USER MOD reduce.3.24.130724 H: found=0, std=0, add=1751, rem=0, adj=70 USER MOD reduce.3.24.130724 removed 1751 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 217 ASN : amide:sc= -0.789 X(o=-0.71,f=-0.61) USER MOD Set 1.2: A 220 SER OG : rot 180:sc= 0.0786 USER MOD Set 2.1: A 173 THR OG1 : rot 138:sc= 1.31 USER MOD Set 2.2: A 188 MET CE :methyl 154:sc= -2.06 (180deg=-3.51!) USER MOD Set 3.1: A 17 TYR OH : rot -143:sc= 1.23 USER MOD Set 3.2: A 172 GLN : amide:sc= 0.973 K(o=2.2,f=-2) USER MOD Set 4.1: A 95 HIS : no HE2:sc= -0.305 K(o=-0.31,f=-2.7) USER MOD Set 4.2: A 137 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: A 131 SER OG : rot 39:sc= 0.294 USER MOD Set 5.2: A 149 HIS : no HD1:sc= -1.17 K(o=-0.87,f=-1.4) USER MOD Set 6.1: A 116 TYR OH : rot 180:sc= 0.0489 USER MOD Set 6.2: A 118 LYS NZ :NH3+ -135:sc= 0.0488 (180deg=0) USER MOD Set 7.1: A 22 SER OG : rot -99:sc= 0.924 USER MOD Set 7.2: A 38 LYS NZ :NH3+ -164:sc= 2.98 (180deg=1.1) USER MOD Set 8.1: A 18 ASN : amide:sc= 0.928 K(o=0.93,f=-5.9!) USER MOD Set 8.2: A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 8.3: A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl -179:sc= -1.66 (180deg=-1.7) USER MOD Single : A 1 MET N :NH3+ -151:sc= 0.0265 (180deg=-0.27) USER MOD Single : A 4 LYS NZ :NH3+ -175:sc= 0.973 (180deg=0.847) USER MOD Single : A 8 GLN : amide:sc= -1.97 X(o=-2,f=-2.1) USER MOD Single : A 9 GLN : amide:sc= -2.12! X(o=-2.1!,f=-1.7) USER MOD Single : A 10 THR OG1 : rot -13:sc= 1.1 USER MOD Single : A 12 GLN : amide:sc= 0.306 X(o=0.31,f=0) USER MOD Single : A 21 THR OG1 : rot 38:sc= 0.406 USER MOD Single : A 25 LYS NZ :NH3+ -136:sc= 0 (180deg=-0.0537) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot -3:sc= 0.321 USER MOD Single : A 31 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0584) USER MOD Single : A 32 LYS NZ :NH3+ -165:sc= -0.0614 (180deg=-0.351) USER MOD Single : A 34 THR OG1 : rot -8:sc= 1.04 USER MOD Single : A 36 SER OG : rot 128:sc= 0.981 USER MOD Single : A 37 SER OG : rot 28:sc= 0.124 USER MOD Single : A 40 SER OG : rot 150:sc= -2.62! USER MOD Single : A 42 LYS NZ :NH3+ -171:sc= 1.06 (180deg=0.858) USER MOD Single : A 44 HIS : no HD1:sc= 0 X(o=0,f=-0.0018) USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0.042 USER MOD Single : A 60 LYS NZ :NH3+ -152:sc= -0.156 (180deg=-1.27!) USER MOD Single : A 62 SER OG : rot 4:sc= 0.961 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -1.2! K(o=-1.2!,f=-0.098) USER MOD Single : A 68 THR OG1 : rot -52:sc= -0.598 USER MOD Single : A 73 THR OG1 : rot 26:sc= 0.623 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 1.2 (180deg=1.2) USER MOD Single : A 77 SER OG : rot 180:sc= 0.00294 USER MOD Single : A 79 GLN : amide:sc= 0.753 K(o=0.75,f=-0.076) USER MOD Single : A 81 TYR OH : rot 171:sc= -1.72! USER MOD Single : A 82 ASN : amide:sc= -0.58 X(o=-0.58,f=-0.11) USER MOD Single : A 83 MET CE :methyl -160:sc= -0.185 (180deg=-0.765) USER MOD Single : A 85 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot -80:sc= -1.28! USER MOD Single : A 94 CYS SG : rot -58:sc= -0.329 USER MOD Single : A 96 THR OG1 : rot -105:sc= 0.475 USER MOD Single : A 98 THR OG1 : rot -179:sc= 1.97 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0.17) USER MOD Single : A 100 SER OG : rot 32:sc= -0.577 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= -1.92! USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= -0.667 K(o=-0.67,f=-0.063) USER MOD Single : A 125 ASN : amide:sc= -0.544 K(o=-0.54,f=-4.3!) USER MOD Single : A 128 SER OG : rot 151:sc= -1.42 USER MOD Single : A 129 SER OG : rot 180:sc= -0.109 USER MOD Single : A 130 LYS NZ :NH3+ 145:sc= -4.66! (180deg=-7.21!) USER MOD Single : A 140 SER OG : rot 180:sc=-0.00125 USER MOD Single : A 141 SER OG : rot -26:sc= 0.0697 USER MOD Single : A 142 ASN : amide:sc= -0.0124 K(o=-0.012,f=-1.5!) USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 TYR OH : rot 180:sc= -0.512 USER MOD Single : A 148 ASN : amide:sc= 1.49 K(o=1.5,f=-0.37) USER MOD Single : A 151 CYS SG : rot -80:sc= -6.34! USER MOD Single : A 155 CYS SG : rot 90:sc= -0.121 USER MOD Single : A 158 MET CE :methyl 161:sc= -0.122 (180deg=-0.663) USER MOD Single : A 161 ASN : amide:sc= -3.19! C(o=-3.2!,f=-5!) USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 165 SER OG : rot -72:sc= -0.844! USER MOD Single : A 166 LYS NZ :NH3+ 168:sc= 1.25 (180deg=0.859) USER MOD Single : A 169 MET CE :methyl -155:sc= 0 (180deg=-0.00499) USER MOD Single : A 175 MET CE :methyl -160:sc= -0.0992 (180deg=-0.647) USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 180 SER OG : rot 180:sc= 0 USER MOD Single : A 182 SER OG : rot 180:sc= 0 USER MOD Single : A 186 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 187 THR OG1 : rot 180:sc= 0 USER MOD Single : A 190 SER OG : rot 180:sc= -0.0336 USER MOD Single : A 191 ASN : amide:sc= -0.403! X(o=-0.4!,f=-0.16) USER MOD Single : A 194 ASN : amide:sc=-0.00444 K(o=-0.0044,f=-2.7!) USER MOD Single : A 198 ASN : amide:sc= -5.31! C(o=-5.3!,f=-11!) USER MOD Single : A 200 LYS NZ :NH3+ -135:sc= -0.282 (180deg=-0.881) USER MOD Single : A 204 LYS NZ :NH3+ 154:sc= 1.16 (180deg=0.391) USER MOD Single : A 206 HIS : no HD1:sc= -0.0997 K(o=1.7,f=-8.2!) USER MOD Single : A 208 THR OG1 : rot 60:sc= -2.44! USER MOD Single : A 210 SER OG : rot -50:sc= 0.323 USER MOD Single : A 215 HIS : no HD1:sc= -0.648! C(o=-0.65!,f=-3.3!) USER MOD Single : A 216 HIS : no HD1:sc= -0.494 X(o=-0.49,f=-0.16) USER MOD Single : A 218 SER OG : rot 180:sc= 0 USER MOD Single : A 219 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.668 -3.684 -22.261 1.00 1.81 N ATOM 2 CA MET A 1 -7.570 -4.523 -21.437 1.00 1.25 C ATOM 3 C MET A 1 -8.496 -3.626 -20.627 1.00 1.04 C ATOM 4 O MET A 1 -8.556 -2.422 -20.876 1.00 1.62 O ATOM 5 CB MET A 1 -6.763 -5.428 -20.498 1.00 1.61 C ATOM 6 CG MET A 1 -5.531 -6.037 -21.148 1.00 2.19 C ATOM 7 SD MET A 1 -4.754 -7.309 -20.135 1.00 2.82 S ATOM 8 CE MET A 1 -5.891 -8.672 -20.385 1.00 3.86 C ATOM 0 H1 MET A 1 -6.405 -4.201 -23.124 1.00 1.81 H new ATOM 0 H2 MET A 1 -7.155 -2.803 -22.521 1.00 1.81 H new ATOM 0 H3 MET A 1 -5.811 -3.459 -21.717 1.00 1.81 H new ATOM 0 HA MET A 1 -8.161 -5.157 -22.097 1.00 1.25 H new ATOM 0 HB2 MET A 1 -6.455 -4.850 -19.626 1.00 1.61 H new ATOM 0 HB3 MET A 1 -7.407 -6.230 -20.138 1.00 1.61 H new ATOM 0 HG2 MET A 1 -5.810 -6.467 -22.110 1.00 2.19 H new ATOM 0 HG3 MET A 1 -4.806 -5.248 -21.350 1.00 2.19 H new ATOM 0 HE1 MET A 1 -5.558 -9.534 -19.807 1.00 3.86 H new ATOM 0 HE2 MET A 1 -6.888 -8.379 -20.057 1.00 3.86 H new ATOM 0 HE3 MET A 1 -5.919 -8.933 -21.443 1.00 3.86 H new ATOM 20 N ASP A 2 -9.203 -4.186 -19.654 1.00 0.84 N ATOM 21 CA ASP A 2 -10.071 -3.394 -18.810 1.00 0.67 C ATOM 22 C ASP A 2 -9.336 -3.025 -17.545 1.00 0.52 C ATOM 23 O ASP A 2 -9.170 -1.848 -17.249 1.00 0.53 O ATOM 24 CB ASP A 2 -11.361 -4.144 -18.468 1.00 0.98 C ATOM 25 CG ASP A 2 -12.229 -3.378 -17.486 1.00 1.50 C ATOM 26 OD1 ASP A 2 -13.037 -2.533 -17.928 1.00 1.72 O ATOM 27 OD2 ASP A 2 -12.117 -3.623 -16.268 1.00 2.25 O ATOM 0 H ASP A 2 -9.189 -5.182 -19.435 1.00 0.84 H new ATOM 0 HA ASP A 2 -10.349 -2.492 -19.355 1.00 0.67 H new ATOM 0 HB2 ASP A 2 -11.925 -4.327 -19.382 1.00 0.98 H new ATOM 0 HB3 ASP A 2 -11.112 -5.118 -18.047 1.00 0.98 H new ATOM 32 N PHE A 3 -8.828 -4.037 -16.844 1.00 0.43 N ATOM 33 CA PHE A 3 -8.139 -3.831 -15.584 1.00 0.34 C ATOM 34 C PHE A 3 -6.948 -2.933 -15.800 1.00 0.37 C ATOM 35 O PHE A 3 -6.609 -2.097 -14.963 1.00 0.40 O ATOM 36 CB PHE A 3 -7.662 -5.156 -15.007 1.00 0.30 C ATOM 37 CG PHE A 3 -8.753 -6.037 -14.483 1.00 0.29 C ATOM 38 CD1 PHE A 3 -9.359 -5.756 -13.274 1.00 0.28 C ATOM 39 CD2 PHE A 3 -9.149 -7.164 -15.180 1.00 0.30 C ATOM 40 CE1 PHE A 3 -10.337 -6.577 -12.769 1.00 0.29 C ATOM 41 CE2 PHE A 3 -10.131 -7.989 -14.684 1.00 0.31 C ATOM 42 CZ PHE A 3 -10.724 -7.697 -13.476 1.00 0.29 C ATOM 0 H PHE A 3 -8.885 -5.013 -17.135 1.00 0.43 H new ATOM 0 HA PHE A 3 -8.835 -3.370 -14.884 1.00 0.34 H new ATOM 0 HB2 PHE A 3 -7.115 -5.697 -15.779 1.00 0.30 H new ATOM 0 HB3 PHE A 3 -6.958 -4.953 -14.200 1.00 0.30 H new ATOM 0 HD1 PHE A 3 -9.060 -4.879 -12.719 1.00 0.28 H new ATOM 0 HD2 PHE A 3 -8.682 -7.399 -16.125 1.00 0.30 H new ATOM 0 HE1 PHE A 3 -10.802 -6.347 -11.822 1.00 0.29 H new ATOM 0 HE2 PHE A 3 -10.436 -8.863 -15.240 1.00 0.31 H new ATOM 0 HZ PHE A 3 -11.493 -8.345 -13.082 1.00 0.29 H new ATOM 52 N LYS A 4 -6.342 -3.093 -16.960 1.00 0.40 N ATOM 53 CA LYS A 4 -5.188 -2.352 -17.306 1.00 0.47 C ATOM 54 C LYS A 4 -5.602 -0.923 -17.537 1.00 0.54 C ATOM 55 O LYS A 4 -4.970 -0.016 -17.048 1.00 0.95 O ATOM 56 CB LYS A 4 -4.528 -2.944 -18.549 1.00 0.54 C ATOM 57 CG LYS A 4 -3.019 -2.817 -18.538 1.00 0.68 C ATOM 58 CD LYS A 4 -2.381 -3.536 -19.713 1.00 0.83 C ATOM 59 CE LYS A 4 -0.873 -3.337 -19.728 1.00 1.10 C ATOM 60 NZ LYS A 4 -0.227 -4.036 -20.872 1.00 1.51 N ATOM 0 H LYS A 4 -6.652 -3.748 -17.678 1.00 0.40 H new ATOM 0 HA LYS A 4 -4.454 -2.394 -16.501 1.00 0.47 H new ATOM 0 HB2 LYS A 4 -4.797 -3.997 -18.629 1.00 0.54 H new ATOM 0 HB3 LYS A 4 -4.922 -2.446 -19.435 1.00 0.54 H new ATOM 0 HG2 LYS A 4 -2.743 -1.763 -18.565 1.00 0.68 H new ATOM 0 HG3 LYS A 4 -2.627 -3.225 -17.606 1.00 0.68 H new ATOM 0 HD2 LYS A 4 -2.609 -4.600 -19.659 1.00 0.83 H new ATOM 0 HD3 LYS A 4 -2.808 -3.166 -20.645 1.00 0.83 H new ATOM 0 HE2 LYS A 4 -0.649 -2.272 -19.782 1.00 1.10 H new ATOM 0 HE3 LYS A 4 -0.450 -3.705 -18.793 1.00 1.10 H new ATOM 0 HZ1 LYS A 4 0.806 -3.945 -20.796 1.00 1.51 H new ATOM 0 HZ2 LYS A 4 -0.488 -5.043 -20.856 1.00 1.51 H new ATOM 0 HZ3 LYS A 4 -0.547 -3.610 -21.765 1.00 1.51 H new ATOM 74 N ALA A 5 -6.723 -0.750 -18.221 1.00 0.45 N ATOM 75 CA ALA A 5 -7.255 0.569 -18.521 1.00 0.47 C ATOM 76 C ALA A 5 -7.370 1.427 -17.266 1.00 0.42 C ATOM 77 O ALA A 5 -6.992 2.597 -17.279 1.00 0.42 O ATOM 78 CB ALA A 5 -8.608 0.442 -19.199 1.00 0.54 C ATOM 0 H ALA A 5 -7.288 -1.519 -18.583 1.00 0.45 H new ATOM 0 HA ALA A 5 -6.559 1.066 -19.197 1.00 0.47 H new ATOM 0 HB1 ALA A 5 -8.999 1.435 -19.420 1.00 0.54 H new ATOM 0 HB2 ALA A 5 -8.499 -0.120 -20.127 1.00 0.54 H new ATOM 0 HB3 ALA A 5 -9.299 -0.081 -18.538 1.00 0.54 H new ATOM 84 N ILE A 6 -7.831 0.823 -16.172 1.00 0.42 N ATOM 85 CA ILE A 6 -8.071 1.571 -14.944 1.00 0.43 C ATOM 86 C ILE A 6 -6.749 1.787 -14.241 1.00 0.37 C ATOM 87 O ILE A 6 -6.407 2.884 -13.840 1.00 0.38 O ATOM 88 CB ILE A 6 -9.021 0.846 -13.954 1.00 0.53 C ATOM 89 CG1 ILE A 6 -10.215 0.211 -14.666 1.00 0.91 C ATOM 90 CG2 ILE A 6 -9.515 1.816 -12.892 1.00 1.07 C ATOM 91 CD1 ILE A 6 -10.173 -1.302 -14.661 1.00 0.65 C ATOM 0 H ILE A 6 -8.043 -0.173 -16.113 1.00 0.42 H new ATOM 0 HA ILE A 6 -8.548 2.507 -15.235 1.00 0.43 H new ATOM 0 HB ILE A 6 -8.448 0.047 -13.484 1.00 0.53 H new ATOM 0 HG12 ILE A 6 -11.136 0.545 -14.187 1.00 0.91 H new ATOM 0 HG13 ILE A 6 -10.246 0.564 -15.697 1.00 0.91 H new ATOM 0 HG21 ILE A 6 -10.180 1.294 -12.204 1.00 1.07 H new ATOM 0 HG22 ILE A 6 -8.664 2.216 -12.341 1.00 1.07 H new ATOM 0 HG23 ILE A 6 -10.055 2.634 -13.369 1.00 1.07 H new ATOM 0 HD11 ILE A 6 -11.048 -1.692 -15.182 1.00 0.65 H new ATOM 0 HD12 ILE A 6 -9.269 -1.643 -15.165 1.00 0.65 H new ATOM 0 HD13 ILE A 6 -10.172 -1.663 -13.632 1.00 0.65 H new ATOM 103 N ALA A 7 -6.005 0.711 -14.125 1.00 0.33 N ATOM 104 CA ALA A 7 -4.700 0.721 -13.493 1.00 0.31 C ATOM 105 C ALA A 7 -3.758 1.697 -14.157 1.00 0.30 C ATOM 106 O ALA A 7 -3.065 2.457 -13.510 1.00 0.32 O ATOM 107 CB ALA A 7 -4.108 -0.637 -13.635 1.00 0.34 C ATOM 0 H ALA A 7 -6.289 -0.206 -14.469 1.00 0.33 H new ATOM 0 HA ALA A 7 -4.830 1.014 -12.451 1.00 0.31 H new ATOM 0 HB1 ALA A 7 -3.124 -0.656 -13.167 1.00 0.34 H new ATOM 0 HB2 ALA A 7 -4.755 -1.368 -13.150 1.00 0.34 H new ATOM 0 HB3 ALA A 7 -4.011 -0.883 -14.692 1.00 0.34 H new ATOM 113 N GLN A 8 -3.739 1.611 -15.452 1.00 0.31 N ATOM 114 CA GLN A 8 -2.874 2.389 -16.311 1.00 0.34 C ATOM 115 C GLN A 8 -3.120 3.867 -16.155 1.00 0.35 C ATOM 116 O GLN A 8 -2.196 4.681 -16.205 1.00 0.39 O ATOM 117 CB GLN A 8 -3.134 1.957 -17.740 1.00 0.38 C ATOM 118 CG GLN A 8 -2.303 0.769 -18.139 1.00 0.96 C ATOM 119 CD GLN A 8 -2.349 0.487 -19.629 1.00 1.04 C ATOM 120 OE1 GLN A 8 -1.390 -0.030 -20.205 1.00 1.59 O ATOM 121 NE2 GLN A 8 -3.460 0.819 -20.263 1.00 1.50 N ATOM 0 H GLN A 8 -4.346 0.974 -15.968 1.00 0.31 H new ATOM 0 HA GLN A 8 -1.834 2.213 -16.037 1.00 0.34 H new ATOM 0 HB2 GLN A 8 -4.190 1.714 -17.857 1.00 0.38 H new ATOM 0 HB3 GLN A 8 -2.922 2.788 -18.412 1.00 0.38 H new ATOM 0 HG2 GLN A 8 -1.269 0.938 -17.839 1.00 0.96 H new ATOM 0 HG3 GLN A 8 -2.652 -0.110 -17.597 1.00 0.96 H new ATOM 0 HE21 GLN A 8 -4.232 1.245 -19.750 1.00 1.50 H new ATOM 0 HE22 GLN A 8 -3.546 0.649 -21.265 1.00 1.50 H new ATOM 130 N GLN A 9 -4.369 4.211 -15.955 1.00 0.36 N ATOM 131 CA GLN A 9 -4.717 5.609 -15.758 1.00 0.40 C ATOM 132 C GLN A 9 -4.661 5.942 -14.276 1.00 0.38 C ATOM 133 O GLN A 9 -4.556 7.105 -13.886 1.00 0.45 O ATOM 134 CB GLN A 9 -6.088 5.938 -16.371 1.00 0.48 C ATOM 135 CG GLN A 9 -7.242 5.100 -15.847 1.00 0.74 C ATOM 136 CD GLN A 9 -7.841 5.616 -14.544 1.00 1.65 C ATOM 137 OE1 GLN A 9 -8.363 4.845 -13.740 1.00 2.47 O ATOM 138 NE2 GLN A 9 -7.791 6.922 -14.331 1.00 2.31 N ATOM 0 H GLN A 9 -5.154 3.560 -15.923 1.00 0.36 H new ATOM 0 HA GLN A 9 -3.990 6.233 -16.278 1.00 0.40 H new ATOM 0 HB2 GLN A 9 -6.309 6.989 -16.187 1.00 0.48 H new ATOM 0 HB3 GLN A 9 -6.027 5.810 -17.452 1.00 0.48 H new ATOM 0 HG2 GLN A 9 -8.024 5.063 -16.605 1.00 0.74 H new ATOM 0 HG3 GLN A 9 -6.896 4.077 -15.696 1.00 0.74 H new ATOM 0 HE21 GLN A 9 -7.351 7.534 -15.018 1.00 2.31 H new ATOM 0 HE22 GLN A 9 -8.193 7.316 -13.480 1.00 2.31 H new ATOM 147 N THR A 10 -4.696 4.898 -13.462 1.00 0.34 N ATOM 148 CA THR A 10 -4.644 5.033 -12.024 1.00 0.34 C ATOM 149 C THR A 10 -3.201 5.172 -11.532 1.00 0.30 C ATOM 150 O THR A 10 -2.943 5.925 -10.595 1.00 0.30 O ATOM 151 CB THR A 10 -5.337 3.840 -11.331 1.00 0.37 C ATOM 152 OG1 THR A 10 -6.460 4.283 -10.561 1.00 0.48 O ATOM 153 CG2 THR A 10 -4.377 3.080 -10.439 1.00 0.34 C ATOM 0 H THR A 10 -4.761 3.933 -13.786 1.00 0.34 H new ATOM 0 HA THR A 10 -5.182 5.944 -11.760 1.00 0.34 H new ATOM 0 HB THR A 10 -5.683 3.168 -12.116 1.00 0.37 H new ATOM 0 HG1 THR A 10 -6.432 5.259 -10.473 1.00 0.48 H new ATOM 0 HG21 THR A 10 -4.900 2.248 -9.968 1.00 0.34 H new ATOM 0 HG22 THR A 10 -3.550 2.697 -11.037 1.00 0.34 H new ATOM 0 HG23 THR A 10 -3.990 3.747 -9.669 1.00 0.34 H new ATOM 161 N ALA A 11 -2.260 4.431 -12.140 1.00 0.29 N ATOM 162 CA ALA A 11 -0.848 4.569 -11.776 1.00 0.28 C ATOM 163 C ALA A 11 -0.432 6.030 -11.772 1.00 0.30 C ATOM 164 O ALA A 11 -0.022 6.573 -10.748 1.00 0.31 O ATOM 165 CB ALA A 11 0.036 3.791 -12.730 1.00 0.31 C ATOM 0 H ALA A 11 -2.449 3.745 -12.871 1.00 0.29 H new ATOM 0 HA ALA A 11 -0.725 4.163 -10.772 1.00 0.28 H new ATOM 0 HB1 ALA A 11 1.079 3.910 -12.438 1.00 0.31 H new ATOM 0 HB2 ALA A 11 -0.232 2.735 -12.696 1.00 0.31 H new ATOM 0 HB3 ALA A 11 -0.102 4.168 -13.743 1.00 0.31 H new ATOM 171 N GLN A 12 -0.569 6.658 -12.924 1.00 0.35 N ATOM 172 CA GLN A 12 -0.249 8.067 -13.097 1.00 0.40 C ATOM 173 C GLN A 12 -1.209 8.966 -12.320 1.00 0.40 C ATOM 174 O GLN A 12 -0.973 10.162 -12.190 1.00 0.45 O ATOM 175 CB GLN A 12 -0.319 8.419 -14.577 1.00 0.48 C ATOM 176 CG GLN A 12 -1.717 8.250 -15.141 1.00 0.98 C ATOM 177 CD GLN A 12 -1.784 8.476 -16.635 1.00 0.97 C ATOM 178 OE1 GLN A 12 -1.983 9.598 -17.095 1.00 1.30 O ATOM 179 NE2 GLN A 12 -1.636 7.405 -17.399 1.00 1.64 N ATOM 0 H GLN A 12 -0.907 6.205 -13.773 1.00 0.35 H new ATOM 0 HA GLN A 12 0.756 8.234 -12.710 1.00 0.40 H new ATOM 0 HB2 GLN A 12 0.006 9.450 -14.719 1.00 0.48 H new ATOM 0 HB3 GLN A 12 0.374 7.787 -15.132 1.00 0.48 H new ATOM 0 HG2 GLN A 12 -2.075 7.246 -14.915 1.00 0.98 H new ATOM 0 HG3 GLN A 12 -2.390 8.948 -14.643 1.00 0.98 H new ATOM 0 HE21 GLN A 12 -1.472 6.493 -16.973 1.00 1.64 H new ATOM 0 HE22 GLN A 12 -1.686 7.492 -18.414 1.00 1.64 H new ATOM 188 N GLU A 13 -2.295 8.396 -11.818 1.00 0.38 N ATOM 189 CA GLU A 13 -3.278 9.164 -11.080 1.00 0.39 C ATOM 190 C GLU A 13 -2.898 9.231 -9.609 1.00 0.37 C ATOM 191 O GLU A 13 -2.984 10.290 -8.987 1.00 0.42 O ATOM 192 CB GLU A 13 -4.661 8.548 -11.272 1.00 0.43 C ATOM 193 CG GLU A 13 -5.502 8.486 -10.016 1.00 1.10 C ATOM 194 CD GLU A 13 -6.922 8.046 -10.294 1.00 1.65 C ATOM 195 OE1 GLU A 13 -7.138 6.848 -10.562 1.00 2.54 O ATOM 196 OE2 GLU A 13 -7.833 8.905 -10.254 1.00 1.64 O ATOM 0 H GLU A 13 -2.515 7.404 -11.910 1.00 0.38 H new ATOM 0 HA GLU A 13 -3.303 10.185 -11.461 1.00 0.39 H new ATOM 0 HB2 GLU A 13 -5.199 9.123 -12.026 1.00 0.43 H new ATOM 0 HB3 GLU A 13 -4.543 7.538 -11.665 1.00 0.43 H new ATOM 0 HG2 GLU A 13 -5.043 7.796 -9.308 1.00 1.10 H new ATOM 0 HG3 GLU A 13 -5.515 9.467 -9.542 1.00 1.10 H new ATOM 203 N VAL A 14 -2.447 8.109 -9.059 1.00 0.34 N ATOM 204 CA VAL A 14 -2.011 8.087 -7.675 1.00 0.33 C ATOM 205 C VAL A 14 -0.649 8.754 -7.587 1.00 0.33 C ATOM 206 O VAL A 14 -0.326 9.471 -6.636 1.00 0.36 O ATOM 207 CB VAL A 14 -1.972 6.652 -7.086 1.00 0.32 C ATOM 208 CG1 VAL A 14 -0.623 5.983 -7.245 1.00 0.53 C ATOM 209 CG2 VAL A 14 -2.391 6.684 -5.633 1.00 0.49 C ATOM 0 H VAL A 14 -2.376 7.216 -9.546 1.00 0.34 H new ATOM 0 HA VAL A 14 -2.735 8.636 -7.073 1.00 0.33 H new ATOM 0 HB VAL A 14 -2.678 6.048 -7.656 1.00 0.32 H new ATOM 0 HG11 VAL A 14 -0.660 4.983 -6.814 1.00 0.53 H new ATOM 0 HG12 VAL A 14 -0.374 5.913 -8.304 1.00 0.53 H new ATOM 0 HG13 VAL A 14 0.138 6.572 -6.732 1.00 0.53 H new ATOM 0 HG21 VAL A 14 -2.362 5.674 -5.224 1.00 0.49 H new ATOM 0 HG22 VAL A 14 -1.709 7.323 -5.072 1.00 0.49 H new ATOM 0 HG23 VAL A 14 -3.404 7.078 -5.555 1.00 0.49 H new ATOM 219 N LEU A 15 0.119 8.559 -8.638 1.00 0.32 N ATOM 220 CA LEU A 15 1.369 9.235 -8.813 1.00 0.33 C ATOM 221 C LEU A 15 1.089 10.699 -9.052 1.00 0.39 C ATOM 222 O LEU A 15 1.881 11.582 -8.716 1.00 0.43 O ATOM 223 CB LEU A 15 2.027 8.659 -10.028 1.00 0.34 C ATOM 224 CG LEU A 15 3.392 9.199 -10.328 1.00 0.43 C ATOM 225 CD1 LEU A 15 4.403 8.078 -10.261 1.00 0.56 C ATOM 226 CD2 LEU A 15 3.406 9.865 -11.692 1.00 0.60 C ATOM 0 H LEU A 15 -0.117 7.919 -9.397 1.00 0.32 H new ATOM 0 HA LEU A 15 2.008 9.118 -7.938 1.00 0.33 H new ATOM 0 HB2 LEU A 15 2.100 7.578 -9.905 1.00 0.34 H new ATOM 0 HB3 LEU A 15 1.385 8.839 -10.890 1.00 0.34 H new ATOM 0 HG LEU A 15 3.656 9.952 -9.586 1.00 0.43 H new ATOM 0 HD11 LEU A 15 5.396 8.470 -10.479 1.00 0.56 H new ATOM 0 HD12 LEU A 15 4.397 7.641 -9.262 1.00 0.56 H new ATOM 0 HD13 LEU A 15 4.146 7.312 -10.993 1.00 0.56 H new ATOM 0 HD21 LEU A 15 4.404 10.253 -11.897 1.00 0.60 H new ATOM 0 HD22 LEU A 15 3.136 9.136 -12.456 1.00 0.60 H new ATOM 0 HD23 LEU A 15 2.688 10.685 -11.704 1.00 0.60 H new ATOM 238 N GLY A 16 -0.074 10.926 -9.639 1.00 0.43 N ATOM 239 CA GLY A 16 -0.541 12.267 -9.895 1.00 0.50 C ATOM 240 C GLY A 16 -0.789 12.999 -8.605 1.00 0.50 C ATOM 241 O GLY A 16 -0.844 14.220 -8.574 1.00 0.57 O ATOM 0 H GLY A 16 -0.711 10.191 -9.947 1.00 0.43 H new ATOM 0 HA2 GLY A 16 0.196 12.807 -10.489 1.00 0.50 H new ATOM 0 HA3 GLY A 16 -1.459 12.232 -10.481 1.00 0.50 H new ATOM 245 N TYR A 17 -0.907 12.228 -7.534 1.00 0.45 N ATOM 246 CA TYR A 17 -1.078 12.779 -6.206 1.00 0.48 C ATOM 247 C TYR A 17 0.266 13.115 -5.628 1.00 0.50 C ATOM 248 O TYR A 17 0.390 13.995 -4.779 1.00 0.64 O ATOM 249 CB TYR A 17 -1.769 11.790 -5.288 1.00 0.49 C ATOM 250 CG TYR A 17 -3.191 11.496 -5.685 1.00 0.96 C ATOM 251 CD1 TYR A 17 -4.056 12.516 -6.036 1.00 1.59 C ATOM 252 CD2 TYR A 17 -3.664 10.194 -5.703 1.00 1.41 C ATOM 253 CE1 TYR A 17 -5.362 12.249 -6.401 1.00 2.29 C ATOM 254 CE2 TYR A 17 -4.967 9.913 -6.066 1.00 2.13 C ATOM 255 CZ TYR A 17 -5.815 10.962 -6.418 1.00 2.49 C ATOM 256 OH TYR A 17 -7.111 10.670 -6.785 1.00 3.27 O ATOM 0 H TYR A 17 -0.887 11.209 -7.565 1.00 0.45 H new ATOM 0 HA TYR A 17 -1.695 13.674 -6.287 1.00 0.48 H new ATOM 0 HB2 TYR A 17 -1.203 10.859 -5.278 1.00 0.49 H new ATOM 0 HB3 TYR A 17 -1.757 12.181 -4.271 1.00 0.49 H new ATOM 0 HD1 TYR A 17 -3.706 13.537 -6.025 1.00 1.59 H new ATOM 0 HD2 TYR A 17 -3.003 9.385 -5.429 1.00 1.41 H new ATOM 0 HE1 TYR A 17 -6.023 13.058 -6.673 1.00 2.29 H new ATOM 0 HE2 TYR A 17 -5.324 8.894 -6.077 1.00 2.13 H new ATOM 0 HH TYR A 17 -7.448 9.932 -6.236 1.00 3.27 H new ATOM 266 N ASN A 18 1.286 12.412 -6.096 1.00 0.43 N ATOM 267 CA ASN A 18 2.636 12.676 -5.622 1.00 0.51 C ATOM 268 C ASN A 18 3.139 14.001 -6.185 1.00 0.62 C ATOM 269 O ASN A 18 4.096 14.590 -5.683 1.00 0.77 O ATOM 270 CB ASN A 18 3.554 11.508 -5.984 1.00 0.60 C ATOM 271 CG ASN A 18 5.030 11.863 -5.970 1.00 1.20 C ATOM 272 OD1 ASN A 18 5.682 11.803 -4.925 1.00 2.03 O ATOM 273 ND2 ASN A 18 5.572 12.213 -7.125 1.00 1.65 N ATOM 0 H ASN A 18 1.209 11.668 -6.790 1.00 0.43 H new ATOM 0 HA ASN A 18 2.633 12.765 -4.536 1.00 0.51 H new ATOM 0 HB2 ASN A 18 3.380 10.690 -5.284 1.00 0.60 H new ATOM 0 HB3 ASN A 18 3.287 11.142 -6.975 1.00 0.60 H new ATOM 0 HD21 ASN A 18 6.564 12.445 -7.173 1.00 1.65 H new ATOM 0 HD22 ASN A 18 4.998 12.250 -7.967 1.00 1.65 H new ATOM 280 N ARG A 19 2.450 14.483 -7.207 1.00 0.61 N ATOM 281 CA ARG A 19 2.779 15.760 -7.825 1.00 0.80 C ATOM 282 C ARG A 19 1.629 16.753 -7.646 1.00 0.90 C ATOM 283 O ARG A 19 1.615 17.825 -8.249 1.00 1.10 O ATOM 284 CB ARG A 19 3.092 15.545 -9.308 1.00 0.83 C ATOM 285 CG ARG A 19 1.967 14.874 -10.076 1.00 1.26 C ATOM 286 CD ARG A 19 2.505 13.966 -11.170 1.00 1.01 C ATOM 287 NE ARG A 19 3.309 14.702 -12.146 1.00 1.65 N ATOM 288 CZ ARG A 19 4.245 14.150 -12.917 1.00 1.85 C ATOM 289 NH1 ARG A 19 4.493 12.849 -12.845 1.00 1.70 N ATOM 290 NH2 ARG A 19 4.929 14.904 -13.767 1.00 2.72 N ATOM 0 H ARG A 19 1.654 14.006 -7.629 1.00 0.61 H new ATOM 0 HA ARG A 19 3.660 16.179 -7.338 1.00 0.80 H new ATOM 0 HB2 ARG A 19 3.310 16.509 -9.768 1.00 0.83 H new ATOM 0 HB3 ARG A 19 3.993 14.938 -9.396 1.00 0.83 H new ATOM 0 HG2 ARG A 19 1.352 14.293 -9.389 1.00 1.26 H new ATOM 0 HG3 ARG A 19 1.322 15.634 -10.517 1.00 1.26 H new ATOM 0 HD2 ARG A 19 3.110 13.178 -10.722 1.00 1.01 H new ATOM 0 HD3 ARG A 19 1.673 13.479 -11.679 1.00 1.01 H new ATOM 0 HE ARG A 19 3.142 15.704 -12.243 1.00 1.65 H new ATOM 0 HH11 ARG A 19 3.966 12.264 -12.196 1.00 1.70 H new ATOM 0 HH12 ARG A 19 5.211 12.433 -13.438 1.00 1.70 H new ATOM 0 HH21 ARG A 19 4.738 15.904 -13.829 1.00 2.72 H new ATOM 0 HH22 ARG A 19 5.646 14.484 -14.358 1.00 2.72 H new ATOM 304 N ASP A 20 0.673 16.388 -6.801 1.00 0.87 N ATOM 305 CA ASP A 20 -0.520 17.200 -6.581 1.00 1.08 C ATOM 306 C ASP A 20 -0.515 17.792 -5.185 1.00 0.94 C ATOM 307 O ASP A 20 -0.749 17.089 -4.200 1.00 1.32 O ATOM 308 CB ASP A 20 -1.766 16.344 -6.742 1.00 1.59 C ATOM 309 CG ASP A 20 -3.054 17.132 -6.612 1.00 1.74 C ATOM 310 OD1 ASP A 20 -3.166 18.199 -7.250 1.00 1.91 O ATOM 311 OD2 ASP A 20 -3.965 16.685 -5.888 1.00 2.16 O ATOM 0 H ASP A 20 0.700 15.528 -6.252 1.00 0.87 H new ATOM 0 HA ASP A 20 -0.521 18.006 -7.315 1.00 1.08 H new ATOM 0 HB2 ASP A 20 -1.742 15.859 -7.718 1.00 1.59 H new ATOM 0 HB3 ASP A 20 -1.755 15.553 -5.992 1.00 1.59 H new ATOM 316 N THR A 21 -0.274 19.080 -5.090 1.00 0.91 N ATOM 317 CA THR A 21 -0.164 19.727 -3.799 1.00 1.05 C ATOM 318 C THR A 21 -1.116 20.909 -3.709 1.00 1.13 C ATOM 319 O THR A 21 -0.943 21.909 -4.408 1.00 1.46 O ATOM 320 CB THR A 21 1.286 20.161 -3.554 1.00 1.45 C ATOM 321 OG1 THR A 21 1.738 21.007 -4.622 1.00 1.82 O ATOM 322 CG2 THR A 21 2.169 18.928 -3.471 1.00 1.70 C ATOM 0 H THR A 21 -0.150 19.701 -5.890 1.00 0.91 H new ATOM 0 HA THR A 21 -0.446 19.017 -3.021 1.00 1.05 H new ATOM 0 HB THR A 21 1.340 20.718 -2.619 1.00 1.45 H new ATOM 0 HG1 THR A 21 1.009 21.599 -4.901 1.00 1.82 H new ATOM 0 HG21 THR A 21 3.201 19.231 -3.297 1.00 1.70 H new ATOM 0 HG22 THR A 21 1.833 18.295 -2.650 1.00 1.70 H new ATOM 0 HG23 THR A 21 2.107 18.372 -4.407 1.00 1.70 H new ATOM 330 N SER A 22 -2.117 20.782 -2.846 1.00 1.05 N ATOM 331 CA SER A 22 -3.230 21.720 -2.828 1.00 1.30 C ATOM 332 C SER A 22 -4.223 21.402 -1.710 1.00 1.31 C ATOM 333 O SER A 22 -4.822 20.326 -1.692 1.00 2.15 O ATOM 334 CB SER A 22 -3.945 21.665 -4.176 1.00 1.67 C ATOM 335 OG SER A 22 -4.211 20.320 -4.551 1.00 2.19 O ATOM 0 H SER A 22 -2.180 20.039 -2.150 1.00 1.05 H new ATOM 0 HA SER A 22 -2.833 22.718 -2.644 1.00 1.30 H new ATOM 0 HB2 SER A 22 -4.879 22.223 -4.120 1.00 1.67 H new ATOM 0 HB3 SER A 22 -3.331 22.145 -4.938 1.00 1.67 H new ATOM 0 HG SER A 22 -3.529 20.017 -5.186 1.00 2.19 H new ATOM 341 N GLY A 23 -4.381 22.333 -0.776 1.00 0.96 N ATOM 342 CA GLY A 23 -5.397 22.204 0.256 1.00 1.10 C ATOM 343 C GLY A 23 -5.223 20.973 1.121 1.00 0.89 C ATOM 344 O GLY A 23 -6.202 20.370 1.557 1.00 1.01 O ATOM 0 H GLY A 23 -3.819 23.182 -0.714 1.00 0.96 H new ATOM 0 HA2 GLY A 23 -5.375 23.090 0.890 1.00 1.10 H new ATOM 0 HA3 GLY A 23 -6.380 22.173 -0.214 1.00 1.10 H new ATOM 348 N TRP A 24 -3.981 20.591 1.355 1.00 0.79 N ATOM 349 CA TRP A 24 -3.684 19.451 2.207 1.00 0.66 C ATOM 350 C TRP A 24 -2.837 19.909 3.380 1.00 0.67 C ATOM 351 O TRP A 24 -2.681 21.108 3.603 1.00 0.83 O ATOM 352 CB TRP A 24 -3.014 18.327 1.387 1.00 0.71 C ATOM 353 CG TRP A 24 -1.552 18.483 1.078 1.00 0.81 C ATOM 354 CD1 TRP A 24 -0.700 19.448 1.516 1.00 1.34 C ATOM 355 CD2 TRP A 24 -0.770 17.609 0.261 1.00 0.87 C ATOM 356 NE1 TRP A 24 0.559 19.211 1.058 1.00 1.41 N ATOM 357 CE2 TRP A 24 0.546 18.097 0.272 1.00 