0.872 1.00 0.58 H new ATOM 0 HD11 LEU A 130 6.880 12.771 -0.365 1.00 1.38 H new ATOM 0 HD12 LEU A 130 5.580 12.815 0.849 1.00 1.38 H new ATOM 0 HD13 LEU A 130 7.115 11.995 1.219 1.00 1.38 H new ATOM 0 HD21 LEU A 130 7.466 10.698 -1.492 1.00 1.28 H new ATOM 0 HD22 LEU A 130 7.674 9.829 0.047 1.00 1.28 H new ATOM 0 HD23 LEU A 130 6.554 9.201 -1.185 1.00 1.28 H new ATOM 1979 N PHE A 131 2.229 9.560 2.637 1.00 0.23 N ATOM 1980 CA PHE A 131 1.499 8.650 3.503 1.00 0.27 C ATOM 1981 C PHE A 131 0.362 8.032 2.703 1.00 0.26 C ATOM 1982 O PHE A 131 -0.306 8.721 1.930 1.00 0.26 O ATOM 1983 CB PHE A 131 1.008 9.424 4.742 1.00 0.42 C ATOM 1984 CG PHE A 131 0.714 8.608 5.970 1.00 0.36 C ATOM 1985 CD1 PHE A 131 -0.004 7.429 5.908 1.00 0.63 C ATOM 1986 CD2 PHE A 131 1.150 9.055 7.206 1.00 0.65 C ATOM 1987 CE1 PHE A 131 -0.282 6.710 7.052 1.00 0.97 C ATOM 1988 CE2 PHE A 131 0.878 8.340 8.354 1.00 0.96 C ATOM 1989 CZ PHE A 131 0.161 7.165 8.277 1.00 1.05 C ATOM 0 H PHE A 131 1.672 9.996 1.902 1.00 0.23 H new ATOM 0 HA PHE A 131 2.132 7.838 3.860 1.00 0.27 H new ATOM 0 HB2 PHE A 131 1.761 10.169 5.000 1.00 0.42 H new ATOM 0 HB3 PHE A 131 0.103 9.967 4.469 1.00 0.42 H new ATOM 0 HD1 PHE A 131 -0.352 7.066 4.952 1.00 0.63 H new ATOM 0 HD2 PHE A 131 1.711 9.976 7.272 1.00 0.65 H new ATOM 0 HE1 PHE A 131 -0.846 5.791 6.989 1.00 0.97 H new ATOM 0 HE2 PHE A 131 1.226 8.700 9.311 1.00 0.96 H new ATOM 0 HZ PHE A 131 -0.053 6.602 9.173 1.00 1.05 H new ATOM 1999 N ILE A 132 0.121 6.757 2.925 1.00 0.28 N ATOM 2000 CA ILE A 132 -0.722 5.968 2.066 1.00 0.27 C ATOM 2001 C ILE A 132 -2.156 6.101 2.506 1.00 0.25 C ATOM 2002 O ILE A 132 -2.607 5.499 3.481 1.00 0.32 O ATOM 2003 CB ILE A 132 -0.269 4.490 2.085 1.00 0.34 C ATOM 2004 CG1 ILE A 132 0.993 4.337 1.247 1.00 0.87 C ATOM 2005 CG2 ILE A 132 -1.361 3.554 1.576 1.00 0.80 C ATOM 2006 CD1 ILE A 132 0.821 4.765 -0.193 1.00 1.39 C ATOM 0 H ILE A 132 0.510 6.240 3.714 1.00 0.28 H new ATOM 0 HA ILE A 132 -0.638 6.331 1.042 1.00 0.27 H new ATOM 0 HB ILE A 132 -0.062 4.211 3.118 1.00 0.34 H new ATOM 0 HG12 ILE A 132 1.792 4.925 1.699 1.00 0.87 H new ATOM 0 HG13 ILE A 132 1.311 3.295 1.272 1.00 0.87 H new ATOM 0 HG21 ILE A 132 -1.002 2.525 1.606 1.00 0.80 H new ATOM 0 HG22 ILE A 132 -2.244 3.648 2.207 1.00 0.80 H new ATOM 0 HG23 ILE A 132 -1.618 3.819 0.550 1.00 0.80 H new ATOM 0 HD11 ILE A 132 1.761 4.628 -0.728 1.00 1.39 H new ATOM 0 HD12 ILE A 132 0.045 4.160 -0.662 1.00 1.39 H new ATOM 0 HD13 ILE A 132 0.533 5.816 -0.228 1.00 1.39 H new ATOM 2018 N ALA A 133 -2.836 6.939 1.769 1.00 0.22 N ATOM 2019 CA ALA A 133 -4.206 7.304 2.039 1.00 0.23 C ATOM 2020 C ALA A 133 -5.185 6.469 1.253 1.00 0.23 C ATOM 2021 O ALA A 133 -4.842 5.909 0.228 1.00 0.26 O ATOM 2022 CB ALA A 133 -4.398 8.764 1.719 1.00 0.25 C ATOM 0 H ALA A 133 -2.446 7.398 0.946 1.00 0.22 H new ATOM 0 HA ALA A 133 -4.404 7.118 3.095 1.00 0.23 H new ATOM 0 HB1 ALA A 133 -5.431 9.048 1.920 1.00 