USER MOD reduce.3.24.130724 H: found=0, std=0, add=1138, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1135 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 37 LYS NZ :NH3+ 161:sc= 0.0515 (180deg=0.0112) USER MOD Set 1.2: A 92 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 80 THR OG1 : rot -160:sc= -0.147 USER MOD Set 2.2: A 129 SER OG : rot 170:sc= 0.0365 USER MOD Set 3.1: A 52 THR OG1 : rot 160:sc= -0.255 USER MOD Set 3.2: A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 27 THR OG1 : rot 142:sc= -0.639 USER MOD Set 4.2: A 30 MET CE :methyl -145:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl -155:sc= -0.246 (180deg=-1.15) USER MOD Single : A 1 MET N :NH3+ 177:sc= -0.37 (180deg=-0.39) USER MOD Single : A 2 ASN : amide:sc= -0.308 X(o=-0.31,f=-0.034) USER MOD Single : A 9 GLN : amide:sc= -0.079 K(o=-0.079,f=-2!) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.0119 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 MET CE :methyl 175:sc= -6.22! (180deg=-6.29!) USER MOD Single : A 32 ASN : amide:sc= -0.519 K(o=-0.52,f=-2.4!) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 MET CE :methyl -135:sc= -7.61! (180deg=-9.34!) USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ -173:sc= 0.00103 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ -162:sc= -0.235 (180deg=-0.507) USER MOD Single : A 46 SER OG : rot 180:sc= -0.416 USER MOD Single : A 47 LYS NZ :NH3+ 164:sc=-0.000569 (180deg=-0.0856) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.0109 K(o=-0.011,f=-0.75) USER MOD Single : A 55 GLN : amide:sc= -0.0379 X(o=-0.038,f=-0.037) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.453 X(o=-0.45,f=-0.0057) USER MOD Single : A 72 MET CE :methyl -116:sc= 0 (180deg=-0.00971) USER MOD Single : A 73 LYS NZ :NH3+ -127:sc= 0 (180deg=-0.0627) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 180:sc= -0.439 USER MOD Single : A 94 GLN : amide:sc= -2.8 X(o=-2.8,f=-2.9) USER MOD Single : A 100 SER OG : rot -120:sc= -0.828 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 CYS SG : rot 70:sc= -1.18 USER MOD Single : A 110 HIS : no HD1:sc= -0.0135 X(o=-0.014,f=-0.1) USER MOD Single : A 119 CYS SG : rot 57:sc= -0.248 USER MOD Single : A 123 THR OG1 : rot 180:sc= -0.29 USER MOD Single : A 125 TYR OH : rot -105:sc= -0.153 USER MOD Single : A 126 TYR OH : rot 180:sc= -0.0971 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.024 -2.634 -4.851 1.00 64.55 N ATOM 2 CA MET A 1 0.070 -1.428 -5.669 1.00 4.54 C ATOM 3 C MET A 1 1.435 -0.753 -5.566 1.00 33.02 C ATOM 4 O MET A 1 1.871 -0.069 -6.491 1.00 75.40 O ATOM 5 CB MET A 1 -1.027 -0.452 -5.239 1.00 33.55 C ATOM 6 CG MET A 1 -0.973 -0.088 -3.764 1.00 20.53 C ATOM 7 SD MET A 1 -2.090 1.262 -3.340 1.00 44.41 S ATOM 8 CE MET A 1 -1.443 2.573 -4.375 1.00 3.52 C ATOM 0 H1 MET A 1 -0.929 -3.048 -4.896 1.00 64.55 H new ATOM 0 H2 MET A 1 0.718 -3.322 -5.207 1.00 64.55 H new ATOM 0 H3 MET A 1 0.250 -2.393 -3.865 1.00 64.55 H new ATOM 0 HA MET A 1 -0.096 -1.717 -6.707 1.00 4.54 H new ATOM 0 HB2 MET A 1 -0.945 0.458 -5.833 1.00 33.55 H new ATOM 0 HB3 MET A 1 -2.000 -0.891 -5.461 1.00 33.55 H new ATOM 0 HG2 MET A 1 -1.226 -0.965 -3.168 1.00 20.53 H new ATOM 0 HG3 MET A 1 0.047 0.193 -3.500 1.00 20.53 H new ATOM 0 HE1 MET A 1 -1.696 3.539 -3.939 1.00 3.52 H new ATOM 0 HE2 MET A 1 -0.359 2.479 -4.446 1.00 3.52 H new ATOM 0 HE3 MET A 1 -1.879 2.499 -5.371 1.00 3.52 H new ATOM 18 N ASN A 2 2.104 -0.950 -4.434 1.00 74.23 N ATOM 19 CA ASN A 2 3.418 -0.360 -4.211 1.00 3.21 C ATOM 20 C ASN A 2 4.514 -1.417 -4.311 1.00 74.22 C ATOM 21 O ASN A 2 4.231 -2.606 -4.462 1.00 41.11 O ATOM 22 CB ASN A 2 3.470 0.316 -2.839 1.00 64.02 C ATOM 23 CG ASN A 2 2.941 1.737 -2.874 1.00 