0.99 C ATOM 358 CE3 TRP A 24 -1.056 16.458 -0.474 1.00 1.36 C ATOM 359 CZ2 TRP A 24 1.578 17.473 -0.417 1.00 1.09 C ATOM 360 CZ3 TRP A 24 -0.032 15.841 -1.163 1.00 1.67 C ATOM 361 CH2 TRP A 24 1.272 16.350 -1.127 1.00 1.37 C ATOM 0 H TRP A 24 -3.159 21.054 0.967 1.00 0.79 H new ATOM 0 HA TRP A 24 -4.606 19.032 2.610 1.00 0.66 H new ATOM 0 HB2 TRP A 24 -3.147 17.389 1.926 1.00 0.71 H new ATOM 0 HB3 TRP A 24 -3.551 18.231 0.443 1.00 0.71 H new ATOM 0 HD1 TRP A 24 -0.983 20.284 2.139 1.00 1.34 H new ATOM 0 HE1 TRP A 24 1.381 19.776 1.269 1.00 1.41 H new ATOM 0 HE3 TRP A 24 -2.059 16.058 -0.503 1.00 1.36 H new ATOM 0 HZ2 TRP A 24 2.585 17.863 -0.391 1.00 1.09 H new ATOM 0 HZ3 TRP A 24 -0.240 14.951 -1.739 1.00 1.67 H new ATOM 0 HH2 TRP A 24 2.053 15.842 -1.674 1.00 1.37 H new ATOM 372 N LYS A 25 -2.294 18.954 4.101 1.00 0.60 N ATOM 373 CA LYS A 25 -1.461 19.202 5.260 1.00 0.70 C ATOM 374 C LYS A 25 -0.930 17.885 5.739 1.00 0.61 C ATOM 375 O LYS A 25 -1.531 16.850 5.491 1.00 0.59 O ATOM 376 CB LYS A 25 -2.235 19.834 6.411 1.00 0.89 C ATOM 377 CG LYS A 25 -2.160 21.350 6.475 1.00 1.29 C ATOM 378 CD LYS A 25 -2.596 21.867 7.839 1.00 1.62 C ATOM 379 CE LYS A 25 -3.797 21.102 8.373 1.00 2.23 C ATOM 380 NZ LYS A 25 -5.008 21.282 7.525 1.00 2.95 N ATOM 0 H LYS A 25 -2.421 17.963 3.895 1.00 0.60 H new ATOM 0 HA LYS A 25 -0.671 19.891 4.962 1.00 0.70 H new ATOM 0 HB2 LYS A 25 -3.281 19.539 6.331 1.00 0.89 H new ATOM 0 HB3 LYS A 25 -1.860 19.426 7.350 1.00 0.89 H new ATOM 0 HG2 LYS A 25 -1.140 21.675 6.269 1.00 1.29 H new ATOM 0 HG3 LYS A 25 -2.794 21.781 5.700 1.00 1.29 H new ATOM 0 HD2 LYS A 25 -1.768 21.781 8.542 1.00 1.62 H new ATOM 0 HD3 LYS A 25 -2.843 22.926 7.765 1.00 1.62 H new ATOM 0 HE2 LYS A 25 -3.552 20.041 8.431 1.00 2.23 H new ATOM 0 HE3 LYS A 25 -4.015 21.435 9.388 1.00 2.23 H new ATOM 0 HZ1 LYS A 25 -5.836 21.447 8.133 1.00 2.95 H new ATOM 0 HZ2 LYS A 25 -4.873 22.099 6.895 1.00 2.95 H new ATOM 0 HZ3 LYS A 25 -5.162 20.427 6.954 1.00 2.95 H new ATOM 394 N VAL A 26 0.171 17.915 6.436 1.00 0.63 N ATOM 395 CA VAL A 26 0.687 16.705 7.017 1.00 0.58 C ATOM 396 C VAL A 26 -0.094 16.381 8.268 1.00 0.66 C ATOM 397 O VAL A 26 -0.159 17.169 9.218 1.00 0.80 O ATOM 398 CB VAL A 26 2.181 16.791 7.324 1.00 0.64 C ATOM 399 CG1 VAL A 26 2.482 18.085 8.038 1.00 1.22 C ATOM 400 CG2 VAL A 26 2.627 15.589 8.134 1.00 1.56 C ATOM 0 H VAL A 26 0.724 18.753 6.615 1.00 0.63 H new ATOM 0 HA VAL A 26 0.568 15.906 6.285 1.00 0.58 H new ATOM 0 HB VAL A 26 2.742 16.781 6.390 1.00 0.64 H new ATOM 0 HG11 VAL A 26 3.549 18.141 8.255 1.00 1.22 H new ATOM 0 HG12 VAL A 26 2.195 18.925 7.405 1.00 1.22 H new ATOM 0 HG13 VAL A 26 1.920 18.125 8.971 1.00 1.22 H new ATOM 0 HG21 VAL A 26 3.694 15.667 8.343 1.00 1.56 H new ATOM 0 HG22 VAL A 26 2.074 15.558 9.073 1.00 1.56 H new ATOM 0 HG23 VAL A 26 2.434 14.677 7.569 1.00 1.56 H new ATOM 410 N VAL A 27 -0.716 15.231 8.245 1.00 0.62 N ATOM 411 CA VAL A 27 -1.540 14.802 9.342 1.00 0.73 C ATOM 412 C VAL A 27 -0.680 14.100 10.372 1.00 0.76 C ATOM 413 O VAL A 27 -1.009 14.084 11.560 1.00 0.90 O ATOM 414 CB VAL A 27 -2.689 13.876 8.872 1.00 0.75 C ATOM 415 CG1 VAL A 27 -2.159 12.533 8.392 1.00 1.21 C ATOM 416 CG2 VAL A 27 -3.720 13.687 9.972 1.00 1.22 C ATOM 0 H VAL A 27 -0.666 14.570 7.470 1.00 0.62 H new ATOM 0 HA VAL A 27 -2.001 15.683 9.788 1.00 0.73 H new ATOM 0 HB VAL A 27 -3.178 14.362 8.027 1.00 0.75 H new ATOM 0 HG11 VAL A 27 -2.991 11.908 8.069 1.00 1.21 H new ATOM 0 HG12 VAL A 27 -1.477 12.689 7.556 1.00 1.21 H new ATOM 0 HG13 VAL A 27 -1.628 12.039 9.206 1.00 1.21 H new ATOM 0 HG21 VAL A 27 -4.516 13.033 9.616 1.00 1.22 H new ATOM 0 HG22 VAL A 27 -3.244 13.238 10.844 1.00 1.22 H new ATOM 0 HG23 VAL A 27 -4.141 14.654 10.246 1.00 1.22 H new ATOM 426 N LYS A 28 0.452 13.556 9.923 1.00 0.65 N ATOM 427 CA LYS A 28 1.304 12.797 10.818 1.00 0.68 C ATOM 428 C LYS A 28 2.637 12.414 10.177 1.00 0.58 C ATOM 429 O LYS A 28 2.735 12.255 8.960 1.00 0.55 O ATOM 430 CB LYS A 28 0.584 11.528 11.292 1.00 0.77 C ATOM 431 CG LYS A 28 1.056 11.041 12.649 1.00 0.87 C ATOM 432 CD LYS A 28 0.747 12.069 13.725 1.00 1.45 C ATOM 433 CE LYS A 28 -0.732 12.084 14.080 1.00 2.02 C ATOM 434 NZ LYS A 28 -1.046 13.112 15.105 1.00 2.41 N ATOM 0 H LYS A 28 0.789 13.628 8.963 1.00 0.65 H new ATOM 0 HA LYS A 28 1.519 13.445 11.668 1.00 0.68 H new ATOM 0 HB2 LYS A 28 -0.488 11.722 11.336 1.00 0.77 H new ATOM 0 HB3 LYS A 28 0.735 10.737 10.557 1.00 0.77 H new ATOM 0 HG2 LYS A 28 0.570 10.096 12.891 1.00 0.87 H new ATOM 0 HG3 LYS A 28 2.129 10.849 12.619 1.00 0.87 H new ATOM 0 HD2 LYS A 28 1.333 11.849 14.617 1.00 1.45 H new ATOM 0 HD3 LYS A 28 1.049 13.058 13.381 1.00 1.45 H new ATOM 0 HE2 LYS A 28 -1.319 12.276 13.182 1.00 2.02 H new ATOM 0 HE3 LYS A 28 -1.027 11.102 14.449 1.00 2.02 H new ATOM 0 HZ1 LYS A 28 -2.064 13.090 15.319 1.00 2.41 H new ATOM 0 HZ2 LYS A 28 -0.506 12.915 15.971 1.00 2.41 H new ATOM 0 HZ3 LYS A 28 -0.789 14.053 14.743 1.00 2.41 H new ATOM 448 N THR A 29 3.661 12.285 11.016 1.00 0.61 N ATOM 449 CA THR A 29 4.967 11.797 10.596 1.00 0.59 C ATOM 450 C THR A 29 5.476 10.765 11.597 1.00 0.72 C ATOM 451 O THR A 29 5.147 10.838 12.783 1.00 0.88 O ATOM 452 CB THR A 29 6.003 12.933 10.513 1.00 0.75 C ATOM 453 OG1 THR A 29 6.225 13.486 11.817 1.00 1.38 O ATOM 454 CG2 THR A 29 5.544 14.042 9.579 1.00 0.82 C ATOM 0 H THR A 29 3.606 12.517 12.008 1.00 0.61 H new ATOM 0 HA THR A 29 4.845 11.357 9.606 1.00 0.59 H new ATOM 0 HB THR A 29 6.926 12.508 10.120 1.00 0.75 H new ATOM 0 HG1 THR A 29 6.886 14.207 11.758 1.00 1.38 H new ATOM 0 HG21 THR A 29 6.300 14.826 9.546 1.00 0.82 H new ATOM 0 HG22 THR A 29 5.397 13.637 8.578 1.00 0.82 H new ATOM 0 HG23 THR A 29 4.605 14.459 9.943 1.00 0.82 H new ATOM 462 N SER A 30 6.243 9.790 11.131 1.00 0.80 N ATOM 463 CA SER A 30 6.813 8.786 12.034 1.00 1.04 C ATOM 464 C SER A 30 8.122 8.191 11.501 1.00 1.45 C ATOM 465 O SER A 30 8.108 7.123 10.903 1.00 2.37 O ATOM 466 CB SER A 30 5.798 7.666 12.286 1.00 1.24 C ATOM 467 OG SER A 30 4.609 8.177 12.871 1.00 1.93 O ATOM 0 H SER A 30 6.486 9.668 10.148 1.00 0.80 H new ATOM 0 HA SER A 30 7.045 9.294 12.970 1.00 1.04 H new ATOM 0 HB2 SER A 30 5.560 7.168 11.346 1.00 1.24 H new ATOM 0 HB3 SER A 30 6.236 6.914 12.943 1.00 1.24 H new ATOM 0 HG SER A 30 4.715 9.136 13.042 1.00 1.93 H new ATOM 473 N LYS A 31 9.245 8.876 11.748 1.00 1.32 N ATOM 474 CA LYS A 31 10.583 8.391 11.358 1.00 1.71 C ATOM 475 C LYS A 31 10.858 8.647 9.877 1.00 1.47 C ATOM 476 O LYS A 31 10.869 7.719 9.064 1.00 2.02 O ATOM 477 CB LYS A 31 10.802 6.898 11.683 1.00 2.29 C ATOM 478 CG LYS A 31 10.917 6.568 13.169 1.00 2.73 C ATOM 479 CD LYS A 31 9.564 6.560 13.866 1.00 3.59 C ATOM 480 CE LYS A 31 9.672 6.071 15.301 1.00 4.18 C ATOM 481 NZ LYS A 31 10.538 6.951 16.131 1.00 4.55 N ATOM 0 H LYS A 31 9.257 9.779 12.222 1.00 1.32 H new ATOM 0 HA LYS A 31 11.292 8.962 11.957 1.00 1.71 H new ATOM 0 HB2 LYS A 31 9.975 6.326 11.263 1.00 2.29 H new ATOM 0 HB3 LYS A 31 11.709 6.562 11.181 1.00 2.29 H new ATOM 0 HG2 LYS A 31 11.389 5.593 13.287 1.00 2.73 H new ATOM 0 HG3 LYS A 31 11.567 7.298 13.652 1.00 2.73 H new ATOM 0 HD2 LYS A 31 9.143 7.566 13.855 1.00 3.59 H new ATOM 0 HD3 LYS A 31 8.875 5.920 13.315 1.00 3.59 H new ATOM 0 HE2 LYS A 31 8.677 6.023 15.742 1.00 4.18 H new ATOM 0 HE3 LYS A 31 10.073 5.058 15.308 1.00 4.18 H new ATOM 0 HZ1 LYS A 31 10.515 6.628 17.119 1.00 4.55 H new ATOM 0 HZ2 LYS A 31 11.515 6.911 15.776 1.00 4.55 H new ATOM 0 HZ3 LYS A 31 10.190 7.930 16.078 1.00 4.55 H new ATOM 495 N LYS A 32 11.057 9.926 9.546 1.00 0.87 N ATOM 496 CA LYS A 32 11.368 10.376 8.182 1.00 0.69 C ATOM 497 C LYS A 32 10.152 10.303 7.275 1.00 0.51 C ATOM 498 O LYS A 32 10.281 10.267 6.053 1.00 0.59 O ATOM 499 CB LYS A 32 12.499 9.563 7.551 1.00 0.80 C ATOM 500 CG LYS A 32 13.877 9.835 8.130 1.00 1.00 C ATOM 501 CD LYS A 32 14.960 9.167 7.294 1.00 0.93 C ATOM 502 CE LYS A 32 16.352 9.463 7.828 1.00 1.14 C ATOM 503 NZ LYS A 32 16.632 10.922 7.870 1.00 1.42 N ATOM 0 H LYS A 32 11.007 10.688 10.223 1.00 0.87 H new ATOM 0 HA LYS A 32 11.687 11.414 8.278 1.00 0.69 H new ATOM 0 HB2 LYS A 32 12.274 8.503 7.667 1.00 0.80 H new ATOM 0 HB3 LYS A 32 12.523 9.769 6.481 1.00 0.80 H new ATOM 0 HG2 LYS A 32 14.054 10.910 8.169 1.00 1.00 H new ATOM 0 HG3 LYS A 32 13.924 9.467 9.155 1.00 1.00 H new ATOM 0 HD2 LYS A 32 14.797 8.089 7.283 1.00 0.93 H new ATOM 0 HD3 LYS A 32 14.886 9.511 6.262 1.00 0.93 H new ATOM 0 HE2 LYS A 32 16.453 9.045 8.830 1.00 1.14 H new ATOM 0 HE3 LYS A 32 17.094 8.969 7.201 1.00 1.14 H new ATOM 0 HZ1 LYS A 32 17.653 11.076 7.992 1.00 1.42 H new ATOM 0 HZ2 LYS A 32 16.319 11.361 6.981 1.00 1.42 H new ATOM 0 HZ3 LYS A 32 16.120 11.351 8.667 1.00 1.42 H new ATOM 517 N ILE A 33 8.980 10.284 7.873 1.00 0.37 N ATOM 518 CA ILE A 33 7.743 10.173 7.110 1.00 0.33 C ATOM 519 C ILE A 33 6.992 11.472 7.122 1.00 0.36 C ATOM 520 O ILE A 33 7.318 12.386 7.871 1.00 0.46 O ATOM 521 CB ILE A 33 6.830 9.056 7.656 1.00 0.41 C ATOM 522 CG1 ILE A 33 7.677 7.864 8.061 1.00 0.58 C ATOM 523 CG2 ILE A 33 5.781 8.643 6.630 1.00 0.76 C ATOM 524 CD1 ILE A 33 6.888 6.598 8.313 1.00 0.75 C ATOM 0 H ILE A 33 8.852 10.344 8.883 1.00 0.37 H new ATOM 0 HA ILE A 33 8.024 9.922 6.087 1.00 0.33 H new ATOM 0 HB ILE A 33 6.300 9.438 8.529 1.00 0.41 H new ATOM 0 HG12 ILE A 33 8.411 7.671 7.278 1.00 0.58 H new ATOM 0 HG13 ILE A 33 8.233 8.118 8.964 1.00 0.58 H new ATOM 0 HG21 ILE A 33 5.155 7.854 7.047 1.00 0.76 H new ATOM 0 HG22 ILE A 33 5.161 9.503 6.377 1.00 0.76 H new ATOM 0 HG23 ILE A 33 6.276 8.276 5.731 1.00 0.76 H new ATOM 0 HD11 ILE A 33 7.569 5.796 8.597 1.00 0.75 H new ATOM 0 HD12 ILE A 33 6.173 6.769 9.117 1.00 0.75 H new ATOM 0 HD13 ILE A 33 6.353 6.316 7.406 1.00 0.75 H new ATOM 536 N THR A 34 6.018 11.547 6.248 1.00 0.33 N ATOM 537 CA THR A 34 5.141 12.676 6.158 1.00 0.36 C ATOM 538 C THR A 34 3.850 12.257 5.466 1.00 0.36 C ATOM 539 O THR A 34 3.816 12.066 4.253 1.00 0.39 O ATOM 540 CB THR A 34 5.812 13.832 5.385 1.00 0.39 C ATOM 541 OG1 THR A 34 6.931 14.338 6.125 1.00 0.58 O ATOM 542 CG2 THR A 34 4.832 14.950 5.122 1.00 0.56 C ATOM 0 H THR A 34 5.814 10.811 5.572 1.00 0.33 H new ATOM 0 HA THR A 34 4.916 13.031 7.164 1.00 0.36 H new ATOM 0 HB THR A 34 6.156 13.440 4.428 1.00 0.39 H new ATOM 0 HG1 THR A 34 6.946 13.930 7.016 1.00 0.58 H new ATOM 0 HG21 THR A 34 5.331 15.751 4.576 1.00 0.56 H new ATOM 0 HG22 THR A 34 3.999 14.572 4.530 1.00 0.56 H new ATOM 0 HG23 THR A 34 4.457 15.336 6.070 1.00 0.56 H new ATOM 550 N VAL A 35 2.809 12.062 6.253 1.00 0.39 N ATOM 551 CA VAL A 35 1.511 11.681 5.727 1.00 0.40 C ATOM 552 C VAL A 35 0.646 12.919 5.563 1.00 0.40 C ATOM 553 O VAL A 35 0.145 13.463 6.538 1.00 0.44 O ATOM 554 CB VAL A 35 0.804 10.669 6.656 1.00 0.48 C ATOM 555 CG1 VAL A 35 -0.463 10.125 6.016 1.00 0.82 C ATOM 556 CG2 VAL A 35 1.744 9.534 7.024 1.00 0.86 C ATOM 0 H VAL A 35 2.838 12.162 7.268 1.00 0.39 H new ATOM 0 HA VAL A 35 1.661 11.203 4.759 1.00 0.40 H new ATOM 0 HB VAL A 35 0.520 11.195 7.568 1.00 0.48 H new ATOM 0 HG11 VAL A 35 -0.938 9.416 6.694 1.00 0.82 H new ATOM 0 HG12 VAL A 35 -1.149 10.947 5.812 1.00 0.82 H new ATOM 0 HG13 VAL A 35 -0.212 9.622 5.082 1.00 0.82 H new ATOM 0 HG21 VAL A 35 1.228 8.832 7.679 1.00 0.86 H new ATOM 0 HG22 VAL A 35 2.064 9.018 6.119 1.00 0.86 H new ATOM 0 HG23 VAL A 35 2.616 9.936 7.539 1.00 0.86 H new ATOM 566 N SER A 36 0.505 13.382 4.336 1.00 0.42 N ATOM 567 CA SER A 36 -0.264 14.578 4.057 1.00 0.42 C ATOM 568 C SER A 36 -1.682 14.226 3.640 1.00 0.43 C ATOM 569 O SER A 36 -1.906 13.481 2.684 1.00 0.47 O ATOM 570 CB SER A 36 0.431 15.409 2.996 1.00 0.45 C ATOM 571 OG SER A 36 0.378 14.773 1.732 1.00 1.10 O ATOM 0 H SER A 36 0.916 12.944 3.512 1.00 0.42 H new ATOM 0 HA SER A 36 -0.329 15.172 4.969 1.00 0.42 H new ATOM 0 HB2 SER A 36 -0.040 16.390 2.933 1.00 0.45 H new ATOM 0 HB3 SER A 36 1.470 15.572 3.281 1.00 0.45 H new ATOM 0 HG SER A 36 0.022 15.398 1.066 1.00 1.10 H new ATOM 577 N SER A 37 -2.624 14.775 4.374 1.00 0.45 N ATOM 578 CA SER A 37 -4.032 14.498 4.178 1.00 0.48 C ATOM 579 C SER A 37 -4.669 15.540 3.270 1.00 0.53 C ATOM 580 O SER A 37 -4.532 16.741 3.497 1.00 0.59 O ATOM 581 CB SER A 37 -4.743 14.479 5.531 1.00 0.59 C ATOM 582 OG SER A 37 -4.502 15.680 6.245 1.00 1.27 O ATOM 0 H SER A 37 -2.434 15.432 5.131 1.00 0.45 H new ATOM 0 HA SER A 37 -4.132 13.524 3.700 1.00 0.48 H new ATOM 0 HB2 SER A 37 -5.815 14.349 5.382 1.00 0.59 H new ATOM 0 HB3 SER A 37 -4.397 13.627 6.116 1.00 0.59 H new ATOM 0 HG SER A 37 -4.333 16.409 5.612 1.00 1.27 H new ATOM 588 N LYS A 38 -5.343 15.064 2.240 1.00 0.59 N ATOM 589 CA LYS A 38 -6.088 15.925 1.330 1.00 0.76 C ATOM 590 C LYS A 38 -7.448 15.307 1.022 1.00 0.90 C ATOM 591 O LYS A 38 -7.524 14.178 0.552 1.00 1.69 O ATOM 592 CB LYS A 38 -5.329 16.134 0.017 1.00 0.99 C ATOM 593 CG LYS A 38 -5.901 17.272 -0.815 1.00 1.06 C ATOM 594 CD LYS A 38 -5.370 17.278 -2.241 1.00 1.11 C ATOM 595 CE LYS A 38 -3.860 17.401 -2.282 1.00 1.44 C ATOM 596 NZ LYS A 38 -3.380 17.788 -3.630 1.00 1.91 N ATOM 0 H LYS A 38 -5.392 14.072 2.008 1.00 0.59 H new ATOM 0 HA LYS A 38 -6.217 16.891 1.819 1.00 0.76 H new ATOM 0 HB2 LYS A 38 -4.281 16.340 0.236 1.00 0.99 H new ATOM 0 HB3 LYS A 38 -5.358 15.213 -0.565 1.00 0.99 H new ATOM 0 HG2 LYS A 38 -6.988 17.191 -0.836 1.00 1.06 H new ATOM 0 HG3 LYS A 38 -5.661 18.222 -0.338 1.00 1.06 H new ATOM 0 HD2 LYS A 38 -5.673 16.360 -2.745 1.00 1.11 H new ATOM 0 HD3 LYS A 38 -5.817 18.106 -2.791 1.00 1.11 H new ATOM 0 HE2 LYS A 38 -3.535 18.143 -1.553 1.00 1.44 H new ATOM 0 HE3 LYS A 38 -3.409 16.452 -1.993 1.00 1.44 H new ATOM 0 HZ1 LYS A 38 -2.359 17.602 -3.702 1.00 1.91 H new ATOM 0 HZ2 LYS A 38 -3.884 17.233 -4.351 1.00 1.91 H new ATOM 0 HZ3 LYS A 38 -3.559 18.801 -3.785 1.00 1.91 H new ATOM 610 N ALA A 39 -8.511 16.051 1.290 1.00 1.16 N ATOM 611 CA ALA A 39 -9.876 15.574 1.077 1.00 1.25 C ATOM 612 C ALA A 39 -10.111 15.105 -0.360 1.00 1.19 C ATOM 613 O ALA A 39 -9.836 15.837 -1.313 1.00 1.50 O ATOM 614 CB ALA A 39 -10.867 16.669 1.430 1.00 1.68 C ATOM 0 H ALA A 39 -8.456 17.000 1.660 1.00 1.16 H new ATOM 0 HA ALA A 39 -10.024 14.713 1.729 1.00 1.25 H new ATOM 0 HB1 ALA A 39 -11.882 16.307 1.269 1.00 1.68 H new ATOM 0 HB2 ALA A 39 -10.743 16.948 2.476 1.00 1.68 H new ATOM 0 HB3 ALA A 39 -10.688 17.539 0.799 1.00 1.68 H new ATOM 620 N SER A 40 -10.623 13.885 -0.507 1.00 1.11 N ATOM 621 CA SER A 40 -10.972 13.355 -1.811 1.00 1.35 C ATOM 622 C SER A 40 -12.382 13.795 -2.172 1.00 1.53 C ATOM 623 O SER A 40 -13.282 13.775 -1.326 1.00 2.09 O ATOM 624 CB SER A 40 -10.893 11.831 -1.805 1.00 1.66 C ATOM 625 OG SER A 40 -9.625 11.392 -1.364 1.00 2.06 O ATOM 0 H SER A 40 -10.804 13.247 0.268 1.00 1.11 H new ATOM 0 HA SER A 40 -10.267 13.737 -2.550 1.00 1.35 H new ATOM 0 HB2 SER A 40 -11.669 11.426 -1.155 1.00 1.66 H new ATOM 0 HB3 SER A 40 -11.086 11.449 -2.808 1.00 1.66 H new ATOM 0 HG SER A 40 -9.716 10.525 -0.917 1.00 2.06 H new ATOM 631 N ARG A 41 -12.584 14.196 -3.411 1.00 1.87 N ATOM 632 CA ARG A 41 -13.894 14.643 -3.849 1.00 2.15 C ATOM 633 C ARG A 41 -14.728 13.481 -4.357 1.00 1.92 C ATOM 634 O ARG A 41 -15.766 13.679 -4.988 1.00 2.12 O ATOM 635 CB ARG A 41 -13.781 15.711 -4.929 1.00 3.07 C ATOM 636 CG ARG A 41 -13.078 16.987 -4.477 1.00 3.62 C ATOM 637 CD ARG A 41 -13.861 17.722 -3.394 1.00 4.44 C ATOM 638 NE ARG A 41 -13.913 16.973 -2.137 1.00 4.95 N ATOM 639 CZ ARG A 41 -14.810 17.186 -1.176 1.00 5.91 C ATOM 640 NH1 ARG A 41 -15.712 18.155 -1.302 1.00 6.46 N ATOM 641 NH2 ARG A 41 -14.804 16.426 -0.088 1.00 6.61 N ATOM 0 H ARG A 41 -11.862 14.222 -4.131 1.00 1.87 H new ATOM 0 HA ARG A 41 -14.393 15.078 -2.983 1.00 2.15 H new ATOM 0 HB2 ARG A 41 -13.242 15.295 -5.780 1.00 3.07 H new ATOM 0 HB3 ARG A 41 -14.782 15.965 -5.278 1.00 3.07 H new ATOM 0 HG2 ARG A 41 -12.085 16.739 -4.101 1.00 3.62 H new ATOM 0 HG3 ARG A 41 -12.939 17.646 -5.334 1.00 3.62 H new ATOM 0 HD2 ARG A 41 -13.403 18.695 -3.215 1.00 4.44 H new ATOM 0 HD3 ARG A 41 -14.876 17.907 -3.746 1.00 4.44 H new ATOM 0 HE ARG A 41 -13.218 16.242 -1.988 1.00 4.95 H new ATOM 0 HH11 ARG A 41 -15.719 18.740 -2.138 1.00 6.46 H new ATOM 0 HH12 ARG A 41 -16.397 18.314 -0.563 1.00 6.46 H new ATOM 0 HH21 ARG A 41 -14.114 15.681 0.010 1.00 6.61 H new ATOM 0 HH22 ARG A 41 -15.490 16.586 0.650 1.00 6.61 H new ATOM 655 N LYS A 42 -14.271 12.266 -4.080 1.00 1.99 N ATOM 656 CA LYS A 42 -15.038 11.085 -4.429 1.00 2.62 C ATOM 657 C LYS A 42 -16.349 11.053 -3.648 1.00 2.59 C ATOM 658 O LYS A 42 -17.311 10.427 -4.084 1.00 3.13 O ATOM 659 CB LYS A 42 -14.218 9.793 -4.221 1.00 3.24 C ATOM 660 CG LYS A 42 -13.563 9.627 -2.848 1.00 3.85 C ATOM 661 CD LYS A 42 -14.562 9.251 -1.762 1.00 4.70 C ATOM 662 CE LYS A 42 -13.864 8.812 -0.484 1.00 5.56 C ATOM 663 NZ LYS A 42 -13.242 7.468 -0.622 1.00 6.46 N ATOM 0 H LYS A 42 -13.381 12.077 -3.619 1.00 1.99 H new ATOM 0 HA LYS A 42 -15.278 11.137 -5.491 1.00 2.62 H new ATOM 0 HB2 LYS A 42 -14.873 8.939 -4.395 1.00 3.24 H new ATOM 0 HB3 LYS A 42 -13.437 9.756 -4.981 1.00 3.24 H new ATOM 0 HG2 LYS A 42 -12.792 8.859 -2.908 1.00 3.85 H new ATOM 0 HG3 LYS A 42 -13.066 10.557 -2.572 1.00 3.85 H new ATOM 0 HD2 LYS A 42 -15.207 10.104 -1.550 1.00 4.70 H new ATOM 0 HD3 LYS A 42 -15.204 8.447 -2.121 1.00 4.70 H new ATOM 0 HE2 LYS A 42 -13.097 9.541 -0.221 1.00 5.56 H new ATOM 0 HE3 LYS A 42 -14.583 8.796 0.335 1.00 5.56 H new ATOM 0 HZ1 LYS A 42 -12.911 7.141 0.308 1.00 6.46 H new ATOM 0 HZ2 LYS A 42 -13.944 6.797 -0.995 1.00 6.46 H new ATOM 0 HZ3 LYS A 42 -12.435 7.524 -1.276 1.00 6.46 H new ATOM 677 N PHE A 43 -16.380 11.754 -2.506 1.00 2.24 N ATOM 678 CA PHE A 43 -17.590 11.855 -1.683 1.00 2.56 C ATOM 679 C PHE A 43 -17.279 12.606 -0.393 1.00 2.44 C ATOM 680 O PHE A 43 -17.388 13.829 -0.331 1.00 3.00 O ATOM 681 CB PHE A 43 -18.171 10.464 -1.362 1.00 3.06 C ATOM 682 CG PHE A 43 -19.502 10.500 -0.660 1.00 3.83 C ATOM 683 CD1 PHE A 43 -20.664 10.779 -1.360 1.00 4.52 C ATOM 684 CD2 PHE A 43 -19.587 10.263 0.703 1.00 4.19 C ATOM 685 CE1 PHE A 43 -21.885 10.818 -0.716 1.00 5.45 C ATOM 686 CE2 PHE A 43 -20.806 10.302 1.352 1.00 5.06 C ATOM 687 CZ PHE A 43 -21.962 10.550 0.632 1.00 5.65 C ATOM 0 H PHE A 43 -15.578 12.260 -2.132 1.00 2.24 H new ATOM 0 HA PHE A 43 -18.340 12.406 -2.250 1.00 2.56 H new ATOM 0 HB2 PHE A 43 -18.277 9.904 -2.291 1.00 3.06 H new ATOM 0 HB3 PHE A 43 -17.460 9.920 -0.741 1.00 3.06 H new ATOM 0 HD1 PHE A 43 -20.615 10.968 -2.422 1.00 4.52 H new ATOM 0 HD2 PHE A 43 -18.690 10.045 1.264 1.00 4.19 H new ATOM 0 HE1 PHE A 43 -22.780 11.059 -1.270 1.00 5.45 H new ATOM 0 HE2 PHE A 43 -20.857 10.139 2.418 1.00 5.06 H new ATOM 0 HZ PHE A 43 -22.922 10.533 1.127 1.00 5.65 H new ATOM 697 N HIS A 44 -16.866 11.870 0.623 1.00 2.18 N ATOM 698 CA HIS A 44 -16.470 12.455 1.892 1.00 2.43 C ATOM 699 C HIS A 44 -15.447 11.547 2.553 1.00 1.88 C ATOM 700 O HIS A 44 -15.782 10.711 3.388 1.00 2.06 O ATOM 701 CB HIS A 44 -17.683 12.658 2.809 1.00 3.27 C ATOM 702 CG HIS A 44 -17.366 13.396 4.075 1.00 4.01 C ATOM 703 ND1 HIS A 44 -17.111 12.764 5.273 1.00 4.55 N ATOM 704 CD2 HIS A 44 -17.269 14.724 4.327 1.00 4.75 C ATOM 705 CE1 HIS A 44 -16.873 13.668 6.204 1.00 5.43 C ATOM 706 NE2 HIS A 44 -16.961 14.863 5.657 1.00 5.56 N ATOM 0 H HIS A 44 -16.796 10.853 0.592 1.00 2.18 H new ATOM 0 HA HIS A 44 -16.029 13.436 1.712 1.00 2.43 H new ATOM 0 HB2 HIS A 44 -18.452 13.205 2.263 1.00 3.27 H new ATOM 0 HB3 HIS A 44 -18.103 11.684 3.062 1.00 3.27 H new ATOM 0 HD2 HIS A 44 -17.408 15.523 3.614 1.00 4.75 H new ATOM 0 HE1 HIS A 44 -16.645 13.463 7.239 1.00 5.43 H new ATOM 0 HE2 HIS A 44 -16.823 15.749 6.143 1.00 5.56 H new ATOM 715 N GLY A 45 -14.204 11.701 2.144 1.00 1.56 N ATOM 716 CA GLY A 45 -13.143 10.872 2.643 1.00 1.46 C ATOM 717 C GLY A 45 -11.822 11.467 2.264 1.00 1.27 C ATOM 718 O GLY A 45 -11.615 11.820 1.107 1.00 1.42 O ATOM 0 H GLY A 45 -13.910 12.400 1.462 1.00 1.56 H new ATOM 0 HA2 GLY A 45 -13.216 10.783 3.727 1.00 1.46 H new ATOM 0 HA3 GLY A 45 -13.231 9.865 2.234 1.00 1.46 H new ATOM 722 N ASN A 46 -10.947 11.620 3.224 1.00 1.06 N ATOM 723 CA ASN A 46 -9.677 12.264 2.978 1.00 0.90 C ATOM 724 C ASN A 46 -8.678 11.284 2.395 1.00 0.81 C ATOM 725 O ASN A 46 -8.587 10.138 2.830 1.00 0.95 O ATOM 726 CB ASN A 46 -9.134 12.868 4.268 1.00 0.91 C ATOM 727 CG ASN A 46 -9.913 14.082 4.738 1.00 1.32 C ATOM 728 OD1 ASN A 46 -10.894 13.959 5.469 1.00 2.05 O ATOM 729 ND2 ASN A 46 -9.471 15.267 4.345 1.00 1.87 N ATOM 0 H ASN A 46 -11.088 11.308 4.185 1.00 1.06 H new ATOM 0 HA ASN A 46 -9.833 13.063 2.253 1.00 0.90 H new ATOM 0 HB2 ASN A 46 -9.150 12.110 5.051 1.00 0.91 H new ATOM 0 HB3 ASN A 46 -8.092 13.150 4.118 1.00 0.91 H new ATOM 0 HD21 ASN A 46 -9.948 16.116 4.649 1.00 1.87 H new ATOM 0 HD22 ASN A 46 -8.654 15.331 3.738 1.00 1.87 H new ATOM 736 N LEU A 47 -7.956 11.740 1.390 1.00 0.70 N ATOM 737 CA LEU A 47 -6.872 10.975 0.813 1.00 0.62 C ATOM 738 C LEU A 47 -5.607 11.277 1.587 1.00 0.54 C ATOM 739 O LEU A 47 -5.373 12.418 1.983 1.00 0.58 O ATOM 740 CB LEU A 47 -6.696 11.326 -0.670 1.00 0.66 C ATOM 741 CG LEU A 47 -5.577 10.586 -1.407 1.00 0.70 C ATOM 742 CD1 LEU A 47 -5.993 10.311 -2.838 1.00 0.77 C ATOM 743 CD2 LEU A 47 -4.285 11.393 -1.390 1.00 0.87 C ATOM 0 H LEU A 47 -8.105 12.649 0.953 1.00 0.70 H new ATOM 0 HA LEU A 47 -7.096 9.910 0.876 1.00 0.62 H new ATOM 0 HB2 LEU A 47 -7.636 11.127 -1.184 1.00 0.66 H new ATOM 0 HB3 LEU A 47 -6.510 12.397 -0.750 1.00 0.66 H new ATOM 0 HG LEU A 47 -5.398 9.641 -0.894 1.00 0.70 H new ATOM 0 HD11 LEU A 47 -5.191 9.784 -3.355 1.00 0.77 H new ATOM 0 HD12 LEU A 47 -6.893 9.697 -2.844 1.00 0.77 H new ATOM 0 HD13 LEU A 47 -6.194 11.254 -3.346 1.00 0.77 H new ATOM 0 HD21 LEU A 47 -3.506 10.845 -1.920 1.00 0.87 H new ATOM 0 HD22 LEU A 47 -4.449 12.353 -1.879 1.00 0.87 H new ATOM 0 HD23 LEU A 47 -3.973 11.559 -0.359 1.00 0.87 H new ATOM 755 N TYR A 48 -4.798 10.271 1.816 1.00 0.48 N ATOM 756 CA TYR A 48 -3.597 10.455 2.595 1.00 0.45 C ATOM 757 C TYR A 48 -2.373 10.067 1.782 1.00 0.46 C ATOM 758 O TYR A 48 -2.243 8.925 1.337 1.00 0.54 O ATOM 759 CB TYR A 48 -3.670 9.636 3.884 1.00 0.48 C ATOM 760 CG TYR A 48 -4.714 10.116 4.871 1.00 0.53 C ATOM 761 CD1 TYR A 48 -6.054 9.798 4.698 1.00 0.63 C ATOM 762 CD2 TYR A 48 -4.361 10.890 5.970 1.00 0.64 C ATOM 763 CE1 TYR A 48 -7.013 10.237 5.592 1.00 0.76 C ATOM 764 CE2 TYR A 48 -5.316 11.330 6.867 1.00 0.78 C ATOM 765 CZ TYR A 48 -6.625 10.993 6.692 1.00 0.82 C ATOM 766 OH TYR A 48 -7.591 11.438 7.566 1.00 0.99 O ATOM 0 H TYR A 48 -4.948 9.321 1.476 1.00 0.48 H new ATOM 0 HA TYR A 48 -3.512 11.509 2.861 1.00 0.45 H new ATOM 0 HB2 TYR A 48 -3.879 8.597 3.629 1.00 0.48 H new ATOM 0 HB3 TYR A 48 -2.694 9.655 4.368 1.00 0.48 H new ATOM 0 HD1 TYR A 48 -6.352 9.198 3.851 1.00 0.63 H new ATOM 0 HD2 TYR A 48 -3.325 11.152 6.125 1.00 0.64 H new ATOM 0 HE1 TYR A 48 -8.054 9.995 5.437 1.00 0.76 H new ATOM 0 HE2 TYR A 48 -5.025 11.942 7.708 1.00 0.78 H new ATOM 0 HH TYR A 48 -7.169 11.952 8.286 1.00 0.99 H new ATOM 776 N ARG A 49 -1.498 11.035 1.563 1.00 0.45 N ATOM 777 CA ARG A 49 -0.246 10.790 0.866 1.00 0.48 C ATOM 778 C ARG A 49 0.861 10.595 1.886 1.00 0.40 C ATOM 779 O ARG A 49 1.243 11.527 2.585 1.00 0.48 O ATOM 780 CB ARG A 49 0.099 11.947 -0.072 1.00 0.59 C ATOM 781 CG ARG A 49 1.409 11.753 -0.825 1.00 0.71 C ATOM 782 CD ARG A 49 1.801 13.007 -1.581 1.00 1.32 C ATOM 783 NE ARG A 49 3.072 12.853 -2.284 1.00 1.69 N ATOM 784 CZ ARG A 49 4.147 13.607 -2.057 1.00 2.18 C ATOM 785 NH1 ARG A 49 4.135 14.517 -1.090 1.00 2.54 N ATOM 786 NH2 ARG A 49 5.239 13.445 -2.788 1.00 2.92 N ATOM 0 H ARG A 49 -1.633 12.002 1.859 1.00 0.45 H new ATOM 0 HA ARG A 49 -0.352 9.891 0.259 1.00 0.48 H new ATOM 0 HB2 ARG A 49 -0.709 12.073 -0.793 1.00 0.59 H new ATOM 0 HB3 ARG A 49 0.156 12.869 0.507 1.00 0.59 H new ATOM 0 HG2 ARG A 49 2.199 11.488 -0.122 1.00 0.71 H new ATOM 0 HG3 ARG A 49 1.310 10.921 -1.523 1.00 0.71 H new ATOM 0 HD2 ARG A 49 1.019 13.256 -2.298 1.00 1.32 H new ATOM 0 HD3 ARG A 49 1.872 13.842 -0.884 1.00 1.32 H new ATOM 0 HE ARG A 49 3.141 12.123 -2.993 1.00 1.69 H new ATOM 0 HH11 ARG A 49 3.300 14.641 -0.517 1.00 2.54 H new ATOM 0 HH12 ARG A 49 4.960 15.092 -0.920 1.00 2.54 H new ATOM 0 HH21 ARG A 49 5.259 12.742 -3.527 1.00 2.92 H new ATOM 0 HH22 ARG A 49 6.061 14.023 -2.612 1.00 2.92 H new ATOM 800 N VAL A 50 1.369 9.387 1.957 1.00 0.37 N ATOM 801 CA VAL A 50 2.320 9.007 2.978 1.00 0.42 C ATOM 802 C VAL A 50 3.711 8.863 2.367 1.00 0.46 C ATOM 803 O VAL A 50 3.932 8.054 1.476 1.00 0.62 O ATOM 804 CB VAL A 50 1.851 7.710 3.677 1.00 0.63 C ATOM 805 CG1 VAL A 50 1.248 6.748 2.673 1.00 1.29 C ATOM 806 CG2 VAL A 50 2.976 7.036 4.419 1.00 1.33 C ATOM 0 H VAL A 50 1.134 8.637 1.307 1.00 0.37 H new ATOM 0 HA VAL A 50 2.377 9.786 3.738 1.00 0.42 H new ATOM 0 HB VAL A 50 1.090 7.994 4.403 1.00 0.63 H new ATOM 0 HG11 VAL A 50 0.925 5.842 3.186 1.00 1.29 H new ATOM 0 HG12 VAL A 50 0.391 7.217 2.189 1.00 1.29 H new ATOM 0 HG13 VAL A 50 1.994 6.492 1.921 1.00 1.29 H new ATOM 0 HG21 VAL A 50 2.605 6.129 4.896 1.00 1.33 H new ATOM 0 HG22 VAL A 50 3.771 6.779 3.719 1.00 1.33 H new ATOM 0 HG23 VAL A 50 3.367 7.712 5.179 1.00 1.33 H new ATOM 816 N GLU A 51 4.644 9.661 2.855 1.00 0.37 N ATOM 817 CA GLU A 51 5.925 9.841 2.191 1.00 0.37 C ATOM 818 C GLU A 51 7.078 9.768 3.184 1.00 0.38 C ATOM 819 O