0.25 H new ATOM 0 HB2 ALA A 133 -3.730 9.363 2.338 1.00 0.25 H new ATOM 0 HB3 ALA A 133 -4.172 8.939 0.667 1.00 0.25 H new ATOM 2028 N THR A 134 -6.394 6.378 1.759 1.00 0.23 N ATOM 2029 CA THR A 134 -7.500 5.828 1.034 1.00 0.25 C ATOM 2030 C THR A 134 -8.628 6.841 1.073 1.00 0.26 C ATOM 2031 O THR A 134 -8.949 7.403 2.124 1.00 0.31 O ATOM 2032 CB THR A 134 -7.919 4.484 1.618 1.00 0.31 C ATOM 2033 OG1 THR A 134 -6.736 3.818 2.045 1.00 0.96 O ATOM 2034 CG2 THR A 134 -8.635 3.635 0.579 1.00 1.01 C ATOM 0 H THR A 134 -6.633 6.691 2.700 1.00 0.23 H new ATOM 0 HA THR A 134 -7.221 5.635 -0.002 1.00 0.25 H new ATOM 0 HB THR A 134 -8.608 4.640 2.448 1.00 0.31 H new ATOM 0 HG1 THR A 134 -6.803 3.613 3.001 1.00 0.96 H new ATOM 0 HG21 THR A 134 -8.922 2.682 1.023 1.00 1.01 H new ATOM 0 HG22 THR A 134 -9.527 4.158 0.234 1.00 1.01 H new ATOM 0 HG23 THR A 134 -7.970 3.456 -0.266 1.00 1.01 H new ATOM 2042 N LYS A 135 -9.150 7.138 -0.080 1.00 0.28 N ATOM 2043 CA LYS A 135 -10.152 8.174 -0.216 1.00 0.31 C ATOM 2044 C LYS A 135 -11.506 7.523 -0.477 1.00 0.40 C ATOM 2045 O LYS A 135 -11.590 6.513 -1.172 1.00 0.47 O ATOM 2046 CB LYS A 135 -9.768 9.126 -1.361 1.00 0.35 C ATOM 2047 CG LYS A 135 -10.209 10.569 -1.141 1.00 0.69 C ATOM 2048 CD LYS A 135 -9.090 11.453 -0.585 1.00 0.76 C ATOM 2049 CE LYS A 135 -8.182 11.998 -1.692 1.00 0.89 C ATOM 2050 NZ LYS A 135 -7.182 12.988 -1.175 1.00 0.63 N ATOM 0 H LYS A 135 -8.900 6.676 -0.954 1.00 0.28 H new ATOM 0 HA LYS A 135 -10.212 8.759 0.702 1.00 0.31 H new ATOM 0 HB2 LYS A 135 -8.686 9.103 -1.491 1.00 0.35 H new ATOM 0 HB3 LYS A 135 -10.209 8.759 -2.288 1.00 0.35 H new ATOM 0 HG2 LYS A 135 -10.559 10.985 -2.086 1.00 0.69 H new ATOM 0 HG3 LYS A 135 -11.054 10.585 -0.453 1.00 0.69 H new ATOM 0 HD2 LYS A 135 -9.527 12.285 -0.032 1.00 0.76 H new ATOM 0 HD3 LYS A 135 -8.493 10.879 0.123 1.00 0.76 H new ATOM 0 HE2 LYS A 135 -7.657 11.170 -2.168 1.00 0.89 H new ATOM 0 HE3 LYS A 135 -8.794 12.471 -2.460 1.00 0.89 H new ATOM 0 HZ1 LYS A 135 -6.413 13.097 -1.866 1.00 0.63 H new ATOM 0 HZ2 LYS A 135 -7.647 13.906 -1.027 1.00 0.63 H new ATOM 0 HZ3 LYS A 135 -6.792 12.648 -0.273 1.00 0.63 H new ATOM 2064 N GLN A 136 -12.558 8.121 0.051 1.00 0.49 N ATOM 2065 CA GLN A 136 -13.890 7.535 -0.018 1.00 0.63 C ATOM 2066 C GLN A 136 -14.577 7.850 -1.335 1.00 0.58 C ATOM 2067 O GLN A 136 -15.412 7.087 -1.816 1.00 0.69 O ATOM 2068 CB GLN A 136 -14.733 8.022 1.168 1.00 0.82 C ATOM 2069 CG GLN A 136 -16.203 7.639 1.102 1.00 1.05 C ATOM 2070 CD GLN A 136 -16.895 7.735 2.449 1.00 1.14 C ATOM 2071 OE1 GLN A 136 -16.184 7.386 3.511 1.00 1.75 O flip ATOM 2072 NE2 GLN A 136 -18.073 8.079 2.530 1.00 1.20 N flip ATOM 0 H GLN A 136 -12.518 9.018 0.536 1.00 0.49 H new ATOM 0 HA GLN A 136 -13.788 6.451 0.037 1.00 0.63 H new ATOM 0 HB2 GLN A 136 -14.308 7.620 2.088 1.00 0.82 H new ATOM 0 HB3 GLN A 136 -14.657 9.108 1.229 1.00 0.82 H new ATOM 0 HG2 GLN A 136 -16.712 8.289 0.390 1.00 