74.50 C ATOM 24 OD1 ASN A 2 2.045 2.096 -2.110 1.00 20.34 O ATOM 25 ND2 ASN A 2 3.493 2.552 -3.764 1.00 42.24 N ATOM 0 H ASN A 2 1.757 -1.514 -3.658 1.00 74.23 H new ATOM 0 HA ASN A 2 3.588 0.388 -4.985 1.00 3.21 H new ATOM 0 HB2 ASN A 2 2.887 -0.268 -2.127 1.00 64.02 H new ATOM 0 HB3 ASN A 2 4.499 0.323 -2.479 1.00 64.02 H new ATOM 0 HD21 ASN A 2 3.177 3.519 -3.835 1.00 42.24 H new ATOM 0 HD22 ASN A 2 4.233 2.211 -4.377 1.00 42.24 H new ATOM 32 N ASP A 3 5.764 -0.976 -4.226 1.00 14.11 N ATOM 33 CA ASP A 3 6.902 -1.884 -4.305 1.00 41.22 C ATOM 34 C ASP A 3 7.640 -1.948 -2.972 1.00 11.04 C ATOM 35 O ASP A 3 8.281 -0.981 -2.559 1.00 64.20 O ATOM 36 CB ASP A 3 7.860 -1.439 -5.411 1.00 61.14 C ATOM 37 CG ASP A 3 8.390 -0.036 -5.189 1.00 71.21 C ATOM 38 OD1 ASP A 3 7.605 0.925 -5.334 1.00 61.31 O ATOM 39 OD2 ASP A 3 9.589 0.101 -4.869 1.00 50.03 O ATOM 0 H ASP A 3 6.015 0.005 -4.102 1.00 14.11 H new ATOM 0 HA ASP A 3 6.525 -2.880 -4.539 1.00 41.22 H new ATOM 0 HB2 ASP A 3 8.696 -2.136 -5.465 1.00 61.14 H new ATOM 0 HB3 ASP A 3 7.346 -1.482 -6.371 1.00 61.14 H new ATOM 44 N ILE A 4 7.543 -3.092 -2.302 1.00 43.33 N ATOM 45 CA ILE A 4 8.202 -3.281 -1.016 1.00 34.34 C ATOM 46 C ILE A 4 9.203 -4.430 -1.074 1.00 73.12 C ATOM 47 O ILE A 4 9.082 -5.331 -1.905 1.00 15.41 O ATOM 48 CB ILE A 4 7.181 -3.561 0.103 1.00 32.31 C ATOM 49 CG1 ILE A 4 5.985 -4.338 -0.451 1.00 33.23 C ATOM 50 CG2 ILE A 4 6.723 -2.258 0.741 1.00 24.01 C ATOM 51 CD1 ILE A 4 6.357 -5.679 -1.043 1.00 62.30 C ATOM 0 H ILE A 4 7.015 -3.901 -2.629 1.00 43.33 H new ATOM 0 HA ILE A 4 8.730 -2.354 -0.793 1.00 34.34 H new ATOM 0 HB ILE A 4 7.662 -4.169 0.870 1.00 32.31 H new ATOM 0 HG12 ILE A 4 5.260 -4.491 0.348 1.00 33.23 H new ATOM 0 HG13 ILE A 4 5.494 -3.736 -1.216 1.00 33.23 H new ATOM 0 HG21 ILE A 4 6.002 -2.473 1.530 1.00 24.01 H new ATOM 0 HG22 ILE A 4 7.582 -1.739 1.166 1.00 24.01 H new ATOM 0 HG23 ILE A 4 6.256 -1.627 -0.015 1.00 24.01 H new ATOM 0 HD11 ILE A 4 5.460 -6.174 -1.416 1.00 62.30 H new ATOM 0 HD12 ILE A 4 7.058 -5.532 -1.864 1.00 62.30 H new ATOM 0 HD13 ILE A 4 6.821 -6.299 -0.276 1.00 62.30 H new ATOM 63 N ARG A 5 10.190 -4.393 -0.186 1.00 4.21 N ATOM 64 CA ARG A 5 11.213 -5.431 -0.136 1.00 34.21 C ATOM 65 C ARG A 5 10.587 -6.798 0.124 1.00 35.22 C ATOM 66 O ARG A 5 9.468 -6.893 0.631 1.00 25.34 O ATOM 67 CB ARG A 5 12.240 -5.113 0.952 1.00 32.42 C ATOM 68 CG ARG A 5 13.290 -4.102 0.522 1.00 60.52 C ATOM 69 CD ARG A 5 12.677 -2.733 0.274 1.00 33.14 C ATOM 70 NE ARG A 5 11.959 -2.235 1.445 1.00 73.43 N ATOM 71 CZ ARG A 5 12.559 -1.836 2.560 1.00 21.24 C ATOM 72 NH1 ARG A 5 13.881 -1.876 2.656 1.00 11.25 N ATOM 73 NH2 ARG A 5 11.837 -1.396 3.583 1.00 40.22 N ATOM 0 H ARG A 5 10.304 -3.655 0.509 1.00 4.21 H new ATOM 0 HA ARG A 5 11.715 -5.458 -1.103 1.00 34.21 H new ATOM 0 HB2 ARG A 5 11.720 -4.732 1.831 1.00 32.42 H new ATOM 0 HB3 ARG A 5 12.737 -6.036 1.251 1.00 32.42 H new ATOM 0 HG2 ARG A 5 14.058 -4.024 1.292 1.00 60.52 H new ATOM 0 HG3 ARG A 5 13.783 -4.451 -0.386 1.00 60.52 H new ATOM 0 HD2 ARG A 5 13.463 -2.028 0.003 1.00 33.14 H new ATOM 0 HD3 ARG A 5 11.994 -2.790 -0.573 1.00 33.14 H new ATOM 0 HE ARG A 5 10.941 -2.192 1.404 1.00 73.43 H new ATOM 0 HH11 ARG A 5 14.439 -2.214 1.872 1.00 11.25 H new ATOM 0 HH12 ARG A 5 14.340 -1.569 3.514 1.00 11.25 H new ATOM 0 HH21 ARG A 5 10.820 -1.364 3.513 1.00 40.22 H new ATOM 0 HH22 ARG A 5 12.299 -1.090 4.439 1.00 40.22 H new ATOM 87 N ILE A 6 11.314 -7.853 -0.227 1.00 4.11 N ATOM 88 CA ILE A 6 10.831 -9.214 -0.031 1.00 14.22 C ATOM 89 C ILE A 6 11.728 -9.983 0.933 1.00 50.21 C ATOM 90 O ILE A 6 11.303 -10.962 1.546 1.00 24.14 O ATOM 91 CB ILE A 6 10.752 -9.981 -1.364 1.00 14.20 C ATOM 92 CG1 ILE A 6 11.960 -9.648 -2.241 1.00 63.12 C ATOM 93 CG2 ILE A 6 9.456 -9.649 -2.090 1.00 23.42 C ATOM 94 CD1 ILE A 6 11.754 -8.433 -3.118 1.00 4.21 C ATOM 0 H ILE A 6 12.241 -7.791 -0.649 1.00 4.11 H new ATOM 0 HA ILE A 6 9.830 -9.135 0.393 1.00 14.22 H new ATOM 0 HB ILE A 6 10.764 -11.050 -1.152 1.00 14.20 H new ATOM 0 HG12 ILE A 6 12.828 -9.482 -1.602 1.00 63.12 H new ATOM 0 HG13 ILE A 6 12.188 -10.507 -2.872 1.00 63.12 H new ATOM 0 HG21 ILE A 6 9.415 -10.199 -3.030 1.00 23.42 H new ATOM 0 HG22 ILE A 6 8.607 -9.931 -1.467 1.00 23.42 H new ATOM 0 HG23 ILE A 6 9.417 -8.579 -2.293 1.00 23.42 H new ATOM 0 HD11 ILE A 6 12.651 -8.257 -3.712 1.00 4.21 H new ATOM 0 HD12 ILE A 6 10.907 -8.603 -3.782 1.00 4.21 H new ATOM 0 HD13 ILE A 6 11.556 -7.562 -2.493 1.00 4.21 H new ATOM 106 N VAL A 7 12.972 -9.532 1.063 1.00 54.43 N ATOM 107 CA VAL A 7 13.929 -10.175 1.954 1.00 21.12 C ATOM 108 C VAL A 7 14.982 -9.184 2.437 1.00 10.05 C ATOM 109 O VAL A 7 15.951 -8.881 1.741 1.00 52.50 O ATOM 110 CB VAL A 7 14.633 -11.358 1.263 1.00 74.02 C ATOM 111 CG1 VAL A 7 13.673 -12.526 1.096 1.00 60.44 C ATOM 112 CG2 VAL A 7 15.201 -10.928 -0.081 1.00 51.31 C ATOM 0 H VAL A 7 13.340 -8.723 0.562 1.00 54.43 H new ATOM 0 HA VAL A 7 13.364 -10.547 2.809 1.00 21.12 H new ATOM 0 HB VAL A 7 15.460 -11.685 1.893 1.00 74.02 H new ATOM 0 HG11 VAL A 7 14.188 -13.353 0.606 1.00 60.44 H new ATOM 0 HG12 VAL A 7 13.318 -12.848 2.075 1.00 60.44 H new ATOM 0 HG13 VAL A 7 12.824 -12.215 0.487 1.00 60.44 H new ATOM 0 HG21 VAL A 7 15.695 -11.776 -0.555 1.00 51.31 H new ATOM 0 HG22 VAL A 7 14.393 -10.574 -0.721 1.00 51.31 H new ATOM 0 HG23 VAL A 7 15.923 -10.125 0.069 1.00 51.31 H new ATOM 122 N PRO A 8 14.790 -8.666 3.660 1.00 63.31 N ATOM 123 CA PRO A 8 15.714 -7.702 4.265 1.00 52.11 C ATOM 124 C PRO A 8 17.051 -8.334 4.635 1.00 2.21 C ATOM 125 O PRO A 8 17.221 -9.549 4.539 1.00 12.15 O ATOM 126 CB PRO A 8 14.973 -7.243 5.523 1.00 12.51 C ATOM 127 CG PRO A 8 14.061 -8.372 5.859 1.00 12.51 C ATOM 128 CD PRO A 8 13.657 -8.983 4.546 1.00 45.02 C ATOM 0 HA PRO A 8 15.963 -6.891 3.580 1.00 52.11 H new ATOM 0 HB2 PRO A 8 15.667 -7.038 6.338 1.00 12.51 H new ATOM 0 HB3 PRO A 8 14.415 -6.324 5.341 1.00 12.51 H new ATOM 0 HG2 PRO A 8 14.563 -9.104 6.492 1.00 12.51 H new ATOM 0 HG3 PRO A 8 13.189 -8.019 6.410 1.00 12.51 H new ATOM 0 HD2 PRO A 8 13.504 -10.059 4.633 1.00 45.02 H new ATOM 0 HD3 PRO A 8 12.725 -8.557 4.174 1.00 45.02 H new ATOM 136 N GLN A 9 17.997 -7.501 5.058 1.00 31.22 N ATOM 137 CA GLN A 9 19.319 -7.980 5.442 1.00 25.05 C ATOM 138 C GLN A 9 19.261 -8.737 6.765 1.00 22.21 C ATOM 139 O GLN A 9 18.301 -8.605 7.525 1.00 24.01 O ATOM 140 CB GLN A 9 20.297 -6.808 5.555 1.00 75.44 C ATOM 141 CG GLN A 9 19.882 -5.767 6.581 1.00 1.22 C ATOM 142 CD GLN A 9 20.524 -4.416 6.334 1.00 52.24 C ATOM 143 OE1 GLN A 9 21.151 -4.194 5.298 1.00 62.14 O ATOM 144 NE2 GLN A 9 20.370 -3.503 7.286 1.00 34.40 N ATOM 0 H GLN A 9 17.872 -6.492 5.143 1.00 31.22 H new ATOM 0 HA GLN A 9 19.669 -8.663 4.668 1.00 25.05 H new ATOM 0 HB2 GLN A 9 21.283 -7.192 5.818 1.00 75.44 H new ATOM 0 HB3 GLN A 9 20.391 -6.329 4.581 1.00 75.44 H new ATOM 0 HG2 GLN A 9 18.798 -5.658 6.564 1.00 1.22 H new ATOM 0 HG3 GLN A 9 20.152 -6.117 7.577 1.00 1.22 H new ATOM 0 HE21 GLN A 9 19.842 -3.729 8.129 1.00 34.40 H new ATOM 0 HE22 GLN A 9 20.779 -2.575 7.174 1.00 34.40 H new ATOM 153 N ILE A 10 20.293 -9.530 7.033 1.00 60.30 N ATOM 154 CA ILE A 10 20.359 -10.308 8.264 1.00 12.22 C ATOM 155 C ILE A 10 21.514 -9.845 9.145 1.00 23.33 C ATOM 156 O ILE A 10 22.653 -9.737 8.690 1.00 63.24 O ATOM 157 CB ILE A 10 20.520 -11.811 7.973 1.00 63.45 C ATOM 158 CG1 ILE A 10 21.738 -12.052 7.077 1.00 14.33 C ATOM 159 CG2 ILE A 10 19.260 -12.363 7.322 1.00 24.00 C