GLU A 51 7.183 10.594 4.082 1.00 0.56 O ATOM 820 CB GLU A 51 5.933 11.192 1.469 1.00 0.40 C ATOM 821 CG GLU A 51 7.296 11.592 0.938 1.00 0.47 C ATOM 822 CD GLU A 51 7.284 12.901 0.172 1.00 0.52 C ATOM 823 OE1 GLU A 51 6.807 13.915 0.720 1.00 1.02 O ATOM 824 OE2 GLU A 51 7.766 12.923 -0.983 1.00 1.07 O ATOM 0 H GLU A 51 4.538 10.199 3.715 1.00 0.37 H new ATOM 0 HA GLU A 51 6.060 9.036 1.469 1.00 0.37 H new ATOM 0 HB2 GLU A 51 5.227 11.155 0.640 1.00 0.40 H new ATOM 0 HB3 GLU A 51 5.580 11.962 2.154 1.00 0.40 H new ATOM 0 HG2 GLU A 51 7.993 11.674 1.772 1.00 0.47 H new ATOM 0 HG3 GLU A 51 7.670 10.802 0.287 1.00 0.47 H new ATOM 831 N GLY A 52 7.939 8.784 3.012 1.00 0.27 N ATOM 832 CA GLY A 52 9.085 8.636 3.880 1.00 0.29 C ATOM 833 C GLY A 52 10.283 8.099 3.134 1.00 0.25 C ATOM 834 O GLY A 52 10.134 7.296 2.221 1.00 0.29 O ATOM 0 H GLY A 52 7.865 8.078 2.280 1.00 0.27 H new ATOM 0 HA2 GLY A 52 9.334 9.601 4.322 1.00 0.29 H new ATOM 0 HA3 GLY A 52 8.836 7.964 4.701 1.00 0.29 H new ATOM 838 N ILE A 53 11.470 8.546 3.496 1.00 0.24 N ATOM 839 CA ILE A 53 12.674 8.065 2.842 1.00 0.23 C ATOM 840 C ILE A 53 13.177 6.786 3.490 1.00 0.23 C ATOM 841 O ILE A 53 13.283 6.691 4.717 1.00 0.30 O ATOM 842 CB ILE A 53 13.790 9.124 2.857 1.00 0.29 C ATOM 843 CG1 ILE A 53 13.324 10.368 2.100 1.00 0.37 C ATOM 844 CG2 ILE A 53 15.070 8.560 2.247 1.00 0.27 C ATOM 845 CD1 ILE A 53 14.317 11.503 2.129 1.00 0.58 C ATOM 0 H ILE A 53 11.627 9.235 4.232 1.00 0.24 H new ATOM 0 HA ILE A 53 12.408 7.857 1.806 1.00 0.23 H new ATOM 0 HB ILE A 53 14.008 9.402 3.888 1.00 0.29 H new ATOM 0 HG12 ILE A 53 13.125 10.098 1.063 1.00 0.37 H new ATOM 0 HG13 ILE A 53 12.381 10.711 2.527 1.00 0.37 H new ATOM 0 HG21 ILE A 53 15.849 9.323 2.266 1.00 0.27 H new ATOM 0 HG22 ILE A 53 15.396 7.694 2.823 1.00 0.27 H new ATOM 0 HG23 ILE A 53 14.880 8.260 1.216 1.00 0.27 H new ATOM 0 HD11 ILE A 53 13.917 12.350 1.572 1.00 0.58 H new ATOM 0 HD12 ILE A 53 14.499 11.801 3.162 1.00 0.58 H new ATOM 0 HD13 ILE A 53 15.253 11.179 1.675 1.00 0.58 H new ATOM 857 N ILE A 54 13.468 5.803 2.657 1.00 0.24 N ATOM 858 CA ILE A 54 14.032 4.554 3.114 1.00 0.26 C ATOM 859 C ILE A 54 15.479 4.457 2.637 1.00 0.29 C ATOM 860 O ILE A 54 15.741 4.343 1.447 1.00 0.31 O ATOM 861 CB ILE A 54 13.186 3.351 2.642 1.00 0.26 C ATOM 862 CG1 ILE A 54 11.739 3.578 3.077 1.00 0.32 C ATOM 863 CG2 ILE A 54 13.730 2.053 3.224 1.00 0.32 C ATOM 864 CD1 ILE A 54 10.786 2.508 2.625 1.00 0.35 C ATOM 0 H ILE A 54 13.319 5.851 1.649 1.00 0.24 H new ATOM 0 HA ILE A 54 14.021 4.528 4.204 1.00 0.26 H new ATOM 0 HB ILE A 54 13.233 3.267 1.556 1.00 0.26 H new ATOM 0 HG12 ILE A 54 11.704 3.644 4.164 1.00 0.32 H new ATOM 0 HG13 ILE A 54 11.401 4.538 2.688 1.00 0.32 H new ATOM 0 HG21 ILE A 54 13.121 1.217 2.880 1.00 0.32 H new ATOM 0 HG22 ILE A 54 14.760 1.911 2.896 1.00 0.32 H new ATOM 0 HG23 ILE A 54 13.699 2.101 4.312 1.00 0.32 H new ATOM 0 HD11 ILE A 54 9.781 2.744 2.975 1.00 0.35 H new ATOM 0 HD12 ILE A 54 10.788 2.455 1.536 1.00 0.35 H new ATOM 0 HD13 ILE A 54 11.096 1.547 3.036 1.00 0.35 H new ATOM 876 N PRO A 55 16.428 4.593 3.579 1.00 0.36 N ATOM 877 CA PRO A 55 17.875 4.662 3.301 1.00 0.44 C ATOM 878 C PRO A 55 18.479 3.414 2.647 1.00 0.47 C ATOM 879 O PRO A 55 19.440 2.837 3.164 1.00 0.62 O ATOM 880 CB PRO A 55 18.502 4.877 4.684 1.00 0.54 C ATOM 881 CG PRO A 55 17.396 5.385 5.538 1.00 0.53 C ATOM 882 CD PRO A 55 16.143 4.760 5.004 1.00 0.42 C ATOM 0 HA PRO A 55 18.070 5.451 2.575 1.00 0.44 H new ATOM 0 HB2 PRO A 55 18.910 3.947 5.080 1.00 0.54 H new ATOM 0 HB3 PRO A 55 19.324 5.592 4.637 1.00 0.54 H new ATOM 0 HG2 PRO A 55 17.553 5.114 6.582 1.00 0.53 H new ATOM 0 HG3 PRO A 55 17.338 6.473 5.496 1.00 0.53 H new ATOM 0 HD2 PRO A 55 15.933 3.805 5.486 1.00 0.42 H new ATOM 0 HD3 PRO A 55 15.274 5.398 5.168 1.00 0.42 H new ATOM 890 N GLU A 56 17.932 3.015 1.509 1.00 0.43 N ATOM 891 CA GLU A 56 18.561 2.020 0.660 1.00 0.49 C ATOM 892 C GLU A 56 17.931 2.046 -0.718 1.00 0.46 C ATOM 893 O GLU A 56 17.270 3.019 -1.067 1.00 0.60 O ATOM 894 CB GLU A 56 18.539 0.621 1.285 1.00 0.66 C ATOM 895 CG GLU A 56 17.270 0.267 2.030 1.00 0.77 C ATOM 896 CD GLU A 56 17.583 -0.566 3.263 1.00 1.18 C ATOM 897 OE1 GLU A 56 17.978 -1.747 3.110 1.00 1.68 O ATOM 898 OE2 GLU A 56 17.407 -0.061 4.394 1.00 1.38 O ATOM 0 H GLU A 56 17.045 3.370 1.151 1.00 0.43 H new ATOM 0 HA GLU A 56 19.615 2.277 0.558 1.00 0.49 H new ATOM 0 HB2 GLU A 56 18.695 -0.114 0.496 1.00 0.66 H new ATOM 0 HB3 GLU A 56 19.381 0.534 1.972 1.00 0.66 H new ATOM 0 HG2 GLU A 56 16.749 1.178 2.324 1.00 0.77 H new ATOM 0 HG3 GLU A 56 16.599 -0.286 1.373 1.00 0.77 H new ATOM 905 N SER A 57 18.129 1.004 -1.500 1.00 0.45 N ATOM 906 CA SER A 57 17.774 1.050 -2.885 1.00 0.45 C ATOM 907 C SER A 57 16.281 0.888 -3.098 1.00 0.43 C ATOM 908 O SER A 57 15.617 0.061 -2.465 1.00 0.43 O ATOM 909 CB SER A 57 18.546 -0.022 -3.661 1.00 0.53 C ATOM 910 OG SER A 57 18.271 -1.319 -3.155 1.00 1.18 O ATOM 0 H SER A 57 18.534 0.120 -1.191 1.00 0.45 H new ATOM 0 HA SER A 57 18.047 2.035 -3.262 1.00 0.45 H new ATOM 0 HB2 SER A 57 18.277 0.024 -4.716 1.00 0.53 H new ATOM 0 HB3 SER A 57 19.616 0.178 -3.596 1.00 0.53 H new ATOM 0 HG SER A 57 18.775 -1.984 -3.669 1.00 1.18 H new ATOM 916 N PRO A 58 15.750 1.700 -4.018 1.00 0.44 N ATOM 917 CA PRO A 58 14.373 1.597 -4.483 1.00 0.43 C ATOM 918 C PRO A 58 14.154 0.254 -5.156 1.00 0.46 C ATOM 919 O PRO A 58 13.026 -0.174 -5.400 1.00 0.46 O ATOM 920 CB PRO A 58 14.226 2.748 -5.492 1.00 0.44 C ATOM 921 CG PRO A 58 15.404 3.640 -5.263 1.00 0.49 C ATOM 922 CD PRO A 58 16.481 2.789 -4.665 1.00 0.52 C ATOM 0 HA PRO A 58 13.644 1.665 -3.676 1.00 0.43 H new ATOM 0 HB2 PRO A 58 14.212 2.372 -6.515 1.00 0.44 H new ATOM 0 HB3 PRO A 58 13.291 3.287 -5.338 1.00 0.44 H new ATOM 0 HG2 PRO A 58 15.739 4.086 -6.199 1.00 0.49 H new ATOM 0 HG3 PRO A 58 15.144 4.460 -4.594 1.00 0.49 H new ATOM 0 HD2 PRO A 58 17.164 2.414 -5.428 1.00 0.52 H new ATOM 0 HD3 PRO A 58 17.081 3.349 -3.948 1.00 0.52 H new ATOM 930 N ALA A 59 15.270 -0.401 -5.436 1.00 0.50 N ATOM 931 CA ALA A 59 15.282 -1.727 -5.999 1.00 0.54 C ATOM 932 C ALA A 59 14.794 -2.744 -4.996 1.00 0.50 C ATOM 933 O ALA A 59 13.873 -3.507 -5.277 1.00 0.51 O ATOM 934 CB ALA A 59 16.683 -2.079 -6.439 1.00 0.64 C ATOM 0 H ALA A 59 16.200 -0.015 -5.274 1.00 0.50 H new ATOM 0 HA ALA A 59 14.611 -1.742 -6.858 1.00 0.54 H new ATOM 0 HB1 ALA A 59 16.689 -3.083 -6.864 1.00 0.64 H new ATOM 0 HB2 ALA A 59 17.019 -1.364 -7.190 1.00 0.64 H new ATOM 0 HB3 ALA A 59 17.353 -2.045 -5.580 1.00 0.64 H new ATOM 940 N LYS A 60 15.403 -2.748 -3.819 1.00 0.49 N ATOM 941 CA LYS A 60 15.002 -3.680 -2.790 1.00 0.49 C ATOM 942 C LYS A 60 13.621 -3.292 -2.312 1.00 0.42 C ATOM 943 O LYS A 60 12.852 -4.128 -1.850 1.00 0.43 O ATOM 944 CB LYS A 60 16.005 -3.687 -1.639 1.00 0.58 C ATOM 945 CG LYS A 60 15.803 -4.835 -0.659 1.00 0.65 C ATOM 946 CD LYS A 60 17.038 -5.048 0.189 1.00 1.35 C ATOM 947 CE LYS A 60 17.387 -3.806 0.983 1.00 2.45 C ATOM 948 NZ LYS A 60 18.851 -3.658 1.187 1.00 3.30 N ATOM 0 H LYS A 60 16.166 -2.123 -3.560 1.00 0.49 H new ATOM 0 HA LYS A 60 14.978 -4.692 -3.194 1.00 0.49 H new ATOM 0 HB2 LYS A 60 17.014 -3.743 -2.048 1.00 0.58 H new ATOM 0 HB3 LYS A 60 15.932 -2.743 -1.099 1.00 0.58 H new ATOM 0 HG2 LYS A 60 14.948 -4.623 -0.016 1.00 0.65 H new ATOM 0 HG3 LYS A 60 15.571 -5.749 -1.206 1.00 0.65 H new ATOM 0 HD2 LYS A 60 16.873 -5.882 0.871 1.00 1.35 H new ATOM 0 HD3 LYS A 60 17.878 -5.320 -0.451 1.00 1.35 H new ATOM 0 HE2 LYS A 60 17.004 -2.927 0.464 1.00 2.45 H new ATOM 0 HE3 LYS A 60 16.890 -3.846 1.952 1.00 2.45 H new ATOM 0 HZ1 LYS A 60 19.028 -3.133 2.067 1.00 3.30 H new ATOM 0 HZ2 LYS A 60 19.289 -4.599 1.251 1.00 3.30 H new ATOM 0 HZ3 LYS A 60 19.262 -3.138 0.385 1.00 3.30 H new ATOM 962 N LEU A 61 13.322 -2.003 -2.435 1.00 0.37 N ATOM 963 CA LEU A 61 11.972 -1.511 -2.210 1.00 0.35 C ATOM 964 C LEU A 61 10.986 -2.225 -3.128 1.00 0.38 C ATOM 965 O LEU A 61 10.090 -2.929 -2.670 1.00 0.41 O ATOM 966 CB LEU A 61 11.894 0.000 -2.426 1.00 0.34 C ATOM 967 CG LEU A 61 12.568 0.853 -1.343 1.00 0.31 C ATOM 968 CD1 LEU A 61 12.286 2.326 -1.576 1.00 0.34 C ATOM 969 CD2 LEU A 61 12.062 0.444 0.022 1.00 0.30 C ATOM 0 H LEU A 61 13.998 -1.282 -2.689 1.00 0.37 H new ATOM 0 HA LEU A 61 11.706 -1.721 -1.174 1.00 0.35 H new ATOM 0 HB2 LEU A 61 12.349 0.237 -3.388 1.00 0.34 H new ATOM 0 HB3 LEU A 61 10.845 0.287 -2.491 1.00 0.34 H new ATOM 0 HG LEU A 61 13.645 0.691 -1.392 1.00 0.31 H new ATOM 0 HD11 LEU A 61 12.771 2.917 -0.799 1.00 0.34 H new ATOM 0 HD12 LEU A 61 12.673 2.621 -2.551 1.00 0.34 H new ATOM 0 HD13 LEU A 61 11.210 2.500 -1.545 1.00 0.34 H new ATOM 0 HD21 LEU A 61 12.544 1.053 0.786 1.00 0.30 H new ATOM 0 HD22 LEU A 61 10.983 0.590 0.069 1.00 0.30 H new ATOM 0 HD23 LEU A 61 12.294 -0.607 0.196 1.00 0.30 H new ATOM 981 N SER A 62 11.175 -2.098 -4.427 1.00 0.41 N ATOM 982 CA SER A 62 10.289 -2.761 -5.367 1.00 0.46 C ATOM 983 C SER A 62 10.365 -4.277 -5.208 1.00 0.46 C ATOM 984 O SER A 62 9.498 -4.999 -5.687 1.00 0.50 O ATOM 985 CB SER A 62 10.635 -2.355 -6.801 1.00 0.53 C ATOM 986 OG SER A 62 12.009 -2.576 -7.088 1.00 1.29 O ATOM 0 H SER A 62 11.923 -1.550 -4.852 1.00 0.41 H new ATOM 0 HA SER A 62 9.267 -2.448 -5.153 1.00 0.46 H new ATOM 0 HB2 SER A 62 10.020 -2.923 -7.499 1.00 0.53 H new ATOM 0 HB3 SER A 62 10.396 -1.302 -6.950 1.00 0.53 H new ATOM 0 HG SER A 62 12.438 -3.009 -6.321 1.00 1.29 H new ATOM 992 N ASP A 63 11.405 -4.750 -4.527 1.00 0.44 N ATOM 993 CA ASP A 63 11.619 -6.187 -4.382 1.00 0.48 C ATOM 994 C ASP A 63 10.982 -6.765 -3.107 1.00 0.49 C ATOM 995 O ASP A 63 10.642 -7.949 -3.070 1.00 0.60 O ATOM 996 CB ASP A 63 13.113 -6.505 -4.419 1.00 0.53 C ATOM 997 CG ASP A 63 13.391 -7.984 -4.612 1.00 0.87 C ATOM 998 OD1 ASP A 63 12.918 -8.559 -5.614 1.00 1.10 O ATOM 999 OD2 ASP A 63 14.098 -8.577 -3.773 1.00 1.32 O ATOM 0 H ASP A 63 12.106 -4.166 -4.071 1.00 0.44 H new ATOM 0 HA ASP A 63 11.121 -6.665 -5.225 1.00 0.48 H new ATOM 0 HB2 ASP A 63 13.580 -5.943 -5.228 1.00 0.53 H new ATOM 0 HB3 ASP A 63 13.575 -6.171 -3.490 1.00 0.53 H new ATOM 1004 N PHE A 64 10.815 -5.952 -2.058 1.00 0.44 N ATOM 1005 CA PHE A 64 10.319 -6.477 -0.779 1.00 0.48 C ATOM 1006 C PHE A 64 8.790 -6.431 -0.727 1.00 0.51 C ATOM 1007 O PHE A 64 8.154 -7.376 -0.262 1.00 0.61 O ATOM 1008 CB PHE A 64 10.926 -5.726 0.433 1.00 0.51 C ATOM 1009 CG PHE A 64 10.238 -4.436 0.761 1.00 0.46 C ATOM 1010 CD1 PHE A 64 10.371 -3.347 -0.055 1.00 0.50 C ATOM 1011 CD2 PHE A 64 9.425 -4.334 1.865 1.00 0.59 C ATOM 1012 CE1 PHE A 64 9.697 -2.175 0.205 1.00 0.50 C ATOM 1013 CE2 PHE A 64 8.753 -3.165 2.143 1.00 0.59 C ATOM 1014 CZ PHE A 64 8.887 -2.085 1.303 1.00 0.47 C ATOM 0 H PHE A 64 11.010 -4.951 -2.065 1.00 0.44 H new ATOM 0 HA PHE A 64 10.640 -7.517 -0.714 1.00 0.48 H new ATOM 0 HB2 PHE A 64 10.889 -6.377 1.306 1.00 0.51 H new ATOM 0 HB3 PHE A 64 11.978 -5.523 0.231 1.00 0.51 H new ATOM 0 HD1 PHE A 64 11.016 -3.407 -0.919 1.00 0.50 H new ATOM 0 HD2 PHE A 64 9.312 -5.183 2.523 1.00 0.59 H new ATOM 0 HE1 PHE A 64 9.808 -1.329 -0.457 1.00 0.50 H new ATOM 0 HE2 PHE A 64 8.123 -3.097 3.018 1.00 0.59 H new ATOM 0 HZ PHE A 64 8.354 -1.169 1.510 1.00 0.47 H new ATOM 1024 N LEU A 65 8.192 -5.343 -1.213 1.00 0.49 N ATOM 1025 CA LEU A 65 6.736 -5.215 -1.186 1.00 0.58 C ATOM 1026 C LEU A 65 6.144 -5.721 -2.494 1.00 0.64 C ATOM 1027 O LEU A 65 4.939 -5.640 -2.706 1.00 0.81 O ATOM 1028 CB LEU A 65 6.324 -3.747 -0.880 1.00 0.66 C ATOM 1029 CG LEU A 65 6.197 -2.725 -2.046 1.00 0.78 C ATOM 1030 CD1 LEU A 65 7.267 -2.900 -3.108 1.00 1.25 C ATOM 1031 CD2 LEU A 65 4.809 -2.755 -2.671 1.00 1.50 C ATOM 0 H LEU A 65 8.684 -4.550 -1.624 1.00 0.49 H new ATOM 0 HA LEU A 65 6.333 -5.833 -0.383 1.00 0.58 H new ATOM 0 HB2 LEU A 65 5.362 -3.778 -0.368 1.00 0.66 H new ATOM 0 HB3 LEU A 65 7.049 -3.346 -0.172 1.00 0.66 H new ATOM 0 HG LEU A 65 6.352 -1.743 -1.599 1.00 0.78 H new ATOM 0 HD11 LEU A 65 7.124 -2.158 -3.894 1.00 1.25 H new ATOM 0 HD12 LEU A 65 8.251 -2.768 -2.658 1.00 1.25 H new ATOM 0 HD13 LEU A 65 7.195 -3.900 -3.536 1.00 1.25 H new ATOM 0 HD21 LEU A 65 4.759 -2.028 -3.481 1.00 1.50 H new ATOM 0 HD22 LEU A 65 4.609 -3.751 -3.065 1.00 1.50 H new ATOM 0 HD23 LEU A 65 4.064 -2.507 -1.915 1.00 1.50 H new ATOM 1043 N TYR A 66 7.006 -6.317 -3.313 1.00 0.58 N ATOM 1044 CA TYR A 66 6.693 -6.645 -4.701 1.00 0.64 C ATOM 1045 C TYR A 66 5.304 -7.272 -4.855 1.00 0.72 C ATOM 1046 O TYR A 66 4.382 -6.632 -5.356 1.00 0.89 O ATOM 1047 CB TYR A 66 7.753 -7.597 -5.267 1.00 0.73 C ATOM 1048 CG TYR A 66 7.953 -7.486 -6.765 1.00 0.88 C ATOM 1049 CD1 TYR A 66 6.912 -7.081 -7.590 1.00 0.82 C ATOM 1050 CD2 TYR A 66 9.170 -7.797 -7.358 1.00 1.27 C ATOM 1051 CE1 TYR A 66 7.079 -6.986 -8.957 1.00 1.01 C ATOM 1052 CE2 TYR A 66 9.345 -7.703 -8.725 1.00 1.47 C ATOM 1053 CZ TYR A 66 8.343 -7.265 -9.511 1.00 1.29 C ATOM 1054 OH TYR A 66 8.465 -7.204 -10.881 1.00 1.52 O ATOM 0 H TYR A 66 7.948 -6.588 -3.030 1.00 0.58 H new ATOM 0 HA TYR A 66 6.694 -5.709 -5.260 1.00 0.64 H new ATOM 0 HB2 TYR A 66 8.703 -7.402 -4.770 1.00 0.73 H new ATOM 0 HB3 TYR A 66 7.471 -8.622 -5.025 1.00 0.73 H new ATOM 0 HD1 TYR A 66 5.955 -6.836 -7.154 1.00 0.82 H new ATOM 0 HD2 TYR A 66 9.995 -8.118 -6.739 1.00 1.27 H new ATOM 0 HE1 TYR A 66 6.253 -6.702 -9.592 1.00 1.01 H new ATOM 0 HE2 TYR A 66 10.291 -7.982 -9.166 1.00 1.47 H new ATOM 0 HH TYR A 66 9.387 -7.416 -11.137 1.00 1.52 H new ATOM 1064 N GLN A 67 5.138 -8.509 -4.409 1.00 0.89 N ATOM 1065 CA GLN A 67 3.876 -9.200 -4.621 1.00 1.13 C ATOM 1066 C GLN A 67 3.445 -10.012 -3.408 1.00 1.10 C ATOM 1067 O GLN A 67 2.550 -9.613 -2.677 1.00 1.76 O ATOM 1068 CB GLN A 67 3.962 -10.108 -5.851 1.00 1.54 C ATOM 1069 CG GLN A 67 4.112 -9.349 -7.162 1.00 2.13 C ATOM 1070 CD GLN A 67 4.306 -10.267 -8.356 1.00 2.94 C ATOM 1071 OE1 GLN A 67 3.889 -9.959 -9.471 1.00 3.50 O ATOM 1072 NE2 GLN A 67 4.973 -11.390 -8.139 1.00 3.60 N ATOM 0 H GLN A 67 5.846 -9.045 -3.908 1.00 0.89 H new ATOM 0 HA GLN A 67 3.120 -8.432 -4.786 1.00 1.13 H new ATOM 0 HB2 GLN A 67 4.809 -10.784 -5.734 1.00 1.54 H new ATOM 0 HB3 GLN A 67 3.065 -10.725 -5.899 1.00 1.54 H new ATOM 0 HG2 GLN A 67 3.227 -8.733 -7.323 1.00 2.13 H new ATOM 0 HG3 GLN A 67 4.963 -8.671 -7.089 1.00 2.13 H new ATOM 0 HE21 GLN A 67 5.304 -11.613 -7.200 1.00 3.60 H new ATOM 0 HE22 GLN A 67 5.156 -12.032 -8.910 1.00 3.60 H new ATOM 1081 N THR A 68 4.095 -11.137 -3.180 1.00 0.83 N ATOM 1082 CA THR A 68 3.606 -12.101 -2.207 1.00 0.93 C ATOM 1083 C THR A 68 4.742 -12.985 -1.707 1.00 1.09 C ATOM 1084 O THR A 68 4.550 -14.150 -1.354 1.00 1.39 O ATOM 1085 CB THR A 68 2.490 -12.968 -2.836 1.00 1.18 C ATOM 1086 OG1 THR A 68 1.937 -13.874 -1.872 1.00 1.48 O ATOM 1087 CG2 THR A 68 3.015 -13.743 -4.037 1.00 1.29 C ATOM 0 H THR A 68 4.958 -11.407 -3.651 1.00 0.83 H new ATOM 0 HA THR A 68 3.196 -11.557 -1.356 1.00 0.93 H new ATOM 0 HB THR A 68 1.701 -12.295 -3.172 1.00 1.18 H new ATOM 0 HG1 THR A 68 2.660 -14.379 -1.446 1.00 1.48 H new ATOM 0 HG21 THR A 68 2.211 -14.345 -4.461 1.00 1.29 H new ATOM 0 HG22 THR A 68 3.381 -13.044 -4.789 1.00 1.29 H new ATOM 0 HG23 THR A 68 3.829 -14.396 -3.721 1.00 1.29 H new ATOM 1095 N GLY A 69 5.930 -12.426 -1.671 1.00 1.06 N ATOM 1096 CA GLY A 69 7.085 -13.215 -1.351 1.00 1.39 C ATOM 1097 C GLY A 69 7.372 -13.245 0.111 1.00 1.17 C ATOM 1098 O GLY A 69 7.592 -14.301 0.708 1.00 1.46 O ATOM 0 H GLY A 69 6.115 -11.440 -1.858 1.00 1.06 H new ATOM 0 HA2 GLY A 69 6.935 -14.234 -1.709 1.00 1.39 H new ATOM 0 HA3 GLY A 69 7.951 -12.816 -1.879 1.00 1.39 H new ATOM 1102 N ASP A 70 7.336 -12.079 0.684 1.00 0.84 N ATOM 1103 CA ASP A 70 7.757 -11.889 2.049 1.00 0.83 C ATOM 1104 C ASP A 70 7.035 -10.708 2.677 1.00 0.65 C ATOM 1105 O ASP A 70 6.957 -10.614 3.896 1.00 0.61 O ATOM 1106 CB ASP A 70 9.281 -11.707 2.101 1.00 1.12 C ATOM 1107 CG ASP A 70 9.789 -10.464 1.381 1.00 1.45 C ATOM 1108 OD1 ASP A 70 9.296 -10.176 0.265 1.00 2.19 O ATOM 1109 OD2 ASP A 70 10.664 -9.765 1.926 1.00 1.68 O ATOM 0 H ASP A 70 7.014 -11.229 0.222 1.00 0.84 H new ATOM 0 HA ASP A 70 7.496 -12.774 2.629 1.00 0.83 H new ATOM 0 HB2 ASP A 70 9.594 -11.662 3.144 1.00 1.12 H new ATOM 0 HB3 ASP A 70 9.755 -12.585 1.663 1.00 1.12 H new ATOM 1114 N ARG A 71 6.465 -9.844 1.837 1.00 0.60 N ATOM 1115 CA ARG A 71 5.738 -8.666 2.291 1.00 0.51 C ATOM 1116 C ARG A 71 4.743 -9.038 3.371 1.00 0.43 C ATOM 1117 O ARG A 71 4.592 -8.331 4.351 1.00 0.49 O ATOM 1118 CB ARG A 71 4.991 -7.993 1.130 1.00 0.59 C ATOM 1119 CG ARG A 71 4.026 -8.912 0.424 1.00 0.83 C ATOM 1120 CD ARG A 71 2.767 -8.185 0.011 1.00 0.87 C ATOM 1121 NE ARG A 71 2.998 -7.133 -0.978 1.00 1.77 N ATOM 1122 CZ ARG A 71 2.040 -6.319 -1.428 1.00 2.46 C ATOM 1123 NH1 ARG A 71 0.821 -6.360 -0.895 1.00 2.69 N ATOM 1124 NH2 ARG A 71 2.304 -5.456 -2.400 1.00 3.38 N ATOM 0 H ARG A 71 6.496 -9.944 0.822 1.00 0.60 H new ATOM 0 HA ARG A 71 6.470 -7.966 2.694 1.00 0.51 H new ATOM 0 HB2 ARG A 71 4.446 -7.129 1.511 1.00 0.59 H new ATOM 0 HB3 ARG A 71 5.718 -7.619 0.409 1.00 0.59 H new ATOM 0 HG2 ARG A 71 4.506 -9.338 -0.457 1.00 0.83 H new ATOM 0 HG3 ARG A 71 3.768 -9.743 1.080 1.00 0.83 H new ATOM 0 HD2 ARG A 71 2.058 -8.906 -0.396 1.00 0.87 H new ATOM 0 HD3 ARG A 71 2.304 -7.746 0.895 1.00 0.87 H new ATOM 0 HE ARG A 71 3.943 -7.015 -1.344 1.00 1.77 H new ATOM 0 HH11 ARG A 71 0.616 -7.015 -0.140 1.00 2.69 H new ATOM 0 HH12 ARG A 71 0.092 -5.737 -1.241 1.00 2.69 H new ATOM 0 HH21 ARG A 71 3.239 -5.414 -2.804 1.00 3.38 H new ATOM 0 HH22 ARG A 71 1.572 -4.835 -2.743 1.00 3.38 H new ATOM 1138 N ILE A 72 4.096 -10.181 3.203 1.00 0.44 N ATOM 1139 CA ILE A 72 3.052 -10.584 4.133 1.00 0.44 C ATOM 1140 C ILE A 72 3.624 -11.366 5.293 1.00 0.54 C ATOM 1141 O ILE A 72 2.921 -11.657 6.258 1.00 0.64 O ATOM 1142 CB ILE A 72 1.942 -11.441 3.476 1.00 0.45 C ATOM 1143 CG1 ILE A 72 2.471 -12.791 2.972 1.00 0.62 C ATOM 1144 CG2 ILE A 72 1.291 -10.687 2.345 1.00 0.47 C ATOM 1145 CD1 ILE A 72 3.108 -12.763 1.594 1.00 0.71 C ATOM 0 H ILE A 72 4.271 -10.838 2.443 1.00 0.44 H new ATOM 0 HA ILE A 72 2.607 -9.652 4.480 1.00 0.44 H new ATOM 0 HB ILE A 72 1.200 -11.646 4.248 1.00 0.45 H new ATOM 0 HG12 ILE A 72 3.205 -13.165 3.686 1.00 0.62 H new ATOM 0 HG13 ILE A 72 1.647 -13.504 2.959 1.00 0.62 H new ATOM 0 HG21 ILE A 72 0.514 -11.305 1.896 1.00 0.47 H new ATOM 0 HG22 ILE A 72 0.848 -9.768 2.728 1.00 0.47 H new ATOM 0 HG23 ILE A 72 2.040 -10.442 1.592 1.00 0.47 H new ATOM 0 HD11 ILE A 72 3.449 -13.764 1.330 1.00 0.71 H new ATOM 0 HD12 ILE A 72 2.375 -12.424 0.861 1.00 0.71 H new ATOM 0 HD13 ILE A 72 3.958 -12.080 1.600 1.00 0.71 H new ATOM 1157 N THR A 73 4.896 -11.699 5.215 1.00 0.59 N ATOM 1158 CA THR A 73 5.472 -12.554 6.214 1.00 0.72 C ATOM 1159 C THR A 73 6.191 -11.739 7.289 1.00 0.74 C ATOM 1160 O THR A 73 6.209 -12.126 8.458 1.00 0.88 O ATOM 1161 CB THR A 73 6.422 -13.615 5.601 1.00 0.81 C ATOM 1162 OG1 THR A 73 6.410 -14.797 6.411 1.00 0.97 O ATOM 1163 CG2 THR A 73 7.856 -13.109 5.483 1.00 0.80 C ATOM 0 H THR A 73 5.535 -11.394 4.481 1.00 0.59 H new ATOM 0 HA THR A 73 4.648 -13.091 6.683 1.00 0.72 H new ATOM 0 HB THR A 73 6.059 -13.832 4.596 1.00 0.81 H new ATOM 0 HG1 THR A 73 5.561 -14.852 6.897 1.00 0.97 H new ATOM 0 HG21 THR A 73 8.482 -13.888 5.048 1.00 0.80 H new ATOM 0 HG22 THR A 73 7.879 -12.226 4.844 1.00 0.80 H new ATOM 0 HG23 THR A 73 8.233 -12.850 6.472 1.00 0.80 H new ATOM 1171 N TRP A 74 6.771 -10.605 6.900 1.00 0.64 N ATOM 1172 CA TRP A 74 7.473 -9.758 7.867 1.00 0.66 C ATOM 1173 C TRP A 74 6.621 -8.562 8.276 1.00 0.63 C ATOM 1174 O TRP A 74 7.020 -7.771 9.133 1.00 0.75 O ATOM 1175 CB TRP A 74 8.824 -9.277 7.304 1.00 0.66 C ATOM 1176 CG TRP A 74 8.745 -8.708 5.914 1.00 0.59 C ATOM 1177 CD1 TRP A 74 9.276 -9.248 4.781 1.00 0.66 C ATOM 1178 CD2 TRP A 74 8.101 -7.494 5.505 1.00 0.53 C ATOM 1179 NE1 TRP A 74 8.991 -8.458 3.701 1.00 0.65 N ATOM 1180 CE2 TRP A 74 8.273 -7.377 4.117 1.00 0.58 C ATOM 1181 CE3 TRP A 74 7.395 -6.496 6.171 1.00 0.52 C ATOM 1182 CZ2 TRP A 74 7.759 -6.314 3.389 1.00 0.62 C ATOM 1183 CZ3 TRP A 74 6.889 -5.441 5.451 1.00 0.56 C ATOM 1184 CH2 TRP A 74 7.072 -5.354 4.069 1.00 0.61 C ATOM 0 H TRP A 74 6.771 -10.255 5.942 1.00 0.64 H new ATOM 0 HA TRP A 74 7.662 -10.365 8.753 1.00 0.66 H new ATOM 0 HB2 TRP A 74 9.234 -8.520 7.972 1.00 0.66 H new ATOM 0 HB3 TRP A 74 9.523 -10.113 7.303 1.00 0.66 H new ATOM 0 HD1 TRP A 74 9.841 -10.168 4.741 1.00 0.66 H new ATOM 0 HE1 TRP A 74 9.271 -8.648 2.739 1.00 0.65 H new ATOM 0 HE3 TRP A 74 7.247 -6.550 7.239 1.00 0.52 H new ATOM 0 HZ2 TRP A 74 7.899 -6.250 2.320 1.00 0.62 H new ATOM 0 HZ3 TRP A 74 6.340 -4.665 5.963 1.00 0.56 H new ATOM 0 HH2 TRP A 74 6.662 -4.512 3.531 1.00 0.61 H new ATOM 1195 N ASP A 75 5.452 -8.447 7.654 1.00 0.55 N ATOM 1196 CA ASP A 75 4.589 -7.273 7.806 1.00 0.58 C ATOM 1197 C ASP A 75 4.060 -7.121 9.232 1.00 0.58 C ATOM 1198 O ASP A 75 4.355 -7.920 10.125 1.00 0.73 O ATOM 1199 CB ASP A 75 3.405 -7.379 6.844 1.00 0.83 C ATOM 1200 CG ASP A 75 2.792 -6.034 6.485 1.00 1.44 C ATOM 1201 OD1 ASP A 75 1.958 -5.524 7.268 1.00 1.44 O ATOM 1202 OD2 ASP A 75 3.135 -5.488 5.423 1.00 2.19 O ATOM 0 H ASP A 75 5.074 -9.161 7.031 1.00 0.55 H new ATOM 0 HA ASP A 75 5.194 -6.395 7.578 1.00 0.58 H new ATOM 0 HB2 ASP A 75 3.733 -7.875 5.931 1.00 0.83 H new ATOM 0 HB3 ASP A 75 2.638 -8.011 7.292 1.00 0.83 H new ATOM 1207 N LYS A 76 3.255 -6.095 9.416 1.00 0.58 N ATOM 1208 CA LYS A 76 2.624 -5.809 10.693 1.00 0.65 C ATOM 1209 C LYS A 76 1.162 -6.212 10.619 1.00 0.62 C ATOM 1210 O LYS A 76 0.570 -6.645 11.606 1.00 0.75 O ATOM 1211 CB LYS A 76 2.684 -4.311 11.029 1.00 0.88 C ATOM 1212 CG LYS A 76 3.972 -3.629 10.740 1.00 0.78 C ATOM 1213 CD LYS A 76 5.112 -4.143 11.551 1.00 1.63 C ATOM 1214 CE LYS A 76 6.283 -3.302 11.209 1.00 1.97 C ATOM 1215 NZ LYS A 76 7.519 -3.684 11.938 1.00 3.19 N ATOM 0 H LYS A 76 3.017 -5.430 8.680 1.00 0.58 H new ATOM 0 HA LYS A 76 3.156 -6.366 11.464 1.00 0.65 H new ATOM 0 HB2 LYS A 76 1.895 -3.803 10.475 1.00 0.88 H new ATOM 0 HB3 LYS A 76 2.460 -4.187 12.089 1.00 0.88 H new ATOM 0 HG2 LYS A 76 4.207 -3.747 9.682 1.00 0.78 H new ATOM 0 HG3 LYS A 76 3.858 -2.561 10.924 1.00 0.78 H new ATOM 0 HD2 LYS A 76 4.889 -4.083 12.616 1.00 1.63 H new ATOM 0 HD3 LYS A 76 5.308 -5.191 11.325 1.00 1.63 H new ATOM 0 HE2 LYS A 76 6.468 -3.369 10.137 1.00 1.97 H new ATOM 0 HE3 LYS A 76 6.049 -2.260 11.428 1.00 1.97 H new ATOM 0 HZ1 LYS A 76 8.298 -3.057 11.653 1.00 3.19 H new ATOM 0 HZ2 LYS A 76 7.360 -3.595 12.962 1.00 3.19 H new ATOM 0 HZ3 LYS A 76 7.766 -4.668 11.711 1.00 3.19 H new ATOM 1229 N SER A 77 0.589 -6.059 9.429 1.00 0.61 N ATOM 1230 CA SER A 77 -0.842 -6.209 9.244 1.00 0.72 C ATOM 1231 C SER A 77 -1.181 -7.054 8.012 1.00 0.61 C ATOM 1232 O SER A 77 -2.304 -7.006 7.515 1.00 0.65 O ATOM 1233 CB SER A 77 -1.485 -4.828 9.111 1.00 0.91 C ATOM 1234 OG SER A 77 -1.116 -3.985 10.194 1.00 1.58 O ATOM 0 H SER A 77 1.101 -5.830 8.577 1.00 0.61 H new ATOM 0 HA SER A 77 -1.236 -6.729 10.117 1.00 0.72 H new ATOM 0 HB2 SER A 77 -1.180 -4.371 8.170 1.00 0.91 H new ATOM 0 HB3 SER A 77 -2.570 -4.930 9.079 1.00 0.91 H new ATOM 0 HG SER A 77 -1.539 -3.108 10.084 1.00 1.58 H new ATOM 1240 N LEU A 78 -0.231 -7.840 7.532 1.00 0.54 N ATOM 1241 CA LEU A 78 -0.484 -8.698 6.380 1.00 0.50 C ATOM 1242 C LEU A 78 -0.562 -10.152 6.807 1.00 0.53 C ATOM 1243 O LEU A 78 0.025 -10.550 7.812 1.00 0.71 O ATOM 1244 CB LEU A 78 0.598 -8.545 5.307 1.00 0.45 C ATOM 1245 CG LEU A 78 0.506 -7.297 4.427 1.00 0.45 C ATOM 1246 CD1 LEU A 78 1.639 -7.284 3.396 1.00 0.49 C ATOM 1247 CD2 LEU A 78 -0.849 -7.236 3.737 1.00 0.51 C ATOM 0 H LEU A 78 0.712 -7.904 7.915 1.00 0.54 H new ATOM 0 HA LEU A 78 -1.438 -8.387 5.953 1.00 0.50 H new ATOM 0 HB2 LEU A 78 1.571 -8.546 5.799 1.00 0.45 H new ATOM 0 HB3 LEU A 78 0.566 -9.423 4.661 1.00 0.45 H new ATOM 0 HG LEU A 78 0.610 -6.416 5.060 1.00 0.45 H new ATOM 0 HD11 LEU A 78 1.559 -6.390 2.778 1.00 0.49 H new ATOM 0 HD12 LEU A 78 2.600 -7.284 3.911 1.00 0.49 H new ATOM 0 HD13 LEU A 78 1.566 -8.169 2.764 1.00 0.49 H new ATOM 0 HD21 LEU A 78 -0.900 -6.343 3.114 1.00 0.51 H new ATOM 0 HD22 LEU A 78 -0.980 -8.121 3.114 1.00 0.51 H new ATOM 0 HD23 LEU A 78 -1.638 -7.201 4.488 1.00 0.51 H new ATOM 1259 N GLN A 79 -1.294 -10.938 6.034 1.00 0.46 N ATOM 1260 CA GLN A 79 -1.521 -12.338 6.348 1.00 0.50 C ATOM 1261 C GLN A 79 -1.324 -13.202 5.113 1.00 0.48 C ATOM 1262 O GLN A 79 -0.384 -13.992 5.032 1.00 0.55 O ATOM 1263 CB GLN A 79 -2.946 -12.547 6.873 1.00 0.56 C ATOM 1264 CG GLN A 79 -3.206 -11.973 8.246 1.00 0.55 C ATOM 1265 CD GLN A 79 -2.471 -12.710 9.345 1.00 1.03 C ATOM 1266 OE1 GLN A 79 -2.996 -13.660 9.927 1.00 1.66 O ATOM 1267 NE2 GLN A 79 -1.256 -12.282 9.639 1.00 1.73 N ATOM 0 H GLN A 79 -1.746 -10.624 5.175 1.00 0.46 H new ATOM 0 HA GLN A 79 -0.802 -12.627 7.114 1.00 0.50 H new ATOM 0 HB2 GLN A 79 -3.647 -12.099 6.169 1.00 0.56 H new ATOM 0 HB3 GLN A 79 -3.157 -13.616 6.896 1.00 0.56 H new ATOM 0 HG2 GLN A 79 -2.908 -10.924 8.258 1.00 0.55 H new ATOM 0 HG3 GLN A 79 -4.276 -12.003 8.449 1.00 0.55 H new ATOM 0 HE21 GLN A 79 -0.857 -11.491 9.133 1.00 1.73 H new ATOM 0 HE22 GLN A 79 -0.717 -12.742 10.372 1.00 1.73 H new ATOM 1276 N VAL A 80 -2.215 -13.031 4.143 1.00 0.41 N ATOM 1277 CA VAL A 80 -2.277 -13.932 3.000 1.00 0.43 C ATOM 1278 C VAL A 80 -2.456 -13.152 1.704 1.00 