1.05 H new ATOM 0 HG3 GLN A 136 -16.292 6.620 0.724 1.00 1.05 H new ATOM 0 HE21 GLN A 136 -18.587 8.341 1.689 1.00 1.20 H new ATOM 0 HE22 GLN A 136 -18.536 8.103 3.439 1.00 1.20 H new ATOM 2081 N ASP A 137 -14.216 8.972 -1.914 1.00 0.48 N ATOM 2082 CA ASP A 137 -14.911 9.471 -3.095 1.00 0.52 C ATOM 2083 C ASP A 137 -13.931 9.764 -4.215 1.00 0.47 C ATOM 2084 O ASP A 137 -14.230 9.557 -5.393 1.00 0.56 O ATOM 2085 CB ASP A 137 -15.683 10.754 -2.756 1.00 0.63 C ATOM 2086 CG ASP A 137 -16.563 10.611 -1.529 1.00 1.34 C ATOM 2087 OD1 ASP A 137 -17.723 10.172 -1.670 1.00 1.43 O ATOM 2088 OD2 ASP A 137 -16.095 10.945 -0.416 1.00 2.21 O ATOM 0 H ASP A 137 -13.448 9.561 -1.593 1.00 0.48 H new ATOM 0 HA ASP A 137 -15.607 8.699 -3.423 1.00 0.52 H new ATOM 0 HB2 ASP A 137 -14.974 11.566 -2.595 1.00 0.63 H new ATOM 0 HB3 ASP A 137 -16.301 11.035 -3.609 1.00 0.63 H new ATOM 2093 N TYR A 138 -12.753 10.235 -3.840 1.00 0.39 N ATOM 2094 CA TYR A 138 -11.750 10.648 -4.808 1.00 0.38 C ATOM 2095 C TYR A 138 -10.771 9.517 -5.035 1.00 0.32 C ATOM 2096 O TYR A 138 -10.932 8.431 -4.476 1.00 0.31 O ATOM 2097 CB TYR A 138 -11.002 11.902 -4.336 1.00 0.44 C ATOM 2098 CG TYR A 138 -11.899 12.978 -3.770 1.00 0.82 C ATOM 2099 CD1 TYR A 138 -12.880 13.559 -4.560 1.00 0.99 C ATOM 2100 CD2 TYR A 138 -11.761 13.423 -2.460 1.00 1.41 C ATOM 2101 CE1 TYR A 138 -13.700 14.550 -4.065 1.00 1.45 C ATOM 2102 CE2 TYR A 138 -12.582 14.416 -1.956 1.00 1.98 C ATOM 2103 CZ TYR A 138 -13.548 14.938 -2.692 1.00 1.94 C ATOM 2104 OH TYR A 138 -14.364 15.969 -2.276 1.00 2.50 O ATOM 0 H TYR A 138 -12.467 10.341 -2.867 1.00 0.39 H new ATOM 0 HA TYR A 138 -12.255 10.891 -5.743 1.00 0.38 H new ATOM 0 HB2 TYR A 138 -10.274 11.614 -3.577 1.00 0.44 H new ATOM 0 HB3 TYR A 138 -10.441 12.315 -5.175 1.00 0.44 H new ATOM 0 HD1 TYR A 138 -13.003 13.229 -5.581 1.00 0.99 H new ATOM 0 HD2 TYR A 138 -11.002 12.987 -1.827 1.00 1.41 H new ATOM 0 HE1 TYR A 138 -14.439 15.023 -4.695 1.00 1.45 H new ATOM 0 HE2 TYR A 138 -12.431 14.770 -0.947 1.00 1.98 H new ATOM 0 HH TYR A 138 -14.191 16.162 -1.331 1.00 2.50 H new ATOM 2114 N TRP A 139 -9.759 9.758 -5.844 1.00 0.34 N ATOM 2115 CA TRP A 139 -8.719 8.770 -6.033 1.00 0.33 C ATOM 2116 C TRP A 139 -7.853 8.662 -4.777 1.00 0.30 C ATOM 2117 O TRP A 139 -7.812 9.569 -3.942 1.00 0.32 O ATOM 2118 CB TRP A 139 -7.862 9.084 -7.270 1.00 0.40 C ATOM 2119 CG TRP A 139 -7.557 10.538 -7.476 1.00 1.19 C ATOM 2120 CD1 TRP A 139 -7.102 11.431 -6.551 1.00 2.40 C ATOM 2121 CD2 TRP A 139 -7.660 11.257 -8.711 1.00 1.47 C ATOM 2122 NE1 TRP A 139 -6.932 12.665 -7.130 1.00 3.09 N ATOM 2123 CE2 TRP A 139 -7.266 12.582 -8.455 1.00 2.48 C ATOM 2124 CE3 TRP A 139 -8.052 10.909 -10.008 1.00 1.75 C ATOM 2125 CZ2 TRP A 139 -7.250 13.559 -9.447 1.00 2.99 C ATOM 2126 CZ3 TRP A 139 -8.035 11.879 -10.991 1.00 2.37 C ATOM 2127 CH2 TRP A 139 -7.637 13.190 -10.706 1.00 2.74 C ATOM 0 H TRP A 139 -9.636 10.620 -6.375 1.00 0.34 H