ATOM 160 CD1 ILE A 10 21.932 -13.503 6.698 1.00 31.13 C ATOM 0 H ILE A 10 21.095 -9.651 6.414 1.00 60.30 H new ATOM 0 HA ILE A 10 19.417 -10.148 8.789 1.00 12.22 H new ATOM 0 HB ILE A 10 20.677 -12.334 8.917 1.00 63.45 H new ATOM 0 HG12 ILE A 10 21.634 -11.459 6.169 1.00 14.33 H new ATOM 0 HG13 ILE A 10 22.632 -11.696 7.589 1.00 14.33 H new ATOM 0 HG21 ILE A 10 19.390 -13.427 7.122 1.00 24.00 H new ATOM 0 HG22 ILE A 10 18.412 -12.220 7.992 1.00 24.00 H new ATOM 0 HG23 ILE A 10 19.075 -11.838 6.385 1.00 24.00 H new ATOM 0 HD11 ILE A 10 22.813 -13.599 6.063 1.00 31.13 H new ATOM 0 HD12 ILE A 10 22.068 -14.100 7.600 1.00 31.13 H new ATOM 0 HD13 ILE A 10 21.055 -13.858 6.157 1.00 31.13 H new ATOM 172 N THR A 11 21.214 -9.575 10.412 1.00 40.42 N ATOM 173 CA THR A 11 22.227 -9.125 11.358 1.00 0.40 C ATOM 174 C THR A 11 22.765 -10.288 12.182 1.00 25.51 C ATOM 175 O THR A 11 22.460 -11.449 11.908 1.00 32.22 O ATOM 176 CB THR A 11 21.668 -8.051 12.311 1.00 43.12 C ATOM 177 OG1 THR A 11 20.372 -7.632 11.871 1.00 74.24 O ATOM 178 CG2 THR A 11 22.599 -6.850 12.378 1.00 41.42 C ATOM 0 H THR A 11 20.277 -9.660 10.806 1.00 40.42 H new ATOM 0 HA THR A 11 23.038 -8.693 10.771 1.00 0.40 H new ATOM 0 HB THR A 11 21.590 -8.486 13.307 1.00 43.12 H new ATOM 0 HG1 THR A 11 20.023 -6.951 12.483 1.00 74.24 H new ATOM 0 HG21 THR A 11 22.184 -6.105 13.057 1.00 41.42 H new ATOM 0 HG22 THR A 11 23.576 -7.167 12.742 1.00 41.42 H new ATOM 0 HG23 THR A 11 22.705 -6.416 11.384 1.00 41.42 H new ATOM 186 N ASP A 12 23.568 -9.971 13.192 1.00 15.23 N ATOM 187 CA ASP A 12 24.147 -10.991 14.058 1.00 4.01 C ATOM 188 C ASP A 12 23.056 -11.793 14.760 1.00 13.41 C ATOM 189 O ASP A 12 23.291 -12.910 15.218 1.00 72.44 O ATOM 190 CB ASP A 12 25.070 -10.347 15.094 1.00 43.22 C ATOM 191 CG ASP A 12 26.458 -10.956 15.091 1.00 24.41 C ATOM 192 OD1 ASP A 12 26.600 -12.110 15.547 1.00 60.34 O ATOM 193 OD2 ASP A 12 27.403 -10.279 14.634 1.00 23.31 O ATOM 0 H ASP A 12 23.833 -9.015 13.431 1.00 15.23 H new ATOM 0 HA ASP A 12 24.729 -11.671 13.436 1.00 4.01 H new ATOM 0 HB2 ASP A 12 25.145 -9.278 14.895 1.00 43.22 H new ATOM 0 HB3 ASP A 12 24.631 -10.456 16.086 1.00 43.22 H new ATOM 198 N GLU A 13 21.862 -11.212 14.842 1.00 63.52 N ATOM 199 CA GLU A 13 20.735 -11.873 15.490 1.00 5.11 C ATOM 200 C GLU A 13 20.208 -13.018 14.631 1.00 61.25 C ATOM 201 O GLU A 13 19.672 -13.998 15.146 1.00 21.32 O ATOM 202 CB GLU A 13 19.615 -10.868 15.763 1.00 13.40 C ATOM 203 CG GLU A 13 20.099 -9.573 16.393 1.00 12.51 C ATOM 204 CD GLU A 13 18.967 -8.606 16.682 1.00 0.42 C ATOM 205 OE1 GLU A 13 17.857 -8.815 16.151 1.00 34.20 O ATOM 206 OE2 GLU A 13 19.192 -7.639 17.440 1.00 24.14 O ATOM 0 H GLU A 13 21.651 -10.287 14.468 1.00 63.52 H new ATOM 0 HA GLU A 13 21.084 -12.284 16.437 1.00 5.11 H new ATOM 0 HB2 GLU A 13 19.108 -10.639 14.826 1.00 13.40 H new ATOM 0 HB3 GLU A 13 18.877 -11.328 16.420 1.00 13.40 H new ATOM 0 HG2 GLU A 13 20.625 -9.799 17.321 1.00 12.51 H new ATOM 0 HG3 GLU A 13 20.818 -9.096 15.727 1.00 12.51 H new ATOM 213 N GLU A 14 20.364 -12.885 13.317 1.00 25.11 N ATOM 214 CA GLU A 14 19.903 -13.908 12.386 1.00 52.00 C ATOM 215 C GLU A 14 21.066 -14.770 11.904 1.00 22.01 C ATOM 216 O GLU A 14 20.968 -15.997 11.860 1.00 1.51 O ATOM 217 CB GLU A 14 19.203 -13.261 11.189 1.00 60.11 C ATOM 218 CG GLU A 14 17.965 -12.465 11.565 1.00 10.41 C ATOM 219 CD GLU A 14 16.965 -13.281 12.361 1.00 65.20 C ATOM 220 OE1 GLU A 14 17.187 -13.472 13.575 1.00 52.30 O ATOM 221 OE2 GLU A 14 15.961 -13.730 11.769 1.00 43.41 O ATOM 0 H GLU A 14 20.806 -12.079 12.874 1.00 25.11 H new ATOM 0 HA GLU A 14 19.193 -14.547 12.911 1.00 52.00 H new ATOM 0 HB2 GLU A 14 19.907 -12.603 10.679 1.00 60.11 H new ATOM 0 HB3 GLU A 