0.39 C ATOM 1279 O VAL A 80 -3.502 -12.551 1.484 1.00 0.45 O ATOM 1280 CB VAL A 80 -3.460 -14.920 3.130 1.00 0.48 C ATOM 1281 CG1 VAL A 80 -3.231 -16.146 2.259 1.00 0.78 C ATOM 1282 CG2 VAL A 80 -3.701 -15.316 4.584 1.00 0.74 C ATOM 0 H VAL A 80 -2.903 -12.278 4.126 1.00 0.41 H new ATOM 0 HA VAL A 80 -1.337 -14.483 2.980 1.00 0.43 H new ATOM 0 HB VAL A 80 -4.359 -14.414 2.779 1.00 0.48 H new ATOM 0 HG11 VAL A 80 -4.074 -16.829 2.364 1.00 0.78 H new ATOM 0 HG12 VAL A 80 -3.139 -15.840 1.217 1.00 0.78 H new ATOM 0 HG13 VAL A 80 -2.315 -16.648 2.571 1.00 0.78 H new ATOM 0 HG21 VAL A 80 -4.539 -16.011 4.638 1.00 0.74 H new ATOM 0 HG22 VAL A 80 -2.807 -15.794 4.984 1.00 0.74 H new ATOM 0 HG23 VAL A 80 -3.929 -14.426 5.170 1.00 0.74 H new ATOM 1292 N TYR A 81 -1.443 -13.157 0.855 1.00 0.42 N ATOM 1293 CA TYR A 81 -1.546 -12.516 -0.450 1.00 0.46 C ATOM 1294 C TYR A 81 -1.847 -13.576 -1.501 1.00 0.51 C ATOM 1295 O TYR A 81 -1.262 -14.659 -1.480 1.00 0.78 O ATOM 1296 CB TYR A 81 -0.247 -11.778 -0.787 1.00 0.74 C ATOM 1297 CG TYR A 81 -0.314 -10.892 -2.014 1.00 1.91 C ATOM 1298 CD1 TYR A 81 -0.324 -11.448 -3.286 1.00 2.02 C ATOM 1299 CD2 TYR A 81 -0.404 -9.509 -1.905 1.00 3.05 C ATOM 1300 CE1 TYR A 81 -0.415 -10.651 -4.413 1.00 3.15 C ATOM 1301 CE2 TYR A 81 -0.500 -8.707 -3.025 1.00 4.21 C ATOM 1302 CZ TYR A 81 -0.372 -9.247 -4.259 1.00 4.24 C ATOM 1303 OH TYR A 81 -0.604 -8.486 -5.395 1.00 5.40 O ATOM 0 H TYR A 81 -0.541 -13.596 1.042 1.00 0.42 H new ATOM 0 HA TYR A 81 -2.353 -11.784 -0.433 1.00 0.46 H new ATOM 0 HB2 TYR A 81 0.038 -11.167 0.069 1.00 0.74 H new ATOM 0 HB3 TYR A 81 0.544 -12.514 -0.931 1.00 0.74 H new ATOM 0 HD1 TYR A 81 -0.260 -12.520 -3.398 1.00 2.02 H new ATOM 0 HD2 TYR A 81 -0.399 -9.053 -0.926 1.00 3.05 H new ATOM 0 HE1 TYR A 81 -0.517 -11.094 -5.393 1.00 3.15 H new ATOM 0 HE2 TYR A 81 -0.677 -7.647 -2.916 1.00 4.21 H new ATOM 0 HH TYR A 81 -0.693 -7.543 -5.144 1.00 5.40 H new ATOM 1313 N ASN A 82 -2.750 -13.263 -2.418 1.00 0.42 N ATOM 1314 CA ASN A 82 -3.192 -14.216 -3.420 1.00 0.46 C ATOM 1315 C ASN A 82 -3.423 -13.497 -4.732 1.00 0.44 C ATOM 1316 O ASN A 82 -4.371 -12.724 -4.870 1.00 0.45 O ATOM 1317 CB ASN A 82 -4.490 -14.919 -3.002 1.00 0.50 C ATOM 1318 CG ASN A 82 -4.370 -15.711 -1.713 1.00 0.93 C ATOM 1319 OD1 ASN A 82 -4.003 -16.885 -1.721 1.00 1.69 O ATOM 1320 ND2 ASN A 82 -4.690 -15.073 -0.598 1.00 1.40 N ATOM 0 H ASN A 82 -3.193 -12.347 -2.487 1.00 0.42 H new ATOM 0 HA ASN A 82 -2.413 -14.971 -3.528 1.00 0.46 H new ATOM 0 HB2 ASN A 82 -5.276 -14.172 -2.887 1.00 0.50 H new ATOM 0 HB3 ASN A 82 -4.803 -15.590 -3.802 1.00 0.50 H new ATOM 0 HD21 ASN A 82 -4.637 -15.556 0.299 1.00 1.40 H new ATOM 0 HD22 ASN A 82 -4.990 -14.099 -0.636 1.00 1.40 H new ATOM 1327 N MET A 83 -2.534 -13.720 -5.672 1.00 0.47 N ATOM 1328 CA MET A 83 -2.690 -13.195 -7.014 1.00 0.48 C ATOM 1329 C MET A 83 -3.889 -13.874 -7.678 1.00 0.47 C ATOM 1330 O MET A 83 -3.803 -15.024 -8.112 1.00 0.57 O ATOM 1331 CB MET A 83 -1.402 -13.456 -7.786 1.00 0.58 C ATOM 1332 CG MET A 83 -0.648 -12.197 -8.197 1.00 0.63 C ATOM 1333 SD MET A 83 0.908 -12.555 -9.036 1.00 1.66 S ATOM 1334 CE MET A 83 1.804 -13.425 -7.752 1.00 2.05 C ATOM 0 H MET A 83 -1.685 -14.268 -5.532 1.00 0.47 H new ATOM 0 HA MET A 83 -2.875 -12.121 -6.998 1.00 0.48 H new ATOM 0 HB2 MET A 83 -0.745 -14.075 -7.174 1.00 0.58 H new ATOM 0 HB3 MET A 83 -1.639 -14.031 -8.681 1.00 0.58 H new ATOM 0 HG2 MET A 83 -1.280 -11.599 -8.853 1.00 0.63 H new ATOM 0 HG3 MET A 83 -0.447 -11.594 -7.311 1.00 0.63 H new ATOM 0 HE1 MET A 83 2.871 -13.399 -7.972 1.00 2.05 H new ATOM 0 HE2 MET A 83 1.620 -12.945 -6.791 1.00 2.05 H new ATOM 0 HE3 MET A 83 1.467 -14.461 -7.711 1.00 2.05 H new ATOM 1344 N VAL A 84 -5.010 -13.155 -7.731 1.00 0.38 N ATOM 1345 CA VAL A 84 -6.292 -13.741 -8.140 1.00 0.39 C ATOM 1346 C VAL A 84 -6.312 -14.007 -9.634 1.00 0.42 C ATOM 1347 O VAL A 84 -6.277 -15.154 -10.076 1.00 0.64 O ATOM 1348 CB VAL A 84 -7.495 -12.832 -7.790 1.00 0.38 C ATOM 1349 CG1 VAL A 84 -8.712 -13.660 -7.394 1.00 0.55 C ATOM 1350 CG2 VAL A 84 -7.144 -11.841 -6.695 1.00 0.42 C ATOM 0 H VAL A 84 -5.059 -12.164 -7.496 1.00 0.38 H new ATOM 0 HA VAL A 84 -6.388 -14.676 -7.587 1.00 0.39 H new ATOM 0 HB VAL A 84 -7.744 -12.265 -8.687 1.00 0.38 H new ATOM 0 HG11 VAL A 84 -9.542 -12.995 -7.153 1.00 0.55 H new ATOM 0 HG12 VAL A 84 -8.996 -14.309 -8.222 1.00 0.55 H new ATOM 0 HG13 VAL A 84 -8.470 -14.268 -6.523 1.00 0.55 H new ATOM 0 HG21 VAL A 84 -8.012 -11.219 -6.475 1.00 0.42 H new ATOM 0 HG22 VAL A 84 -6.848 -12.382 -5.796 1.00 0.42 H new ATOM 0 HG23 VAL A 84 -6.320 -11.209 -7.026 1.00 0.42 H new ATOM 1360 N HIS A 85 -6.374 -12.941 -10.411 1.00 0.30 N ATOM 1361 CA HIS A 85 -6.330 -13.055 -11.854 1.00 0.31 C ATOM 1362 C HIS A 85 -5.343 -12.036 -12.392 1.00 0.32 C ATOM 1363 O HIS A 85 -5.503 -10.836 -12.179 1.00 0.38 O ATOM 1364 CB HIS A 85 -7.719 -12.835 -12.461 1.00 0.37 C ATOM 1365 CG HIS A 85 -7.946 -13.605 -13.728 1.00 0.80 C ATOM 1366 ND1 HIS A 85 -8.044 -13.017 -14.971 1.00 1.36 N ATOM 1367 CD2 HIS A 85 -8.109 -14.934 -13.933 1.00 1.71 C ATOM 1368 CE1 HIS A 85 -8.261 -13.950 -15.880 1.00 1.75 C ATOM 1369 NE2 HIS A 85 -8.302 -15.118 -15.277 1.00 1.96 N ATOM 0 H HIS A 85 -6.455 -11.985 -10.064 1.00 0.30 H new ATOM 0 HA HIS A 85 -6.008 -14.059 -12.130 1.00 0.31 H new ATOM 0 HB2 HIS A 85 -8.476 -13.121 -11.731 1.00 0.37 H new ATOM 0 HB3 HIS A 85 -7.855 -11.772 -12.661 1.00 0.37 H new ATOM 0 HD2 HIS A 85 -8.090 -15.705 -13.177 1.00 1.71 H new ATOM 0 HE1 HIS A 85 -8.384 -13.782 -16.940 1.00 1.75 H new ATOM 0 HE2 HIS A 85 -8.453 -16.016 -15.736 1.00 1.96 H new ATOM 1378 N ARG A 86 -4.308 -12.518 -13.048 1.00 0.34 N ATOM 1379 CA ARG A 86 -3.242 -11.657 -13.531 1.00 0.36 C ATOM 1380 C ARG A 86 -3.514 -11.252 -14.971 1.00 0.38 C ATOM 1381 O ARG A 86 -3.362 -12.049 -15.895 1.00 0.52 O ATOM 1382 CB ARG A 86 -1.901 -12.377 -13.403 1.00 0.40 C ATOM 1383 CG ARG A 86 -1.710 -13.052 -12.049 1.00 0.45 C ATOM 1384 CD ARG A 86 -0.275 -13.521 -11.861 1.00 0.69 C ATOM 1385 NE ARG A 86 0.091 -14.587 -12.790 1.00 1.15 N ATOM 1386 CZ ARG A 86 1.344 -14.865 -13.152 1.00 1.68 C ATOM 1387 NH1 ARG A 86 2.356 -14.141 -12.684 1.00 1.98 N ATOM 1388 NH2 ARG A 86 1.585 -15.872 -13.982 1.00 2.44 N ATOM 0 H ARG A 86 -4.180 -13.507 -13.261 1.00 0.34 H new ATOM 0 HA ARG A 86 -3.203 -10.750 -12.927 1.00 0.36 H new ATOM 0 HB2 ARG A 86 -1.822 -13.127 -14.190 1.00 0.40 H new ATOM 0 HB3 ARG A 86 -1.095 -11.661 -13.562 1.00 0.40 H new ATOM 0 HG2 ARG A 86 -1.974 -12.356 -11.253 1.00 0.45 H new ATOM 0 HG3 ARG A 86 -2.386 -13.903 -11.966 1.00 0.45 H new ATOM 0 HD2 ARG A 86 0.401 -12.677 -11.997 1.00 0.69 H new ATOM 0 HD3 ARG A 86 -0.142 -13.873 -10.838 1.00 0.69 H new ATOM 0 HE ARG A 86 -0.658 -15.154 -13.187 1.00 1.15 H new ATOM 0 HH11 ARG A 86 2.176 -13.367 -12.044 1.00 1.98 H new ATOM 0 HH12 ARG A 86 3.312 -14.359 -12.965 1.00 1.98 H new ATOM 0 HH21 ARG A 86 0.812 -16.432 -14.342 1.00 2.44 H new ATOM 0 HH22 ARG A 86 2.543 -16.086 -14.260 1.00 2.44 H new ATOM 1402 N ILE A 87 -3.930 -10.005 -15.141 1.00 0.35 N ATOM 1403 CA ILE A 87 -4.331 -9.485 -16.443 1.00 0.36 C ATOM 1404 C ILE A 87 -3.137 -9.357 -17.366 1.00 0.39 C ATOM 1405 O ILE A 87 -3.187 -9.727 -18.539 1.00 0.47 O ATOM 1406 CB ILE A 87 -4.994 -8.087 -16.355 1.00 0.38 C ATOM 1407 CG1 ILE A 87 -5.017 -7.529 -14.923 1.00 0.32 C ATOM 1408 CG2 ILE A 87 -6.399 -8.135 -16.927 1.00 0.44 C ATOM 1409 CD1 ILE A 87 -5.989 -8.209 -13.984 1.00 0.27 C ATOM 0 H ILE A 87 -3.999 -9.326 -14.383 1.00 0.35 H new ATOM 0 HA ILE A 87 -5.055 -10.202 -16.830 1.00 0.36 H new ATOM 0 HB ILE A 87 -4.383 -7.407 -16.948 1.00 0.38 H new ATOM 0 HG12 ILE A 87 -4.014 -7.608 -14.503 1.00 0.32 H new ATOM 0 HG13 ILE A 87 -5.261 -6.468 -14.967 1.00 0.32 H new ATOM 0 HG21 ILE A 87 -6.853 -7.147 -16.859 1.00 0.44 H new ATOM 0 HG22 ILE A 87 -6.356 -8.444 -17.971 1.00 0.44 H new ATOM 0 HG23 ILE A 87 -6.998 -8.849 -16.362 1.00 0.44 H new ATOM 0 HD11 ILE A 87 -5.930 -7.744 -13.000 1.00 0.27 H new ATOM 0 HD12 ILE A 87 -7.002 -8.108 -14.373 1.00 0.27 H new ATOM 0 HD13 ILE A 87 -5.736 -9.266 -13.901 1.00 0.27 H new ATOM 1421 N ASP A 88 -2.067 -8.829 -16.817 1.00 0.42 N ATOM 1422 CA ASP A 88 -0.890 -8.498 -17.587 1.00 0.56 C ATOM 1423 C ASP A 88 0.324 -8.686 -16.702 1.00 0.67 C ATOM 1424 O ASP A 88 0.187 -8.835 -15.486 1.00 1.18 O ATOM 1425 CB ASP A 88 -0.998 -7.043 -18.066 1.00 0.65 C ATOM 1426 CG ASP A 88 0.076 -6.641 -19.056 1.00 1.16 C ATOM 1427 OD1 ASP A 88 1.183 -6.269 -18.616 1.00 1.86 O ATOM 1428 OD2 ASP A 88 -0.162 -6.733 -20.275 1.00 1.35 O ATOM 0 H ASP A 88 -1.988 -8.617 -15.822 1.00 0.42 H new ATOM 0 HA ASP A 88 -0.800 -9.143 -18.461 1.00 0.56 H new ATOM 0 HB2 ASP A 88 -1.975 -6.893 -18.525 1.00 0.65 H new ATOM 0 HB3 ASP A 88 -0.947 -6.381 -17.201 1.00 0.65 H new ATOM 1433 N SER A 89 1.503 -8.668 -17.295 1.00 0.65 N ATOM 1434 CA SER A 89 2.738 -8.869 -16.561 1.00 0.70 C ATOM 1435 C SER A 89 3.016 -7.696 -15.618 1.00 0.53 C ATOM 1436 O SER A 89 3.989 -7.716 -14.862 1.00 0.59 O ATOM 1437 CB SER A 89 3.890 -9.038 -17.547 1.00 0.94 C ATOM 1438 OG SER A 89 3.569 -10.002 -18.539 1.00 1.44 O ATOM 0 H SER A 89 1.631 -8.514 -18.295 1.00 0.65 H new ATOM 0 HA SER A 89 2.641 -9.769 -15.954 1.00 0.70 H new ATOM 0 HB2 SER A 89 4.112 -8.082 -18.021 1.00 0.94 H new ATOM 0 HB3 SER A 89 4.789 -9.345 -17.013 1.00 0.94 H new ATOM 0 HG SER A 89 4.320 -10.093 -19.162 1.00 1.44 H new ATOM 1444 N ASP A 90 2.161 -6.673 -15.667 1.00 0.47 N ATOM 1445 CA ASP A 90 2.302 -5.525 -14.795 1.00 0.48 C ATOM 1446 C ASP A 90 0.974 -5.209 -14.125 1.00 0.39 C ATOM 1447 O ASP A 90 0.862 -4.219 -13.406 1.00 0.41 O ATOM 1448 CB ASP A 90 2.771 -4.284 -15.571 1.00 0.73 C ATOM 1449 CG ASP A 90 4.140 -4.438 -16.208 1.00 1.21 C ATOM 1450 OD1 ASP A 90 5.132 -4.588 -15.464 1.00 1.70 O ATOM 1451 OD2 ASP A 90 4.229 -4.442 -17.452 1.00 1.87 O ATOM 0 H ASP A 90 1.366 -6.624 -16.304 1.00 0.47 H new ATOM 0 HA ASP A 90 3.052 -5.776 -14.045 1.00 0.48 H new ATOM 0 HB2 ASP A 90 2.042 -4.057 -16.349 1.00 0.73 H new ATOM 0 HB3 ASP A 90 2.790 -3.430 -14.894 1.00 0.73 H new ATOM 1456 N THR A 91 -0.040 -6.046 -14.351 1.00 0.35 N ATOM 1457 CA THR A 91 -1.366 -5.735 -13.890 1.00 0.32 C ATOM 1458 C THR A 91 -1.956 -6.959 -13.209 1.00 0.28 C ATOM 1459 O THR A 91 -2.256 -7.963 -13.856 1.00 0.30 O ATOM 1460 CB THR A 91 -2.245 -5.293 -15.075 1.00 0.36 C ATOM 1461 OG1 THR A 91 -1.423 -4.677 -16.076 1.00 0.46 O ATOM 1462 CG2 THR A 91 -3.296 -4.294 -14.631 1.00 0.35 C ATOM 0 H THR A 91 0.044 -6.933 -14.847 1.00 0.35 H new ATOM 0 HA THR A 91 -1.325 -4.915 -13.173 1.00 0.32 H new ATOM 0 HB THR A 91 -2.742 -6.176 -15.476 1.00 0.36 H new ATOM 0 HG1 THR A 91 -1.233 -3.751 -15.818 1.00 0.46 H new ATOM 0 HG21 THR A 91 -3.902 -3.999 -15.487 1.00 0.35 H new ATOM 0 HG22 THR A 91 -3.934 -4.750 -13.874 1.00 0.35 H new ATOM 0 HG23 THR A 91 -2.808 -3.414 -14.212 1.00 0.35 H new ATOM 1470 N PHE A 92 -2.079 -6.885 -11.897 1.00 0.25 N ATOM 1471 CA PHE A 92 -2.514 -8.019 -11.107 1.00 0.25 C ATOM 1472 C PHE A 92 -3.708 -7.637 -10.262 1.00 0.22 C ATOM 1473 O PHE A 92 -4.108 -6.481 -10.229 1.00 0.21 O ATOM 1474 CB PHE A 92 -1.397 -8.488 -10.174 1.00 0.30 C ATOM 1475 CG PHE A 92 -0.066 -8.617 -10.840 1.00 0.32 C ATOM 1476 CD1 PHE A 92 0.773 -7.523 -10.943 1.00 0.33 C ATOM 1477 CD2 PHE A 92 0.345 -9.827 -11.362 1.00 0.39 C ATOM 1478 CE1 PHE A 92 1.998 -7.631 -11.557 1.00 0.38 C ATOM 1479 CE2 PHE A 92 1.570 -9.946 -11.976 1.00 0.43 C ATOM 1480 CZ PHE A 92 2.402 -8.846 -12.077 1.00 0.41 C ATOM 0 H PHE A 92 -1.882 -6.045 -11.354 1.00 0.25 H new ATOM 0 HA PHE A 92 -2.780 -8.822 -11.795 1.00 0.25 H new ATOM 0 HB2 PHE A 92 -1.311 -7.786 -9.345 1.00 0.30 H new ATOM 0 HB3 PHE A 92 -1.674 -9.452 -9.748 1.00 0.30 H new ATOM 0 HD1 PHE A 92 0.462 -6.572 -10.536 1.00 0.33 H new ATOM 0 HD2 PHE A 92 -0.302 -10.689 -11.288 1.00 0.39 H new ATOM 0 HE1 PHE A 92 2.643 -6.768 -11.633 1.00 0.38 H new ATOM 0 HE2 PHE A 92 1.882 -10.898 -12.379 1.00 0.43 H new ATOM 0 HZ PHE A 92 3.364 -8.936 -12.560 1.00 0.41 H new ATOM 1490 N ILE A 93 -4.265 -8.611 -9.578 1.00 0.23 N ATOM 1491 CA ILE A 93 -5.289 -8.356 -8.586 1.00 0.23 C ATOM 1492 C ILE A 93 -4.917 -9.113 -7.326 1.00 0.28 C ATOM 1493 O ILE A 93 -4.545 -10.287 -7.394 1.00 0.33 O ATOM 1494 CB ILE A 93 -6.683 -8.788 -9.077 1.00 0.23 C ATOM 1495 CG1 ILE A 93 -6.948 -8.207 -10.460 1.00 0.24 C ATOM 1496 CG2 ILE A 93 -7.758 -8.336 -8.099 1.00 0.26 C ATOM 1497 CD1 ILE A 93 -8.254 -8.650 -11.060 1.00 0.41 C ATOM 0 H ILE A 93 -4.024 -9.596 -9.691 1.00 0.23 H new ATOM 0 HA ILE A 93 -5.342 -7.285 -8.392 1.00 0.23 H new ATOM 0 HB ILE A 93 -6.711 -9.876 -9.138 1.00 0.23 H new ATOM 0 HG12 ILE A 93 -6.938 -7.119 -10.396 1.00 0.24 H new ATOM 0 HG13 ILE A 93 -6.135 -8.494 -11.127 1.00 0.24 H new ATOM 0 HG21 ILE A 93 -8.736 -8.650 -8.463 1.00 0.26 H new ATOM 0 HG22 ILE A 93 -7.573 -8.784 -7.123 1.00 0.26 H new ATOM 0 HG23 ILE A 93 -7.736 -7.250 -8.010 1.00 0.26 H new ATOM 0 HD11 ILE A 93 -8.375 -8.197 -12.044 1.00 0.41 H new ATOM 0 HD12 ILE A 93 -8.260 -9.736 -11.157 1.00 0.41 H new ATOM 0 HD13 ILE A 93 -9.075 -8.339 -10.414 1.00 0.41 H new ATOM 1509 N CYS A 94 -4.985 -8.448 -6.189 1.00 0.36 N ATOM 1510 CA CYS A 94 -4.478 -9.029 -4.965 1.00 0.48 C ATOM 1511 C CYS A 94 -5.593 -9.371 -3.995 1.00 0.39 C ATOM 1512 O CYS A 94 -6.205 -8.487 -3.403 1.00 0.47 O ATOM 1513 CB CYS A 94 -3.470 -8.082 -4.309 1.00 0.74 C ATOM 1514 SG CYS A 94 -4.094 -6.422 -3.959 1.00 2.01 S ATOM 0 H CYS A 94 -5.383 -7.514 -6.089 1.00 0.36 H new ATOM 0 HA CYS A 94 -3.977 -9.961 -5.225 1.00 0.48 H new ATOM 0 HB2 CYS A 94 -3.129 -8.529 -3.376 1.00 0.74 H new ATOM 0 HB3 CYS A 94 -2.599 -7.997 -4.959 1.00 0.74 H new ATOM 0 HG CYS A 94 -4.499 -5.869 -5.064 1.00 2.01 H new ATOM 1520 N HIS A 95 -5.873 -10.660 -3.870 1.00 0.37 N ATOM 1521 CA HIS A 95 -6.714 -11.156 -2.796 1.00 0.36 C ATOM 1522 C HIS A 95 -5.863 -11.286 -1.538 1.00 0.39 C ATOM 1523 O HIS A 95 -5.243 -12.320 -1.289 1.00 0.56 O ATOM 1524 CB HIS A 95 -7.374 -12.492 -3.188 1.00 0.41 C ATOM 1525 CG HIS A 95 -7.909 -13.301 -2.036 1.00 0.50 C ATOM 1526 ND1 HIS A 95 -8.585 -12.763 -0.959 1.00 1.20 N ATOM 1527 CD2 HIS A 95 -7.825 -14.629 -1.790 1.00 1.23 C ATOM 1528 CE1 HIS A 95 -8.887 -13.726 -0.107 1.00 0.99 C ATOM 1529 NE2 HIS A 95 -8.436 -14.865 -0.589 1.00 0.95 N ATOM 0 H HIS A 95 -5.528 -11.382 -4.503 1.00 0.37 H new ATOM 0 HA HIS A 95 -7.527 -10.456 -2.602 1.00 0.36 H new ATOM 0 HB2 HIS A 95 -8.192 -12.287 -3.879 1.00 0.41 H new ATOM 0 HB3 HIS A 95 -6.644 -13.095 -3.728 1.00 0.41 H new ATOM 0 HD1 HIS A 95 -8.815 -11.776 -0.840 1.00 1.20 H new ATOM 0 HD2 HIS A 95 -7.360 -15.368 -2.426 1.00 1.23 H new ATOM 0 HE1 HIS A 95 -9.415 -13.600 0.827 1.00 0.99 H new ATOM 1538 N THR A 96 -5.821 -10.219 -0.768 1.00 0.35 N ATOM 1539 CA THR A 96 -4.904 -10.131 0.355 1.00 0.38 C ATOM 1540 C THR A 96 -5.640 -10.057 1.686 1.00 0.36 C ATOM 1541 O THR A 96 -6.316 -9.073 1.973 1.00 0.41 O ATOM 1542 CB THR A 96 -4.001 -8.891 0.214 1.00 0.43 C ATOM 1543 OG1 THR A 96 -3.352 -8.903 -1.063 1.00 0.50 O ATOM 1544 CG2 THR A 96 -2.958 -8.836 1.326 1.00 0.47 C ATOM 0 H THR A 96 -6.412 -9.397 -0.898 1.00 0.35 H new ATOM 0 HA THR A 96 -4.300 -11.038 0.344 1.00 0.38 H new ATOM 0 HB THR A 96 -4.629 -8.004 0.295 1.00 0.43 H new ATOM 0 HG1 THR A 96 -2.412 -9.154 -0.950 1.00 0.50 H new ATOM 0 HG21 THR A 96 -2.337 -7.950 1.198 1.00 0.47 H new ATOM 0 HG22 THR A 96 -3.459 -8.792 2.293 1.00 0.47 H new ATOM 0 HG23 THR A 96 -2.332 -9.727 1.282 1.00 0.47 H new ATOM 1552 N ILE A 97 -5.483 -11.077 2.518 1.00 0.38 N ATOM 1553 CA ILE A 97 -6.059 -11.031 3.845 1.00 0.40 C ATOM 1554 C ILE A 97 -5.210 -10.135 4.720 1.00 0.41 C ATOM 1555 O ILE A 97 -4.005 -10.346 4.882 1.00 0.42 O ATOM 1556 CB ILE A 97 -6.180 -12.410 4.521 1.00 0.47 C ATOM 1557 CG1 ILE A 97 -7.001 -13.378 3.662 1.00 0.56 C ATOM 1558 CG2 ILE A 97 -6.819 -12.242 5.899 1.00 0.51 C ATOM 1559 CD1 ILE A 97 -8.453 -12.979 3.505 1.00 1.03 C ATOM 0 H ILE A 97 -4.970 -11.931 2.299 1.00 0.38 H new ATOM 0 HA ILE A 97 -7.072 -10.646 3.730 1.00 0.40 H new ATOM 0 HB ILE A 97 -5.183 -12.836 4.632 1.00 0.47 H new ATOM 0 HG12 ILE A 97 -6.545 -13.448 2.674 1.00 0.56 H new ATOM 0 HG13 ILE A 97 -6.954 -14.372 4.106 1.00 0.56 H new ATOM 0 HG21 ILE A 97 -6.906 -13.216 6.381 1.00 0.51 H new ATOM 0 HG22 ILE A 97 -6.197 -11.589 6.511 1.00 0.51 H new ATOM 0 HG23 ILE A 97 -7.810 -11.801 5.789 1.00 0.51 H new ATOM 0 HD11 ILE A 97 -8.967 -13.713 2.885 1.00 1.03 H new ATOM 0 HD12 ILE A 97 -8.927 -12.937 4.486 1.00 1.03 H new ATOM 0 HD13 ILE A 97 -8.512 -11.999 3.032 1.00 1.03 H new ATOM 1571 N THR A 98 -5.852 -9.126 5.249 1.00 0.49 N ATOM 1572 CA THR A 98 -5.211 -8.118 6.049 1.00 0.56 C ATOM 1573 C THR A 98 -5.634 -8.267 7.507 1.00 0.63 C ATOM 1574 O THR A 98 -6.780 -8.620 7.804 1.00 0.77 O ATOM 1575 CB THR A 98 -5.611 -6.740 5.501 1.00 0.71 C ATOM 1576 OG1 THR A 98 -5.366 -6.711 4.091 1.00 1.38 O ATOM 1577 CG2 THR A 98 -4.852 -5.616 6.164 1.00 0.86 C ATOM 0 H THR A 98 -6.855 -8.980 5.133 1.00 0.49 H new ATOM 0 HA THR A 98 -4.127 -8.226 6.002 1.00 0.56 H new ATOM 0 HB THR A 98 -6.669 -6.590 5.715 1.00 0.71 H new ATOM 0 HG1 THR A 98 -5.605 -5.830 3.735 1.00 1.38 H new ATOM 0 HG21 THR A 98 -5.171 -4.663 5.742 1.00 0.86 H new ATOM 0 HG22 THR A 98 -5.053 -5.624 7.235 1.00 0.86 H new ATOM 0 HG23 THR A 98 -3.784 -5.749 5.994 1.00 0.86 H new ATOM 1585 N GLN A 99 -4.698 -8.008 8.405 1.00 0.59 N ATOM 1586 CA GLN A 99 -4.913 -8.181 9.833 1.00 0.72 C ATOM 1587 C GLN A 99 -5.850 -7.117 10.393 1.00 0.99 C ATOM 1588 O GLN A 99 -6.236 -6.174 9.699 1.00 1.32 O ATOM 1589 CB GLN A 99 -3.576 -8.120 10.566 1.00 0.61 C ATOM 1590 CG GLN A 99 -2.918 -9.474 10.765 1.00 0.80 C ATOM 1591 CD GLN A 99 -1.491 -9.359 11.265 1.00 1.04 C ATOM 1592 OE1 GLN A 99 -0.547 -9.316 10.477 1.00 1.62 O ATOM 1593 NE2 GLN A 99 -1.326 -9.296 12.575 1.00 1.82 N ATOM 0 H GLN A 99 -3.766 -7.671 8.164 1.00 0.59 H new ATOM 0 HA GLN A 99 -5.378 -9.155 9.985 1.00 0.72 H new ATOM 0 HB2 GLN A 99 -2.896 -7.476 10.008 1.00 0.61 H new ATOM 0 HB3 GLN A 99 -3.728 -7.655 11.540 1.00 0.61 H new ATOM 0 HG2 GLN A 99 -3.503 -10.057 11.476 1.00 0.80 H new ATOM 0 HG3 GLN A 99 -2.926 -10.020 9.822 1.00 0.80 H new ATOM 0 HE21 GLN A 99 -2.136 -9.335 13.194 1.00 1.82 H new ATOM 0 HE22 GLN A 99 -0.389 -9.208 12.967 1.00 1.82 H new ATOM 1602 N SER A 100 -6.193 -7.273 11.660 1.00 1.67 N ATOM 1603 CA SER A 100 -7.090 -6.358 12.331 1.00 2.03 C ATOM 1604 C SER A 100 -6.299 -5.179 12.878 1.00 1.60 C ATOM 1605 O SER A 100 -5.731 -5.243 13.967 1.00 2.41 O ATOM 1606 CB SER A 100 -7.818 -7.087 13.459 1.00 3.23 C ATOM 1607 OG SER A 100 -8.878 -6.311 13.999 1.00 3.91 O ATOM 0 H SER A 100 -5.857 -8.036 12.248 1.00 1.67 H new ATOM 0 HA SER A 100 -7.830 -5.984 11.624 1.00 2.03 H new ATOM 0 HB2 SER A 100 -8.214 -8.031 13.084 1.00 3.23 H new ATOM 0 HB3 SER A 100 -7.109 -7.331 14.250 1.00 3.23 H new ATOM 0 HG SER A 100 -9.268 -5.753 13.293 1.00 3.91 H new ATOM 1613 N PHE A 101 -6.243 -4.120 12.096 1.00 0.91 N ATOM 1614 CA PHE A 101 -5.554 -2.916 12.484 1.00 1.37 C ATOM 1615 C PHE A 101 -6.544 -1.996 13.170 1.00 1.09 C ATOM 1616 O PHE A 101 -7.525 -1.570 12.562 1.00 1.69 O ATOM 1617 CB PHE A 101 -4.937 -2.238 11.256 1.00 2.29 C ATOM 1618 CG PHE A 101 -3.998 -1.118 11.592 1.00 2.99 C ATOM 1619 CD1 PHE A 101 -2.665 -1.378 11.860 1.00 3.48 C ATOM 1620 CD2 PHE A 101 -4.448 0.190 11.643 1.00 3.67 C ATOM 1621 CE1 PHE A 101 -1.795 -0.353 12.171 1.00 4.58 C ATOM 1622 CE2 PHE A 101 -3.583 1.220 11.954 1.00 4.71 C ATOM 1623 CZ PHE A 101 -2.254 0.947 12.218 1.00 5.16 C ATOM 0 H PHE A 101 -6.676 -4.075 11.174 1.00 0.91 H new ATOM 0 HA PHE A 101 -4.743 -3.154 13.172 1.00 1.37 H new ATOM 0 HB2 PHE A 101 -4.402 -2.985 10.670 1.00 2.29 H new ATOM 0 HB3 PHE A 101 -5.737 -1.852 10.625 1.00 2.29 H new ATOM 0 HD1 PHE A 101 -2.302 -2.395 11.825 1.00 3.48 H new ATOM 0 HD2 PHE A 101 -5.486 0.407 11.438 1.00 3.67 H new ATOM 0 HE1 PHE A 101 -0.757 -0.568 12.377 1.00 4.58 H new ATOM 0 HE2 PHE A 101 -3.944 2.237 11.991 1.00 4.71 H new ATOM 0 HZ PHE A 101 -1.575 1.751 12.461 1.00 5.16 H new ATOM 1633 N ALA A 102 -6.283 -1.741 14.439 1.00 1.17 N ATOM 1634 CA ALA A 102 -7.194 -1.005 15.314 1.00 1.07 C ATOM 1635 C ALA A 102 -8.390 -1.894 15.611 1.00 1.42 C ATOM 1636 O ALA A 102 -9.510 -1.649 15.158 1.00 1.98 O ATOM 1637 CB ALA A 102 -7.619 0.337 14.717 1.00 0.98 C ATOM 0 H ALA A 102 -5.425 -2.040 14.902 1.00 1.17 H new ATOM 0 HA ALA A 102 -6.677 -0.759 16.242 1.00 1.07 H new ATOM 0 HB1 ALA A 102 -8.295 0.844 15.406 1.00 0.98 H new ATOM 0 HB2 ALA A 102 -6.738 0.957 14.551 1.00 0.98 H new ATOM 0 HB3 ALA A 102 -8.128 0.168 13.768 1.00 0.98 H new ATOM 1643 N VAL A 103 -8.121 -2.936 16.392 1.00 1.54 N ATOM 1644 CA VAL A 103 -9.093 -3.986 16.694 1.00 2.05 C ATOM 1645 C VAL A 103 -10.297 -3.476 17.484 1.00 1.79 C ATOM 1646 O VAL A 103 -11.162 -4.261 17.877 1.00 2.21 O ATOM 1647 CB VAL A 103 -8.438 -5.135 17.492 1.00 2.56 C ATOM 1648 CG1 VAL A 103 -7.251 -5.705 16.737 1.00 3.03 C ATOM 1649 CG2 VAL A 103 -8.012 -4.662 18.876 1.00 3.17 C ATOM 0 H VAL A 103 -7.215 -3.078 16.838 1.00 1.54 H new ATOM 0 HA VAL A 103 -9.444 -4.346 15.727 1.00 2.05 H new ATOM 0 HB VAL A 103 -9.180 -5.924 17.615 1.00 2.56 H new ATOM 0 HG11 VAL A 103 -6.805 -6.513 17.317 1.00 3.03 H new ATOM 0 HG12 VAL A 103 -7.584 -6.091 15.774 1.00 3.03 H new ATOM 0 HG13 VAL A 103 -6.511 -4.921 16.577 1.00 3.03 H new ATOM 0 HG21 VAL A 103 -7.554 -5.489 19.418 1.00 3.17 H new ATOM 0 HG22 VAL A 103 -7.292 -3.850 18.777 1.00 3.17 H new ATOM 0 HG23 VAL A 103 -8.885 -4.308 19.424 1.00 3.17 H new ATOM 1659 N GLY A 104 -10.362 -2.175 17.709 1.00 1.47 N ATOM 1660 CA GLY A 104 -11.450 -1.620 18.478 1.00 1.84 C ATOM 1661 C GLY A 104 -12.720 -1.520 17.668 1.00 1.67 C ATOM 1662 O GLY A 104 -13.793 -1.903 18.129 1.00 1.96 O ATOM 0 H GLY A 104 -9.681 -1.494 17.373 1.00 1.47 H new ATOM 0 HA2 GLY A 104 -11.628 -2.241 19.356 1.00 1.84 H new ATOM 0 HA3 GLY A 104 -11.171 -0.630 18.839 1.00 1.84 H new ATOM 1666 N SER A 105 -12.596 -1.018 16.453 1.00 1.38 N ATOM 1667 CA SER A 105 -13.747 -0.846 15.584 1.00 1.39 C ATOM 1668 C SER A 105 -13.485 -1.419 14.198 1.00 1.19 C ATOM 1669 O SER A 105 -14.346 -1.363 13.319 1.00 1.34 O ATOM 1670 CB SER A 105 -14.086 0.637 15.481 1.00 1.59 C ATOM 1671 OG SER A 105 -14.501 1.150 16.737 1.00 1.88 O ATOM 0 H SER A 105 -11.709 -0.722 16.045 1.00 1.38 H new ATOM 0 HA SER A 105 -14.589 -1.388 16.015 1.00 1.39 H new ATOM 0 HB2 SER A 105 -13.215 1.189 15.128 1.00 1.59 H new ATOM 0 HB3 SER A 105 -14.876 0.783 14.745 1.00 1.59 H new ATOM 0 HG SER A 105 -14.712 2.103 16.648 1.00 1.88 H new ATOM 1677 N ILE A 106 -12.300 -1.976 14.001 1.00 1.05 N ATOM 1678 CA ILE A 106 -11.912 -2.478 12.696 1.00 0.96 C ATOM 1679 C ILE A 106 -11.630 -3.975 12.744 1.00 0.94 C ATOM 1680 O ILE A 106 -10.835 -4.448 13.557 1.00 1.12 O ATOM 1681 CB ILE A 106 -10.683 -1.715 12.157 1.00 0.93 C ATOM 1682 CG1 ILE A 106 -11.026 -0.229 12.028 1.00 1.01 C ATOM 1683 CG2 ILE A 106 -10.243 -2.279 10.811 1.00 0.98 C ATOM 1684 CD1 ILE A 106 -9.826 0.671 11.858 1.00 0.94 C ATOM 0 H ILE A 106 -11.593 -2.091 14.727 1.00 1.05 H new ATOM 0 HA ILE A 106 -12.747 -2.312 12.015 1.00 0.96 H new ATOM 0 HB ILE A 106 -9.856 -1.836 12.856 1.00 0.93 H new ATOM 0 HG12 ILE A 106 -11.691 -0.094 11.175 1.00 1.01 H new ATOM 0 HG13 ILE A 106 -11.578 0.083 12.915 1.00 1.01 H new ATOM 0 HG21 ILE A 106 -9.376 -1.726 10.451 1.00 0.98 H new ATOM 0 HG22 ILE A 106 -9.981 -3.331 10.925 1.00 0.98 H new ATOM 0 HG23 ILE A 106 -11.058 -2.184 10.093 1.00 0.98 H new ATOM 0 HD11 ILE A 106 -10.157 1.706 11.774 1.00 0.94 H new ATOM 0 HD12 ILE A 106 -9.169 0.569 12.722 1.00 0.94 H new ATOM 0 HD13 ILE A 106 -9.285 0.389 10.955 1.00 0.94 H new ATOM 1696 N SER A 107 -12.315 -4.708 11.883 1.00 0.84 N ATOM 1697 CA SER A 107 -12.152 -6.149 11.769 1.00 0.86 C ATOM 1698 C SER A 107 -11.099 -6.455 10.700 1.00 0.79 C ATOM 1699 O SER A 107 -10.795 -5.584 9.881 1.00 0.77 O ATOM 1700 CB SER A 107 -13.510 -6.770 11.393 1.00 0.97 C ATOM 1701 OG SER A 107 -13.467 -8.190 11.354 1.00 1.35 O ATOM 0 H SER A 107 -13.004 -4.319 11.239 1.00 0.84 H new ATOM 0 HA SER A 107 -11.816 -6.573 12.715 1.00 0.86 H new ATOM 0 HB2 SER A 107 -14.263 -6.452 12.114 1.00 0.97 H new ATOM 0 HB3 SER A 107 -13.821 -6.392 10.419 1.00 0.97 H new ATOM 0 HG SER A 107 -14.351 -8.538 11.113 1.00 1.35 H new ATOM 1707 N PRO A 108 -10.497 -7.667 10.715 1.00 0.82 N ATOM 1708 CA PRO A 108 -9.615 -8.120 9.636 1.00 0.82 C ATOM 1709 C PRO A 108 -10.210 -7.813 8.266 1.00 0.73 C ATOM 1710 O PRO A 108 -11.420 -7.934 8.059 1.00 0.81 O ATOM 1711 CB PRO A 108 -9.531 -9.626 9.867 1.00 0.91 C ATOM 1712 CG PRO A 108 -9.685 -9.780 11.340 1.00 1.07 C ATOM 1713 CD PRO A 108 -10.604 -8.672 11.788 1.00 0.92 C ATOM 0 HA PRO A 108 -8.643 -7.626 9.647 1.00 0.82 H new ATOM 0 HB2 PRO A 108 -10.316 -10.156 9.327 1.00 0.91 H new ATOM 0 HB3 PRO A 108 -8.579 -10.029 9.522 1.00 0.91 H new ATOM 0 HG2 PRO A 108 -10.103 -10.756 11.587 1.00 1.07 H new ATOM 0 HG3 PRO A 108 -8.720 -9.711 11.841 1.00 1.07 H new ATOM 0 HD2 PRO A 108 -11.629 -9.025 11.904 1.00 0.92 H new ATOM 0 HD3 PRO A 108 -10.297 -8.263 12.751 1.00 0.92 H new ATOM 1721 N ARG A 109 -9.366 -7.438 7.327 1.00 0.61 N ATOM 1722 CA ARG A 109 -9.851 -6.878 6.082 1.00 0.56 C ATOM 1723 C ARG A 109 -9.274 -7.644 4.915 1.00 0.52 C ATOM 1724 O