new ATOM 0 HA TRP A 139 -9.197 7.806 -6.207 1.00 0.33 H new ATOM 0 HB2 TRP A 139 -6.922 8.539 -7.190 1.00 0.40 H new ATOM 0 HB3 TRP A 139 -8.375 8.707 -8.155 1.00 0.40 H new ATOM 0 HD1 TRP A 139 -6.904 11.201 -5.514 1.00 2.40 H new ATOM 0 HE1 TRP A 139 -6.610 13.506 -6.651 1.00 3.09 H new ATOM 0 HE3 TRP A 139 -8.362 9.900 -10.236 1.00 1.75 H new ATOM 0 HZ2 TRP A 139 -6.943 14.572 -9.230 1.00 2.99 H new ATOM 0 HZ3 TRP A 139 -8.334 11.621 -11.996 1.00 2.37 H new ATOM 0 HH2 TRP A 139 -7.635 13.926 -11.497 1.00 2.74 H new ATOM 2138 N VAL A 140 -7.197 7.527 -4.654 1.00 0.30 N ATOM 2139 CA VAL A 140 -6.379 7.195 -3.501 1.00 0.33 C ATOM 2140 C VAL A 140 -5.114 8.047 -3.464 1.00 0.30 C ATOM 2141 O VAL A 140 -4.191 7.843 -4.253 1.00 0.32 O ATOM 2142 CB VAL A 140 -6.028 5.693 -3.556 1.00 0.44 C ATOM 2143 CG1 VAL A 140 -4.958 5.320 -2.548 1.00 1.58 C ATOM 2144 CG2 VAL A 140 -7.285 4.865 -3.337 1.00 1.28 C ATOM 0 H VAL A 140 -7.216 6.795 -5.364 1.00 0.30 H new ATOM 0 HA VAL A 140 -6.938 7.406 -2.589 1.00 0.33 H new ATOM 0 HB VAL A 140 -5.620 5.479 -4.544 1.00 0.44 H new ATOM 0 HG11 VAL A 140 -4.743 4.254 -2.623 1.00 1.58 H new ATOM 0 HG12 VAL A 140 -4.051 5.888 -2.753 1.00 1.58 H new ATOM 0 HG13 VAL A 140 -5.310 5.549 -1.542 1.00 1.58 H new ATOM 0 HG21 VAL A 140 -7.034 3.805 -3.376 1.00 1.28 H new ATOM 0 HG22 VAL A 140 -7.711 5.101 -2.362 1.00 1.28 H new ATOM 0 HG23 VAL A 140 -8.012 5.095 -4.116 1.00 1.28 H new ATOM 2154 N CYS A 141 -5.083 9.012 -2.550 1.00 0.30 N ATOM 2155 CA CYS A 141 -3.998 9.976 -2.523 1.00 0.26 C ATOM 2156 C CYS A 141 -2.972 9.711 -1.424 1.00 0.25 C ATOM 2157 O CYS A 141 -2.826 8.603 -0.909 1.00 0.29 O ATOM 2158 CB CYS A 141 -4.561 11.387 -2.335 1.00 0.33 C ATOM 2159 SG CYS A 141 -5.470 12.039 -3.751 1.00 1.21 S ATOM 0 H CYS A 141 -5.790 9.144 -1.827 1.00 0.30 H new ATOM 0 HA CYS A 141 -3.484 9.878 -3.479 1.00 0.26 H new ATOM 0 HB2 CYS A 141 -5.221 11.386 -1.468 1.00 0.33 H new ATOM 0 HB3 CYS A 141 -3.737 12.064 -2.108 1.00 0.33 H new ATOM 0 HG CYS A 141 -5.533 13.335 -3.667 1.00 1.21 H new ATOM 2165 N LEU A 142 -2.270 10.781 -1.110 1.00 0.21 N ATOM 2166 CA LEU A 142 -1.140 10.811 -0.220 1.00 0.23 C ATOM 2167 C LEU A 142 -1.282 12.071 0.616 1.00 0.24 C ATOM 2168 O LEU A 142 -2.061 12.946 0.257 1.00 0.23 O ATOM 2169 CB LEU A 142 0.100 10.823 -1.128 1.00 0.21 C ATOM 2170 CG LEU A 142 1.425 10.401 -0.531 1.00 0.22 C ATOM 2171 CD1 LEU A 142 1.507 8.888 -0.412 1.00 0.23 C ATOM 2172 CD2 LEU A 142 2.565 10.928 -1.381 1.00 0.25 C ATOM 0 H LEU A 142 -2.489 11.701 -1.493 1.00 0.21 H new ATOM 0 HA LEU A 142 -1.065 9.965 0.463 1.00 0.23 H new ATOM 0 HB2 LEU A 142 -0.104 10.174 -1.979 1.00 0.21 H new ATOM 0 HB3 LEU A 142 0.217 11.834 -1.519 1.00 0.21 H new ATOM 0 HG LEU A 142 1.505 10.823 0.471 1.00 0.22 H new ATOM 0 HD11 LEU A 142 2.468 8.609 0.020 1.00 0.23 H new ATOM 0 HD12 LEU A 142 0.703 8.529 0.230 1.00 0.23 H new ATOM 0 HD13 LEU A 142 1.409 8.439 -1.401 1.00 