14 18.923 -14.039 10.479 1.00 60.11 H new ATOM 0 HG2 GLU A 14 18.262 -11.593 12.147 1.00 10.41 H new ATOM 0 HG3 GLU A 14 17.486 -12.095 10.658 1.00 10.41 H new ATOM 228 N PHE A 15 22.167 -14.119 11.543 1.00 22.30 N ATOM 229 CA PHE A 15 23.349 -14.825 11.063 1.00 44.04 C ATOM 230 C PHE A 15 23.817 -15.860 12.082 1.00 53.11 C ATOM 231 O PHE A 15 24.322 -16.922 11.719 1.00 60.33 O ATOM 232 CB PHE A 15 24.478 -13.834 10.772 1.00 50.45 C ATOM 233 CG PHE A 15 25.825 -14.483 10.629 1.00 74.32 C ATOM 234 CD1 PHE A 15 26.634 -14.680 11.736 1.00 62.31 C ATOM 235 CD2 PHE A 15 26.281 -14.898 9.388 1.00 53.42 C ATOM 236 CE1 PHE A 15 27.874 -15.277 11.607 1.00 21.21 C ATOM 237 CE2 PHE A 15 27.520 -15.495 9.253 1.00 74.51 C ATOM 238 CZ PHE A 15 28.317 -15.686 10.364 1.00 32.44 C ATOM 0 H PHE A 15 22.265 -13.104 11.574 1.00 22.30 H new ATOM 0 HA PHE A 15 23.082 -15.343 10.142 1.00 44.04 H new ATOM 0 HB2 PHE A 15 24.246 -13.291 9.856 1.00 50.45 H new ATOM 0 HB3 PHE A 15 24.521 -13.099 11.576 1.00 50.45 H new ATOM 0 HD1 PHE A 15 26.292 -14.364 12.710 1.00 62.31 H new ATOM 0 HD2 PHE A 15 25.661 -14.753 8.516 1.00 53.42 H new ATOM 0 HE1 PHE A 15 28.496 -15.424 12.477 1.00 21.21 H new ATOM 0 HE2 PHE A 15 27.864 -15.812 8.280 1.00 74.51 H new ATOM 0 HZ PHE A 15 29.285 -16.154 10.262 1.00 32.44 H new ATOM 248 N LYS A 16 23.645 -15.542 13.360 1.00 12.35 N ATOM 249 CA LYS A 16 24.047 -16.442 14.434 1.00 23.13 C ATOM 250 C LYS A 16 23.048 -17.584 14.590 1.00 63.21 C ATOM 251 O LYS A 16 23.294 -18.543 15.323 1.00 51.11 O ATOM 252 CB LYS A 16 24.170 -15.674 15.752 1.00 33.45 C ATOM 253 CG LYS A 16 22.841 -15.456 16.455 1.00 72.20 C ATOM 254 CD LYS A 16 22.646 -16.439 17.597 1.00 10.03 C ATOM 255 CE LYS A 16 23.360 -15.977 18.858 1.00 11.43 C ATOM 256 NZ LYS A 16 22.501 -15.086 19.687 1.00 42.42 N ATOM 0 H LYS A 16 23.229 -14.666 13.678 1.00 12.35 H new ATOM 0 HA LYS A 16 25.018 -16.865 14.175 1.00 23.13 H new ATOM 0 HB2 LYS A 16 24.839 -16.218 16.419 1.00 33.45 H new ATOM 0 HB3 LYS A 16 24.632 -14.706 15.557 1.00 33.45 H new ATOM 0 HG2 LYS A 16 22.794 -14.437 16.839 1.00 72.20 H new ATOM 0 HG3 LYS A 16 22.027 -15.564 15.738 1.00 72.20 H new ATOM 0 HD2 LYS A 16 21.582 -16.554 17.802 1.00 10.03 H new ATOM 0 HD3 LYS A 16 23.022 -17.419 17.303 1.00 10.03 H new ATOM 0 HE2 LYS A 16 23.657 -16.845 19.446 1.00 11.43 H new ATOM 0 HE3 LYS A 16 24.274 -15.449 18.585 1.00 11.43 H new ATOM 0 HZ1 LYS A 16 23.024 -14.793 20.537 1.00 42.42 H new ATOM 0 HZ2 LYS A 16 22.238 -14.245 19.135 1.00 42.42 H new ATOM 0 HZ3 LYS A 16 21.640 -15.598 19.969 1.00 42.42 H new ATOM 270 N THR A 17 21.920 -17.477 13.895 1.00 42.35 N ATOM 271 CA THR A 17 20.884 -18.500 13.955 1.00 25.23 C ATOM 272 C THR A 17 21.250 -19.704 13.094 1.00 55.32 C ATOM 273 O THR A 17 20.517 -20.692 13.050 1.00 72.41 O ATOM 274 CB THR A 17 19.522 -17.948 13.495 1.00 32.54 C ATOM 275 OG1 THR A 17 18.470 -18.526 14.277 1.00 3.24 O ATOM 276 CG2 THR A 17 19.287 -18.246 12.022 1.00 11.21 C ATOM 0 H THR A 17 21.701 -16.691 13.283 1.00 42.35 H new ATOM 0 HA THR A 17 20.807 -18.812 14.997 1.00 25.23 H new ATOM 0 HB THR A 17 19.527 -16.867 13.635 1.00 32.54 H new ATOM 0 HG1 THR A 17 17.607 -18.169 13.980 1.00 3.24 H new ATOM 0 HG21 THR A 17 18.319 -17.847 11.720 1.00 11.21 H new ATOM 0 HG22 THR A 17 20.073 -17.781 11.427 1.00 11.21 H new ATOM 0 HG23 THR A 17 19.301 -19.324 11.862 1.00 11.21 H new ATOM 284 N ILE A 18 22.386 -19.614 12.411 1.00 12.20 N ATOM 285 CA ILE A 18 22.848 -20.697 11.552 1.00 2.12 C ATOM 286 C ILE A 18 24.142 -21.305 12.083 1.00 33.51 C ATOM 287 O ILE A 18 25.088 -20.602 12.437 1.00 22.32 O ATOM 288 CB ILE A 18 23.077 -20.212 10.108 1.00 31.24 C ATOM 289 CG1 ILE A 18 21.797 -19.588 9.548 1.00 2.22 C ATOM 