ARG A 109 -8.085 -7.880 4.851 1.00 0.66 O ATOM 1725 CB ARG A 109 -9.500 -5.382 6.006 1.00 0.64 C ATOM 1726 CG ARG A 109 -10.009 -4.676 4.758 1.00 1.05 C ATOM 1727 CD ARG A 109 -10.072 -3.166 4.958 1.00 0.88 C ATOM 1728 NE ARG A 109 -8.745 -2.538 4.905 1.00 1.89 N ATOM 1729 CZ ARG A 109 -8.165 -1.905 5.932 1.00 2.34 C ATOM 1730 NH1 ARG A 109 -8.803 -1.781 7.093 1.00 2.06 N ATOM 1731 NH2 ARG A 109 -6.948 -1.388 5.793 1.00 3.45 N ATOM 0 H ARG A 109 -8.351 -7.509 7.400 1.00 0.61 H new ATOM 0 HA ARG A 109 -10.936 -6.968 6.039 1.00 0.56 H new ATOM 0 HB2 ARG A 109 -9.909 -4.881 6.883 1.00 0.64 H new ATOM 0 HB3 ARG A 109 -8.416 -5.273 6.053 1.00 0.64 H new ATOM 0 HG2 ARG A 109 -9.356 -4.906 3.916 1.00 1.05 H new ATOM 0 HG3 ARG A 109 -11.000 -5.052 4.504 1.00 1.05 H new ATOM 0 HD2 ARG A 109 -10.710 -2.727 4.191 1.00 0.88 H new ATOM 0 HD3 ARG A 109 -10.536 -2.949 5.920 1.00 0.88 H new ATOM 0 HE ARG A 109 -8.231 -2.588 4.026 1.00 1.89 H new ATOM 0 HH11 ARG A 109 -9.740 -2.169 7.204 1.00 2.06 H new ATOM 0 HH12 ARG A 109 -8.356 -1.298 7.872 1.00 2.06 H new ATOM 0 HH21 ARG A 109 -6.456 -1.474 4.904 1.00 3.45 H new ATOM 0 HH22 ARG A 109 -6.506 -0.906 6.576 1.00 3.45 H new ATOM 1745 N ASP A 110 -10.119 -8.039 3.999 1.00 0.46 N ATOM 1746 CA ASP A 110 -9.671 -8.837 2.874 1.00 0.47 C ATOM 1747 C ASP A 110 -9.610 -7.983 1.638 1.00 0.44 C ATOM 1748 O ASP A 110 -10.603 -7.396 1.251 1.00 0.64 O ATOM 1749 CB ASP A 110 -10.577 -10.040 2.628 1.00 0.62 C ATOM 1750 CG ASP A 110 -10.267 -10.741 1.317 1.00 0.83 C ATOM 1751 OD1 ASP A 110 -9.073 -10.952 1.022 1.00 1.37 O ATOM 1752 OD2 ASP A 110 -11.217 -11.079 0.579 1.00 1.32 O ATOM 0 H ASP A 110 -11.116 -7.826 4.004 1.00 0.46 H new ATOM 0 HA ASP A 110 -8.678 -9.217 3.113 1.00 0.47 H new ATOM 0 HB2 ASP A 110 -10.468 -10.748 3.450 1.00 0.62 H new ATOM 0 HB3 ASP A 110 -11.617 -9.713 2.625 1.00 0.62 H new ATOM 1757 N PHE A 111 -8.468 -7.950 0.997 1.00 0.39 N ATOM 1758 CA PHE A 111 -8.262 -7.038 -0.107 1.00 0.43 C ATOM 1759 C PHE A 111 -8.523 -7.729 -1.423 1.00 0.41 C ATOM 1760 O PHE A 111 -8.229 -8.909 -1.592 1.00 0.54 O ATOM 1761 CB PHE A 111 -6.826 -6.510 -0.143 1.00 0.61 C ATOM 1762 CG PHE A 111 -6.435 -5.563 0.961 1.00 0.94 C ATOM 1763 CD1 PHE A 111 -7.321 -5.208 1.964 1.00 1.36 C ATOM 1764 CD2 PHE A 111 -5.161 -5.017 0.978 1.00 1.60 C ATOM 1765 CE1 PHE A 111 -6.941 -4.327 2.959 1.00 2.01 C ATOM 1766 CE2 PHE A 111 -4.776 -4.138 1.971 1.00 2.30 C ATOM 1767 CZ PHE A 111 -5.670 -3.791 2.962 1.00 2.41 C ATOM 0 H PHE A 111 -7.667 -8.542 1.218 1.00 0.39 H new ATOM 0 HA PHE A 111 -8.956 -6.210 0.040 1.00 0.43 H new ATOM 0 HB2 PHE A 111 -6.147 -7.363 -0.119 1.00 0.61 H new ATOM 0 HB3 PHE A 111 -6.671 -6.006 -1.097 1.00 0.61 H new ATOM 0 HD1 PHE A 111 -8.318 -5.623 1.969 1.00 1.36 H new ATOM 0 HD2 PHE A 111 -4.458 -5.283 0.202 1.00 1.60 H new ATOM 0 HE1 PHE A 111 -7.641 -4.058 3.736 1.00 2.01 H new ATOM 0 HE2 PHE A 111 -3.779 -3.724 1.972 1.00 2.30 H new ATOM 0 HZ PHE A 111 -5.376 -3.101 3.739 1.00 2.41 H new ATOM 1777 N ILE A 112 -9.089 -6.966 -2.331 1.00 0.34 N ATOM 1778 CA ILE A 112 -9.236 -7.360 -3.720 1.00 0.33 C ATOM 1779 C ILE A 112 -8.913 -6.149 -4.561 1.00 0.35 C ATOM 1780 O ILE A 112 -9.750 -5.610 -5.290 1.00 0.43 O ATOM 1781 CB ILE A 112 -10.643 -7.884 -4.101 1.00 0.34 C ATOM 1782 CG1 ILE A 112 -11.080 -9.025 -3.192 1.00 0.40 C ATOM 1783 CG2 ILE A 112 -10.608 -8.378 -5.521 1.00 0.36 C ATOM 1784 CD1 ILE A 112 -10.253 -10.279 -3.400 1.00 0.42 C ATOM 0 H ILE A 112 -9.466 -6.041 -2.126 1.00 0.34 H new ATOM 0 HA ILE A 112 -8.561 -8.198 -3.895 1.00 0.33 H new ATOM 0 HB ILE A 112 -11.355 -7.067 -3.989 1.00 0.34 H new ATOM 0 HG12 ILE A 112 -11.000 -8.709 -2.152 1.00 0.40 H new ATOM 0 HG13 ILE A 112 -12.130 -9.251 -3.376 1.00 0.40 H new ATOM 0 HG21 ILE A 112 -11.594 -8.750 -5.801 1.00 0.36 H new ATOM 0 HG22 ILE A 112 -10.327 -7.560 -6.184 1.00 0.36 H new ATOM 0 HG23 ILE A 112 -9.878 -9.183 -5.608 1.00 0.36 H new ATOM 0 HD11 ILE A 112 -10.605 -11.062 -2.728 1.00 0.42 H new ATOM 0 HD12 ILE A 112 -10.354 -10.614 -4.432 1.00 0.42 H new ATOM 0 HD13 ILE A 112 -9.206 -10.063 -3.189 1.00 0.42 H new ATOM 1796 N ASP A 113 -7.696 -5.692 -4.415 1.00 0.36 N ATOM 1797 CA ASP A 113 -7.284 -4.481 -5.073 1.00 0.42 C ATOM 1798 C ASP A 113 -6.577 -4.816 -6.361 1.00 0.33 C ATOM 1799 O ASP A 113 -5.633 -5.608 -6.377 1.00 0.35 O ATOM 1800 CB ASP A 113 -6.377 -3.637 -4.176 1.00 0.58 C ATOM 1801 CG ASP A 113 -7.058 -3.201 -2.895 1.00 1.23 C ATOM 1802 OD1 ASP A 113 -8.018 -2.409 -2.968 1.00 1.86 O ATOM 1803 OD2 ASP A 113 -6.622 -3.639 -1.810 1.00 1.32 O ATOM 0 H ASP A 113 -6.976 -6.139 -3.848 1.00 0.36 H new ATOM 0 HA ASP A 113 -8.175 -3.892 -5.290 1.00 0.42 H new ATOM 0 HB2 ASP A 113 -5.483 -4.210 -3.930 1.00 0.58 H new ATOM 0 HB3 ASP A 113 -6.049 -2.755 -4.726 1.00 0.58 H new ATOM 1808 N LEU A 114 -7.055 -4.245 -7.447 1.00 0.28 N ATOM 1809 CA LEU A 114 -6.368 -4.392 -8.717 1.00 0.23 C ATOM 1810 C LEU A 114 -5.139 -3.519 -8.729 1.00 0.22 C ATOM 1811 O LEU A 114 -5.211 -2.320 -8.503 1.00 0.24 O ATOM 1812 CB LEU A 114 -7.266 -4.049 -9.886 1.00 0.23 C ATOM 1813 CG LEU A 114 -6.537 -3.735 -11.193 1.00 0.22 C ATOM 1814 CD1 LEU A 114 -6.123 -5.019 -11.893 1.00 0.21 C ATOM 1815 CD2 LEU A 114 -7.417 -2.881 -12.090 1.00 0.26 C ATOM 0 H LEU A 114 -7.905 -3.682 -7.479 1.00 0.28 H new ATOM 0 HA LEU A 114 -6.078 -5.437 -8.826 1.00 0.23 H new ATOM 0 HB2 LEU A 114 -7.946 -4.883 -10.059 1.00 0.23 H new ATOM 0 HB3 LEU A 114 -7.878 -3.189 -9.614 1.00 0.23 H new ATOM 0 HG LEU A 114 -5.632 -3.171 -10.966 1.00 0.22 H new ATOM 0 HD11 LEU A 114 -5.606 -4.777 -12.821 1.00 0.21 H new ATOM 0 HD12 LEU A 114 -5.457 -5.589 -11.244 1.00 0.21 H new ATOM 0 HD13 LEU A 114 -7.009 -5.614 -12.116 1.00 0.21 H new ATOM 0 HD21 LEU A 114 -6.888 -2.663 -13.018 1.00 0.26 H new ATOM 0 HD22 LEU A 114 -8.338 -3.419 -12.315 1.00 0.26 H new ATOM 0 HD23 LEU A 114 -7.657 -1.947 -11.582 1.00 0.26 H new ATOM 1827 N VAL A 115 -4.026 -4.120 -9.030 1.00 0.23 N ATOM 1828 CA VAL A 115 -2.750 -3.506 -8.786 1.00 0.23 C ATOM 1829 C VAL A 115 -1.889 -3.483 -10.026 1.00 0.23 C ATOM 1830 O VAL A 115 -1.707 -4.496 -10.700 1.00 0.24 O ATOM 1831 CB VAL A 115 -2.048 -4.239 -7.634 1.00 0.24 C ATOM 1832 CG1 VAL A 115 -2.587 -5.662 -7.523 1.00 0.25 C ATOM 1833 CG2 VAL A 115 -0.533 -4.235 -7.788 1.00 0.26 C ATOM 0 H VAL A 115 -3.975 -5.048 -9.451 1.00 0.23 H new ATOM 0 HA VAL A 115 -2.913 -2.466 -8.504 1.00 0.23 H new ATOM 0 HB VAL A 115 -2.267 -3.702 -6.711 1.00 0.24 H new ATOM 0 HG11 VAL A 115 -2.086 -6.178 -6.704 1.00 0.25 H new ATOM 0 HG12 VAL A 115 -3.659 -5.631 -7.330 1.00 0.25 H new ATOM 0 HG13 VAL A 115 -2.402 -6.195 -8.455 1.00 0.25 H new ATOM 0 HG21 VAL A 115 -0.081 -4.765 -6.950 1.00 0.26 H new ATOM 0 HG22 VAL A 115 -0.261 -4.730 -8.720 1.00 0.26 H new ATOM 0 HG23 VAL A 115 -0.172 -3.207 -7.805 1.00 0.26 H new ATOM 1843 N TYR A 116 -1.392 -2.308 -10.339 1.00 0.25 N ATOM 1844 CA TYR A 116 -0.474 -2.166 -11.438 1.00 0.25 C ATOM 1845 C TYR A 116 0.901 -1.773 -10.929 1.00 0.26 C ATOM 1846 O TYR A 116 1.088 -0.678 -10.393 1.00 0.28 O ATOM 1847 CB TYR A 116 -0.981 -1.124 -12.437 1.00 0.31 C ATOM 1848 CG TYR A 116 -0.275 -1.142 -13.780 1.00 0.83 C ATOM 1849 CD1 TYR A 116 1.049 -0.741 -13.902 1.00 1.10 C ATOM 1850 CD2 TYR A 116 -0.939 -1.552 -14.929 1.00 1.31 C ATOM 1851 CE1 TYR A 116 1.689 -0.752 -15.126 1.00 1.65 C ATOM 1852 CE2 TYR A 116 -0.305 -1.566 -16.156 1.00 1.87 C ATOM 1853 CZ TYR A 116 1.008 -1.165 -16.249 1.00 1.99 C ATOM 1854 OH TYR A 116 1.640 -1.174 -17.470 1.00 2.57 O ATOM 0 H TYR A 116 -1.609 -1.441 -9.848 1.00 0.25 H new ATOM 0 HA TYR A 116 -0.401 -3.127 -11.948 1.00 0.25 H new ATOM 0 HB2 TYR A 116 -2.047 -1.284 -12.599 1.00 0.31 H new ATOM 0 HB3 TYR A 116 -0.871 -0.133 -11.996 1.00 0.31 H new ATOM 0 HD1 TYR A 116 1.588 -0.415 -13.025 1.00 1.10 H new ATOM 0 HD2 TYR A 116 -1.970 -1.866 -14.862 1.00 1.31 H new ATOM 0 HE1 TYR A 116 2.720 -0.438 -15.202 1.00 1.65 H new ATOM 0 HE2 TYR A 116 -0.837 -1.890 -17.038 1.00 1.87 H new ATOM 0 HH TYR A 116 1.019 -1.493 -18.157 1.00 2.57 H new ATOM 1864 N ILE A 117 1.856 -2.665 -11.106 1.00 0.30 N ATOM 1865 CA ILE A 117 3.223 -2.408 -10.692 1.00 0.33 C ATOM 1866 C ILE A 117 3.989 -1.765 -11.844 1.00 0.38 C ATOM 1867 O ILE A 117 4.444 -2.444 -12.766 1.00 0.46 O ATOM 1868 CB ILE A 117 3.912 -3.712 -10.237 1.00 0.42 C ATOM 1869 CG1 ILE A 117 3.110 -4.345 -9.091 1.00 0.45 C ATOM 1870 CG2 ILE A 117 5.348 -3.438 -9.800 1.00 0.52 C ATOM 1871 CD1 ILE A 117 3.520 -5.761 -8.761 1.00 0.89 C ATOM 0 H ILE A 117 1.710 -3.578 -11.536 1.00 0.30 H new ATOM 0 HA ILE A 117 3.216 -1.724 -9.843 1.00 0.33 H new ATOM 0 HB ILE A 117 3.943 -4.408 -11.076 1.00 0.42 H new ATOM 0 HG12 ILE A 117 3.222 -3.728 -8.199 1.00 0.45 H new ATOM 0 HG13 ILE A 117 2.052 -4.336 -9.354 1.00 0.45 H new ATOM 0 HG21 ILE A 117 5.816 -4.370 -9.483 1.00 0.52 H new ATOM 0 HG22 ILE A 117 5.908 -3.016 -10.635 1.00 0.52 H new ATOM 0 HG23 ILE A 117 5.347 -2.732 -8.970 1.00 0.52 H new ATOM 0 HD11 ILE A 117 2.906 -6.136 -7.942 1.00 0.89 H new ATOM 0 HD12 ILE A 117 3.381 -6.394 -9.638 1.00 0.89 H new ATOM 0 HD13 ILE A 117 4.569 -5.776 -8.465 1.00 0.89 H new ATOM 1883 N LYS A 118 4.117 -0.449 -11.781 1.00 0.42 N ATOM 1884 CA LYS A 118 4.705 0.329 -12.859 1.00 0.52 C ATOM 1885 C LYS A 118 6.138 0.727 -12.525 1.00 0.39 C ATOM 1886 O LYS A 118 6.398 1.361 -11.502 1.00 0.34 O ATOM 1887 CB LYS A 118 3.857 1.581 -13.124 1.00 0.70 C ATOM 1888 CG LYS A 118 4.503 2.583 -14.072 1.00 0.93 C ATOM 1889 CD LYS A 118 4.458 2.121 -15.519 1.00 0.94 C ATOM 1890 CE LYS A 118 3.056 2.226 -16.098 1.00 0.72 C ATOM 1891 NZ LYS A 118 3.015 1.837 -17.534 1.00 1.20 N ATOM 0 H LYS A 118 3.816 0.109 -10.982 1.00 0.42 H new ATOM 0 HA LYS A 118 4.724 -0.288 -13.757 1.00 0.52 H new ATOM 0 HB2 LYS A 118 2.896 1.275 -13.537 1.00 0.70 H new ATOM 0 HB3 LYS A 118 3.653 2.076 -12.174 1.00 0.70 H new ATOM 0 HG2 LYS A 118 3.995 3.543 -13.984 1.00 0.93 H new ATOM 0 HG3 LYS A 118 5.540 2.743 -13.776 1.00 0.93 H new ATOM 0 HD2 LYS A 118 5.144 2.723 -16.115 1.00 0.94 H new ATOM 0 HD3 LYS A 118 4.802 1.089 -15.583 1.00 0.94 H new ATOM 0 HE2 LYS A 118 2.380 1.587 -15.530 1.00 0.72 H new ATOM 0 HE3 LYS A 118 2.694 3.248 -15.989 1.00 0.72 H new ATOM 0 HZ1 LYS A 118 2.448 2.529 -18.065 1.00 1.20 H new ATOM 0 HZ2 LYS A 118 3.982 1.816 -17.916 1.00 1.20 H new ATOM 0 HZ3 LYS A 118 2.586 0.894 -17.626 1.00 1.20 H new ATOM 1905 N ARG A 119 7.059 0.346 -13.392 1.00 0.52 N ATOM 1906 CA ARG A 119 8.450 0.696 -13.248 1.00 0.52 C ATOM 1907 C ARG A 119 8.788 1.812 -14.203 1.00 0.49 C ATOM 1908 O ARG A 119 9.084 1.574 -15.375 1.00 0.58 O ATOM 1909 CB ARG A 119 9.318 -0.524 -13.553 1.00 0.79 C ATOM 1910 CG ARG A 119 10.769 -0.362 -13.156 1.00 1.00 C ATOM 1911 CD ARG A 119 10.873 -0.124 -11.671 1.00 1.25 C ATOM 1912 NE ARG A 119 12.183 -0.499 -11.135 1.00 1.68 N ATOM 1913 CZ ARG A 119 12.403 -1.579 -10.384 1.00 2.18 C ATOM 1914 NH1 ARG A 119 11.427 -2.450 -10.161 1.00 2.57 N ATOM 1915 NH2 ARG A 119 13.608 -1.806 -9.881 1.00 2.80 N ATOM 0 H ARG A 119 6.856 -0.217 -14.218 1.00 0.52 H new ATOM 0 HA ARG A 119 8.639 1.025 -12.226 1.00 0.52 H new ATOM 0 HB2 ARG A 119 8.905 -1.390 -13.035 1.00 0.79 H new ATOM 0 HB3 ARG A 119 9.266 -0.736 -14.621 1.00 0.79 H new ATOM 0 HG2 ARG A 119 11.332 -1.255 -13.430 1.00 1.00 H new ATOM 0 HG3 ARG A 119 11.212 0.473 -13.699 1.00 1.00 H new ATOM 0 HD2 ARG A 119 10.686 0.929 -11.461 1.00 1.25 H new ATOM 0 HD3 ARG A 119 10.098 -0.694 -11.159 1.00 1.25 H new ATOM 0 HE ARG A 119 12.977 0.104 -11.349 1.00 1.68 H new ATOM 0 HH11 ARG A 119 10.503 -2.295 -10.565 1.00 2.57 H new ATOM 0 HH12 ARG A 119 11.601 -3.274 -9.586 1.00 2.57 H new ATOM 0 HH21 ARG A 119 14.370 -1.154 -10.068 1.00 2.80 H new ATOM 0 HH22 ARG A 119 13.774 -2.633 -9.307 1.00 2.80 H new ATOM 1929 N TYR A 120 8.696 3.030 -13.720 1.00 0.43 N ATOM 1930 CA TYR A 120 9.221 4.146 -14.457 1.00 0.46 C ATOM 1931 C TYR A 120 10.733 4.045 -14.406 1.00 0.50 C ATOM 1932 O TYR A 120 11.320 4.217 -13.345 1.00 0.48 O ATOM 1933 CB TYR A 120 8.734 5.476 -13.878 1.00 0.46 C ATOM 1934 CG TYR A 120 7.244 5.699 -14.031 1.00 0.51 C ATOM 1935 CD1 TYR A 120 6.685 5.989 -15.269 1.00 0.76 C ATOM 1936 CD2 TYR A 120 6.395 5.615 -12.934 1.00 0.58 C ATOM 1937 CE1 TYR A 120 5.325 6.187 -15.409 1.00 0.83 C ATOM 1938 CE2 TYR A 120 5.033 5.814 -13.067 1.00 0.66 C ATOM 1939 CZ TYR A 120 4.508 6.118 -14.316 1.00 0.70 C ATOM 1940 OH TYR A 120 3.147 6.296 -14.444 1.00 0.81 O ATOM 0 H TYR A 120 8.265 3.268 -12.827 1.00 0.43 H new ATOM 0 HA TYR A 120 8.871 4.117 -15.489 1.00 0.46 H new ATOM 0 HB2 TYR A 120 8.991 5.517 -12.820 1.00 0.46 H new ATOM 0 HB3 TYR A 120 9.266 6.292 -14.367 1.00 0.46 H new ATOM 0 HD1 TYR A 120 7.324 6.061 -16.137 1.00 0.76 H new ATOM 0 HD2 TYR A 120 6.806 5.390 -11.961 1.00 0.58 H new ATOM 0 HE1 TYR A 120 4.907 6.396 -16.383 1.00 0.83 H new ATOM 0 HE2 TYR A 120 4.384 5.734 -12.208 1.00 0.66 H new ATOM 0 HH TYR A 120 2.722 6.212 -13.565 1.00 0.81 H new ATOM 1950 N GLU A 121 11.304 3.651 -15.542 1.00 0.61 N ATOM 1951 CA GLU A 121 12.750 3.445 -15.742 1.00 0.73 C ATOM 1952 C GLU A 121 13.622 4.278 -14.806 1.00 0.70 C ATOM 1953 O GLU A 121 13.957 5.425 -15.106 1.00 0.79 O ATOM 1954 CB GLU A 121 13.122 3.771 -17.190 1.00 0.96 C ATOM 1955 CG GLU A 121 12.310 3.009 -18.222 1.00 1.06 C ATOM 1956 CD GLU A 121 12.445 1.510 -18.083 1.00 1.69 C ATOM 1957 OE1 GLU A 121 13.448 0.951 -18.563 1.00 2.28 O ATOM 1958 OE2 GLU A 121 11.551 0.881 -17.484 1.00 2.27 O ATOM 0 H GLU A 121 10.760 3.458 -16.383 1.00 0.61 H new ATOM 0 HA GLU A 121 12.944 2.397 -15.512 1.00 0.73 H new ATOM 0 HB2 GLU A 121 12.990 4.840 -17.356 1.00 0.96 H new ATOM 0 HB3 GLU A 121 14.179 3.553 -17.341 1.00 0.96 H new ATOM 0 HG2 GLU A 121 11.260 3.285 -18.127 1.00 1.06 H new ATOM 0 HG3 GLU A 121 12.629 3.307 -19.221 1.00 1.06 H new ATOM 1965 N GLY A 122 13.983 3.674 -13.677 1.00 0.67 N ATOM 1966 CA GLY A 122 14.833 4.324 -12.693 1.00 0.71 C ATOM 1967 C GLY A 122 14.292 5.667 -12.272 1.00 0.66 C ATOM 1968 O GLY A 122 15.031 6.645 -12.147 1.00 0.76 O ATOM 0 H GLY A 122 13.696 2.729 -13.423 1.00 0.67 H new ATOM 0 HA2 GLY A 122 14.929 3.682 -11.817 1.00 0.71 H new ATOM 0 HA3 GLY A 122 15.834 4.451 -13.107 1.00 0.71 H new ATOM 1972 N ASN A 123 12.995 5.701 -12.051 1.00 0.57 N ATOM 1973 CA ASN A 123 12.294 6.929 -11.746 1.00 0.54 C ATOM 1974 C ASN A 123 11.265 6.699 -10.655 1.00 0.45 C ATOM 1975 O ASN A 123 11.203 7.464 -9.696 1.00 0.45 O ATOM 1976 CB ASN A 123 11.607 7.462 -13.002 1.00 0.60 C ATOM 1977 CG ASN A 123 10.880 8.778 -12.775 1.00 1.01 C ATOM 1978 OD1 ASN A 123 9.833 9.029 -13.375 1.00 1.65 O ATOM 1979 ND2 ASN A 123 11.435 9.639 -11.935 1.00 1.61 N ATOM 0 H ASN A 123 12.396 4.876 -12.078 1.00 0.57 H new ATOM 0 HA ASN A 123 13.018 7.663 -11.392 1.00 0.54 H new ATOM 0 HB2 ASN A 123 12.352 7.597 -13.786 1.00 0.60 H new ATOM 0 HB3 ASN A 123 10.896 6.719 -13.362 1.00 0.60 H new ATOM 0 HD21 ASN A 123 10.995 10.544 -11.767 1.00 1.61 H new ATOM 0 HD22 ASN A 123 12.302 9.397 -11.456 1.00 1.61 H new ATOM 1986 N MET A 124 10.458 5.644 -10.791 1.00 0.39 N ATOM 1987 CA MET A 124 9.411 5.374 -9.814 1.00 0.34 C ATOM 1988 C MET A 124 8.946 3.934 -9.903 1.00 0.33 C ATOM 1989 O MET A 124 8.485 3.481 -10.951 1.00 0.40 O ATOM 1990 CB MET A 124 8.229 6.332 -10.000 1.00 0.34 C ATOM 1991 CG MET A 124 8.271 7.538 -9.071 1.00 0.56 C ATOM 1992 SD MET A 124 7.666 9.043 -9.860 1.00 1.09 S ATOM 1993 CE MET A 124 7.968 10.240 -8.565 1.00 1.12 C ATOM 0 H MET A 124 10.511 4.974 -11.558 1.00 0.39 H new ATOM 0 HA MET A 124 9.831 5.537 -8.821 1.00 0.34 H new ATOM 0 HB2 MET A 124 8.213 6.680 -11.033 1.00 0.34 H new ATOM 0 HB3 MET A 124 7.300 5.787 -9.833 1.00 0.34 H new ATOM 0 HG2 MET A 124 7.671 7.330 -8.185 1.00 0.56 H new ATOM 0 HG3 MET A 124 9.295 7.696 -8.733 1.00 0.56 H new ATOM 0 HE1 MET A 124 7.646 11.226 -8.899 1.00 1.12 H new ATOM 0 HE2 MET A 124 7.409 9.959 -7.672 1.00 1.12 H new ATOM 0 HE3 MET A 124 9.033 10.265 -8.334 1.00 1.12 H new ATOM 2003 N ASN A 125 9.076 3.226 -8.797 1.00 0.34 N ATOM 2004 CA ASN A 125 8.707 1.826 -8.733 1.00 0.37 C ATOM 2005 C ASN A 125 7.414 1.705 -7.944 1.00 0.32 C ATOM 2006 O ASN A 125 7.410 1.324 -6.775 1.00 0.37 O ATOM 2007 CB ASN A 125 9.824 0.999 -8.075 1.00 0.50 C ATOM 2008 CG ASN A 125 11.219 1.407 -8.535 1.00 0.95 C ATOM 2009 OD1 ASN A 125 11.400 1.969 -9.614 1.00 1.58 O ATOM 2010 ND2 ASN A 125 12.221 1.109 -7.728 1.00 1.62 N ATOM 0 H ASN A 125 9.439 3.604 -7.922 1.00 0.34 H new ATOM 0 HA ASN A 125 8.562 1.437 -9.741 1.00 0.37 H new ATOM 0 HB2 ASN A 125 9.759 1.107 -6.992 1.00 0.50 H new ATOM 0 HB3 ASN A 125 9.668 -0.056 -8.300 1.00 0.50 H new ATOM 0 HD21 ASN A 125 13.177 1.345 -7.993 1.00 1.62 H new ATOM 0 HD22 ASN A 125 12.039 0.643 -6.839 1.00 1.62 H new ATOM 2017 N ILE A 126 6.327 2.080 -8.593 1.00 0.26 N ATOM 2018 CA ILE A 126 5.030 2.190 -7.946 1.00 0.23 C ATOM 2019 C ILE A 126 4.161 0.955 -8.148 1.00 0.27 C ATOM 2020 O ILE A 126 4.148 0.364 -9.225 1.00 0.30 O ATOM 2021 CB ILE A 126 4.258 3.415 -8.489 1.00 0.22 C ATOM 2022 CG1 ILE A 126 2.780 3.344 -8.083 1.00 0.24 C ATOM 2023 CG2 ILE A 126 4.424 3.530 -9.994 1.00 0.24 C ATOM 2024 CD1 ILE A 126 1.871 4.291 -8.841 1.00 0.26 C ATOM 0 H ILE A 126 6.317 2.317 -9.585 1.00 0.26 H new ATOM 0 HA ILE A 126 5.233 2.298 -6.881 1.00 0.23 H new ATOM 0 HB ILE A 126 4.678 4.318 -8.045 1.00 0.22 H new ATOM 0 HG12 ILE A 126 2.425 2.324 -8.231 1.00 0.24 H new ATOM 0 HG13 ILE A 126 2.699 3.558 -7.017 1.00 0.24 H new ATOM 0 HG21 ILE A 126 3.873 4.398 -10.356 1.00 0.24 H new ATOM 0 HG22 ILE A 126 5.481 3.644 -10.236 1.00 0.24 H new ATOM 0 HG23 ILE A 126 4.038 2.630 -10.472 1.00 0.24 H new ATOM 0 HD11 ILE A 126 0.846 4.172 -8.489 1.00 0.26 H new ATOM 0 HD12 ILE A 126 2.195 5.318 -8.674 1.00 0.26 H new ATOM 0 HD13 ILE A 126 1.917 4.065 -9.906 1.00 0.26 H new ATOM 2036 N ILE A 127 3.430 0.574 -7.108 1.00 0.30 N ATOM 2037 CA ILE A 127 2.324 -0.350 -7.273 1.00 0.34 C ATOM 2038 C ILE A 127 1.006 0.407 -7.066 1.00 0.38 C ATOM 2039 O ILE A 127 0.696 0.878 -5.976 1.00 0.45 O ATOM 2040 CB ILE A 127 2.411 -1.594 -6.342 1.00 0.41 C ATOM 2041 CG1 ILE A 127 2.053 -1.265 -4.890 1.00 0.42 C ATOM 2042 CG2 ILE A 127 3.816 -2.181 -6.393 1.00 0.50 C ATOM 2043 CD1 ILE A 127 1.603 -2.474 -4.100 1.00 0.59 C ATOM 0 H ILE A 127 3.584 0.889 -6.150 1.00 0.30 H new ATOM 0 HA ILE A 127 2.373 -0.746 -8.287 1.00 0.34 H new ATOM 0 HB ILE A 127 1.683 -2.318 -6.707 1.00 0.41 H new ATOM 0 HG12 ILE A 127 2.920 -0.821 -4.400 1.00 0.42 H new ATOM 0 HG13 ILE A 127 1.261 -0.516 -4.878 1.00 0.42 H new ATOM 0 HG21 ILE A 127 3.871 -3.051 -5.739 1.00 0.50 H new ATOM 0 HG22 ILE A 127 4.049 -2.480 -7.415 1.00 0.50 H new ATOM 0 HG23 ILE A 127 4.535 -1.432 -6.061 1.00 0.50 H new ATOM 0 HD11 ILE A 127 1.364 -2.174 -3.080 1.00 0.59 H new ATOM 0 HD12 ILE A 127 0.718 -2.906 -4.568 1.00 0.59 H new ATOM 0 HD13 ILE A 127 2.402 -3.215 -4.082 1.00 0.59 H new ATOM 2055 N SER A 128 0.276 0.606 -8.146 1.00 0.39 N ATOM 2056 CA SER A 128 -0.991 1.315 -8.087 1.00 0.50 C ATOM 2057 C SER A 128 -2.156 0.340 -7.963 1.00 0.55 C ATOM 2058 O SER A 128 -2.409 -0.464 -8.854 1.00 1.00 O ATOM 2059 CB SER A 128 -1.154 2.192 -9.323 1.00 0.68 C ATOM 2060 OG SER A 128 -1.027 1.432 -10.513 1.00 1.18 O ATOM 0 H SER A 128 0.538 0.286 -9.078 1.00 0.39 H new ATOM 0 HA SER A 128 -0.992 1.950 -7.201 1.00 0.50 H new ATOM 0 HB2 SER A 128 -2.130 2.677 -9.301 1.00 0.68 H new ATOM 0 HB3 SER A 128 -0.404 2.983 -9.312 1.00 0.68 H new ATOM 0 HG SER A 128 -1.561 1.845 -11.224 1.00 1.18 H new ATOM 2066 N SER A 129 -2.878 0.437 -6.874 1.00 0.30 N ATOM 2067 CA SER A 129 -3.946 -0.501 -6.573 1.00 0.31 C ATOM 2068 C SER A 129 -5.316 0.188 -6.579 1.00 0.31 C ATOM 2069 O SER A 129 -5.425 1.386 -6.346 1.00 0.43 O ATOM 2070 CB SER A 129 -3.673 -1.168 -5.224 1.00 0.40 C ATOM 2071 OG SER A 129 -2.383 -1.759 -5.206 1.00 1.24 O ATOM 0 H SER A 129 -2.747 1.163 -6.170 1.00 0.30 H new ATOM 0 HA SER A 129 -3.969 -1.264 -7.351 1.00 0.31 H new ATOM 0 HB2 SER A 129 -3.751 -0.430 -4.426 1.00 0.40 H new ATOM 0 HB3 SER A 129 -4.429 -1.929 -5.030 1.00 0.40 H new ATOM 0 HG SER A 129 -2.228 -2.179 -4.334 1.00 1.24 H new ATOM 2077 N LYS A 130 -6.348 -0.581 -6.900 1.00 0.27 N ATOM 2078 CA LYS A 130 -7.720 -0.090 -6.954 1.00 0.32 C ATOM 2079 C LYS A 130 -8.634 -1.146 -6.400 1.00 0.37 C ATOM 2080 O LYS A 130 -8.580 -2.288 -6.834 1.00 0.41 O ATOM 2081 CB LYS A 130 -8.166 0.179 -8.389 1.00 0.40 C ATOM 2082 CG LYS A 130 -7.393 1.258 -9.107 1.00 0.90 C ATOM 2083 CD LYS A 130 -7.096 0.834 -10.529 1.00 0.80 C ATOM 2084 CE LYS A 130 -6.073 -0.285 -10.562 1.00 1.42 C ATOM 2085 NZ LYS A 130 -4.806 0.096 -9.891 1.00 2.26 N ATOM 0 H LYS A 130 -6.257 -1.570 -7.132 1.00 0.27 H new ATOM 0 HA LYS A 130 -7.763 0.836 -6.381 1.00 0.32 H new ATOM 0 HB2 LYS A 130 -8.083 -0.747 -8.959 1.00 0.40 H new ATOM 0 HB3 LYS A 130 -9.221 0.454 -8.380 1.00 0.40 H new ATOM 0 HG2 LYS A 130 -7.966 2.185 -9.109 1.00 0.90 H new ATOM 0 HG3 LYS A 130 -6.461 1.460 -8.579 1.00 0.90 H new ATOM 0 HD2 LYS A 130 -8.015 0.505 -11.013 1.00 0.80 H new ATOM 0 HD3 LYS A 130 -6.725 1.687 -11.096 1.00 0.80 H new ATOM 0 HE2 LYS A 130 -6.488 -1.169 -10.077 1.00 1.42 H new ATOM 0 HE3 LYS A 130 -5.867 -0.556 -11.597 1.00 1.42 H new ATOM 0 HZ1 LYS A 130 -4.403 -0.735 -9.413 1.00 2.26 H new ATOM 0 HZ2 LYS A 130 -4.131 0.450 -10.599 1.00 2.26 H new ATOM 0 HZ3 LYS A 130 -4.995 0.841 -9.190 1.00 2.26 H new ATOM 2099 N SER A 131 -9.493 -0.779 -5.493 1.00 0.41 N ATOM 2100 CA SER A 131 -10.400 -1.730 -4.931 1.00 0.44 C ATOM 2101 C SER A 131 -11.462 -2.049 -5.949 1.00 0.41 C ATOM 2102 O SER A 131 -12.387 -1.261 -6.173 1.00 0.47 O ATOM 2103 CB SER A 131 -10.996 -1.177 -3.656 1.00 0.56 C ATOM 2104 OG SER A 131 -11.517 0.127 -3.848 1.00 1.39 O ATOM 0 H SER A 131 -9.582 0.170 -5.129 1.00 0.41 H new ATOM 0 HA SER A 131 -9.877 -2.652 -4.676 1.00 0.44 H new ATOM 0 HB2 SER A 131 -11.789 -1.839 -3.307 1.00 0.56 H new ATOM 0 HB3 SER A 131 -10.234 -1.154 -2.877 1.00 0.56 H new ATOM 0 HG SER A 131 -11.949 0.181 -4.726 1.00 1.39 H new ATOM 2110 N VAL A 132 -11.317 -3.181 -6.595 1.00 0.35 N ATOM 2111 CA VAL A 132 -12.240 -3.540 -7.627 1.00 0.36 C ATOM 2112 C VAL A 132 -13.169 -4.623 -7.140 1.00 0.37 C ATOM 2113 O VAL A 132 -12.999 -5.162 -6.046 1.00 0.46 O ATOM 2114 CB VAL A 132 -11.571 -4.018 -8.927 1.00 0.40 C ATOM 2115 CG1 VAL A 132 -11.148 -2.850 -9.795 1.00 0.88 C ATOM 2116 CG2 VAL A 132 -10.386 -4.896 -8.634 1.00 1.05 C ATOM 0 H VAL A 132 -10.575 -3.859 -6.422 1.00 0.35 H new ATOM 0 HA VAL A 132 -12.785 -2.626 -7.861 1.00 0.36 H new ATOM 0 HB VAL A 132 -12.312 -4.601 -9.474 1.00 0.40 H new ATOM 0 HG11 VAL A 132 -10.679 -3.224 -10.705 1.00 0.88 H new ATOM 0 HG12 VAL A 132 -12.023 -2.255 -10.056 1.00 0.88 H new ATOM 0 HG13 VAL A 132 -10.437 -2.230 -9.249 1.00 0.88 H new ATOM 0 HG21 VAL A 132 -9.932 -5.219 -9.571 1.00 1.05 H new ATOM 0 HG22 VAL A 132 -9.654 -4.337 -8.051 1.00 1.05 H new ATOM 0 HG23 VAL A 132 -10.711 -5.769 -8.068 1.00 1.05 H new ATOM 2126 N ASP A 133 -14.145 -4.945 -7.951 1.00 0.39 N ATOM 2127 CA ASP A 133 -15.160 -5.886 -7.557 1.00 0.43 C ATOM 2128 C ASP A 133 -15.417 -6.851 -8.693 1.00 0.43 C ATOM 2129 O ASP A 133 -16.487 -6.877 -9.298 1.00 0.59 O ATOM 2130 CB ASP A 133 -16.401 -5.111 -7.171 1.00 0.54 C ATOM 2131 CG ASP A 133 -17.341 -5.900 -6.283 1.00 1.27 C ATOM 2132 OD1 ASP A 133 -18.103 -6.742 -6.803 1.00 1.39 O ATOM 2133 OD2 ASP A 133 -17.334 -5.670 -5.052 1.00 2.17 O ATOM 0 H ASP A 133 -14.257 -4.567 -8.892 1.00 0.39 H new ATOM 0 HA ASP A 133 -14.842 -6.476 -6.697 1.00 0.43 H new ATOM 0 HB2 ASP A 133 -16.106 -4.197 -6.656 1.00 0.54 H new ATOM 0 HB3 ASP A 133 -16.931 -4.811 -8.075 1.00 0.54 H new ATOM 2138 N PHE A 134 -14.393 -7.627 -8.981 1.00 0.35 N ATOM 2139 CA PHE A 134 -14.403 -8.556 -10.096 1.00 0.40 C ATOM 2140 C PHE A 134 -14.775 -9.948 -9.577 1.00 0.46 C ATOM 2141 O PHE A 134 -14.544 -10.257 -8.406 1.00 0.50 O ATOM 2142 CB PHE A 134 -13.027 -8.542 -10.789 1.00 0.39 C ATOM 2143 CG PHE A 134 -12.004 -9.371 -10.084 1.00 0.38 C ATOM 2144 CD1 PHE A 134 -11.710 -9.150 -8.753 1.00 0.36 C ATOM 2145 CD2 PHE A 134 -11.300 -10.337 -10.768 1.00 0.51 C ATOM 2146 CE1 PHE A 134 -10.723 -9.882 -8.130 1.00 0.42 C ATOM 2147 CE2 PHE A 134 -10.327 -11.066 -10.148 1.00 0.53 C ATOM 2148 CZ PHE A 134 -10.205 -10.960 -8.727 1.00 0.45 C ATOM 0 H PHE A 134 -13.524 -7.632 -8.446 1.00 0.35 H new ATOM 0 HA PHE A 134 -15.145 -8.263 -10.838 1.00 0.40 H new ATOM 0 HB2 PHE A 134 -13.138 -8.905 -11.811 1.00 0.39 H new ATOM 0 HB3 PHE A 134 -12.670 -7.514 -10.853 1.00 0.39 H new ATOM 0 HD1 PHE A 134 -12.256 -8.401 -8.199 1.00 0.36 H new ATOM 0 HD2 PHE A 134 -11.521 -10.520 -11.809 1.00 0.51 H new ATOM 0 HE1 PHE A 134 -10.366 -9.584 -7.155 1.00 0.42 H new ATOM 0 HE2 PHE A 134 -9.667 -11.706 -10.715 1.00 0.53 H new ATOM 0 HZ PHE A 134 -9.709 -11.729 -8.153 1.00 0.45 H new ATOM 2158 N PRO A 135 -15.355 -10.807 -10.421 1.00 0.61 N ATOM 2159 CA PRO A 135 -16.011 -12.028 -9.957 1.00 0.75 C ATOM 2160 C PRO A 135 -15.108 -13.235 -9.711 1.00 0.92 C ATOM 2161 O PRO A 135 -15.617 -14.319 -9.420 1.00 1.13 O ATOM 2162 CB PRO A 135 -16.947 -12.362 -11.092 1.00 1.28 C ATOM 2163 CG PRO A 135 -16.274 -11.840 -12.318 1.00 1.19 C ATOM 2164 CD PRO A 135 -15.451 -10.654 -11.885 1.00 0.76 C ATOM 0 HA PRO A 135 -16.461 -11.839 -8.982 1.00 0.75 H new ATOM 0 HB2 PRO A 135 -17.114 -13.437 -11.162 1.00 1.28 H new ATOM 0 HB3 PRO A 135 -17.922 -11.896 -10.949 1.00 1.28 H new ATOM 0 HG2 PRO A 135 -15.643 -12.606 -12.769 1.00 1.19 H new ATOM 0 HG3 PRO A 135 -17.008 -11.549 -13.069 1.00 1.19 H new ATOM 0 HD2 PRO A 135 -14.467 -10.658 -12.353 1.00 0.76 H new ATOM 0 HD3 PRO A 135 -15.930 -9.714 -12.158 1.00 0.76 H new ATOM 2172 N GLU A 136 -13.795 -13.094 -9.819 1.00 1.10 N ATOM 2173 CA GLU A 136 -12.925 -14.212 -9.564 1.00 1.59 C ATOM 2174 C GLU A 136 -12.838 -14.421 -8.070 1.00 1.68 C ATOM 2175 O GLU A 136 -12.421 -15.481 -7.597 1.00 2.17 O ATOM 2176 CB GLU A 136 -11.563 -13.947 -10.164 1.00 1.78 C ATOM 2177 CG GLU A 136 -10.660 -15.151 -10.229 1.00 2.38 C ATOM 2178 CD GLU A 136 -11.252 -16.291 -11.031 1.00 3.03 C ATOM 2179 OE1 GLU A 136 -11.344 -16.169 -12.269 1.00 3.50 O ATOM 2180 OE2 GLU A 136 -11.639 -17.312 -10.428 1.00 3.30 O ATOM 0 H GLU A 136 -13.323 -12.228 -10.078 1.00 1.10 H new ATOM 0 HA GLU A 136 -13.319 -15.117 -10.025 1.00 1.59 H new ATOM 0 HB2 GLU A 136 -11.695 -13.554 -11.172 1.00 1.78 H new ATOM 0 HB3 GLU A 136 -11.069 -13.170 -9.581 1.00 1.78 H new ATOM 0 HG2 GLU A 136 -9.707 -14.860 -10.670 1.00 2.38 H new ATOM 0 HG3 GLU A 136 -10.450 -15.496 -9.217 1.00 2.38 H new ATOM 2187 N TYR A 137 -13.259 -13.406 -7.323 1.00 1.38 N ATOM 2188 CA TYR A 137 -13.314 -13.550 -5.876 1.00 1.79 C ATOM 2189 C TYR A 137 -14.299 -12.591 -5.210 1.00 1.42 C ATOM 2190 O TYR A 137 -14.120 -11.375 -5.247 1.00 1.58 O ATOM 2191 CB TYR A 137 -11.933 -13.362 -5.275 1.00 2.49 C ATOM 2192 CG TYR A 137 -11.808 -14.017 -3.916 1.00 3.43 C ATOM 2193 CD1 TYR A 137 -11.407 -15.341 -3.794 1.00 4.47 C ATOM 2194 CD2 TYR A 137 -12.061 -13.298 -2.756 1.00 3.49 C ATOM 2195 CE1 TYR A 137 -11.265 -15.931 -2.554 1.00 5.35 C ATOM 2196 CE2 TYR A 137 -11.924 -13.881 -1.512 1.00 4.37 C ATOM 2197 CZ TYR A 137 -11.631 -15.239 -1.426 1.00 5.22 C ATOM 2198 OH TYR A 137 -11.382 -15.780 -0.176 1.00 6.12 O ATOM 0 H TYR A 137 -13.559 -12.500 -7.683 1.00 1.38 H new ATOM 0 HA TYR A 137 -13.674 -14.561 -5.683 1.00 1.79 H new ATOM 0 HB2 TYR A 137 -11.185 -13.781 -5.949 1.00 2.49 H new ATOM 0 HB3 TYR A 137 -11.720 -12.297 -5.184 1.00 2.49 H new ATOM 0 HD1 TYR A 137 -11.203 -15.918 -4.684 1.00 4.47 H new ATOM 0 HD2 TYR A 137 -12.370 -12.266 -2.828 1.00 3.49 H new ATOM 0 HE1 TYR A 137 -10.868 -16.932 -2.472 1.00 5.35 H new ATOM 0 HE2 TYR A 137 -12.043 -13.290 -0.616 1.00 4.37 H new ATOM 0 HH TYR A 137 -11.701 -15.164 0.516 1.00 6.12 H new ATOM 2208 N PRO A 138 -15.359 -13.144 -4.603 1.00 1.33 N ATOM 2209 CA PRO A 138 -16.270 -12.406 -3.735 1.00 1.10 C ATOM 2210 C PRO A 138 -15.884 -12.542 -2.252 1.00 0.99 C ATOM 2211 O PRO A 138 -15.498 -13.622 -1.796 1.00 0.99 O ATOM 2212 CB PRO A 138 -17.601 -13.100 -4.012 1.00 0.97 C ATOM 2213 CG PRO A 138 -17.247 -14.519 -4.339 1.00 1.56 C ATOM 2214 CD PRO A 138 -15.788 -14.544 -4.743 1.00 1.77 C ATOM 0 HA PRO A 138 -16.274 -11.333 -3.927 1.00 1.10 H new ATOM 0 HB2 PRO A 138 -18.259 -13.049 -3.145 1.00 0.97 H new ATOM 0 HB3 PRO A 138 -18.127 -12.625 -4.840 1.00 0.97 H new ATOM 0 HG2 PRO A 138 -17.417 -15.165 -3.477 1.00 1.56 H new ATOM 0 HG3 PRO A 138 -17.875 -14.894 -5.147 1.00 1.56 H new ATOM 0 HD2 PRO A 138 -15.207 -15.206 -4.101 1.00 1.77 H new ATOM 0 HD3 PRO A 138 -15.662 -14.900 -5.765 1.00 1.77 H new ATOM 2222 N PRO A 139 -15.976 -11.447 -1.481 1.00 0.96 N ATOM 2223 CA PRO A 139 -15.598 -11.444 -0.066 1.00 0.91 C ATOM 2224 C PRO A 139 -16.685 -12.019 0.844 1.00 1.00 C ATOM 2225 O PRO A 139 -17.626 -12.666 0.385 1.00 1.25 O ATOM 2226 CB PRO A 139 -15.400 -9.960 0.228 1.00 0.82 C ATOM 2227 CG PRO A 139 -16.367 -9.277 -0.676 1.00 0.89 C ATOM 2228 CD PRO A 139 -16.445 -10.121 -1.924 1.00 1.06 C ATOM 0 HA PRO A 139 -14.722 -12.065 0.121 1.00 0.91 H new ATOM 0 HB2 PRO A 139 -15.602 -9.731 1.274 1.00 0.82 H new ATOM 0 HB3 PRO A 139 -14.376 -9.647 0.025 1.00 0.82 H new ATOM 0 HG2 PRO A 139 -17.346 -9.189 -0.204 1.00 0.89 H new ATOM 0 HG3 PRO A 139 -16.034 -8.266 -0.910 1.00 0.89 H new ATOM 0 HD2 PRO A 139 -17.462 -10.166 -2.314 1.00 1.06 H new ATOM 0 HD3 PRO A 139 -15.816 -9.719 -2.719 1.00 1.06 H new ATOM 2236 N SER A 140 -16.539 -11.773 2.137 1.00 0.90 N ATOM 2237 CA SER A 140 -17.483 -12.231 3.139 1.00 1.01 C ATOM 2238 C SER A 140 -17.515 -11.202 4.257 1.00 1.01 C ATOM 2239 O SER A 140 -16.532 -10.515 4.484 1.00 1.13 O ATOM 2240 CB SER A 140 -17.057 -13.599 3.676 1.00 1.09 C ATOM 2241 OG SER A 140 -16.913 -14.537 2.623 1.00 1.60 O ATOM 0 H SER A 140 -15.755 -11.246 2.521 1.00 0.90 H new ATOM 0 HA SER A 140 -18.477 -12.339 2.705 1.00 1.01 H new ATOM 0 HB2 SER A 140 -16.114 -13.504 4.215 1.00 1.09 H new ATOM 0 HB3 SER A 140 -17.797 -13.960 4.390 1.00 1.09 H new ATOM 0 HG SER A 140 -16.639 -15.403 2.991 1.00 1.60 H new ATOM 2247 N SER A 141 -18.640 -11.105 4.952 1.00 1.07 N ATOM 2248 CA SER A 141 -18.903 -9.990 5.859 1.00 1.19 C ATOM 2249 C SER A 141 -17.889 -9.901 7.008 1.00 1.07 C ATOM 2250 O SER A 141 -17.788 -8.864 7.667 1.00 1.22 O ATOM 2251 CB SER A 141 -20.327 -10.101 6.415 1.00 1.47 C ATOM 2252 OG SER A 141 -20.706 -8.932 7.122 1.00 1.97 O ATOM 0 H SER A 141 -19.393 -11.791 4.906 1.00 1.07 H new ATOM 0 HA SER A 141 -18.799 -9.072 5.280 1.00 1.19 H new ATOM 0 HB2 SER A 141 -21.025 -10.273 5.596 1.00 1.47 H new ATOM 0 HB3 SER A 141 -20.393 -10.964 7.077 1.00 1.47 H new ATOM 0 HG SER A 141 -19.906 -8.489 7.475 1.00 1.97 H new ATOM 2258 N ASN A 142 -17.151 -10.980 7.249 1.00 0.97 N ATOM 2259 CA ASN A 142 -16.116 -10.986 8.283 1.00 0.95 C ATOM 2260 C ASN A 142 -14.818 -10.378 7.759 1.00 0.86 C ATOM 2261 O ASN A 142 -13.948 -9.980 8.533 1.00 1.07 O ATOM 2262 CB ASN A 142 -15.853 -12.410 8.778 1.00 1.01 C ATOM 2263 CG ASN A 142 -16.980 -12.953 9.638 1.00 1.37 C ATOM 2264 OD1 ASN A 142 -18.144 -12.584 9.470 1.00 2.18 O ATOM 2265 ND2 ASN A 142 -16.646 -13.842 10.559 1.00 1.73 N ATOM 0 H ASN A 142 -17.248 -11.861 6.745 1.00 0.97 H new ATOM 0 HA ASN A 142 -16.477 -10.381 9.115 1.00 0.95 H new ATOM 0 HB2 ASN A 142 -15.708 -13.067 7.920 1.00 1.01 H new ATOM 0 HB3 ASN A 142 -14.926 -12.425 9.351 1.00 1.01 H new ATOM 0 HD21 ASN A 142 -17.363 -14.247 11.160 1.00 1.73 H new ATOM 0 HD22 ASN A 142 -15.671 -14.122 10.668 1.00 1.73 H new ATOM 2272 N TYR A 143 -14.704 -10.314 6.441 1.00 0.71 N ATOM 2273 CA TYR A 143 -13.527 -9.768 5.779 1.00 0.67 C ATOM 2274 C TYR A 143 -13.948 -8.770 4.729 1.00 0.61 C ATOM 2275 O TYR A 143 -14.451 -9.138 3.668 1.00 0.67 O ATOM 2276 CB TYR A 143 -12.702 -10.879 5.135 1.00 0.76 C ATOM 2277 CG TYR A 143 -12.057 -11.817 6.128 1.00 0.84 C ATOM 2278 CD1 TYR A 143 -10.875 -11.466 6.766 1.00 0.91 C ATOM 2279 CD2 TYR A 143 -12.626 -13.049 6.428 1.00 0.97 C ATOM 2280 CE1 TYR A 143 -10.278 -12.313 7.677 1.00 1.02 C ATOM 2281 CE2 TYR A 143 -12.033 -13.902 7.340 1.00 1.09 C ATOM 2282 CZ TYR A 143 -10.859 -13.529 7.961 1.00 1.09 C ATOM 2283 OH TYR A 143 -10.267 -14.372 8.875 1.00 1.23 O ATOM 0 H TYR A 143 -15.426 -10.640 5.798 1.00 0.71 H new ATOM 0 HA TYR A 143 -12.910 -9.270 6.527 1.00 0.67 H new ATOM 0 HB2 TYR A 143 -13.344 -11.456 4.470 1.00 0.76 H new ATOM 0 HB3 TYR A 143 -11.925 -10.429 4.517 1.00 0.76 H new ATOM 0 HD1 TYR A 143 -10.415 -10.514 6.546 1.00 0.91 H new ATOM 0 HD2 TYR A 143 -13.544 -13.344 5.942 1.00 0.97 H new ATOM 0 HE1 TYR A 143 -9.359 -12.024 8.165 1.00 1.02 H new ATOM 0 HE2 TYR A 143 -12.487 -14.856 7.565 1.00 1.09 H new ATOM 0 HH TYR A 143 -10.803 -15.188 8.962 1.00 1.23 H new ATOM 2293 N ILE A 144 -13.688 -7.511 5.000 1.00 0.56 N ATOM 2294 CA ILE A 144 -14.243 -6.463 4.188 1.00 0.53 C ATOM 2295 C ILE A 144 -13.310 -6.160 3.044 1.00 0.46 C ATOM 2296 O ILE A 144 -12.168 -5.767 3.256 1.00 0.47 O ATOM 2297 CB ILE A 144 -14.554 -5.184 5.009 1.00 0.61 C ATOM 2298 CG1 ILE A 144 -14.798 -3.999 4.071 1.00 0.62 C ATOM 2299 CG2 ILE A 144 -13.448 -4.873 6.007 1.00 0.68 C ATOM 2300 CD1 ILE A 144 -16.034 -4.157 3.209 1.00 0.82 C ATOM 0 H ILE A 144 -13.100 -7.194 5.771 1.00 0.56 H new ATOM 0 HA ILE A 144 -15.196 -6.814 3.791 1.00 0.53 H new ATOM 0 HB ILE A 144 -15.462 -5.366 5.584 1.00 0.61 H new ATOM 0 HG12 ILE A 144 -14.892 -3.089 4.664 1.00 0.62 H new ATOM 0 HG13 ILE A 144 -13.929 -3.871 3.426 1.00 0.62 H new ATOM 0 HG21 ILE A 144 -13.703 -3.970 6.563 1.00 0.68 H new ATOM 0 HG22 ILE A 144 -13.338 -5.707 6.700 1.00 0.68 H new ATOM 0 HG23 ILE A 144 -12.510 -4.718 5.474 1.00 0.68 H new ATOM 0 HD11 ILE A 144 -16.146 -3.282 2.569 1.00 0.82 H new ATOM 0 HD12 ILE A 144 -15.934 -5.048 2.590 1.00 0.82 H new ATOM 0 HD13 ILE A 144 -16.912 -4.255 3.847 1.00 0.82 H new ATOM 2312 N ARG A 145 -13.801 -6.437 1.843 1.00 0.43 N ATOM 2313 CA ARG A 145 -13.087 -6.136 0.608 1.00 0.41 C ATOM 2314 C ARG A 145 -12.312 -4.833 0.728 1.00 0.45 C ATOM 2315 O ARG A 145 -12.901 -3.765 0.922 1.00 0.48 O ATOM 2316 CB ARG A 145 -14.044 -6.030 -0.575 1.00 0.44 C ATOM 2317 CG ARG A 145 -13.317 -6.014 -1.907 1.00 0.81 C ATOM 2318 CD ARG A 145 -14.105 -5.277 -2.976 1.00 2.08 C ATOM 2319 NE ARG A 145 -14.026 -3.827 -2.797 1.00 2.70 N ATOM 2320 CZ ARG A 145 -14.762 -2.945 -3.476 1.00 3.63 C ATOM 2321 NH1 ARG A 145 -15.687 -3.359 -4.334 1.00 4.14 N ATOM 2322 NH2 ARG A 145 -14.579 -1.644 -3.286 1.00 4.42 N ATOM 0 H ARG A 145 -14.709 -6.878 1.697 1.00 0.43 H new ATOM 0 HA ARG A 145 -12.393 -6.959 0.436 1.00 0.41 H new ATOM 0 HB2 ARG A 145 -14.739 -6.870 -0.553 1.00 0.44 H new ATOM 0 HB3 ARG A 145 -14.639 -5.122 -0.478 1.00 0.44 H new ATOM 0 HG2 ARG A 145 -12.343 -5.540 -1.783 1.00 0.81 H new ATOM 0 HG3 ARG A 145 -13.134 -7.038 -2.233 1.00 0.81 H new ATOM 0 HD2 ARG A 145 -13.722 -5.544 -3.961 1.00 2.08 H new ATOM 0 HD3 ARG A 145 -15.148 -5.592 -2.943 1.00 2.08 H new ATOM 0 HE ARG A 145 -13.365 -3.467 -2.108 1.00 2.70 H new ATOM 0 HH11 ARG A 145 -15.839 -4.357 -4.478 1.00 4.14 H new ATOM 0 HH12 ARG A 145 -16.246 -2.679 -4.849 1.00 4.14 H new ATOM 0 HH21 ARG A 145 -13.876 -1.319 -2.622 1.00 4.42 H new ATOM 0 HH22 ARG A 145 -15.141 -0.969 -3.804 1.00 4.42 H new ATOM 2336 N GLY A 146 -10.992 -4.964 0.646 1.00 0.62 N ATOM 2337 CA GLY A 146 -10.087 -3.842 0.733 1.00 0.79 C ATOM 2338 C GLY A 146 -10.569 -2.660 -0.048 1.00 0.57 C ATOM 2339 O GLY A 146 -10.595 -2.682 -1.268 1.00 0.62 O ATOM 0 H GLY A 146 -10.525 -5.861 0.516 1.00 0.62 H new ATOM 0 HA2 GLY A 146 -9.964 -3.558 1.778 1.00 0.79 H new ATOM 0 HA3 GLY A 146 -9.105 -4.141 0.366 1.00 0.79 H new ATOM 2343 N TYR A 147 -11.005 -1.654 0.673 1.00 0.58 N ATOM 2344 CA TYR A 147 -11.516 -0.442 0.077 1.00 0.56 C ATOM 2345 C TYR A 147 -10.402 0.550 -0.234 1.00 0.54 C ATOM 2346 O TYR A 147 -10.445 1.710 0.187 1.00 0.67 O ATOM 2347 CB TYR A 147 -12.534 0.167 1.024 1.00 0.86 C ATOM 2348 CG TYR A 147 -12.251 -0.080 2.489 1.00 1.69 C ATOM 2349 CD1 TYR A 147 -11.300 0.672 3.161 1.00 2.23 C ATOM 2350 CD2 TYR A 147 -12.908 -1.084 3.189 1.00 2.19 C ATOM 2351 CE1 TYR A 147 -11.011 0.430 4.490 1.00 3.13 C ATOM 2352 CE2 TYR A 147 -12.621 -1.336 4.516 1.00 3.07 C ATOM 2353 CZ TYR A 147 -11.791 -0.491 5.198 1.00 3.51 C ATOM 2354 OH TYR A 147 -11.382 -0.819 6.483 1.00 4.44 O ATOM 0 H TYR A 147 -11.015 -1.653 1.693 1.00 0.58 H new ATOM 0 HA TYR A 147 -11.989 -0.685 -0.874 1.00 0.56 H new ATOM 0 HB2 TYR A 147 -12.575 1.242 0.851 1.00 0.86 H new ATOM 0 HB3 TYR A 147 -13.519 -0.233 0.784 1.00 0.86 H new ATOM 0 HD1 TYR A 147 -10.777 1.459 2.638 1.00 2.23 H new ATOM 0 HD2 TYR A 147 -13.657 -1.678 2.686 1.00 2.19 H new ATOM 0 HE1 TYR A 147 -10.195 0.944 4.976 1.00 3.13 H new ATOM 0 HE2 TYR A 147 -13.049 -2.195 5.011 1.00 3.07 H new ATOM 0 HH TYR A 147 -12.007 -1.467 6.870 1.00 4.44 H new ATOM 2364 N ASN A 148 -9.427 0.089 -0.995 1.00 0.46 N ATOM 2365 CA ASN A 148 -8.266 0.892 -1.336 1.00 0.47 C ATOM 2366 C ASN A 148 -8.424 1.507 -2.725 1.00 0.45 C ATOM 2367 O ASN A 148 -7.686 1.174 -3.655 1.00 0.58 O ATOM 2368 CB ASN A 148 -7.010 0.024 -1.274 1.00 0.49 C ATOM 2369 CG ASN A 148 -6.759 -0.548 0.109 1.00 1.08 C ATOM 2370 OD1 ASN A 148 -6.973 0.116 1.126 1.00 1.45 O ATOM 2371 ND2 ASN A 148 -6.350 -1.805 0.158 1.00 1.62 N ATOM 0 H ASN A 148 -9.417 -0.850 -1.394 1.00 0.46 H new ATOM 0 HA ASN A 148 -8.174 1.706 -0.617 1.00 0.47 H new ATOM 0 HB2 ASN A 148 -7.103 -0.793 -1.989 1.00 0.49 H new ATOM 0 HB3 ASN A 148 -6.148 0.618 -1.579 1.00 0.49 H new ATOM 0 HD21 ASN A 148 -6.201 -2.258 1.060 1.00 1.62 H new ATOM 0 HD22 ASN A 148 -6.184 -2.321 -0.706 1.00 1.62 H new ATOM 2378 N HIS A 149 -9.408 2.398 -2.858 1.00 0.43 N ATOM 2379 CA HIS A 149 -9.633 3.133 -4.107 1.00 0.45 C ATOM 2380 C HIS A 149 -8.363 3.845 -4.539 1.00 0.40 C ATOM 2381 O HIS A 149 -7.641 4.369 -3.691 1.00 0.69 O ATOM 2382 CB HIS A 149 -10.732 4.176 -3.936 1.00 0.60 C ATOM 2383 CG HIS A 149 -12.086 3.738 -4.402 1.00 1.08 C ATOM 2384 ND1 HIS A 149 -12.725 4.293 -5.490 1.00 1.67 N ATOM 2385 CD2 HIS A 149 -12.941 2.821 -3.898 1.00 1.88 C ATOM 2386 CE1 HIS A 149 -13.913 3.736 -5.630 1.00 2.14 C ATOM 2387 NE2 HIS A 149 -14.073 2.838 -4.676 1.00 2.32 N ATOM 0 H HIS A 149 -10.065 2.630 -2.113 1.00 0.43 H new ATOM 0 HA HIS A 149 -9.932 2.407 -4.863 1.00 0.45 H new ATOM 0 HB2 HIS A 149 -10.795 4.448 -2.882 1.00 0.60 H new ATOM 0 HB3 HIS A 149 -10.448 5.076 -4.481 1.00 0.60 H new ATOM 0 HD2 HIS A 149 -12.766 2.189 -3.040 1.00 1.88 H new ATOM 0 HE1 HIS A 149 -14.634 3.975 -6.397 1.00 2.14 H new ATOM 0 HE2 HIS A 149 -14.899 2.255 -4.539 1.00 2.32 H new ATOM 2396 N PRO A 150 -8.159 3.943 -5.883 1.00 0.32 N ATOM 2397 CA PRO A 150 -6.896 4.231 -6.559 1.00 0.32 C ATOM 2398 C PRO A 150 -5.756 4.670 -5.667 1.00 0.36 C ATOM 2399 O PRO A 150 -5.243 5.776 -5.781 1.00 0.47 O ATOM 2400 CB PRO A 150 -7.333 5.320 -7.516 1.00 0.41 C ATOM 2401 CG PRO A 150 -8.689 4.856 -7.969 1.00 0.53 C ATOM 2402 CD PRO A 150 -9.203 3.885 -6.912 1.00 0.46 C ATOM 0 HA PRO A 150 -6.460 3.344 -7.018 1.00 0.32 H new ATOM 0 HB2 PRO A 150 -7.383 6.292 -7.024 1.00 0.41 H new ATOM 0 HB3 PRO A 150 -6.642 5.422 -8.353 1.00 0.41 H new ATOM 0 HG2 PRO A 150 -9.369 5.701 -8.080 1.00 0.53 H new ATOM 0 HG3 PRO A 150 -8.625 4.369 -8.942 1.00 0.53 H new ATOM 0 HD2 PRO A 150 -10.174 4.189 -6.521 1.00 0.46 H new ATOM 0 HD3 PRO A 150 -9.322 2.878 -7.311 1.00 0.46 H new ATOM 2410 N CYS A 151 -5.375 3.768 -4.792 1.00 0.38 N ATOM 2411 CA CYS A 151 -4.222 3.943 -3.949 1.00 0.48 C ATOM 2412 C CYS A 151 -2.980 3.516 -4.712 1.00 0.43 C ATOM 2413 O CYS A 151 -3.073 2.956 -5.807 1.00 0.77 O ATOM 2414 CB CYS A 151 -4.374 3.104 -2.681 1.00 0.84 C ATOM 2415 SG CYS A 151 -4.530 1.332 -2.993 1.00 1.58 S ATOM 0 H CYS A 151 -5.864 2.885 -4.646 1.00 0.38 H new ATOM 0 HA CYS A 151 -4.131 4.991 -3.664 1.00 0.48 H new ATOM 0 HB2 CYS A 151 -3.511 3.275 -2.038 1.00 0.84 H new ATOM 0 HB3 CYS A 151 -5.253 3.446 -2.134 1.00 0.84 H new ATOM 0 HG CYS A 151 -5.751 1.060 -3.347 1.00 1.58 H new ATOM 2421 N GLY A 152 -1.824 3.779 -4.154 1.00 0.34 N ATOM 2422 CA GLY A 152 -0.614 3.347 -4.788 1.00 0.39 C ATOM 2423 C GLY A 152 0.565 3.473 -3.880 1.00 0.36 C ATOM 2424 O GLY A 152 0.418 3.739 -2.690 1.00 0.43 O ATOM 0 H GLY A 152 -1.701 4.283 -3.276 1.00 0.34 H new ATOM 0 HA2 GLY A 152 -0.720 2.309 -5.104 1.00 0.39 H new ATOM 0 HA3 GLY A 152 -0.444 3.938 -5.688 1.00 0.39 H new ATOM 2428 N PHE A 153 1.732 3.333 -4.455 1.00 0.32 N ATOM 2429 CA PHE A 153 2.936 3.123 -3.676 1.00 0.31 C ATOM 2430 C PHE A 153 4.141 3.422 -4.539 1.00 0.30 C ATOM 2431 O PHE A 153 4.788 2.508 -5.047 1.00 0.38 O ATOM 2432 CB PHE A 153 2.962 1.669 -3.190 1.00 0.36 C ATOM 2433 CG PHE A 153 3.971 1.367 -2.116 1.00 0.38 C ATOM 2434 CD1 PHE A 153 3.663 1.558 -0.779 1.00 0.54 C ATOM 2435 CD2 PHE A 153 5.235 0.916 -2.450 1.00 0.49 C ATOM 2436 CE1 PHE A 153 4.597 1.299 0.203 1.00 0.60 C ATOM 2437 CE2 PHE A 153 6.174 0.659 -1.472 1.00 0.55 C ATOM 2438 CZ PHE A 153 5.811 0.770 -0.124 1.00 0.52 C ATOM 0 H PHE A 153 1.879 3.360 -5.464 1.00 0.32 H new ATOM 0 HA PHE A 153 2.954 3.785 -2.811 1.00 0.31 H new ATOM 0 HB2 PHE A 153 1.971 1.410 -2.817 1.00 0.36 H new ATOM 0 HB3 PHE A 153 3.160 1.021 -4.044 1.00 0.36 H new ATOM 0 HD1 PHE A 153 2.681 1.913 -0.502 1.00 0.54 H new ATOM 0 HD2 PHE A 153 5.490 0.763 -3.488 1.00 0.49 H new ATOM 0 HE1 PHE A 153 4.366 1.516 1.235 1.00 0.60 H new ATOM 0 HE2 PHE A 153 7.180 0.375 -1.744 1.00 0.55 H new ATOM 0 HZ PHE A 153 6.487 0.439 0.651 1.00 0.52 H new ATOM 2448 N VAL A 154 4.430 4.691 -4.744 1.00 0.25 N ATOM 2449 CA VAL A 154 5.498 5.048 -5.642 1.00 0.25 C ATOM 2450 C VAL A 154 6.820 5.128 -4.896 1.00 0.24 C ATOM 2451 O VAL A 154 6.971 5.850 -3.911 1.00 0.31 O ATOM 2452 CB VAL A 154 5.230 6.355 -6.431 1.00 0.25 C ATOM 2453 CG1 VAL A 154 3.840 6.371 -7.026 1.00 0.27 C ATOM 2454 CG2 VAL A 154 5.454 7.606 -5.610 1.00 0.26 C ATOM 0 H VAL A 154 3.948 5.477 -4.308 1.00 0.25 H new ATOM 0 HA VAL A 154 5.553 4.252 -6.385 1.00 0.25 H new ATOM 0 HB VAL A 154 5.963 6.362 -7.238 1.00 0.25 H new ATOM 0 HG11 VAL A 154 3.688 7.302 -7.572 1.00 0.27 H new ATOM 0 HG12 VAL A 154 3.726 5.528 -7.708 1.00 0.27 H new ATOM 0 HG13 VAL A 154 3.102 6.294 -6.228 1.00 0.27 H new ATOM 0 HG21 VAL A 154 5.249 8.484 -6.222 1.00 0.26 H new ATOM 0 HG22 VAL A 154 4.786 7.600 -4.748 1.00 0.26 H new ATOM 0 HG23 VAL A 154 6.488 7.636 -5.267 1.00 0.26 H new ATOM 2464 N CYS A 155 7.757 4.332 -5.343 1.00 0.21 N ATOM 2465 CA CYS A 155 9.094 4.360 -4.789 1.00 0.23 C ATOM 2466 C CYS A 155 9.991 5.157 -5.720 1.00 0.27 C ATOM 2467 O CYS A 155 10.251 4.739 -6.847 1.00 0.42 O ATOM 2468 CB CYS A 155 9.622 2.943 -4.625 1.00 0.27 C ATOM 2469 SG CYS A 155 8.495 1.828 -3.763 1.00 1.55 S ATOM 0 H CYS A 155 7.622 3.653 -6.092 1.00 0.21 H new ATOM 0 HA CYS A 155 9.078 4.832 -3.806 1.00 0.23 H new ATOM 0 HB2 CYS A 155 9.838 2.532 -5.611 1.00 0.27 H new ATOM 0 HB3 CYS A 155 10.566 2.980 -4.081 1.00 0.27 H new ATOM 0 HG CYS A 155 7.715 1.247 -4.626 1.00 1.55 H new ATOM 2475 N SER A 156 10.447 6.303 -5.258 1.00 0.25 N ATOM 2476 CA SER A 156 11.151 7.236 -6.115 1.00 0.29 C ATOM 2477 C SER A 156 12.642 7.254 -5.810 1.00 0.30 C ATOM 2478 O SER A 156 13.058 7.674 -4.731 1.00 0.29 O ATOM 2479 CB SER A 156 10.572 8.639 -5.934 1.00 0.32 C ATOM 2480 OG SER A 156 9.156 8.618 -5.982 1.00 1.06 O ATOM 0 H SER A 156 10.343 6.612 -4.291 1.00 0.25 H new ATOM 0 HA SER A 156 11.020 6.912 -7.147 1.00 0.29 H new ATOM 0 HB2 SER A 156 10.900 9.051 -4.980 1.00 0.32 H new ATOM 0 HB3 SER A 156 10.955 9.297 -6.714 1.00 0.32 H new ATOM 0 HG SER A 156 8.811 9.527 -5.862 1.00 1.06 H new ATOM 2486 N PRO A 157 13.462 6.755 -6.741 1.00 0.36 N ATOM 2487 CA PRO A 157 14.909 6.929 -6.683 1.00 0.39 C ATOM 2488 C PRO A 157 15.277 8.402 -6.509 1.00 0.40 C ATOM 2489 O PRO A 157 14.944 9.235 -7.356 1.00 0.49 O ATOM 2490 CB PRO A 157 15.381 6.416 -8.044 1.00 0.51 C ATOM 2491 CG PRO A 157 14.335 5.453 -8.479 1.00 0.56 C ATOM 2492 CD PRO A 157 13.042 5.956 -7.905 1.00 0.45 C ATOM 0 HA PRO A 157 15.365 6.405 -5.843 1.00 0.39 H new ATOM 0 HB2 PRO A 157 15.486 7.233 -8.758 1.00 0.51 H new ATOM 0 HB3 PRO A 157 16.355 5.932 -7.967 1.00 0.51 H new ATOM 0 HG2 PRO A 157 14.284 5.398 -9.566 1.00 0.56 H new ATOM 0 HG3 PRO A 157 14.556 4.448 -8.119 1.00 0.56 H new ATOM 0 HD2 PRO A 157 12.492 6.559 -8.627 1.00 0.45 H new ATOM 0 HD3 PRO A 157 12.388 5.135 -7.612 1.00 0.45 H new ATOM 2500 N MET A 158 15.957 8.720 -5.414 1.00 0.37 N ATOM 2501 CA MET A 158 16.295 10.111 -5.112 1.00 0.43 C ATOM 2502 C MET A 158 17.524 10.560 -5.880 1.00 0.48 C ATOM 2503 O MET A 158 18.005 9.861 -6.767 1.00 0.49 O ATOM 2504 CB MET A 158 16.573 10.304 -3.624 1.00 0.43 C ATOM 2505 CG MET A 158 15.328 10.480 -2.776 1.00 0.50 C ATOM 2506 SD MET A 158 15.702 10.739 -1.032 1.00 0.95 S ATOM 2507 CE MET A 158 16.601 12.286 -1.102 1.00 1.16 C ATOM 0 H MET A 158 16.284 8.043 -4.725 1.00 0.37 H new ATOM 0 HA MET A 158 15.433 10.709 -5.409 1.00 0.43 H new ATOM 0 HB2 MET A 158 17.131 9.443 -3.256 1.00 0.43 H new ATOM 0 HB3 MET A 158 17.213 11.177 -3.496 1.00 0.43 H new ATOM 0 HG2 MET A 158 14.756 11.329 -3.150 1.00 0.50 H new ATOM 0 HG3 MET A 158 14.695 9.599 -2.880 1.00 0.50 H new ATOM 0 HE1 MET A 158 16.608 12.748 -0.115 1.00 1.16 H new ATOM 0 HE2 MET A 158 17.626 12.097 -1.421 1.00 1.16 H new ATOM 0 HE3 MET A 158 16.117 12.956 -1.813 1.00 1.16 H new ATOM 2517 N GLU A 159 18.039 11.728 -5.531 1.00 0.57 N ATOM 2518 CA GLU A 159 19.331 12.146 -6.035 1.00 0.62 C ATOM 2519 C GLU A 159 20.404 11.240 -5.449 1.00 0.54 C ATOM 2520 O GLU A 159 21.423 10.958 -6.076 1.00 0.59 O ATOM 2521 CB GLU A 159 19.610 13.608 -5.682 1.00 0.76 C ATOM 2522 CG GLU A 159 18.612 14.579 -6.289 1.00 1.38 C ATOM 2523 CD GLU A 159 18.501 14.424 -7.790 1.00 1.87 C ATOM 2524 OE1 GLU A 159 19.412 14.888 -8.508 1.00 2.63 O ATOM 2525 OE2 GLU A 159 17.520 13.814 -8.260 1.00 2.09 O ATOM 0 H GLU A 159 17.585 12.395 -4.907 1.00 0.57 H new ATOM 0 HA GLU A 159 19.336 12.065 -7.122 1.00 0.62 H new ATOM 0 HB2 GLU A 159 19.600 13.720 -4.598 1.00 0.76 H new ATOM 0 HB3 GLU A 159 20.612 13.870 -6.021 1.00 0.76 H new ATOM 0 HG2 GLU A 159 17.633 14.421 -5.836 1.00 1.38 H new ATOM 0 HG3 GLU A 159 18.912 15.600 -6.052 1.00 1.38 H new ATOM 2532 N GLU A 160 20.127 10.765 -4.244 1.00 0.52 N ATOM 2533 CA GLU A 160 20.980 9.811 -3.551 1.00 0.55 C ATOM 2534 C GLU A 160 20.345 8.434 -3.613 1.00 0.58 C ATOM 2535 O GLU A 160 20.530 7.609 -2.728 1.00 0.76 O ATOM 2536 CB GLU A 160 21.154 10.233 -2.102 1.00 0.63 C ATOM 2537 CG GLU A 160 21.875 11.560 -1.937 1.00 0.77 C ATOM 2538 CD GLU A 160 23.280 11.529 -2.501 1.00 1.32 C ATOM 2539 OE1 GLU A 160 24.155 10.869 -1.905 1.00 1.61 O ATOM 2540 OE2 GLU A 160 23.517 12.168 -3.546 1.00 2.05 O ATOM 0 H GLU A 160 19.297 11.033 -3.715 1.00 0.52 H new ATOM 0 HA GLU A 160 21.958 9.782 -4.031 1.00 0.55 H new ATOM 0 HB2 GLU A 160 20.173 10.301 -1.632 1.00 0.63 H new ATOM 0 HB3 GLU A 160 21.709 9.459 -1.571 1.00 0.63 H new ATOM 0 HG2 GLU A 160 21.304 12.344 -2.434 1.00 0.77 H new ATOM 0 HG3 GLU A 160 21.917 11.818 -0.879 1.00 0.77 H new ATOM 2547 N ASN A 161 19.587 8.231 -4.682 1.00 0.51 N ATOM 2548 CA ASN A 161 18.728 7.053 -4.884 1.00 0.65 C ATOM 2549 C ASN A 161 19.259 5.726 -4.329 1.00 0.53 C ATOM 2550 O ASN A 161 18.498 5.022 -3.671 1.00 0.53 O ATOM 2551 CB ASN A 161 18.319 6.885 -6.364 1.00 0.92 C ATOM 2552 CG ASN A 161 19.469 6.881 -7.356 1.00 1.07 C ATOM 2553 OD1 ASN A 161 20.003 5.829 -7.703 1.00 1.93 O ATOM 2554 ND2 ASN A 161 19.836 8.057 -7.840 1.00 1.62 N ATOM 0 H ASN A 161 19.545 8.893 -5.457 1.00 0.51 H new ATOM 0 HA ASN A 161 17.851 7.282 -4.279 1.00 0.65 H new ATOM 0 HB2 ASN A 161 17.767 5.951 -6.468 1.00 0.92 H new ATOM 0 HB3 ASN A 161 17.634 7.691 -6.629 1.00 0.92 H new ATOM 0 HD21 ASN A 161 20.588 8.114 -8.527 1.00 1.62 H new ATOM 0 HD22 ASN A 161 19.367 8.907 -7.526 1.00 1.62 H new ATOM 2561 N PRO A 162 20.525 5.320 -4.561 1.00 0.55 N ATOM 2562 CA PRO A 162 20.957 4.009 -4.113 1.00 0.57 C ATOM 2563 C PRO A 162 21.129 3.940 -2.596 1.00 0.55 C ATOM 2564 O PRO A 162 21.026 2.873 -1.994 1.00 0.63 O ATOM 2565 CB PRO A 162 22.298 3.806 -4.819 1.00 0.71 C ATOM 2566 CG PRO A 162 22.818 5.185 -5.014 1.00 0.73 C ATOM 2567 CD PRO A 162 21.607 6.038 -5.264 1.00 0.67 C ATOM 0 HA PRO A 162 20.223 3.239 -4.349 1.00 0.57 H new ATOM 0 HB2 PRO A 162 22.979 3.205 -4.216 1.00 0.71 H new ATOM 0 HB3 PRO A 162 22.173 3.289 -5.770 1.00 0.71 H new ATOM 0 HG2 PRO A 162 23.364 5.527 -4.135 1.00 0.73 H new ATOM 0 HG3 PRO A 162 23.509 5.229 -5.856 1.00 0.73 H new ATOM 0 HD2 PRO A 162 21.739 7.047 -4.872 1.00 0.67 H new ATOM 0 HD3 PRO A 162 21.398 6.135 -6.329 1.00 0.67 H new ATOM 2575 N ALA A 163 21.379 5.092 -1.992 1.00 0.53 N ATOM 2576 CA ALA A 163 21.608 5.179 -0.560 1.00 0.59 C ATOM 2577 C ALA A 163 20.358 5.663 0.162 1.00 0.53 C ATOM 2578 O ALA A 163 20.172 5.394 1.347 1.00 0.58 O ATOM 2579 CB ALA A 163 22.772 6.114 -0.278 1.00 0.68 C ATOM 0 H ALA A 163 21.428 5.987 -2.478 1.00 0.53 H new ATOM 0 HA ALA A 163 21.850 4.183 -0.189 1.00 0.59 H new ATOM 0 HB1 ALA A 163 22.938 6.174 0.798 1.00 0.68 H new ATOM 0 HB2 ALA A 163 23.671 5.733 -0.763 1.00 0.68 H new ATOM 0 HB3 ALA A 163 22.544 7.107 -0.666 1.00 0.68 H new ATOM 2585 N TYR A 164 19.520 6.395 -0.556 1.00 0.45 N ATOM 2586 CA TYR A 164 18.278 6.922 -0.011 1.00 0.40 C ATOM 2587 C TYR A 164 17.180 6.872 -1.061 1.00 0.32 C ATOM 2588 O TYR A 164 17.304 7.478 -2.127 1.00 0.38 O ATOM 2589 CB TYR A 164 18.470 8.364 0.465 1.00 0.46 C ATOM 2590 CG TYR A 164 19.278 8.479 1.739 1.00 0.56 C ATOM 2591 CD1 TYR A 164 18.676 8.289 2.976 1.00 0.61 C ATOM 2592 CD2 TYR A 164 20.637 8.768 1.708 1.00 0.67 C ATOM 2593 CE1 TYR A 164 19.403 8.384 4.145 1.00 0.73 C ATOM 2594 CE2 TYR A 164 21.372 8.862 2.875 1.00 0.78 C ATOM 2595 CZ TYR A 164 20.749 8.669 4.091 1.00 0.79 C ATOM 2596 OH TYR A 164 21.473 8.763 5.260 1.00 0.93 O ATOM 0 H TYR A 164 19.682 6.640 -1.533 1.00 0.45 H new ATOM 0 HA TYR A 164 17.989 6.305 0.840 1.00 0.40 H new ATOM 0 HB2 TYR A 164 18.964 8.935 -0.321 1.00 0.46 H new ATOM 0 HB3 TYR A 164 17.492 8.819 0.623 1.00 0.46 H new ATOM 0 HD1 TYR A 164 17.621 8.063 3.024 1.00 0.61 H new ATOM 0 HD2 TYR A 164 21.126 8.922 0.758 1.00 0.67 H new ATOM 0 HE1 TYR A 164 18.918 8.235 5.099 1.00 0.73 H new ATOM 0 HE2 TYR A 164 22.428 9.085 2.835 1.00 0.78 H new ATOM 0 HH TYR A 164 22.408 8.968 5.050 1.00 0.93 H new ATOM 2606 N SER A 165 16.111 6.150 -0.771 1.00 0.26 N ATOM 2607 CA SER A 165 15.019 6.039 -1.711 1.00 0.24 C ATOM 2608 C SER A 165 13.761 6.689 -1.162 1.00 0.23 C ATOM 2609 O SER A 165 13.461 6.592 0.028 1.00 0.26 O ATOM 2610 CB SER A 165 14.768 4.579 -2.053 1.00 0.30 C