0.23 H new ATOM 0 HD21 LEU A 142 3.516 10.621 -0.946 1.00 0.25 H new ATOM 0 HD22 LEU A 142 2.482 10.526 -2.391 1.00 0.25 H new ATOM 0 HD23 LEU A 142 2.518 12.016 -1.418 1.00 0.25 H new ATOM 2184 N ALA A 143 -0.623 12.124 1.748 1.00 0.34 N ATOM 2185 CA ALA A 143 -0.446 13.368 2.484 1.00 0.33 C ATOM 2186 C ALA A 143 0.636 13.171 3.529 1.00 0.60 C ATOM 2187 O ALA A 143 1.011 12.047 3.812 1.00 0.91 O ATOM 2188 CB ALA A 143 -1.754 13.798 3.138 1.00 0.38 C ATOM 0 H ALA A 143 -0.192 11.312 2.190 1.00 0.34 H new ATOM 0 HA ALA A 143 -0.146 14.158 1.795 1.00 0.33 H new ATOM 0 HB1 ALA A 143 -1.599 14.729 3.683 1.00 0.38 H new ATOM 0 HB2 ALA A 143 -2.513 13.948 2.370 1.00 0.38 H new ATOM 0 HB3 ALA A 143 -2.087 13.024 3.830 1.00 0.38 H new ATOM 2194 N GLY A 144 1.158 14.250 4.085 1.00 0.63 N ATOM 2195 CA GLY A 144 2.066 14.118 5.216 1.00 0.93 C ATOM 2196 C GLY A 144 1.298 14.236 6.502 1.00 0.93 C ATOM 2197 O GLY A 144 1.793 14.676 7.538 1.00 1.13 O ATOM 0 H GLY A 144 0.976 15.207 3.783 1.00 0.63 H new ATOM 0 HA2 GLY A 144 2.577 13.156 5.174 1.00 0.93 H new ATOM 0 HA3 GLY A 144 2.835 14.889 5.169 1.00 0.93 H new ATOM 2236 N SER A 148 -6.894 12.714 3.990 1.00 0.49 N ATOM 2237 CA SER A 148 -7.125 11.444 3.371 1.00 0.43 C ATOM 2238 C SER A 148 -7.091 10.357 4.437 1.00 0.37 C ATOM 2239 O SER A 148 -6.295 10.437 5.368 1.00 0.37 O ATOM 2240 CB SER A 148 -6.081 11.229 2.285 1.00 0.57 C ATOM 2241 OG SER A 148 -6.129 12.262 1.309 1.00 0.64 O ATOM 0 HA SER A 148 -8.107 11.408 2.898 1.00 0.43 H new ATOM 0 HB2 SER A 148 -5.088 11.196 2.734 1.00 0.57 H new ATOM 0 HB3 SER A 148 -6.246 10.264 1.805 1.00 0.57 H new ATOM 0 HG SER A 148 -6.316 13.118 1.748 1.00 0.64 H new ATOM 2247 N ILE A 149 -7.927 9.356 4.322 1.00 0.37 N ATOM 2248 CA ILE A 149 -7.956 8.292 5.307 1.00 0.32 C ATOM 2249 C ILE A 149 -6.938 7.213 5.014 1.00 0.26 C ATOM 2250 O ILE A 149 -7.139 6.325 4.185 1.00 0.29 O ATOM 2251 CB ILE A 149 -9.346 7.702 5.480 1.00 0.35 C ATOM 2252 CG1 ILE A 149 -10.260 8.779 6.069 1.00 0.57 C ATOM 2253 CG2 ILE A 149 -9.313 6.471 6.377 1.00 0.56 C ATOM 2254 CD1 ILE A 149 -9.803 9.310 7.413 1.00 1.21 C ATOM 0 H ILE A 149 -8.597 9.251 3.560 1.00 0.37 H new ATOM 0 HA ILE A 149 -7.679 8.752 6.256 1.00 0.32 H new ATOM 0 HB ILE A 149 -9.728 7.382 4.511 1.00 0.35 H new ATOM 0 HG12 ILE A 149 -10.326 9.609 5.366 1.00 0.57 H new ATOM 0 HG13 ILE A 149 -11.265 8.370 6.174 1.00 0.57 H new ATOM 0 HG21 ILE A 149 -10.321 6.071 6.483 1.00 0.56 H new ATOM 0 HG22 ILE A 149 -8.667 5.714 5.933 1.00 0.56 H new ATOM 0 HG23 ILE A 149 -8.927 6.746 7.359 1.00 0.56 H new ATOM 0 HD11 ILE A 149 -10.504 10.069 7.762 1.00 1.21 H new ATOM 0 HD12 ILE A 149 -9.765 8.493 8.133 1.00 1.21 H new ATOM 0 HD13 ILE A 149 -8.811 9.751 7.312 1.00 1.21 H new ATOM 2266 N THR A 150 -5.835 7.305 5.711 1.00 0.24 N ATOM 2267 CA THR A 150 -4.732 6.419 5.496 1.00 0.25 C ATOM 2268 C THR A 150 -4.941 5.197 6.361 1.00 0.26 C ATOM 2269 O THR A 150 -4.002 