290 CG2 ILE A 18 23.539 -21.365 9.230 1.00 50.14 C ATOM 291 CD1 ILE A 18 21.848 -18.078 9.465 1.00 35.33 C ATOM 0 H ILE A 18 23.003 -18.802 12.436 1.00 12.20 H new ATOM 0 HA ILE A 18 22.065 -21.456 11.552 1.00 2.12 H new ATOM 0 HB ILE A 18 23.857 -19.451 10.115 1.00 31.24 H new ATOM 0 HG12 ILE A 18 21.610 -19.993 8.553 1.00 2.22 H new ATOM 0 HG13 ILE A 18 20.955 -19.881 10.175 1.00 2.22 H new ATOM 0 HG21 ILE A 18 23.697 -21.007 8.213 1.00 50.14 H new ATOM 0 HG22 ILE A 18 24.473 -21.769 9.621 1.00 50.14 H new ATOM 0 HG23 ILE A 18 22.779 -22.146 9.226 1.00 50.14 H new ATOM 0 HD11 ILE A 18 20.908 -17.704 9.059 1.00 35.33 H new ATOM 0 HD12 ILE A 18 22.004 -17.664 10.461 1.00 35.33 H new ATOM 0 HD13 ILE A 18 22.669 -17.777 8.814 1.00 35.33 H new ATOM 303 N PRO A 19 24.186 -22.645 12.139 1.00 42.11 N ATOM 304 CA PRO A 19 25.359 -23.378 12.623 1.00 64.50 C ATOM 305 C PRO A 19 26.540 -23.281 11.663 1.00 24.52 C ATOM 306 O PRO A 19 26.361 -23.156 10.452 1.00 73.34 O ATOM 307 CB PRO A 19 24.862 -24.823 12.714 1.00 33.11 C ATOM 308 CG PRO A 19 23.745 -24.902 11.731 1.00 44.04 C ATOM 309 CD PRO A 19 23.095 -23.546 11.733 1.00 32.32 C ATOM 0 HA PRO A 19 25.727 -22.979 13.568 1.00 64.50 H new ATOM 0 HB2 PRO A 19 25.655 -25.530 12.470 1.00 33.11 H new ATOM 0 HB3 PRO A 19 24.521 -25.062 13.721 1.00 33.11 H new ATOM 0 HG2 PRO A 19 24.116 -25.155 10.738 1.00 44.04 H new ATOM 0 HG3 PRO A 19 23.032 -25.677 12.012 1.00 44.04 H new ATOM 0 HD2 PRO A 19 22.705 -23.286 10.749 1.00 32.32 H new ATOM 0 HD3 PRO A 19 22.258 -23.503 12.430 1.00 32.32 H new ATOM 317 N LYS A 20 27.749 -23.340 12.212 1.00 60.51 N ATOM 318 CA LYS A 20 28.961 -23.261 11.405 1.00 72.21 C ATOM 319 C LYS A 20 28.995 -24.375 10.364 1.00 61.42 C ATOM 320 O LYS A 20 29.651 -24.251 9.329 1.00 30.52 O ATOM 321 CB LYS A 20 30.200 -23.346 12.299 1.00 40.31 C ATOM 322 CG LYS A 20 30.223 -24.574 13.192 1.00 63.23 C ATOM 323 CD LYS A 20 31.265 -24.445 14.291 1.00 72.44 C ATOM 324 CE LYS A 20 31.091 -25.521 15.352 1.00 42.10 C ATOM 325 NZ LYS A 20 30.173 -25.084 16.440 1.00 54.35 N ATOM 0 H LYS A 20 27.915 -23.442 13.213 1.00 60.51 H new ATOM 0 HA LYS A 20 28.960 -22.303 10.886 1.00 72.21 H new ATOM 0 HB2 LYS A 20 31.091 -23.347 11.671 1.00 40.31 H new ATOM 0 HB3 LYS A 20 30.250 -22.453 12.922 1.00 40.31 H new ATOM 0 HG2 LYS A 20 29.239 -24.719 13.638 1.00 63.23 H new ATOM 0 HG3 LYS A 20 30.434 -25.458 12.591 1.00 63.23 H new ATOM 0 HD2 LYS A 20 32.263 -24.517 13.858 1.00 72.44 H new ATOM 0 HD3 LYS A 20 31.188 -23.461 14.753 1.00 72.44 H new ATOM 0 HE2 LYS A 20 30.700 -26.427 14.889 1.00 42.10 H new ATOM 0 HE3 LYS A 20 32.063 -25.773 15.776 1.00 42.10 H new ATOM 0 HZ1 LYS A 20 30.081 -25.845 17.143 1.00 54.35 H new ATOM 0 HZ2 LYS A 20 30.558 -24.234 16.899 1.00 54.35 H new ATOM 0 HZ3 LYS A 20 29.238 -24.868 16.039 1.00 54.35 H new ATOM 339 N TYR A 21 28.284 -25.462 10.644 1.00 63.15 N ATOM 340 CA TYR A 21 28.234 -26.599 9.731 1.00 4.54 C ATOM 341 C TYR A 21 27.585 -26.206 8.408 1.00 63.54 C ATOM 342 O TYR A 21 27.772 -26.874 7.391 1.00 23.51 O ATOM 343 CB TYR A 21 27.463 -27.756 10.367 1.00 20.23 C ATOM 344 CG TYR A 21 28.189 -28.404 11.525 1.00 15.32 C ATOM 345 CD1 TYR A 21 28.189 -27.819 12.785 1.00 13.43 C ATOM 346 CD2 TYR A 21 28.873 -29.601 11.359 1.00 62.41 C ATOM 347 CE1 TYR A 21 28.851 -28.406 13.846 1.00 71.34 C ATOM 348 CE2 TYR A 21 29.537 -30.197 12.414 1.00 70.10 C ATOM 349 CZ TYR A 21 29.523 -29.595 13.655 1.00 23.51 C ATOM 350 OH TYR A 21 30.183 -30.185 14.709 1.00 0.12 O ATOM 0 H TYR A 21 27.735 -25.580 11.495 1.00 63.15 H new ATOM 0 HA TYR A 21 29.257 -26.919 9.532 1.00 4.54 H new ATOM 0 HB2 TYR A 21 26.497 -27.390 10.714 1.00 20.23 H new ATOM 0 HB3 TYR A 21 27.264 -28.511 9.606 1.00 