ATOM 2611 OG SER A 165 14.696 3.792 -0.886 1.00 1.41 O ATOM 0 H SER A 165 15.980 5.638 0.101 1.00 0.26 H new ATOM 0 HA SER A 165 15.295 6.567 -2.624 1.00 0.24 H new ATOM 0 HB2 SER A 165 13.839 4.488 -2.615 1.00 0.30 H new ATOM 0 HB3 SER A 165 15.567 4.210 -2.696 1.00 0.30 H new ATOM 0 HG SER A 165 15.591 3.702 -0.496 1.00 1.41 H new ATOM 2617 N LYS A 166 13.032 7.361 -2.032 1.00 0.24 N ATOM 2618 CA LYS A 166 11.843 8.070 -1.625 1.00 0.26 C ATOM 2619 C LYS A 166 10.599 7.196 -1.748 1.00 0.28 C ATOM 2620 O LYS A 166 10.080 6.960 -2.829 1.00 0.43 O ATOM 2621 CB LYS A 166 11.714 9.378 -2.420 1.00 0.36 C ATOM 2622 CG LYS A 166 10.315 9.979 -2.440 1.00 0.32 C ATOM 2623 CD LYS A 166 9.731 10.147 -1.046 1.00 0.37 C ATOM 2624 CE LYS A 166 10.534 11.114 -0.195 1.00 0.47 C ATOM 2625 NZ LYS A 166 10.500 12.498 -0.740 1.00 0.74 N ATOM 0 H LYS A 166 13.246 7.429 -3.027 1.00 0.24 H new ATOM 0 HA LYS A 166 11.934 8.325 -0.569 1.00 0.26 H new ATOM 0 HB2 LYS A 166 12.403 10.111 -2.000 1.00 0.36 H new ATOM 0 HB3 LYS A 166 12.030 9.195 -3.447 1.00 0.36 H new ATOM 0 HG2 LYS A 166 10.347 10.949 -2.936 1.00 0.32 H new ATOM 0 HG3 LYS A 166 9.658 9.341 -3.031 1.00 0.32 H new ATOM 0 HD2 LYS A 166 8.704 10.504 -1.126 1.00 0.37 H new ATOM 0 HD3 LYS A 166 9.694 9.176 -0.551 1.00 0.37 H new ATOM 0 HE2 LYS A 166 10.140 11.115 0.821 1.00 0.47 H new ATOM 0 HE3 LYS A 166 11.568 10.773 -0.136 1.00 0.47 H new ATOM 0 HZ1 LYS A 166 10.882 13.159 -0.034 1.00 0.74 H new ATOM 0 HZ2 LYS A 166 11.076 12.545 -1.605 1.00 0.74 H new ATOM 0 HZ3 LYS A 166 9.518 12.759 -0.963 1.00 0.74 H new ATOM 2639 N LEU A 167 10.137 6.729 -0.610 1.00 0.20 N ATOM 2640 CA LEU A 167 8.942 5.923 -0.520 1.00 0.21 C ATOM 2641 C LEU A 167 7.736 6.833 -0.334 1.00 0.20 C ATOM 2642 O LEU A 167 7.599 7.478 0.703 1.00 0.24 O ATOM 2643 CB LEU A 167 9.080 4.992 0.688 1.00 0.23 C ATOM 2644 CG LEU A 167 8.180 3.753 0.720 1.00 0.24 C ATOM 2645 CD1 LEU A 167 6.707 4.111 0.676 1.00 0.27 C ATOM 2646 CD2 LEU A 167 8.549 2.818 -0.418 1.00 0.25 C ATOM 0 H LEU A 167 10.586 6.901 0.289 1.00 0.20 H new ATOM 0 HA LEU A 167 8.808 5.336 -1.429 1.00 0.21 H new ATOM 0 HB2 LEU A 167 10.116 4.659 0.742 1.00 0.23 H new ATOM 0 HB3 LEU A 167 8.885 5.575 1.588 1.00 0.23 H new ATOM 0 HG LEU A 167 8.347 3.244 1.669 1.00 0.24 H new ATOM 0 HD11 LEU A 167 6.110 3.199 0.701 1.00 0.27 H new ATOM 0 HD12 LEU A 167 6.458 4.732 1.537 1.00 0.27 H new ATOM 0 HD13 LEU A 167 6.493 4.660 -0.241 1.00 0.27 H new ATOM 0 HD21 LEU A 167 7.905 1.939 -0.390 1.00 0.25 H new ATOM 0 HD22 LEU A 167 8.418 3.333 -1.369 1.00 0.25 H new ATOM 0 HD23 LEU A 167 9.589 2.510 -0.313 1.00 0.25 H new ATOM 2658 N VAL A 168 6.875 6.911 -1.329 1.00 0.19 N ATOM 2659 CA VAL A 168 5.642 7.684 -1.169 1.00 0.20 C ATOM 2660 C VAL A 168 4.411 6.901 -1.639 1.00 0.23 C ATOM 2661 O VAL A 168 4.266 6.553 -2.808 1.00 0.28 O ATOM 2662 CB VAL A 168 5.742 9.089 -1.831 1.00 0.20 C ATOM 2663 CG1 VAL A 168 6.710 9.080 -2.996 1.00 0.21 C ATOM 2664 CG2 VAL A 168 4.381 9.611 -2.268 1.00 0.26 C ATOM 0 H VAL A 168 6.993 6.464 -2.238 1.00 0.19 H new ATOM 0 HA VAL A 168 5.511 7.857 -0.101 1.00 0.20 H new ATOM 0 HB VAL A 168 6.127 9.770 -1.072 1.00 0.20 H new ATOM 0 HG11 VAL A 168 6.758 10.076 -3.437 1.00 0.21 H new ATOM 0 HG12 VAL A 168 7.700 8.791 -2.644 1.00 0.21 H new ATOM 0 HG13 VAL A 168 6.370 8.367 -3.746 1.00 0.21 H new ATOM 0 HG21 VAL A 168 4.498 10.594 -2.725 1.00 0.26 H new ATOM 0 HG22 VAL A 168 3.943 8.924 -2.992 1.00 0.26 H new ATOM 0 HG23 VAL A 168 3.726 9.690 -1.400 1.00 0.26 H new ATOM 2674 N MET A 169 3.532 6.633 -0.682 1.00 0.29 N ATOM 2675 CA MET A 169 2.346 5.834 -0.878 1.00 0.32 C ATOM 2676 C MET A 169 1.120 6.730 -0.735 1.00 0.34 C ATOM 2677 O MET A 169 1.208 7.816 -0.173 1.00 0.45 O ATOM 2678 CB MET A 169 2.338 4.689 0.153 1.00 0.35 C ATOM 2679 CG MET A 169 1.037 3.905 0.232 1.00 0.40 C ATOM 2680 SD MET A 169 1.045 2.678 1.553 1.00 0.74 S ATOM 2681 CE MET A 169 -0.589 1.971 1.363 1.00 1.24 C ATOM 0 H MET A 169 3.634 6.977 0.273 1.00 0.29 H new ATOM 0 HA MET A 169 2.332 5.393 -1.875 1.00 0.32 H new ATOM 0 HB2 MET A 169 3.147 3.999 -0.087 1.00 0.35 H new ATOM 0 HB3 MET A 169 2.555 5.105 1.137 1.00 0.35 H new ATOM 0 HG2 MET A 169 0.209 4.597 0.389 1.00 0.40 H new ATOM 0 HG3 MET A 169 0.859 3.406 -0.721 1.00 0.40 H new ATOM 0 HE1 MET A 169 -0.915 1.548 2.313 1.00 1.24 H new ATOM 0 HE2 MET A 169 -1.288 2.748 1.053 1.00 1.24 H new ATOM 0 HE3 MET A 169 -0.560 1.186 0.607 1.00 1.24 H new ATOM 2691 N PHE A 170 -0.001 6.306 -1.283 1.00 0.36 N ATOM 2692 CA PHE A 170 -1.231 7.093 -1.201 1.00 0.42 C ATOM 2693 C PHE A 170 -2.425 6.188 -0.961 1.00 0.37 C ATOM 2694 O PHE A 170 -2.416 5.029 -1.372 1.00 0.38 O ATOM 2695 CB PHE A 170 -1.476 7.871 -2.498 1.00 0.69 C ATOM 2696 CG PHE A 170 -0.232 8.189 -3.273 1.00 1.26 C ATOM 2697 CD1 PHE A 170 0.400 7.205 -4.017 1.00 1.74 C ATOM 2698 CD2 PHE A 170 0.305 9.460 -3.260 1.00 2.02 C ATOM 2699 CE1 PHE A 170 1.540 7.481 -4.729 1.00 2.73 C ATOM 2700 CE2 PHE A 170 1.450 9.743 -3.974 1.00 3.07 C ATOM 2701 CZ PHE A 170 2.069 8.749 -4.709 1.00 3.37 C ATOM 0 H PHE A 170 -0.093 5.426 -1.790 1.00 0.36 H new ATOM 0 HA PHE A 170 -1.113 7.791 -0.372 1.00 0.42 H new ATOM 0 HB2 PHE A 170 -2.147 7.293 -3.133 1.00 0.69 H new ATOM 0 HB3 PHE A 170 -1.988 8.803 -2.258 1.00 0.69 H new ATOM 0 HD1 PHE A 170 -0.011 6.206 -4.037 1.00 1.74 H new ATOM 0 HD2 PHE A 170 -0.175 10.239 -2.686 1.00 2.02 H new ATOM 0 HE1 PHE A 170 2.021 6.703 -5.304 1.00 2.73 H new ATOM 0 HE2 PHE A 170 1.863 10.741 -3.959 1.00 3.07 H new ATOM 0 HZ PHE A 170 2.967 8.969 -5.267 1.00 3.37 H new ATOM 2711 N VAL A 171 -3.446 6.721 -0.300 1.00 0.43 N ATOM 2712 CA VAL A 171 -4.707 6.009 -0.136 1.00 0.50 C ATOM 2713 C VAL A 171 -5.892 6.940 -0.366 1.00 0.49 C ATOM 2714 O VAL A 171 -5.966 8.020 0.219 1.00 0.50 O ATOM 2715 CB VAL A 171 -4.848 5.356 1.261 1.00 0.66 C ATOM 2716 CG1 VAL A 171 -3.961 4.128 1.380 1.00 1.28 C ATOM 2717 CG2 VAL A 171 -4.530 6.354 2.365 1.00 1.40 C ATOM 0 H VAL A 171 -3.425 7.645 0.131 1.00 0.43 H new ATOM 0 HA VAL A 171 -4.703 5.216 -0.884 1.00 0.50 H new ATOM 0 HB VAL A 171 -5.885 5.040 1.376 1.00 0.66 H new ATOM 0 HG11 VAL A 171 -4.079 3.689 2.370 1.00 1.28 H new ATOM 0 HG12 VAL A 171 -4.247 3.398 0.623 1.00 1.28 H new ATOM 0 HG13 VAL A 171 -2.920 4.415 1.232 1.00 1.28 H new ATOM 0 HG21 VAL A 171 -4.637 5.869 3.335 1.00 1.40 H new ATOM 0 HG22 VAL A 171 -3.507 6.712 2.249 1.00 1.40 H new ATOM 0 HG23 VAL A 171 -5.218 7.197 2.303 1.00 1.40 H new ATOM 2727 N GLN A 172 -6.804 6.519 -1.233 1.00 0.57 N ATOM 2728 CA GLN A 172 -8.049 7.240 -1.458 1.00 0.65 C ATOM 2729 C GLN A 172 -9.164 6.413 -0.835 1.00 0.65 C ATOM 2730 O GLN A 172 -10.198 6.133 -1.451 1.00 0.95 O ATOM 2731 CB GLN A 172 -8.280 7.458 -2.959 1.00 0.80 C ATOM 2732 CG GLN A 172 -9.381 8.458 -3.282 1.00 1.01 C ATOM 2733 CD GLN A 172 -9.475 8.758 -4.768 1.00 1.54 C ATOM 2734 OE1 GLN A 172 -8.480 8.712 -5.490 1.00 2.17 O ATOM 2735 NE2 GLN A 172 -10.673 9.067 -5.236 1.00 2.15 N ATOM 0 H GLN A 172 -6.703 5.674 -1.796 1.00 0.57 H new ATOM 0 HA GLN A 172 -8.018 8.229 -1.001 1.00 0.65 H new ATOM 0 HB2 GLN A 172 -7.350 7.800 -3.412 1.00 0.80 H new ATOM 0 HB3 GLN A 172 -8.527 6.502 -3.420 1.00 0.80 H new ATOM 0 HG2 GLN A 172 -10.337 8.067 -2.932 1.00 1.01 H new ATOM 0 HG3 GLN A 172 -9.197 9.385 -2.738 1.00 1.01 H new ATOM 0 HE21 GLN A 172 -11.475 9.095 -4.606 1.00 2.15 H new ATOM 0 HE22 GLN A 172 -10.795 9.277 -6.227 1.00 2.15 H new ATOM 2744 N THR A 173 -8.908 6.038 0.409 1.00 0.59 N ATOM 2745 CA THR A 173 -9.656 5.023 1.131 1.00 0.66 C ATOM 2746 C THR A 173 -11.172 5.197 1.034 1.00 0.75 C ATOM 2747 O THR A 173 -11.711 6.286 1.248 1.00 1.01 O ATOM 2748 CB THR A 173 -9.231 5.040 2.602 1.00 0.93 C ATOM 2749 OG1 THR A 173 -7.871 5.479 2.687 1.00 1.65 O ATOM 2750 CG2 THR A 173 -9.350 3.656 3.209 1.00 1.12 C ATOM 0 H THR A 173 -8.151 6.444 0.959 1.00 0.59 H new ATOM 0 HA THR A 173 -9.424 4.065 0.665 1.00 0.66 H new ATOM 0 HB THR A 173 -9.883 5.718 3.152 1.00 0.93 H new ATOM 0 HG1 THR A 173 -7.776 6.107 3.434 1.00 1.65 H new ATOM 0 HG21 THR A 173 -9.043 3.690 4.254 1.00 1.12 H new ATOM 0 HG22 THR A 173 -10.384 3.318 3.145 1.00 1.12 H new ATOM 0 HG23 THR A 173 -8.708 2.964 2.665 1.00 1.12 H new ATOM 2758 N GLU A 174 -11.848 4.104 0.697 1.00 0.69 N ATOM 2759 CA GLU A 174 -13.297 4.095 0.576 1.00 0.87 C ATOM 2760 C GLU A 174 -13.956 3.774 1.913 1.00 0.99 C ATOM 2761 O GLU A 174 -15.030 4.297 2.205 1.00 1.32 O ATOM 2762 CB GLU A 174 -13.718 3.115 -0.527 1.00 0.97 C ATOM 2763 CG GLU A 174 -15.200 2.797 -0.546 1.00 1.10 C ATOM 2764 CD GLU A 174 -15.635 2.141 -1.843 1.00 1.80 C ATOM 2765 OE1 GLU A 174 -15.519 0.904 -1.960 1.00 2.45 O ATOM 2766 OE2 GLU A 174 -16.080 2.863 -2.761 1.00 2.30 O ATOM 0 H GLU A 174 -11.408 3.205 0.501 1.00 0.69 H new ATOM 0 HA GLU A 174 -13.639 5.090 0.291 1.00 0.87 H new ATOM 0 HB2 GLU A 174 -13.435 3.531 -1.494 1.00 0.97 H new ATOM 0 HB3 GLU A 174 -13.161 2.186 -0.404 1.00 0.97 H new ATOM 0 HG2 GLU A 174 -15.438 2.138 0.289 1.00 1.10 H new ATOM 0 HG3 GLU A 174 -15.768 3.716 -0.399 1.00 1.10 H new ATOM 2773 N MET A 175 -13.315 2.942 2.728 1.00 1.04 N ATOM 2774 CA MET A 175 -13.773 2.708 4.100 1.00 1.36 C ATOM 2775 C MET A 175 -15.175 2.117 4.102 1.00 1.31 C ATOM 2776 O MET A 175 -16.073 2.608 4.787 1.00 1.63 O ATOM 2777 CB MET A 175 -13.749 4.005 4.920 1.00 1.69 C ATOM 2778 CG MET A 175 -12.364 4.614 5.069 1.00 2.10 C ATOM 2779 SD MET A 175 -12.371 6.142 6.025 1.00 3.24 S ATOM 2780 CE MET A 175 -13.402 7.193 4.999 1.00 3.74 C ATOM 0 H MET A 175 -12.479 2.419 2.467 1.00 1.04 H new ATOM 0 HA MET A 175 -13.089 1.997 4.562 1.00 1.36 H new ATOM 0 HB2 MET A 175 -14.407 4.734 4.447 1.00 1.69 H new ATOM 0 HB3 MET A 175 -14.155 3.804 5.911 1.00 1.69 H new ATOM 0 HG2 MET A 175 -11.705 3.892 5.551 1.00 2.10 H new ATOM 0 HG3 MET A 175 -11.951 4.812 4.080 1.00 2.10 H new ATOM 0 HE1 MET A 175 -13.219 8.238 5.249 1.00 3.74 H new ATOM 0 HE2 MET A 175 -13.163 7.024 3.949 1.00 3.74 H new ATOM 0 HE3 MET A 175 -14.451 6.956 5.174 1.00 3.74 H new ATOM 2790 N ARG A 176 -15.343 1.058 3.322 1.00 1.20 N ATOM 2791 CA ARG A 176 -16.632 0.369 3.205 1.00 1.41 C ATOM 2792 C ARG A 176 -17.122 -0.153 4.551 1.00 1.43 C ATOM 2793 O ARG A 176 -18.327 -0.246 4.785 1.00 2.27 O ATOM 2794 CB ARG A 176 -16.521 -0.791 2.226 1.00 1.92 C ATOM 2795 CG ARG A 176 -16.167 -0.362 0.820 1.00 2.40 C ATOM 2796 CD ARG A 176 -16.088 -1.546 -0.122 1.00 3.21 C ATOM 2797 NE ARG A 176 -17.404 -2.121 -0.378 1.00 3.99 N ATOM 2798 CZ ARG A 176 -18.183 -1.753 -1.392 1.00 4.83 C ATOM 2799 NH1 ARG A 176 -17.802 -0.773 -2.208 1.00 5.05 N ATOM 2800 NH2 ARG A 176 -19.355 -2.350 -1.575 1.00 5.78 N ATOM 0 H ARG A 176 -14.600 0.651 2.755 1.00 1.20 H new ATOM 0 HA ARG A 176 -17.356 1.097 2.839 1.00 1.41 H new ATOM 0 HB2 ARG A 176 -15.765 -1.489 2.586 1.00 1.92 H new ATOM 0 HB3 ARG A 176 -17.468 -1.330 2.205 1.00 1.92 H new ATOM 0 HG2 ARG A 176 -16.913 0.344 0.456 1.00 2.40 H new ATOM 0 HG3 ARG A 176 -15.211 0.161 0.829 1.00 2.40 H new ATOM 0 HD2 ARG A 176 -15.639 -1.232 -1.064 1.00 3.21 H new ATOM 0 HD3 ARG A 176 -15.435 -2.307 0.305 1.00 3.21 H new ATOM 0 HE ARG A 176 -17.746 -2.844 0.255 1.00 3.99 H new ATOM 0 HH11 ARG A 176 -16.910 -0.301 -2.057 1.00 5.05 H new ATOM 0 HH12 ARG A 176 -18.402 -0.494 -2.984 1.00 5.05 H new ATOM 0 HH21 ARG A 176 -19.656 -3.089 -0.939 1.00 5.78 H new ATOM 0 HH22 ARG A 176 -19.954 -2.070 -2.351 1.00 5.78 H new ATOM 2814 N GLY A 177 -16.182 -0.494 5.429 1.00 1.09 N ATOM 2815 CA GLY A 177 -16.538 -0.967 6.755 1.00 1.32 C ATOM 2816 C GLY A 177 -17.201 0.113 7.583 1.00 1.51 C ATOM 2817 O GLY A 177 -17.902 -0.182 8.552 1.00 2.26 O ATOM 0 H GLY A 177 -15.180 -0.451 5.245 1.00 1.09 H new ATOM 0 HA2 GLY A 177 -17.210 -1.821 6.667 1.00 1.32 H new ATOM 0 HA3 GLY A 177 -15.642 -1.318 7.267 1.00 1.32 H new ATOM 2821 N LYS A 178 -16.977 1.366 7.180 1.00 1.79 N ATOM 2822 CA LYS A 178 -17.553 2.534 7.839 1.00 2.45 C ATOM 2823 C LYS A 178 -17.301 2.517 9.339 1.00 2.04 C ATOM 2824 O LYS A 178 -18.156 2.108 10.127 1.00 2.30 O ATOM 2825 CB LYS A 178 -19.049 2.636 7.544 1.00 3.40 C ATOM 2826 CG LYS A 178 -19.353 2.868 6.075 1.00 4.30 C ATOM 2827 CD LYS A 178 -20.838 3.063 5.839 1.00 4.79 C ATOM 2828 CE LYS A 178 -21.135 3.338 4.376 1.00 5.70 C ATOM 2829 NZ LYS A 178 -22.571 3.648 4.155 1.00 6.23 N ATOM 0 H LYS A 178 -16.386 1.597 6.381 1.00 1.79 H new ATOM 0 HA LYS A 178 -17.057 3.416 7.434 1.00 2.45 H new ATOM 0 HB2 LYS A 178 -19.541 1.719 7.870 1.00 3.40 H new ATOM 0 HB3 LYS A 178 -19.474 3.451 8.130 1.00 3.40 H new ATOM 0 HG2 LYS A 178 -18.809 3.745 5.724 1.00 4.30 H new ATOM 0 HG3 LYS A 178 -18.999 2.019 5.491 1.00 4.30 H new ATOM 0 HD2 LYS A 178 -21.379 2.173 6.161 1.00 4.79 H new ATOM 0 HD3 LYS A 178 -21.199 3.892 6.447 1.00 4.79 H new ATOM 0 HE2 LYS A 178 -20.525 4.173 4.032 1.00 5.70 H new ATOM 0 HE3 LYS A 178 -20.854 2.471 3.778 1.00 5.70 H new ATOM 0 HZ1 LYS A 178 -22.735 3.830 3.144 1.00 6.23 H new ATOM 0 HZ2 LYS A 178 -23.151 2.841 4.460 1.00 6.23 H new ATOM 0 HZ3 LYS A 178 -22.833 4.491 4.706 1.00 6.23 H new ATOM 2843 N LEU A 179 -16.118 2.966 9.725 1.00 1.64 N ATOM 2844 CA LEU A 179 -15.756 3.054 11.122 1.00 1.35 C ATOM 2845 C LEU A 179 -16.283 4.373 11.680 1.00 1.40 C ATOM 2846 O LEU A 179 -17.195 4.977 11.115 1.00 1.56 O ATOM 2847 CB LEU A 179 -14.225 2.990 11.306 1.00 1.23 C ATOM 2848 CG LEU A 179 -13.457 1.914 10.518 1.00 1.17 C ATOM 2849 CD1 LEU A 179 -14.142 0.564 10.612 1.00 1.61 C ATOM 2850 CD2 LEU A 179 -13.249 2.314 9.062 1.00 1.15 C ATOM 0 H LEU A 179 -15.390 3.276 9.082 1.00 1.64 H new ATOM 0 HA LEU A 179 -16.195 2.210 11.655 1.00 1.35 H new ATOM 0 HB2 LEU A 179 -13.813 3.962 11.036 1.00 1.23 H new ATOM 0 HB3 LEU A 179 -14.020 2.841 12.366 1.00 1.23 H new ATOM 0 HG LEU A 179 -12.473 1.828 10.979 1.00 1.17 H new ATOM 0 HD11 LEU A 179 -13.574 -0.173 10.044 1.00 1.61 H new ATOM 0 HD12 LEU A 179 -14.196 0.255 11.656 1.00 1.61 H new ATOM 0 HD13 LEU A 179 -15.150 0.638 10.203 1.00 1.61 H new ATOM 0 HD21 LEU A 179 -12.703 1.526 8.543 1.00 1.15 H new ATOM 0 HD22 LEU A 179 -14.217 2.461 8.583 1.00 1.15 H new ATOM 0 HD23 LEU A 179 -12.678 3.241 9.017 1.00 1.15 H new ATOM 2862 N SER A 180 -15.697 4.826 12.767 1.00 1.31 N ATOM 2863 CA SER A 180 -16.080 6.086 13.368 1.00 1.39 C ATOM 2864 C SER A 180 -14.935 7.074 13.207 1.00 1.32 C ATOM 2865 O SER A 180 -13.781 6.656 13.123 1.00 1.19 O ATOM 2866 CB SER A 180 -16.445 5.881 14.840 1.00 1.41 C ATOM 2867 OG SER A 180 -17.503 4.947 14.962 1.00 2.04 O ATOM 0 H SER A 180 -14.948 4.336 13.256 1.00 1.31 H new ATOM 0 HA SER A 180 -16.962 6.488 12.869 1.00 1.39 H new ATOM 0 HB2 SER A 180 -15.574 5.527 15.391 1.00 1.41 H new ATOM 0 HB3 SER A 180 -16.738 6.832 15.284 1.00 1.41 H new ATOM 0 HG SER A 180 -17.724 4.825 15.909 1.00 2.04 H new ATOM 2873 N PRO A 181 -15.234 8.381 13.138 1.00 1.45 N ATOM 2874 CA PRO A 181 -14.227 9.429 12.929 1.00 1.44 C ATOM 2875 C PRO A 181 -12.926 9.182 13.695 1.00 1.30 C ATOM 2876 O PRO A 181 -11.859 9.076 13.094 1.00 1.20 O ATOM 2877 CB PRO A 181 -14.935 10.673 13.451 1.00 1.65 C ATOM 2878 CG PRO A 181 -16.371 10.439 13.134 1.00 1.74 C ATOM 2879 CD PRO A 181 -16.592 8.952 13.250 1.00 1.64 C ATOM 0 HA PRO A 181 -13.910 9.491 11.888 1.00 1.44 H new ATOM 0 HB2 PRO A 181 -14.780 10.799 14.522 1.00 1.65 H new ATOM 0 HB3 PRO A 181 -14.563 11.576 12.966 1.00 1.65 H new ATOM 0 HG2 PRO A 181 -17.015 10.983 13.824 1.00 1.74 H new ATOM 0 HG3 PRO A 181 -16.610 10.791 12.130 1.00 1.74 H new ATOM 0 HD2 PRO A 181 -17.058 8.690 14.200 1.00 1.64 H new ATOM 0 HD3 PRO A 181 -17.247 8.583 12.461 1.00 1.64 H new ATOM 2887 N SER A 182 -13.036 9.022 15.009 1.00 1.34 N ATOM 2888 CA SER A 182 -11.871 8.868 15.880 1.00 1.28 C ATOM 2889 C SER A 182 -11.091 7.578 15.594 1.00 1.11 C ATOM 2890 O SER A 182 -9.964 7.412 16.061 1.00 1.09 O ATOM 2891 CB SER A 182 -12.324 8.881 17.339 1.00 1.40 C ATOM 2892 OG SER A 182 -13.156 9.999 17.602 1.00 2.14 O ATOM 0 H SER A 182 -13.929 8.995 15.501 1.00 1.34 H new ATOM 0 HA SER A 182 -11.199 9.703 15.681 1.00 1.28 H new ATOM 0 HB2 SER A 182 -12.863 7.961 17.565 1.00 1.40 H new ATOM 0 HB3 SER A 182 -11.453 8.909 17.994 1.00 1.40 H new ATOM 0 HG SER A 182 -13.435 9.985 18.541 1.00 2.14 H new ATOM 2898 N ILE A 183 -11.677 6.684 14.806 1.00 1.04 N ATOM 2899 CA ILE A 183 -11.063 5.391 14.512 1.00 0.90 C ATOM 2900 C ILE A 183 -10.221 5.527 13.275 1.00 0.79 C ATOM 2901 O ILE A 183 -9.107 5.039 13.183 1.00 0.69 O ATOM 2902 CB ILE A 183 -12.113 4.301 14.233 1.00 0.96 C ATOM 2903 CG1 ILE A 183 -13.173 4.280 15.327 1.00 1.09 C ATOM 2904 CG2 ILE A 183 -11.449 2.938 14.105 1.00 0.92 C ATOM 2905 CD1 ILE A 183 -12.616 4.016 16.711 1.00 1.12 C ATOM 0 H ILE A 183 -12.581 6.830 14.357 1.00 1.04 H new ATOM 0 HA ILE A 183 -10.475 5.101 15.383 1.00 0.90 H new ATOM 0 HB ILE A 183 -12.603 4.534 13.288 1.00 0.96 H new ATOM 0 HG12 ILE A 183 -13.696 5.236 15.332 1.00 1.09 H new ATOM 0 HG13 ILE A 183 -13.911 3.514 15.090 1.00 1.09 H new ATOM 0 HG21 ILE A 183 -12.208 2.181 13.908 1.00 0.92 H new ATOM 0 HG22 ILE A 183 -10.734 2.958 13.283 1.00 0.92 H new ATOM 0 HG23 ILE A 183 -10.929 2.698 15.033 1.00 0.92 H new ATOM 0 HD11 ILE A 183 -13.429 4.016 17.437 1.00 1.12 H new ATOM 0 HD12 ILE A 183 -12.118 3.046 16.724 1.00 1.12 H new ATOM 0 HD13 ILE A 183 -11.899 4.795 16.970 1.00 1.12 H new ATOM 2917 N ILE A 184 -10.812 6.202 12.332 1.00 0.87 N ATOM 2918 CA ILE A 184 -10.221 6.496 11.060 1.00 0.83 C ATOM 2919 C ILE A 184 -9.041 7.440 11.224 1.00 0.81 C ATOM 2920 O ILE A 184 -8.034 7.344 10.516 1.00 0.75 O ATOM 2921 CB ILE A 184 -11.289 7.106 10.134 1.00 0.96 C ATOM 2922 CG1 ILE A 184 -12.210 6.022 9.591 1.00 0.98 C ATOM 2923 CG2 ILE A 184 -10.664 7.897 8.991 1.00 1.00 C ATOM 2924 CD1 ILE A 184 -13.607 6.093 10.159 1.00 1.13 C ATOM 0 H ILE A 184 -11.755 6.577 12.433 1.00 0.87 H new ATOM 0 HA ILE A 184 -9.847 5.575 10.613 1.00 0.83 H new ATOM 0 HB ILE A 184 -11.878 7.802 10.731 1.00 0.96 H new ATOM 0 HG12 ILE A 184 -12.261 6.107 8.505 1.00 0.98 H new ATOM 0 HG13 ILE A 184 -11.782 5.045 9.815 1.00 0.98 H new ATOM 0 HG21 ILE A 184 -11.452 8.311 8.361 1.00 1.00 H new ATOM 0 HG22 ILE A 184 -10.061 8.709 9.397 1.00 1.00 H new ATOM 0 HG23 ILE A 184 -10.032 7.238 8.396 1.00 1.00 H new ATOM 0 HD11 ILE A 184 -14.214 5.294 9.733 1.00 1.13 H new ATOM 0 HD12 ILE A 184 -13.566 5.979 11.242 1.00 1.13 H new ATOM 0 HD13 ILE A 184 -14.051 7.057 9.913 1.00 1.13 H new ATOM 2936 N GLU A 185 -9.171 8.326 12.196 1.00 0.91 N ATOM 2937 CA GLU A 185 -8.091 9.223 12.579 1.00 0.99 C ATOM 2938 C GLU A 185 -6.908 8.406 13.075 1.00 0.91 C ATOM 2939 O GLU A 185 -5.775 8.880 13.116 1.00 0.99 O ATOM 2940 CB GLU A 185 -8.563 10.183 13.671 1.00 1.17 C ATOM 2941 CG GLU A 185 -9.710 11.075 13.235 1.00 1.58 C ATOM 2942 CD GLU A 185 -9.305 12.076 12.175 1.00 2.26 C ATOM 2943 OE1 GLU A 185 -8.783 13.150 12.540 1.00 2.46 O ATOM 2944 OE2 GLU A 185 -9.499 11.797 10.974 1.00 2.89 O ATOM 0 H GLU A 185 -10.025 8.445 12.741 1.00 0.91 H new ATOM 0 HA GLU A 185 -7.786 9.809 11.712 1.00 0.99 H new ATOM 0 HB2 GLU A 185 -8.872 9.606 14.543 1.00 1.17 H new ATOM 0 HB3 GLU A 185 -7.725 10.807 13.983 1.00 1.17 H new ATOM 0 HG2 GLU A 185 -10.521 10.455 12.852 1.00 1.58 H new ATOM 0 HG3 GLU A 185 -10.099 11.609 14.102 1.00 1.58 H new ATOM 2951 N LYS A 186 -7.196 7.180 13.482 1.00 0.82 N ATOM 2952 CA LYS A 186 -6.164 6.232 13.833 1.00 0.79 C ATOM 2953 C LYS A 186 -5.794 5.388 12.626 1.00 0.70 C ATOM 2954 O LYS A 186 -4.621 5.265 12.287 1.00 0.86 O ATOM 2955 CB LYS A 186 -6.629 5.329 14.974 1.00 0.80 C ATOM 2956 CG LYS A 186 -7.031 6.098 16.212 1.00 1.27 C ATOM 2957 CD LYS A 186 -7.469 5.173 17.336 1.00 1.28 C ATOM 2958 CE LYS A 186 -8.859 4.612 17.087 1.00 0.96 C ATOM 2959 NZ LYS A 186 -9.272 3.670 18.159 1.00 1.09 N ATOM 0 H LYS A 186 -8.146 6.821 13.576 1.00 0.82 H new ATOM 0 HA LYS A 186 -5.286 6.788 14.162 1.00 0.79 H new ATOM 0 HB2 LYS A 186 -7.475 4.731 14.635 1.00 0.80 H new ATOM 0 HB3 LYS A 186 -5.829 4.634 15.229 1.00 0.80 H new ATOM 0 HG2 LYS A 186 -6.193 6.707 16.549 1.00 1.27 H new ATOM 0 HG3 LYS A 186 -7.844 6.782 15.967 1.00 1.27 H new ATOM 0 HD2 LYS A 186 -6.757 4.353 17.432 1.00 1.28 H new ATOM 0 HD3 LYS A 186 -7.459 5.717 18.281 1.00 1.28 H new ATOM 0 HE2 LYS A 186 -9.576 5.431 17.026 1.00 0.96 H new ATOM 0 HE3 LYS A 186 -8.878 4.099 16.125 1.00 0.96 H new ATOM 0 HZ1 LYS A 186 -10.225 3.308 17.955 1.00 1.09 H new ATOM 0 HZ2 LYS A 186 -8.602 2.876 18.201 1.00 1.09 H new ATOM 0 HZ3 LYS A 186 -9.279 4.166 19.073 1.00 1.09 H new ATOM 2973 N THR A 187 -6.805 4.837 11.953 1.00 0.59 N ATOM 2974 CA THR A 187 -6.560 3.821 10.937 1.00 0.54 C ATOM 2975 C THR A 187 -5.706 4.349 9.780 1.00 0.50 C ATOM 2976 O THR A 187 -4.879 3.619 9.249 1.00 0.53 O ATOM 2977 CB THR A 187 -7.877 3.198 10.400 1.00 0.58 C ATOM 2978 OG1 THR A 187 -7.589 1.992 9.680 1.00 0.62 O ATOM 2979 CG2 THR A 187 -8.627 4.148 9.482 1.00 0.60 C ATOM 0 H THR A 187 -7.787 5.075 12.092 1.00 0.59 H new ATOM 0 HA THR A 187 -5.995 3.033 11.434 1.00 0.54 H new ATOM 0 HB THR A 187 -8.508 2.987 11.264 1.00 0.58 H new ATOM 0 HG1 THR A 187 -8.424 1.603 9.345 1.00 0.62 H new ATOM 0 HG21 THR A 187 -9.541 3.669 9.131 1.00 0.60 H new ATOM 0 HG22 THR A 187 -8.880 5.057 10.027 1.00 0.60 H new ATOM 0 HG23 THR A 187 -7.999 4.400 8.628 1.00 0.60 H new ATOM 2987 N MET A 188 -5.867 5.614 9.404 1.00 0.52 N ATOM 2988 CA MET A 188 -5.116 6.137 8.265 1.00 0.53 C ATOM 2989 C MET A 188 -3.683 6.517 8.650 1.00 0.54 C ATOM 2990 O MET A 188 -2.734 5.926 8.132 1.00 0.54 O ATOM 2991 CB MET A 188 -5.826 7.325 7.598 1.00 0.62 C ATOM 2992 CG MET A 188 -7.263 7.049 7.173 1.00 0.80 C ATOM 2993 SD MET A 188 -7.404 6.349 5.514 1.00 1.06 S ATOM 2994 CE MET A 188 -6.669 4.732 5.732 1.00 0.83 C ATOM 0 H MET A 188 -6.492 6.281 9.856 1.00 0.52 H new ATOM 0 HA MET A 188 -5.066 5.327 7.537 1.00 0.53 H new ATOM 0 HB2 MET A 188 -5.821 8.168 8.289 1.00 0.62 H new ATOM 0 HB3 MET A 188 -5.254 7.628 6.721 1.00 0.62 H new ATOM 0 HG2 MET A 188 -7.719 6.364 7.887 1.00 0.80 H new ATOM 0 HG3 MET A 188 -7.831 7.979 7.216 1.00 0.80 H new ATOM 0 HE1 MET A 188 -7.077 4.044 4.991 1.00 0.83 H new ATOM 0 HE2 MET A 188 -5.589 4.803 5.605 1.00 0.83 H new ATOM 0 HE3 MET A 188 -6.893 4.362 6.733 1.00 0.83 H new ATOM 3004 N PRO A 189 -3.476 7.475 9.581 1.00 0.60 N ATOM 3005 CA PRO A 189 -2.141 8.000 9.871 1.00 0.71 C ATOM 3006 C PRO A 189 -1.282 7.013 10.650 1.00 0.74 C ATOM 3007 O PRO A 189 -0.079 7.206 10.793 1.00 0.91 O ATOM 3008 CB PRO A 189 -2.413 9.260 10.710 1.00 0.84 C ATOM 3009 CG PRO A 189 -3.889 9.475 10.637 1.00 0.83 C ATOM 3010 CD PRO A 189 -4.476 8.112 10.447 1.00 0.63 C ATOM 0 HA PRO A 189 -1.582 8.200 8.957 1.00 0.71 H new ATOM 0 HB2 PRO A 189 -2.087 9.123 11.741 1.00 0.84 H new ATOM 0 HB3 PRO A 189 -1.871 10.119 10.315 1.00 0.84 H new ATOM 0 HG2 PRO A 189 -4.264 9.942 11.548 1.00 0.83 H new ATOM 0 HG3 PRO A 189 -4.150 10.135 9.810 1.00 0.83 H new ATOM 0 HD2 PRO A 189 -4.596 7.583 11.392 1.00 0.63 H new ATOM 0 HD3 PRO A 189 -5.459 8.151 9.977 1.00 0.63 H new ATOM 3018 N SER A 190 -1.897 5.966 11.174 1.00 0.66 N ATOM 3019 CA SER A 190 -1.149 4.939 11.873 1.00 0.76 C ATOM 3020 C SER A 190 -0.747 3.830 10.910 1.00 0.72 C ATOM 3021 O SER A 190 0.331 3.251 11.032 1.00 0.90 O ATOM 3022 CB SER A 190 -1.966 4.371 13.037 1.00 0.84 C ATOM 3023 OG SER A 190 -1.170 3.560 13.885 1.00 1.50 O ATOM 0 H SER A 190 -2.903 5.807 11.129 1.00 0.66 H new ATOM 0 HA SER A 190 -0.244 5.389 12.281 1.00 0.76 H new ATOM 0 HB2 SER A 190 -2.396 5.189 13.614 1.00 0.84 H new ATOM 0 HB3 SER A 190 -2.798 3.784 12.647 1.00 0.84 H new ATOM 0 HG SER A 190 -1.721 3.214 14.618 1.00 1.50 H new ATOM 3029 N ASN A 191 -1.601 3.563 9.923 1.00 0.57 N ATOM 3030 CA ASN A 191 -1.388 2.430 9.024 1.00 0.61 C ATOM 3031 C ASN A 191 -0.390 2.791 7.940 1.00 0.51 C ATOM 3032 O ASN A 191 0.440 1.970 7.562 1.00 0.52 O ATOM 3033 CB ASN A 191 -2.707 1.982 8.382 1.00 0.70 C ATOM 3034 CG ASN A 191 -2.684 0.557 7.829 1.00 1.08 C ATOM 3035 OD1 ASN A 191 -3.714 -0.118 7.804 1.00 1.88 O ATOM 3036 ND2 ASN A 191 -1.530 0.085 7.376 1.00 1.46 N ATOM 0 H ASN A 191 -2.439 4.110 9.727 1.00 0.57 H new ATOM 0 HA ASN A 191 -0.990 1.606 9.616 1.00 0.61 H new ATOM 0 HB2 ASN A 191 -3.503 2.059 9.123 1.00 0.70 H new ATOM 0 HB3 ASN A 191 -2.956 2.669 7.573 1.00 0.70 H new ATOM 0 HD21 ASN A 191 -1.480 -0.860 6.994 1.00 1.46 H new ATOM 0 HD22 ASN A 191 -0.693 0.667 7.409 1.00 1.46 H new ATOM 3043 N LEU A 192 -0.460 4.018 7.445 1.00 0.45 N ATOM 3044 CA LEU A 192 0.396 4.432 6.347 1.00 0.42 C ATOM 3045 C LEU A 192 1.849 4.496 6.776 1.00 0.36 C ATOM 3046 O LEU A 192 2.736 4.015 6.074 1.00 0.35 O ATOM 3047 CB LEU A 192 -0.049 5.784 5.815 1.00 0.48 C ATOM 3048 CG LEU A 192 -1.474 5.815 5.274 1.00 0.62 C ATOM 3049 CD1 LEU A 192 -1.766 7.150 4.633 1.00 1.04 C ATOM 3050 CD2 LEU A 192 -1.704 4.682 4.285 1.00 1.09 C ATOM 0 H LEU A 192 -1.097 4.739 7.785 1.00 0.45 H new ATOM 0 HA LEU A 192 0.309 3.688 5.555 1.00 0.42 H new ATOM 0 HB2 LEU A 192 0.039 6.521 6.613 1.00 0.48 H new ATOM 0 HB3 LEU A 192 0.633 6.090 5.022 1.00 0.48 H new ATOM 0 HG LEU A 192 -2.159 5.676 6.110 1.00 0.62 H new ATOM 0 HD11 LEU A 192 -2.787 7.155 4.252 1.00 1.04 H new ATOM 0 HD12 LEU A 192 -1.651 7.942 5.373 1.00 1.04 H new ATOM 0 HD13 LEU A 192 -1.071 7.318 3.810 1.00 1.04 H new ATOM 0 HD21 LEU A 192 -2.728 4.726 3.913 1.00 1.09 H new ATOM 