4.631 6.909 1.00 0.34 O ATOM 2270 CB THR A 150 -3.405 7.122 5.899 1.00 0.28 C ATOM 2271 OG1 THR A 150 -3.522 7.646 7.232 1.00 0.53 O ATOM 2272 CG2 THR A 150 -3.092 8.278 4.961 1.00 0.69 C ATOM 0 H THR A 150 -5.681 7.998 6.443 1.00 0.24 H new ATOM 0 HA THR A 150 -4.672 6.137 4.445 1.00 0.25 H new ATOM 0 HB THR A 150 -2.605 6.384 5.842 1.00 0.28 H new ATOM 0 HG1 THR A 150 -2.645 7.958 7.539 1.00 0.53 H new ATOM 0 HG21 THR A 150 -2.159 8.752 5.266 1.00 0.69 H new ATOM 0 HG22 THR A 150 -2.993 7.903 3.942 1.00 0.69 H new ATOM 0 HG23 THR A 150 -3.900 9.009 5.002 1.00 0.69 H new ATOM 2280 N ASP A 151 -6.202 4.787 6.475 1.00 0.25 N ATOM 2281 CA ASP A 151 -6.510 3.571 7.115 1.00 0.25 C ATOM 2282 C ASP A 151 -6.672 2.500 6.092 1.00 0.26 C ATOM 2283 O ASP A 151 -7.107 2.734 4.982 1.00 0.27 O ATOM 2284 CB ASP A 151 -7.726 3.671 8.002 1.00 0.29 C ATOM 2285 CG ASP A 151 -7.403 4.153 9.402 1.00 0.79 C ATOM 2286 OD1 ASP A 151 -6.922 3.336 10.211 1.00 1.25 O ATOM 2287 OD2 ASP A 151 -7.669 5.335 9.716 1.00 1.07 O ATOM 0 H ASP A 151 -7.009 5.301 6.122 1.00 0.25 H new ATOM 0 HA ASP A 151 -5.680 3.319 7.775 1.00 0.25 H new ATOM 0 HB2 ASP A 151 -8.445 4.352 7.547 1.00 0.29 H new ATOM 0 HB3 ASP A 151 -8.206 2.694 8.062 1.00 0.29 H new ATOM 2292 N PHE A 152 -6.279 1.355 6.471 1.00 0.27 N ATOM 2293 CA PHE A 152 -6.668 0.158 5.811 1.00 0.27 C ATOM 2294 C PHE A 152 -7.046 -0.833 6.877 1.00 0.28 C ATOM 2295 O PHE A 152 -6.768 -0.622 8.036 1.00 0.30 O ATOM 2296 CB PHE A 152 -5.551 -0.359 4.890 1.00 0.30 C ATOM 2297 CG PHE A 152 -5.057 -1.764 5.154 1.00 1.46 C ATOM 2298 CD1 PHE A 152 -4.056 -1.997 6.086 1.00 2.11 C ATOM 2299 CD2 PHE A 152 -5.599 -2.846 4.483 1.00 2.12 C ATOM 2300 CE1 PHE A 152 -3.605 -3.278 6.339 1.00 3.33 C ATOM 2301 CE2 PHE A 152 -5.150 -4.131 4.731 1.00 3.35 C ATOM 2302 CZ PHE A 152 -4.145 -4.350 5.622 1.00 3.93 C ATOM 0 H PHE A 152 -5.661 1.207 7.269 1.00 0.27 H new ATOM 0 HA PHE A 152 -7.522 0.333 5.156 1.00 0.27 H new ATOM 0 HB2 PHE A 152 -5.907 -0.310 3.861 1.00 0.30 H new ATOM 0 HB3 PHE A 152 -4.703 0.321 4.967 1.00 0.30 H new ATOM 0 HD1 PHE A 152 -3.623 -1.165 6.621 1.00 2.11 H new ATOM 0 HD2 PHE A 152 -6.382 -2.685 3.757 1.00 2.12 H new ATOM 0 HE1 PHE A 152 -2.842 -3.450 7.084 1.00 3.33 H new ATOM 0 HE2 PHE A 152 -5.600 -4.966 4.214 1.00 3.35 H new ATOM 0 HZ PHE A 152 -3.765 -5.349 5.775 1.00 3.93 H new ATOM 2312 N GLN A 153 -7.659 -1.889 6.467 1.00 0.30 N ATOM 2313 CA GLN A 153 -8.169 -2.908 7.347 1.00 0.33 C ATOM 2314 C GLN A 153 -8.402 -4.141 6.518 1.00 0.38 C ATOM 2315 O GLN A 153 -8.752 -4.035 5.340 1.00 0.44 O ATOM 2316 CB GLN A 153 -9.439 -2.464 8.086 1.00 0.44 C ATOM 2317 CG GLN A 153 -10.566 -1.981 7.194 1.00 0.70 C ATOM 2318 CD GLN A 153 -11.817 -1.656 7.986 1.00 0.63 C ATOM 2319 OE1 GLN A 153 -12.087 -2.267 9.022 1.00 1.27 O ATOM 2320 NE2 GLN A 153 -12.579 -0.683 7.520 1.00 1.20 N ATOM 0 H GLN A 153 -7.830 -2.083 5.480 1.00 0.30 H new ATOM 0 HA GLN A 153 -7.443 -3.113 8.134 1.00 0.33 H new ATOM 0 HB2 GLN A 153 -9.803 -3.299 8.685 1.00 0.44 H new ATOM 0 HB3 GLN A 153 -9.177 -1.665 8.779 1.00 0.44 H new ATOM 0 HG2 GLN A 153 -10.242 -1.095 6.648 1.00 0.70 H new ATOM 0 HG3 GLN A 153 -10.795 -2.746 6.452 1.00 0.70 H new ATOM 0 HE21 GLN A 153 -12.321 -0.201 6.659 1.00 1.20 H new ATOM 0 HE22 GLN A 153 -13.425 -0.413 8.022 1.00 1.20 H new ATOM 2329 N ILE A 154 -8.187 -5.298 7.096 1.00 0.43 N ATOM 2330 CA ILE A 154 -8.077 -6.499 6.313 1.00 0.45 C ATOM 2331 C ILE A 154 -9.435 -7.161 6.210 1.00 0.44 C ATOM 2332 O ILE A 154 -10.032 -7.599 7.195 1.00 0.49 O ATOM 2333 CB ILE A 154 -7.046 -7.469 6.950 1.00 0.56 C ATOM 2334 CG1 ILE A 154 -7.124 -8.857 6.311 1.00 1.14 C ATOM 2335 CG2 ILE A 154 -7.241 -7.555 8.461 1.00 1.53 C ATOM 2336 CD1 ILE A 154 -6.175 -9.863 6.929 1.00 1.63 C ATOM 0 H ILE A 154 -8.085 -5.431 8.102 1.00 0.43 H new ATOM 0 HA ILE A 154 -7.728 -6.243 5.312 1.00 0.45 H new ATOM 0 HB ILE A 154 -6.050 -7.069 6.758 1.00 0.56 H new ATOM 0 HG12 ILE A 154 -8.144 -9.231 6.398 1.00 1.14 H new ATOM 0 HG13 ILE A 154 -6.906 -8.771 5.247 1.00 1.14 H new ATOM 0 HG21 ILE A 154 -6.507 -8.241 8.884 1.00 1.53 H new ATOM 0 HG22 ILE A 154 -7.111 -6.567 8.902 1.00 1.53 H new ATOM 0 HG23 ILE A 154 -8.245 -7.919 8.678 1.00 1.53 H new ATOM 0 HD11 ILE A 154 -6.285 -10.824 6.426 1.00 1.63 H new ATOM 0 HD12 ILE A 154 -5.149 -9.511 6.818 1.00 1.63 H new ATOM 0 HD13 ILE A 154 -6.407 -9.979 7.988 1.00 1.63 H new ATOM 2348 N LEU A 155 -9.910 -7.204 4.981 1.00 0.43 N ATOM 2349 CA LEU A 155 -11.223 -7.713 4.677 1.00 0.44 C ATOM 2350 C LEU A 155 -11.105 -9.092 4.054 1.00 0.57 C ATOM 2351 O LEU A 155 -10.485 -9.269 3.010 1.00 0.67 O ATOM 2352 CB LEU A 155 -11.981 -6.781 3.712 1.00 0.53 C ATOM 2353 CG LEU A 155 -12.351 -5.375 4.227 1.00 0.46 C ATOM 2354 CD1 LEU A 155 -13.486 -4.812 3.388 1.00 0.82 C ATOM 2355 CD2 LEU A 155 -12.741 -5.417 5.699 1.00 0.73 C ATOM 0 H LEU A 155 -9.389 -6.884 4.164 1.00 0.43 H new ATOM 0 HA LEU A 155 -11.785 -7.769 5.610 1.00 0.44 H new ATOM 0 HB2 LEU A 155 -11.375 -6.662 2.814 1.00 0.53 H new ATOM 0 HB3 LEU A 155 -12.901 -7.283 3.412 1.00 0.53 H new ATOM 0 HG LEU A 155 -11.480 -4.726 4.135 1.00 0.46 H new ATOM 0 HD11 LEU A 155 -13.749 -3.818 3.751 1.00 0.82 H new ATOM 0 HD12 LEU A 155 -13.171 -4.746 2.347 1.00 0.82 H new ATOM 0 HD13 LEU A 155 -14.354 -5.467 3.464 1.00 0.82 H new ATOM 0 HD21 LEU A 155 -12.997 -4.413 6.036 1.00 0.73 H new ATOM 0 HD22 LEU A 155 -13.601 -6.074 5.829 1.00 0.73 H new ATOM 0 HD23 LEU A 155 -11.904 -5.795 6.286 1.00 0.73 H new ATOM 2367 N GLU A 156 -11.671 -10.062 4.727 1.00 0.67 N ATOM 2368 CA GLU A 156 -11.755 -11.414 4.218 1.00 0.89 C ATOM 2369 C GLU A 156 -13.009 -11.514 3.367 1.00 0.99 C ATOM 2370 O GLU A 156 -13.927 -10.731 3.548 1.00 0.90 O ATOM 2371 CB GLU A 156 -11.819 -12.391 5.401 1.00 1.04 C ATOM 2372 CG GLU A 156 -11.984 -13.850 5.011 1.00 1.58 C ATOM 2373 CD GLU A 156 -10.819 -14.374 4.202 1.00 2.05 C ATOM 2374 OE1 GLU A 156 -9.848 -14.871 4.808 1.00 2.57 O ATOM 2375 OE2 GLU A 156 -10.873 -14.281 2.959 1.00 2.53 O ATOM 0 H GLU A 156 -12.090 -9.939 5.649 1.00 0.67 H new ATOM 0 HA GLU A 156 -10.883 -11.664 3.613 1.00 0.89 H new ATOM 0 HB2 GLU A 156 -10.908 -12.287 5.990 1.00 1.04 H new ATOM 0 HB3 GLU A 156 -12.650 -12.105 6.046 1.00 1.04 H new ATOM 0 HG2 GLU A 156 -12.095 -14.452 5.913 1.00 1.58 H new ATOM 0 HG3 GLU A 156 -12.902 -13.966 4.435 1.00 1.58 H new ATOM 2382 N ASN A 157 -13.054 -12.471 2.461 1.00 1.23 N ATOM 2383 CA ASN A 157 -14.207 -12.631 1.577 1.00 1.41 C ATOM 2384 C ASN A 157 -15.278 -13.433 2.316 1.00 1.66 C ATOM 2385 O ASN A 157 -14.952 -14.195 3.229 1.00 1.82 O ATOM 2386 CB ASN A 157 -13.759 -13.404 0.331 1.00 1.68 C ATOM 2387 CG ASN A 157 -14.830 -13.526 -0.734 1.00 2.14 C ATOM 2388 OD1 ASN A 157 -15.577 -12.589 -1.001 1.00 2.67 O ATOM 2389 ND2 ASN A 157 -14.912 -14.692 -1.347 1.00 2.44 N ATOM 0 H ASN A 157 -12.310 -13.152 2.313 1.00 1.23 H new ATOM 0 HA ASN A 157 -14.609 -11.660 1.286 1.00 1.41 H new ATOM 0 HB2 ASN A 157 -12.888 -12.908 -0.098 1.00 1.68 H new ATOM 0 HB3 ASN A 157 -13.442 -14.403 0.630 1.00 1.68 H new ATOM 0 HD21 ASN A 157 -15.615 -14.839 -2.071 1.00 2.44 H new ATOM 0 HD22 ASN A 157 -14.272 -15.446 -1.096 1.00 2.44 H new ATOM 2396 N GLN A 158 -16.538 -13.295 1.925 1.00 1.77 N ATOM 2397 CA GLN A 158 -17.619 -13.931 2.653 1.00 2.06 C ATOM 2398 C GLN A 158 -17.620 -15.443 2.432 1.00 2.49 C ATOM 2399 O GLN A 158 -17.593 -16.213 3.392 1.00 2.73 O ATOM 2400 CB GLN A 158 -18.960 -13.292 2.276 1.00 2.08 C ATOM 2401 CG GLN A 158 -19.271 -13.286 0.788 1.00 2.54 C ATOM 2402 CD GLN A 158 -20.501 -12.461 0.463 1.00 2.68 C ATOM 2403 OE1 GLN A 158 -20.784 -11.461 1.124 1.00 3.15 O ATOM 2404 NE2 GLN A 158 -21.254 -12.885 -0.540 1.00 2.98 N ATOM 0 H GLN A 158 -16.832 -12.752 1.113 1.00 1.77 H new ATOM 0 HA GLN A 158 -17.463 -13.771 3.720 1.00 2.06 H new ATOM 0 HB2 GLN A 158 -19.757 -13.822 2.797 1.00 2.08 H new ATOM 0 HB3 GLN A 158 -18.971 -12.264 2.639 1.00 2.08 H new ATOM 0 HG2 GLN A 158 -18.415 -12.890 0.241 1.00 2.54 H new ATOM 0 HG3 GLN A 158 -19.422 -14.310 0.446 1.00 2.54 H new ATOM 0 HE21 GLN A 158 -20.985 -13.718 -1.063 1.00 2.98 H new ATOM 0 HE22 GLN A 158 -22.103 -12.378 -0.790 1.00 2.98 H new ATOM 2413 N ALA A 159 -17.624 -15.865 1.178 1.00 2.67 N ATOM 2414 CA ALA A 159 -17.518 -17.273 0.846 1.00 3.14 C ATOM 2415 C ALA A 159 -16.346 -17.496 -0.097 1.00 3.38 C ATOM 2416 O ALA A 159 -16.494 -17.233 -1.309 1.00 3.55 O ATOM 2417 CB ALA A 159 -18.811 -17.782 0.227 1.00 3.37 C ATOM 2418 OXT ALA A 159 -15.269 -17.912 0.382 1.00 3.78 O ATOM 0 H ALA A 159 -17.700 -15.247 0.370 1.00 2.67 H new ATOM 0 HA ALA A 159 -17.343 -17.835 1.763 1.00 3.14 H new ATOM 0 HB1 ALA A 159 -18.707 -18.840 -0.014 1.00 3.37 H new ATOM 0 HB2 ALA A 159 -19.630 -17.649 0.934 1.00 3.37 H new ATOM 0 HB3 ALA A 159 -19.024 -17.222 -0.684 1.00 3.37 H new