0 HD22 LEU A 192 -1.010 4.781 3.450 1.00 1.09 H new ATOM 0 HD23 LEU A 192 -1.539 3.726 4.782 1.00 1.09 H new ATOM 3062 N VAL A 193 2.088 5.074 7.940 1.00 0.36 N ATOM 3063 CA VAL A 193 3.443 5.178 8.458 1.00 0.36 C ATOM 3064 C VAL A 193 3.962 3.795 8.786 1.00 0.39 C ATOM 3065 O VAL A 193 5.147 3.508 8.659 1.00 0.42 O ATOM 3066 CB VAL A 193 3.517 6.067 9.717 1.00 0.44 C ATOM 3067 CG1 VAL A 193 2.626 7.275 9.547 1.00 0.68 C ATOM 3068 CG2 VAL A 193 3.139 5.314 10.989 1.00 0.59 C ATOM 0 H VAL A 193 1.369 5.476 8.541 1.00 0.36 H new ATOM 0 HA VAL A 193 4.058 5.644 7.688 1.00 0.36 H new ATOM 0 HB VAL A 193 4.554 6.383 9.828 1.00 0.44 H new ATOM 0 HG11 VAL A 193 2.683 7.898 10.440 1.00 0.68 H new ATOM 0 HG12 VAL A 193 2.954 7.850 8.681 1.00 0.68 H new ATOM 0 HG13 VAL A 193 1.597 6.950 9.397 1.00 0.68 H new ATOM 0 HG21 VAL A 193 3.208 5.986 11.844 1.00 0.59 H new ATOM 0 HG22 VAL A 193 2.118 4.942 10.902 1.00 0.59 H new ATOM 0 HG23 VAL A 193 3.820 4.475 11.131 1.00 0.59 H new ATOM 3078 N ASN A 194 3.041 2.943 9.187 1.00 0.43 N ATOM 3079 CA ASN A 194 3.351 1.577 9.533 1.00 0.48 C ATOM 3080 C ASN A 194 3.619 0.760 8.289 1.00 0.45 C ATOM 3081 O ASN A 194 4.357 -0.215 8.331 1.00 0.49 O ATOM 3082 CB ASN A 194 2.205 0.969 10.328 1.00 0.58 C ATOM 3083 CG ASN A 194 2.601 0.620 11.748 1.00 1.28 C ATOM 3084 OD1 ASN A 194 3.138 -0.457 12.010 1.00 1.80 O ATOM 3085 ND2 ASN A 194 2.321 1.519 12.677 1.00 2.07 N ATOM 0 H ASN A 194 2.054 3.182 9.281 1.00 0.43 H new ATOM 0 HA ASN A 194 4.251 1.569 10.148 1.00 0.48 H new ATOM 0 HB2 ASN A 194 1.371 1.670 10.349 1.00 0.58 H new ATOM 0 HB3 ASN A 194 1.853 0.070 9.822 1.00 0.58 H new ATOM 0 HD21 ASN A 194 2.551 1.332 13.653 1.00 2.07 H new ATOM 0 HD22 ASN A 194 1.876 2.399 12.417 1.00 2.07 H new ATOM 3092 N PHE A 195 3.023 1.170 7.179 1.00 0.44 N ATOM 3093 CA PHE A 195 3.280 0.531 5.905 1.00 0.44 C ATOM 3094 C PHE A 195 4.665 0.943 5.425 1.00 0.36 C ATOM 3095 O PHE A 195 5.353 0.187 4.743 1.00 0.36 O ATOM 3096 CB PHE A 195 2.214 0.919 4.877 1.00 0.47 C ATOM 3097 CG PHE A 195 1.960 -0.146 3.845 1.00 0.73 C ATOM 3098 CD1 PHE A 195 2.875 -0.369 2.829 1.00 1.51 C ATOM 3099 CD2 PHE A 195 0.812 -0.919 3.888 1.00 1.06 C ATOM 3100 CE1 PHE A 195 2.649 -1.344 1.875 1.00 2.00 C ATOM 3101 CE2 PHE A 195 0.579 -1.894 2.938 1.00 1.43 C ATOM 3102 CZ PHE A 195 1.484 -2.122 1.950 1.00 1.76 C ATOM 0 H PHE A 195 2.359 1.943 7.139 1.00 0.44 H new ATOM 0 HA PHE A 195 3.240 -0.552 6.025 1.00 0.44 H new ATOM 0 HB2 PHE A 195 1.282 1.139 5.397 1.00 0.47 H new ATOM 0 HB3 PHE A 195 2.522 1.835 4.374 1.00 0.47 H new ATOM 0 HD1 PHE A 195 3.775 0.226 2.782 1.00 1.51 H new ATOM 0 HD2 PHE A 195 0.090 -0.757 4.674 1.00 1.06 H new ATOM 0 HE1 PHE A 195 3.362 -1.505 1.080 1.00 2.00 H new ATOM 0 HE2 PHE A 195 -0.328 -2.479 2.980 1.00 1.43 H new ATOM 0 HZ PHE A 195 1.307 -2.901 1.224 1.00 1.76 H new ATOM 3112 N ILE A 196 5.080 2.148 5.803 1.00 0.31 N ATOM 3113 CA ILE A 196 6.428 2.592 5.533 1.00 0.27 C ATOM 3114 C ILE A 196 7.406 1.960 6.506 1.00 0.28 C ATOM 3115 O ILE A 196 8.531 1.659 6.147 1.00 0.28 O ATOM 3116 CB ILE A 196 6.534 4.120 5.591 1.00 0.25 C ATOM 3117 CG1 ILE A 196 5.883 4.708 4.349 1.00 0.25 C ATOM 3118 CG2 ILE A 196 7.984 4.565 5.719 1.00 0.29 C ATOM 3119 CD1 ILE A 196 6.046 6.196 4.234 1.00 0.26 C ATOM 0 H ILE A 196 4.499 2.827 6.295 1.00 0.31 H new ATOM 0 HA ILE A 196 6.684 2.273 4.523 1.00 0.27 H new ATOM 0 HB ILE A 196 6.011 4.485 6.475 1.00 0.25 H new ATOM 0 HG12 ILE A 196 6.311 4.234 3.465 1.00 0.25 H new ATOM 0 HG13 ILE A 196 4.820 4.467 4.357 1.00 0.25 H new ATOM 0 HG21 ILE A 196 8.028 5.653 5.758 1.00 0.29 H new ATOM 0 HG22 ILE A 196 8.412 4.151 6.632 1.00 0.29 H new ATOM 0 HG23 ILE A 196 8.551 4.209 4.859 1.00 0.29 H new ATOM 0 HD11 ILE A 196 5.557 6.546 3.325 1.00 0.26 H new ATOM 0 HD12 ILE A 196 5.593 6.680 5.099 1.00 0.26 H new ATOM 0 HD13 ILE A 196 7.107 6.444 4.194 1.00 0.26 H new ATOM 3131 N LEU A 197 6.974 1.748 7.735 1.00 0.33 N ATOM 3132 CA LEU A 197 7.789 1.037 8.707 1.00 0.37 C ATOM 3133 C LEU A 197 7.932 -0.398 8.294 1.00 0.36 C ATOM 3134 O LEU A 197 8.974 -1.012 8.483 1.00 0.38 O ATOM 3135 CB LEU A 197 7.178 1.103 10.095 1.00 0.50 C ATOM 3136 CG LEU A 197 7.208 2.472 10.741 1.00 0.52 C ATOM 3137 CD1 LEU A 197 6.549 2.400 12.103 1.00 1.00 C ATOM 3138 CD2 LEU A 197 8.644 2.955 10.838 1.00 1.03 C ATOM 0 H LEU A 197 6.067 2.056 8.085 1.00 0.33 H new ATOM 0 HA LEU A 197 8.768 1.516 8.740 1.00 0.37 H new ATOM 0 HB2 LEU A 197 6.143 0.768 10.036 1.00 0.50 H new ATOM 0 HB3 LEU A 197 7.704 0.401 10.741 1.00 0.50 H new ATOM 0 HG LEU A 197 6.653 3.188 10.135 1.00 0.52 H new ATOM 0 HD11 LEU A 197 6.570 3.385 12.570 1.00 1.00 H new ATOM 0 HD12 LEU A 197 5.515 2.074 11.990 1.00 1.00 H new ATOM 0 HD13 LEU A 197 7.087 1.690 12.731 1.00 1.00 H new ATOM 0 HD21 LEU A 197 8.666 3.941 11.303 1.00 1.03 H new ATOM 0 HD22 LEU A 197 9.223 2.256 11.442 1.00 1.03 H new ATOM 0 HD23 LEU A 197 9.076 3.016 9.839 1.00 1.03 H new ATOM 3150 N ASN A 198 6.860 -0.921 7.747 1.00 0.38 N ATOM 3151 CA ASN A 198 6.903 -2.193 7.051 1.00 0.43 C ATOM 3152 C ASN A 198 8.024 -2.182 6.042 1.00 0.31 C ATOM 3153 O ASN A 198 8.686 -3.176 5.824 1.00 0.32 O ATOM 3154 CB ASN A 198 5.601 -2.459 6.316 1.00 0.65 C ATOM 3155 CG ASN A 198 4.609 -3.235 7.145 1.00 1.05 C ATOM 3156 OD1 ASN A 198 4.990 -4.033 7.998 1.00 1.90 O ATOM 3157 ND2 ASN A 198 3.329 -3.010 6.897 1.00 1.61 N ATOM 0 H ASN A 198 5.939 -0.484 7.769 1.00 0.38 H new ATOM 0 HA ASN A 198 7.062 -2.975 7.794 1.00 0.43 H new ATOM 0 HB2 ASN A 198 5.156 -1.509 6.020 1.00 0.65 H new ATOM 0 HB3 ASN A 198 5.812 -3.011 5.400 1.00 0.65 H new ATOM 0 HD21 ASN A 198 2.612 -3.509 7.424 1.00 1.61 H new ATOM 0 HD22 ASN A 198 3.059 -2.338 6.179 1.00 1.61 H new ATOM 3164 N ALA A 199 8.236 -1.039 5.432 1.00 0.29 N ATOM 3165 CA ALA A 199 9.261 -0.895 4.447 1.00 0.25 C ATOM 3166 C ALA A 199 10.618 -0.687 5.101 1.00 0.23 C ATOM 3167 O ALA A 199 11.604 -1.276 4.682 1.00 0.26 O ATOM 3168 CB ALA A 199 8.882 0.249 3.552 1.00 0.26 C ATOM 0 H ALA A 199 7.700 -0.190 5.610 1.00 0.29 H new ATOM 0 HA ALA A 199 9.349 -1.804 3.851 1.00 0.25 H new ATOM 0 HB1 ALA A 199 9.648 0.383 2.788 1.00 0.26 H new ATOM 0 HB2 ALA A 199 7.926 0.035 3.074 1.00 0.26 H new ATOM 0 HB3 ALA A 199 8.796 1.161 4.143 1.00 0.26 H new ATOM 3174 N LYS A 200 10.655 0.137 6.142 1.00 0.26 N ATOM 3175 CA LYS A 200 11.882 0.369 6.903 1.00 0.29 C ATOM 3176 C LYS A 200 12.401 -0.946 7.478 1.00 0.31 C ATOM 3177 O LYS A 200 13.606 -1.197 7.527 1.00 0.36 O ATOM 3178 CB LYS A 200 11.607 1.325 8.061 1.00 0.34 C ATOM 3179 CG LYS A 200 10.844 2.590 7.678 1.00 0.57 C ATOM 3180 CD LYS A 200 11.568 3.429 6.634 1.00 0.54 C ATOM 3181 CE LYS A 200 12.626 4.331 7.248 1.00 0.64 C ATOM 3182 NZ LYS A 200 12.051 5.268 8.253 1.00 0.97 N ATOM 0 H LYS A 200 9.847 0.659 6.481 1.00 0.26 H new ATOM 0 HA LYS A 200 12.624 0.800 6.231 1.00 0.29 H new ATOM 0 HB2 LYS A 200 11.041 0.794 8.826 1.00 0.34 H new ATOM 0 HB3 LYS A 200 12.558 1.613 8.510 1.00 0.34 H new ATOM 0 HG2 LYS A 200 9.861 2.313 7.296 1.00 0.57 H new ATOM 0 HG3 LYS A 200 10.680 3.193 8.571 1.00 0.57 H new ATOM 0 HD2 LYS A 200 12.036 2.770 5.903 1.00 0.54 H new ATOM 0 HD3 LYS A 200 10.843 4.039 6.095 1.00 0.54 H new ATOM 0 HE2 LYS A 200 13.393 3.718 7.722 1.00 0.64 H new ATOM 0 HE3 LYS A 200 13.116 4.902 6.460 1.00 0.64 H new ATOM 0 HZ1 LYS A 200 12.437 6.221 8.100 1.00 0.97 H new ATOM 0 HZ2 LYS A 200 11.016 5.293 8.152 1.00 0.97 H new ATOM 0 HZ3 LYS A 200 12.297 4.944 9.210 1.00 0.97 H new ATOM 3196 N ASP A 201 11.464 -1.768 7.923 1.00 0.30 N ATOM 3197 CA ASP A 201 11.780 -3.055 8.537 1.00 0.33 C ATOM 3198 C ASP A 201 11.869 -4.147 7.496 1.00 0.31 C ATOM 3199 O ASP A 201 12.775 -4.970 7.534 1.00 0.36 O ATOM 3200 CB ASP A 201 10.729 -3.455 9.582 1.00 0.40 C ATOM 3201 CG ASP A 201 10.885 -2.725 10.900 1.00 1.10 C ATOM 3202 OD1 ASP A 201 12.014 -2.685 11.432 1.00 1.18 O ATOM 3203 OD2 ASP A 201 9.871 -2.217 11.430 1.00 1.94 O ATOM 0 H ASP A 201 10.466 -1.566 7.871 1.00 0.30 H new ATOM 0 HA ASP A 201 12.746 -2.938 9.028 1.00 0.33 H new ATOM 0 HB2 ASP A 201 9.735 -3.258 9.181 1.00 0.40 H new ATOM 0 HB3 ASP A 201 10.794 -4.528 9.760 1.00 0.40 H new ATOM 3208 N GLY A 202 10.925 -4.150 6.567 1.00 0.31 N ATOM 3209 CA GLY A 202 10.868 -5.198 5.560 1.00 0.37 C ATOM 3210 C GLY A 202 12.044 -5.144 4.624 1.00 0.37 C ATOM 3211 O GLY A 202 12.494 -6.166 4.119 1.00 0.47 O ATOM 0 H GLY A 202 10.193 -3.444 6.490 1.00 0.31 H new ATOM 0 HA2 GLY A 202 10.839 -6.171 6.050 1.00 0.37 H new ATOM 0 HA3 GLY A 202 9.945 -5.102 4.988 1.00 0.37 H new ATOM 3215 N ILE A 203 12.537 -3.943 4.393 1.00 0.30 N ATOM 3216 CA ILE A 203 13.689 -3.736 3.548 1.00 0.37 C ATOM 3217 C ILE A 203 14.931 -4.319 4.205 1.00 0.47 C ATOM 3218 O ILE A 203 15.815 -4.857 3.537 1.00 0.61 O ATOM 3219 CB ILE A 203 13.892 -2.225 3.277 1.00 0.32 C ATOM 3220 CG1 ILE A 203 14.528 -1.979 1.928 1.00 0.41 C ATOM 3221 CG2 ILE A 203 14.749 -1.584 4.334 1.00 0.38 C ATOM 3222 CD1 ILE A 203 13.614 -2.278 0.793 1.00 0.52 C ATOM 0 H ILE A 203 12.148 -3.086 4.787 1.00 0.30 H new ATOM 0 HA ILE A 203 13.520 -4.243 2.598 1.00 0.37 H new ATOM 0 HB ILE A 203 12.898 -1.778 3.294 1.00 0.32 H new ATOM 0 HG12 ILE A 203 14.847 -0.938 1.867 1.00 0.41 H new ATOM 0 HG13 ILE A 203 15.424 -2.593 1.837 1.00 0.41 H new ATOM 0 HG21 ILE A 203 14.870 -0.524 4.111 1.00 0.38 H new ATOM 0 HG22 ILE A 203 14.272 -1.698 5.308 1.00 0.38 H new ATOM 0 HG23 ILE A 203 15.727 -2.065 4.351 1.00 0.38 H new ATOM 0 HD11 ILE A 203 14.127 -2.082 -0.149 1.00 0.52 H new ATOM 0 HD12 ILE A 203 13.315 -3.326 0.833 1.00 0.52 H new ATOM 0 HD13 ILE A 203 12.729 -1.646 0.862 1.00 0.52 H new ATOM 3234 N LYS A 204 14.977 -4.237 5.525 1.00 0.47 N ATOM 3235 CA LYS A 204 16.111 -4.726 6.262 1.00 0.63 C ATOM 3236 C LYS A 204 15.924 -6.191 6.562 1.00 0.64 C ATOM 3237 O LYS A 204 16.877 -6.943 6.637 1.00 0.78 O ATOM 3238 CB LYS A 204 16.331 -3.921 7.524 1.00 0.74 C ATOM 3239 CG LYS A 204 16.799 -2.514 7.217 1.00 1.21 C ATOM 3240 CD LYS A 204 17.122 -1.740 8.470 1.00 1.55 C ATOM 3241 CE LYS A 204 17.748 -0.399 8.128 1.00 2.41 C ATOM 3242 NZ LYS A 204 16.945 0.352 7.123 1.00 3.37 N ATOM 0 H LYS A 204 14.237 -3.835 6.100 1.00 0.47 H new ATOM 0 HA LYS A 204 17.008 -4.609 5.653 1.00 0.63 H new ATOM 0 HB2 LYS A 204 15.404 -3.879 8.095 1.00 0.74 H new ATOM 0 HB3 LYS A 204 17.069 -4.421 8.151 1.00 0.74 H new ATOM 0 HG2 LYS A 204 17.682 -2.557 6.580 1.00 1.21 H new ATOM 0 HG3 LYS A 204 16.026 -1.989 6.656 1.00 1.21 H new ATOM 0 HD2 LYS A 204 16.213 -1.585 9.052 1.00 1.55 H new ATOM 0 HD3 LYS A 204 17.805 -2.317 9.094 1.00 1.55 H new ATOM 0 HE2 LYS A 204 17.844 0.198 9.035 1.00 2.41 H new ATOM 0 HE3 LYS A 204 18.755 -0.557 7.742 1.00 2.41 H new ATOM 0 HZ1 LYS A 204 17.118 1.372 7.232 1.00 3.37 H new ATOM 0 HZ2 LYS A 204 17.221 0.054 6.165 1.00 3.37 H new ATOM 0 HZ3 LYS A 204 15.934 0.155 7.269 1.00 3.37 H new ATOM 3256 N ALA A 205 14.676 -6.581 6.710 1.00 0.57 N ATOM 3257 CA ALA A 205 14.307 -7.981 6.753 1.00 0.69 C ATOM 3258 C ALA A 205 14.676 -8.635 5.437 1.00 0.87 C ATOM 3259 O ALA A 205 15.002 -9.820 5.375 1.00 1.02 O ATOM 3260 CB ALA A 205 12.815 -8.111 6.994 1.00 0.68 C ATOM 0 H ALA A 205 13.889 -5.938 6.804 1.00 0.57 H new ATOM 0 HA ALA A 205 14.840 -8.475 7.565 1.00 0.69 H new ATOM 0 HB1 ALA A 205 12.542 -9.166 7.026 1.00 0.68 H new ATOM 0 HB2 ALA A 205 12.557 -7.641 7.943 1.00 0.68 H new ATOM 0 HB3 ALA A 205 12.272 -7.620 6.187 1.00 0.68 H new ATOM 3266 N HIS A 206 14.604 -7.841 4.379 1.00 0.89 N ATOM 3267 CA HIS A 206 14.950 -8.308 3.053 1.00 1.11 C ATOM 3268 C HIS A 206 16.467 -8.365 2.853 1.00 1.21 C ATOM 3269 O HIS A 206 16.941 -9.069 1.962 1.00 1.52 O ATOM 3270 CB HIS A 206 14.293 -7.416 2.000 1.00 1.29 C ATOM 3271 CG HIS A 206 13.967 -8.136 0.729 1.00 2.13 C ATOM 3272 ND1 HIS A 206 12.761 -8.774 0.515 1.00 2.83 N ATOM 3273 CD2 HIS A 206 14.687 -8.317 -0.398 1.00 2.92 C ATOM 3274 CE1 HIS A 206 12.762 -9.313 -0.687 1.00 3.56 C ATOM 3275 NE2 HIS A 206 13.916 -9.049 -1.265 1.00 3.63 N ATOM 0 H HIS A 206 14.307 -6.866 4.418 1.00 0.89 H new ATOM 0 HA HIS A 206 14.573 -9.325 2.940 1.00 1.11 H new ATOM 0 HB2 HIS A 206 13.378 -6.992 2.414 1.00 1.29 H new ATOM 0 HB3 HIS A 206 14.958 -6.582 1.776 1.00 1.29 H new ATOM 0 HD2 HIS A 206 15.687 -7.953 -0.583 1.00 2.92 H new ATOM 0 HE1 HIS A 206 11.952 -9.877 -1.125 1.00 3.56 H new ATOM 0 HE2 HIS A 206 14.191 -9.341 -2.203 1.00 3.63 H new ATOM 3284 N ARG A 207 17.235 -7.635 3.665 1.00 1.11 N ATOM 3285 CA ARG A 207 18.695 -7.715 3.556 1.00 1.23 C ATOM 3286 C ARG A 207 19.299 -8.593 4.658 1.00 1.36 C ATOM 3287 O ARG A 207 20.120 -9.466 4.381 1.00 1.67 O ATOM 3288 CB ARG A 207 19.332 -6.319 3.566 1.00 1.20 C ATOM 3289 CG ARG A 207 19.233 -5.606 4.896 1.00 1.41 C ATOM 3290 CD ARG A 207 19.526 -4.120 4.767 1.00 1.49 C ATOM 3291 NE ARG A 207 20.934 -3.862 4.478 1.00 1.73 N ATOM 3292 CZ ARG A 207 21.432 -2.655 4.209 1.00 2.04 C ATOM 3293 NH1 ARG A 207 20.619 -1.614 4.051 1.00 2.47 N ATOM 3294 NH2 ARG A 207 22.742 -2.499 4.053 1.00 2.59 N ATOM 0 H ARG A 207 16.886 -7.001 4.384 1.00 1.11 H new ATOM 0 HA ARG A 207 18.919 -8.184 2.598 1.00 1.23 H new ATOM 0 HB2 ARG A 207 20.383 -6.409 3.291 1.00 1.20 H new ATOM 0 HB3 ARG A 207 18.854 -5.707 2.801 1.00 1.20 H new ATOM 0 HG2 ARG A 207 18.233 -5.744 5.308 1.00 1.41 H new ATOM 0 HG3 ARG A 207 19.933 -6.054 5.601 1.00 1.41 H new ATOM 0 HD2 ARG A 207 18.910 -3.697 3.974 1.00 1.49 H new ATOM 0 HD3 ARG A 207 19.247 -3.614 5.691 1.00 1.49 H new ATOM 0 HE ARG A 207 21.576 -4.654 4.482 1.00 1.73 H new ATOM 0 HH11 ARG A 207 19.610 -1.737 4.136 1.00 2.47 H new ATOM 0 HH12 ARG A 207 21.005 -0.692 3.845 1.00 2.47 H new ATOM 0 HH21 ARG A 207 23.365 -3.302 4.139 1.00 2.59 H new ATOM 0 HH22 ARG A 207 23.125 -1.576 3.847 1.00 2.59 H new ATOM 3308 N THR A 208 18.879 -8.377 5.896 1.00 1.20 N ATOM 3309 CA THR A 208 19.428 -9.097 7.036 1.00 1.41 C ATOM 3310 C THR A 208 18.460 -10.214 7.435 1.00 1.48 C ATOM 3311 O THR A 208 17.267 -10.137 7.129 1.00 1.35 O ATOM 3312 CB THR A 208 19.681 -8.126 8.229 1.00 1.37 C ATOM 3313 OG1 THR A 208 20.717 -8.628 9.084 1.00 1.84 O ATOM 3314 CG2 THR A 208 18.421 -7.905 9.058 1.00 1.53 C ATOM 0 H THR A 208 18.153 -7.703 6.138 1.00 1.20 H new ATOM 0 HA THR A 208 20.387 -9.536 6.761 1.00 1.41 H new ATOM 0 HB THR A 208 19.988 -7.173 7.798 1.00 1.37 H new ATOM 0 HG1 THR A 208 21.547 -8.723 8.571 1.00 1.84 H new ATOM 0 HG21 THR A 208 18.641 -7.222 9.879 1.00 1.53 H new ATOM 0 HG22 THR A 208 17.642 -7.476 8.428 1.00 1.53 H new ATOM 0 HG23 THR A 208 18.078 -8.858 9.461 1.00 1.53 H new ATOM 3322 N PRO A 209 18.955 -11.283 8.085 1.00 1.78 N ATOM 3323 CA PRO A 209 18.109 -12.391 8.550 1.00 1.95 C ATOM 3324 C PRO A 209 17.166 -11.979 9.685 1.00 1.87 C ATOM 3325 O PRO A 209 17.292 -12.449 10.818 1.00 2.12 O ATOM 3326 CB PRO A 209 19.121 -13.431 9.043 1.00 2.33 C ATOM 3327 CG PRO A 209 20.335 -12.641 9.384 1.00 2.35 C ATOM 3328 CD PRO A 209 20.378 -11.517 8.392 1.00 2.03 C ATOM 0 HA PRO A 209 17.452 -12.755 7.760 1.00 1.95 H new ATOM 0 HB2 PRO A 209 18.743 -13.972 9.911 1.00 2.33 H new ATOM 0 HB3 PRO A 209 19.334 -14.173 8.273 1.00 2.33 H new ATOM 0 HG2 PRO A 209 20.281 -12.261 10.404 1.00 2.35 H new ATOM 0 HG3 PRO A 209 21.233 -13.255 9.319 1.00 2.35 H new ATOM 0 HD2 PRO A 209 20.851 -10.629 8.811 1.00 2.03 H new ATOM 0 HD3 PRO A 209 20.943 -11.789 7.500 1.00 2.03 H new ATOM 3336 N SER A 210 16.223 -11.101 9.375 1.00 1.76 N ATOM 3337 CA SER A 210 15.245 -10.649 10.348 1.00 1.78 C ATOM 3338 C SER A 210 13.865 -11.211 10.004 1.00 1.74 C ATOM 3339 O SER A 210 12.845 -10.534 10.132 1.00 2.01 O ATOM 3340 CB SER A 210 15.213 -9.115 10.402 1.00 1.85 C ATOM 3341 OG SER A 210 14.421 -8.649 11.484 1.00 2.31 O ATOM 0 H SER A 210 16.116 -10.686 8.449 1.00 1.76 H new ATOM 0 HA SER A 210 15.531 -11.016 11.334 1.00 1.78 H new ATOM 0 HB2 SER A 210 16.229 -8.732 10.502 1.00 1.85 H new ATOM 0 HB3 SER A 210 14.816 -8.725 9.465 1.00 1.85 H new ATOM 0 HG SER A 210 13.551 -9.100 11.470 1.00 2.31 H new ATOM 3347 N ARG A 211 13.849 -12.452 9.539 1.00 1.75 N ATOM 3348 CA ARG A 211 12.604 -13.175 9.311 1.00 1.94 C ATOM 3349 C ARG A 211 12.480 -14.288 10.338 1.00 2.32 C ATOM 3350 O ARG A 211 11.660 -15.190 10.207 1.00 2.55 O ATOM 3351 CB ARG A 211 12.559 -13.759 7.898 1.00 2.31 C ATOM 3352 CG ARG A 211 12.504 -12.712 6.795 1.00 2.60 C ATOM 3353 CD ARG A 211 12.443 -13.372 5.429 1.00 3.06 C ATOM 3354 NE ARG A 211 12.345 -12.403 4.337 1.00 3.80 N ATOM 3355 CZ ARG A 211 12.805 -12.632 3.106 1.00 4.56 C ATOM 3356 NH1 ARG A 211 13.425 -13.772 2.830 1.00 4.78 N ATOM 3357 NH2 ARG A 211 12.638 -11.729 2.150 1.00 5.45 N ATOM 0 H ARG A 211 14.690 -12.983 9.311 1.00 1.75 H new ATOM 0 HA ARG A 211 11.770 -12.481 9.414 1.00 1.94 H new ATOM 0 HB2 ARG A 211 13.439 -14.385 7.747 1.00 2.31 H new ATOM 0 HB3 ARG A 211 11.687 -14.408 7.812 1.00 2.31 H new ATOM 0 HG2 ARG A 211 11.631 -12.075 6.935 1.00 2.60 H new ATOM 0 HG3 ARG A 211 13.382 -12.068 6.854 1.00 2.60 H new ATOM 0 HD2 ARG A 211 13.333 -13.985 5.286 1.00 3.06 H new ATOM 0 HD3 ARG A 211 11.585 -14.043 5.392 1.00 3.06 H new ATOM 0 HE ARG A 211 11.901 -11.504 4.527 1.00 3.80 H new ATOM 0 HH11 ARG A 211 13.550 -14.474 3.559 1.00 4.78 H new ATOM 0 HH12 ARG A 211 13.776 -13.946 1.888 1.00 4.78 H new ATOM 0 HH21 ARG A 211 12.156 -10.854 2.354 1.00 5.45 H new ATOM 0 HH22 ARG A 211 12.992 -11.909 1.211 1.00 5.45 H new ATOM 3371 N ARG A 212 13.314 -14.203 11.367 1.00 2.62 N ATOM 3372 CA ARG A 212 13.323 -15.180 12.452 1.00 3.26 C ATOM 3373 C ARG A 212 11.982 -15.206 13.179 1.00 3.32 C ATOM 3374 O ARG A 212 11.628 -16.189 13.830 1.00 3.71 O ATOM 3375 CB ARG A 212 14.454 -14.851 13.425 1.00 3.80 C ATOM 3376 CG ARG A 212 14.396 -13.430 13.964 1.00 4.37 C ATOM 3377 CD ARG A 212 15.697 -13.040 14.638 1.00 4.99 C ATOM 3378 NE ARG A 212 16.827 -13.096 13.711 1.00 5.44 N ATOM 3379 CZ ARG A 212 18.062 -12.704 14.012 1.00 6.24 C ATOM 3380 NH1 ARG A 212 18.332 -12.200 15.209 1.00 6.66 N ATOM 3381 NH2 ARG A 212 19.025 -12.813 13.108 1.00 6.86 N ATOM 0 H ARG A 212 14.002 -13.458 11.474 1.00 2.62 H new ATOM 0 HA ARG A 212 13.488 -16.171 12.029 1.00 3.26 H new ATOM 0 HB2 ARG A 212 14.419 -15.550 14.261 1.00 3.80 H new ATOM 0 HB3 ARG A 212 15.410 -15.002 12.923 1.00 3.80 H new ATOM 0 HG2 ARG A 212 14.186 -12.738 13.148 1.00 4.37 H new ATOM 0 HG3 ARG A 212 13.575 -13.343 14.676 1.00 4.37 H new ATOM 0 HD2 ARG A 212 15.609 -12.032 15.043 1.00 4.99 H new ATOM 0 HD3 ARG A 212 15.884 -13.706 15.480 1.00 4.99 H new ATOM 0 HE ARG A 212 16.657 -13.459 12.773 1.00 5.44 H new ATOM 0 HH11 ARG A 212 17.591 -12.111 15.904 1.00 6.66 H new ATOM 0 HH12 ARG A 212 19.281 -11.901 15.434 1.00 6.66 H new ATOM 0 HH21 ARG A 212 18.818 -13.196 12.186 1.00 6.86 H new ATOM 0 HH22 ARG A 212 19.973 -12.514 13.335 1.00 6.86 H new ATOM 3395 N GLY A 213 11.244 -14.115 13.063 1.00 3.12 N ATOM 3396 CA GLY A 213 9.914 -14.045 13.618 1.00 3.37 C ATOM 3397 C GLY A 213 8.891 -13.792 12.539 1.00 2.92 C ATOM 3398 O GLY A 213 7.953 -13.015 12.728 1.00 3.19 O ATOM 0 H GLY A 213 11.550 -13.266 12.587 1.00 3.12 H new ATOM 0 HA2 GLY A 213 9.682 -14.977 14.133 1.00 3.37 H new ATOM 0 HA3 GLY A 213 9.868 -13.250 14.362 1.00 3.37 H new ATOM 3402 N PHE A 214 9.090 -14.425 11.391 1.00 2.56 N ATOM 3403 CA PHE A 214 8.173 -14.281 10.273 1.00 2.44 C ATOM 3404 C PHE A 214 6.839 -14.941 10.603 1.00 2.70 C ATOM 3405 O PHE A 214 6.786 -15.902 11.373 1.00 3.00 O ATOM 3406 CB PHE A 214 8.759 -14.915 9.002 1.00 2.65 C ATOM 3407 CG PHE A 214 8.686 -16.422 8.974 1.00 3.21 C ATOM 3408 CD1 PHE A 214 9.533 -17.181 9.766 1.00 3.82 C ATOM 3409 CD2 PHE A 214 7.777 -17.079 8.158 1.00 3.73 C ATOM 3410 CE1 PHE A 214 9.476 -18.560 9.746 1.00 4.85 C ATOM 3411 CE2 PHE A 214 7.716 -18.458 8.134 1.00 4.67 C ATOM 3412 CZ PHE A 214 8.534 -19.198 8.915 1.00 5.21 C ATOM 0 H PHE A 214 9.880 -15.044 11.211 1.00 2.56 H new ATOM 0 HA PHE A 214 8.018 -13.217 10.094 1.00 2.44 H new ATOM 0 HB2 PHE A 214 8.229 -14.520 8.135 1.00 2.65 H new ATOM 0 HB3 PHE A 214 9.801 -14.611 8.905 1.00 2.65 H new ATOM 0 HD1 PHE A 214 10.247 -16.687 10.408 1.00 3.82 H new ATOM 0 HD2 PHE A 214 7.109 -16.505 7.534 1.00 3.73 H new ATOM 0 HE1 PHE A 214 10.146 -19.143 10.360 1.00 4.85 H new ATOM 0 HE2 PHE A 214 7.007 -18.950 7.485 1.00 4.67 H new ATOM 0 HZ PHE A 214 8.466 -20.276 8.902 1.00 5.21 H new ATOM 3422 N HIS A 215 5.767 -14.425 10.036 1.00 2.97 N ATOM 3423 CA HIS A 215 4.468 -15.065 10.165 1.00 3.39 C ATOM 3424 C HIS A 215 3.948 -15.424 8.780 1.00 3.17 C ATOM 3425 O HIS A 215 4.049 -14.631 7.847 1.00 3.66 O ATOM 3426 CB HIS A 215 3.473 -14.176 10.929 1.00 4.23 C ATOM 3427 CG HIS A 215 3.148 -12.872 10.266 1.00 4.93 C ATOM 3428 ND1 HIS A 215 3.838 -11.705 10.512 1.00 5.70 N ATOM 3429 CD2 HIS A 215 2.185 -12.553 9.370 1.00 5.40 C ATOM 3430 CE1 HIS A 215 3.312 -10.728 9.799 1.00 6.46 C ATOM 3431 NE2 HIS A 215 2.309 -11.217 9.098 1.00 6.32 N ATOM 0 H HIS A 215 5.766 -13.568 9.483 1.00 2.97 H new ATOM 0 HA HIS A 215 4.579 -15.978 10.750 1.00 3.39 H new ATOM 0 HB2 HIS A 215 2.547 -14.734 11.073 1.00 4.23 H new ATOM 0 HB3 HIS A 215 3.879 -13.971 11.920 1.00 4.23 H new ATOM 0 HD2 HIS A 215 1.454 -13.227 8.948 1.00 5.40 H new ATOM 0 HE1 HIS A 215 3.647 -9.701 9.791 1.00 6.46 H new ATOM 0 HE2 HIS A 215 1.720 -10.686 8.456 1.00 6.32 H new ATOM 3440 N HIS A 216 3.421 -16.626 8.640 1.00 2.99 N ATOM 3441 CA HIS A 216 3.012 -17.128 7.337 1.00 3.27 C ATOM 3442 C HIS A 216 1.687 -17.869 7.456 1.00 3.26 C ATOM 3443 O HIS A 216 1.552 -18.786 8.264 1.00 3.78 O ATOM 3444 CB HIS A 216 4.098 -18.056 6.783 1.00 3.92 C ATOM 3445 CG HIS A 216 3.899 -18.463 5.355 1.00 4.66 C ATOM 3446 ND1 HIS A 216 3.702 -19.768 4.967 1.00 5.31 N ATOM 3447 CD2 HIS A 216 3.910 -17.733 4.217 1.00 5.27 C ATOM 3448 CE1 HIS A 216 3.604 -19.824 3.653 1.00 6.09 C ATOM 3449 NE2 HIS A 216 3.726 -18.603 3.172 1.00 6.09 N ATOM 0 H HIS A 216 3.265 -17.275 9.411 1.00 2.99 H new ATOM 0 HA HIS A 216 2.878 -16.291 6.652 1.00 3.27 H new ATOM 0 HB2 HIS A 216 5.064 -17.559 6.875 1.00 3.92 H new ATOM 0 HB3 HIS A 216 4.141 -18.953 7.401 1.00 3.92 H new ATOM 0 HD2 HIS A 216 4.040 -16.663 4.144 1.00 5.27 H new ATOM 0 HE1 HIS A 216 3.450 -20.720 3.069 1.00 6.09 H new ATOM 0 HE2 HIS A 216 3.690 -18.347 2.185 1.00 6.09 H new ATOM 3458 N ASN A 217 0.709 -17.466 6.663 1.00 3.18 N ATOM 3459 CA ASN A 217 -0.605 -18.087 6.712 1.00 3.63 C ATOM 3460 C ASN A 217 -1.070 -18.472 5.313 1.00 4.03 C ATOM 3461 O ASN A 217 -2.018 -17.910 4.777 1.00 4.27 O ATOM 3462 CB ASN A 217 -1.622 -17.151 7.374 1.00 3.95 C ATOM 3463 CG ASN A 217 -2.940 -17.843 7.681 1.00 4.57 C ATOM 3464 OD1 ASN A 217 -3.866 -17.849 6.869 1.00 5.00 O ATOM 3465 ND2 ASN A 217 -3.030 -18.437 8.858 1.00 5.12 N ATOM 0 H ASN A 217 0.798 -16.714 5.979 1.00 3.18 H new ATOM 0 HA ASN A 217 -0.530 -18.994 7.312 1.00 3.63 H new ATOM 0 HB2 ASN A 217 -1.199 -16.756 8.298 1.00 3.95 H new ATOM 0 HB3 ASN A 217 -1.807 -16.300 6.719 1.00 3.95 H new ATOM 0 HD21 ASN A 217 -3.888 -18.922 9.120 1.00 5.12 H new ATOM 0 HD22 ASN A 217 -2.241 -18.411 9.504 1.00 5.12 H new ATOM 3472 N SER A 218 -0.381 -19.423 4.714 1.00 4.58 N ATOM 3473 CA SER A 218 -0.789 -19.945 3.423 1.00 5.38 C ATOM 3474 C SER A 218 -1.695 -21.151 3.641 1.00 5.75 C ATOM 3475 O SER A 218 -2.522 -21.489 2.798 1.00 6.25 O ATOM 3476 CB SER A 218 0.438 -20.331 2.594 1.00 6.28 C ATOM 3477 OG SER A 218 0.101 -20.582 1.240 1.00 6.76 O ATOM 0 H SER A 218 0.462 -19.850 5.099 1.00 4.58 H new ATOM 0 HA SER A 218 -1.336 -19.179 2.873 1.00 5.38 H new ATOM 0 HB2 SER A 218 1.176 -19.530 2.642 1.00 6.28 H new ATOM 0 HB3 SER A 218 0.902 -21.219 3.024 1.00 6.28 H new ATOM 0 HG SER A 218 0.909 -20.824 0.741 1.00 6.76 H new ATOM 3483 N HIS A 219 -1.529 -21.782 4.796 1.00 5.79 N ATOM 3484 CA HIS A 219 -2.340 -22.922 5.182 1.00 6.41 C ATOM 3485 C HIS A 219 -2.634 -22.855 6.674 1.00 6.51 C ATOM 3486 O HIS A 219 -1.799 -23.235 7.496 1.00 6.61 O ATOM 3487 CB HIS A 219 -1.616 -24.228 4.838 1.00 7.04 C ATOM 3488 CG HIS A 219 -2.406 -25.465 5.151 1.00 7.61 C ATOM 3489 ND1 HIS A 219 -3.319 -26.014 4.280 1.00 8.17 N ATOM 3490 CD2 HIS A 219 -2.408 -26.264 6.245 1.00 8.02 C ATOM 3491 CE1 HIS A 219 -3.850 -27.092 4.823 1.00 8.82 C ATOM 3492 NE2 HIS A 219 -3.314 -27.267 6.015 1.00 8.76 N ATOM 0 H HIS A 219 -0.829 -21.516 5.488 1.00 5.79 H new ATOM 0 HA HIS A 219 -3.281 -22.896 4.632 1.00 6.41 H new ATOM 0 HB2 HIS A 219 -1.369 -24.226 3.776 1.00 7.04 H new ATOM 0 HB3 HIS A 219 -0.673 -24.264 5.384 1.00 7.04 H new ATOM 0 HD2 HIS A 219 -1.807 -26.135 7.133 1.00 8.02 H new ATOM 0 HE1 HIS A 219 -4.598 -27.725 4.368 1.00 8.82 H new ATOM 0 HE2 HIS A 219 -3.537 -28.025 6.660 1.00 8.76 H new ATOM 3501 N SER A 220 -3.806 -22.353 7.019 1.00 6.83 N ATOM 3502 CA SER A 220 -4.196 -22.217 8.411 1.00 7.31 C ATOM 3503 C SER A 220 -4.900 -23.489 8.873 1.00 7.98 C ATOM 3504 O SER A 220 -6.051 -23.724 8.447 1.00 8.48 O ATOM 3505 CB SER A 220 -5.103 -20.994 8.596 1.00 7.71 C ATOM 3506 OG SER A 220 -5.139 -20.575 9.953 1.00 7.85 O ATOM 3507 OXT SER A 220 -4.293 -24.259 9.649 1.00 8.25 O ATOM 0 H SER A 220 -4.507 -22.032 6.351 1.00 6.83 H new ATOM 0 HA SER A 220 -3.304 -22.069 9.020 1.00 7.31 H new ATOM 0 HB2 SER A 220 -4.745 -20.176 7.971 1.00 7.71 H new ATOM 0 HB3 SER A 220 -6.112 -21.234 8.261 1.00 7.71 H new ATOM 0 HG SER A 220 -5.724 -19.793 10.039 1.00 7.85 H new TER 3513 SER A 220