20.23 H new ATOM 0 HD1 TYR A 21 27.662 -26.889 12.938 1.00 13.43 H new ATOM 0 HD2 TYR A 21 28.886 -30.074 10.388 1.00 62.41 H new ATOM 0 HE1 TYR A 21 28.842 -27.937 14.819 1.00 71.34 H new ATOM 0 HE2 TYR A 21 30.064 -31.128 12.268 1.00 70.10 H new ATOM 0 HH TYR A 21 30.604 -31.017 14.407 1.00 0.12 H new ATOM 360 N GLN A 22 26.822 -25.118 8.430 1.00 64.35 N ATOM 361 CA GLN A 22 26.145 -24.637 7.231 1.00 2.55 C ATOM 362 C GLN A 22 26.850 -23.408 6.665 1.00 74.34 C ATOM 363 O GLN A 22 26.888 -23.207 5.450 1.00 13.31 O ATOM 364 CB GLN A 22 24.686 -24.303 7.544 1.00 15.15 C ATOM 365 CG GLN A 22 23.923 -25.451 8.186 1.00 1.11 C ATOM 366 CD GLN A 22 23.312 -26.389 7.164 1.00 23.21 C ATOM 367 OE1 GLN A 22 24.006 -27.215 6.570 1.00 32.32 O ATOM 368 NE2 GLN A 22 22.007 -26.267 6.954 1.00 51.04 N ATOM 0 H GLN A 22 26.657 -24.554 9.263 1.00 64.35 H new ATOM 0 HA GLN A 22 26.177 -25.429 6.483 1.00 2.55 H new ATOM 0 HB2 GLN A 22 24.654 -23.440 8.209 1.00 15.15 H new ATOM 0 HB3 GLN A 22 24.182 -24.014 6.622 1.00 15.15 H new ATOM 0 HG2 GLN A 22 24.597 -26.013 8.833 1.00 1.11 H new ATOM 0 HG3 GLN A 22 23.134 -25.048 8.821 1.00 1.11 H new ATOM 0 HE21 GLN A 22 21.471 -25.569 7.469 1.00 51.04 H new ATOM 0 HE22 GLN A 22 21.541 -26.872 6.278 1.00 51.04 H new ATOM 377 N LEU A 23 27.406 -22.590 7.551 1.00 52.00 N ATOM 378 CA LEU A 23 28.109 -21.380 7.139 1.00 24.21 C ATOM 379 C LEU A 23 29.294 -21.719 6.240 1.00 51.44 C ATOM 380 O LEU A 23 29.367 -21.269 5.097 1.00 42.30 O ATOM 381 CB LEU A 23 28.591 -20.604 8.366 1.00 25.31 C ATOM 382 CG LEU A 23 27.507 -20.162 9.350 1.00 61.45 C ATOM 383 CD1 LEU A 23 28.119 -19.389 10.507 1.00 24.01 C ATOM 384 CD2 LEU A 23 26.455 -19.322 8.641 1.00 1.40 C ATOM 0 H LEU A 23 27.384 -22.742 8.559 1.00 52.00 H new ATOM 0 HA LEU A 23 27.413 -20.759 6.574 1.00 24.21 H new ATOM 0 HB2 LEU A 23 29.310 -21.223 8.903 1.00 25.31 H new ATOM 0 HB3 LEU A 23 29.126 -19.718 8.024 1.00 25.31 H new ATOM 0 HG LEU A 23 27.023 -21.052 9.752 1.00 61.45 H new ATOM 0 HD11 LEU A 23 27.332 -19.083 11.197 1.00 24.01 H new ATOM 0 HD12 LEU A 23 28.834 -20.023 11.031 1.00 24.01 H new ATOM 0 HD13 LEU A 23 28.630 -18.506 10.124 1.00 24.01 H new ATOM 0 HD21 LEU A 23 25.691 -19.016 9.356 1.00 1.40 H new ATOM 0 HD22 LEU A 23 26.925 -18.437 8.211 1.00 1.40 H new ATOM 0 HD23 LEU A 23 25.994 -19.910 7.847 1.00 1.40 H new ATOM 396 N GLY A 24 30.219 -22.517 6.763 1.00 23.04 N ATOM 397 CA GLY A 24 31.387 -22.904 5.993 1.00 31.15 C ATOM 398 C GLY A 24 32.270 -21.722 5.645 1.00 32.23 C ATOM 399 O GLY A 24 32.342 -21.313 4.486 1.00 11.15 O ATOM 0 H GLY A 24 30.181 -22.903 7.706 1.00 23.04 H new ATOM 0 HA2 GLY A 24 31.967 -23.632 6.560 1.00 31.15 H new ATOM 0 HA3 GLY A 24 31.066 -23.397 5.075 1.00 31.15 H new ATOM 403 N ARG A 25 32.942 -21.171 6.651 1.00 71.23 N ATOM 404 CA ARG A 25 33.822 -20.027 6.445 1.00 31.23 C ATOM 405 C ARG A 25 33.021 -18.789 6.052 1.00 64.22 C ATOM 406 O ARG A 25 33.586 -17.780 5.628 1.00 64.12 O ATOM 407 CB ARG A 25 34.859 -20.342 5.365 1.00 12.34 C ATOM 408 CG ARG A 25 36.183 -19.622 5.564 1.00 13.20 C ATOM 409 CD ARG A 25 37.290 -20.255 4.737 1.00 45.45 C ATOM 410 NE ARG A 25 37.363 -19.686 3.393 1.00 31.31 N ATOM 411 CZ ARG A 25 38.215 -20.103 2.464 1.00 64.43 C ATOM 412 NH1 ARG A 25 39.063 -21.087 2.731 1.00 60.54 N ATOM 413 NH2 ARG A 25 38.221 -19.536 1.264 1.00 31.32 N ATOM 0 H ARG A 25 32.894 -21.498 7.616 1.00 71.23 H new ATOM 0 HA ARG A 25 34.337 -19.822 7.384 1.00 31.23 H new ATOM 0 HB2 ARG A 25 35.039 -21.417 5.348 1.00 12.34 H new ATOM 0 HB3 ARG A 25 34.451 -20.072 4.391 1.00 12.34 H new ATOM 0 HG2 ARG A 25 36.074 -18.574 5.286 1.00 13.20 H new ATOM 0 HG3 ARG A 25 36.456 -19.645 6.619 1.00 13.20 H new ATOM 0 HD2 ARG A 25 38.245 -20.115 5.242 1.00 45.45 H new ATOM 0 HD3 ARG A 25 37.121 -21.330 4.667 1.00 45.45 H new ATOM 0 HE ARG A 25 36.724 -18.927 3.156 1.00 31.31 H new ATOM 0 HH11 ARG A 25 39.062 -21.525 3.652 1.00 60.54 H new ATOM 0 HH12 ARG A 25 39.716 -21.405 2.015 1.00 60.54 H new ATOM 0 HH21 ARG A 25 37.571 -18.779 1.054 1.00 31.32 H new ATOM 0 HH22 ARG A 25 38.876 -19.857 0.551 1.00 31.32 H new ATOM 427 N LEU A 26 31.703 -18.874 6.194 1.00 3.53 N ATOM 428 CA LEU A 26 30.824 -17.760 5.853 1.00 21.54 C ATOM 429 C LEU A 26 30.892 -16.668 6.916 1.00 52.03 C ATOM 430 O LEU A 26 31.289 -16.917 8.054 1.00 24.14 O ATOM 431 CB LEU A 26 29.383 -18.251 5.701 1.00 23.12 C ATOM 432 CG LEU A 26 28.852 -18.340 4.270 1.00 63.40 C ATOM 433 CD1 LEU A 26 27.597 -19.198 4.219 1.00 65.03 C ATOM 434 CD2 LEU A 26 28.574 -16.950 3.717 1.00 74.52 C ATOM 0 H LEU A 26 31.219 -19.702 6.543 1.00 3.53 H new ATOM 0 HA LEU A 26 31.160 -17.340 4.905 1.00 21.54 H new ATOM 0 HB2 LEU A 26 29.306 -19.238 6.158 1.00 23.12 H new ATOM 0 HB3 LEU A 26 28.732 -17.586 6.268 1.00 23.12 H new ATOM 0 HG LEU A 26 29.614 -18.810 3.648 1.00 63.40 H new ATOM 0 HD11 LEU A 26 27.233 -19.250 3.193 1.00 65.03 H new ATOM 0 HD12 LEU A 26 27.828 -20.203 4.573 1.00 65.03 H new ATOM 0 HD13 LEU A 26 26.829 -18.757 4.854 1.00 65.03 H new ATOM 0 HD21 LEU A 26 28.197 -17.033 2.698 1.00 74.52 H new ATOM 0 HD22 LEU A 26 27.831 -16.453 4.340 1.00 74.52 H new ATOM 0 HD23 LEU A 26 29.495 -16.368 3.717 1.00 74.52 H new ATOM 446 N THR A 27 30.499 -15.456 6.537 1.00 52.23 N ATOM 447 CA THR A 27 30.514 -14.325 7.456 1.00 34.22 C ATOM 448 C THR A 27 29.301 -13.427 7.242 1.00 0.53 C ATOM 449 O THR A 27 28.733 -13.383 6.150 1.00 14.04 O ATOM 450 CB THR A 27 31.795 -13.486 7.294 1.00 22.12 C ATOM 451 OG1 THR A 27 32.284 -13.592 5.952 1.00 32.04 O ATOM 452 CG2 THR A 27 32.870 -13.946 8.268 1.00 14.43 C ATOM 0 H THR A 27 30.166 -15.233 5.599 1.00 52.23 H new ATOM 0 HA THR A 27 30.484 -14.737 8.465 1.00 34.22 H new ATOM 0 HB THR A 27 31.551 -12.446 7.511 1.00 22.12 H new ATOM 0 HG1 THR A 27 32.635 -12.724 5.662 1.00 32.04 H new ATOM 0 HG21 THR A 27 33.765 -13.339 8.135 1.00 14.43 H new ATOM 0 HG22 THR A 27 32.506 -13.837 9.290 1.00 14.43 H new ATOM 0 HG23 THR A 27 33.110 -14.992 8.078 1.00 14.43 H new ATOM 460 N LEU A 28 28.910 -12.710 8.290 1.00 15.10 N ATOM 461 CA LEU A 28 27.763 -11.810 8.217 1.00 65.35 C ATOM 462 C LEU A 28 27.867 -10.895 7.001 1.00 1.40 C ATOM 463 O LEU A 28 26.881 -10.659 6.304 1.00 14.35 O ATOM 464 CB LEU A 28 27.665 -10.973 9.493 1.00 74.20 C ATOM 465 CG LEU A 28 26.303 -10.968 10.189 1.00 71.15 C ATOM 466 CD1 LEU A 28 26.469 -11.150 11.689 1.00 3.12 C ATOM 467 CD2 LEU A 28 25.554 -9.679 9.886 1.00 50.55 C ATOM 0 H LEU A 28 29.370 -12.734 9.200 1.00 15.10 H new ATOM 0 HA LEU A 28 26.862 -12.415 8.117 1.00 65.35 H new ATOM 0 HB2 LEU A 28 28.411 -11.336 10.200 1.00 74.20 H new ATOM 0 HB3 LEU A 28 27.930 -9.944 9.250 1.00 74.20 H new ATOM 0 HG LEU A 28 25.718 -11.804 9.805 1.00 71.15 H new ATOM 0 HD11 LEU A 28 25.489 -11.144 12.167 1.00 3.12 H new ATOM 0 HD12 LEU A 28 26.964 -12.101 11.888 1.00 3.12 H new ATOM 0 HD13 LEU A 28 27.073 -10.336 12.090 1.00 3.12 H new ATOM 0 HD21 LEU A 28 24.587 -9.693 10.389 1.00 50.55 H new ATOM 0 HD22 LEU A 28 26.136 -8.828 10.241 1.00 50.55 H new ATOM 0 HD23 LEU A 28 25.402 -9.591 8.810 1.00 50.55 H new ATOM 479 N GLU A 29 29.069 -10.384 6.752 1.00 11.31 N ATOM 480 CA GLU A 29 29.301 -9.495 5.619 1.00 33.24 C ATOM 481 C GLU A 29 28.957 -10.189 4.304 1.00 11.14 C ATOM 482 O GLU A 29 28.387 -9.580 3.400 1.00 51.33 O ATOM 483 CB GLU A 29 30.758 -9.030 5.597 1.00 23.14 C ATOM 484 CG GLU A 29 31.095 -8.140 4.413 1.00 24.10 C ATOM 485 CD GLU A 29 31.454 -6.727 4.829 1.00 45.31 C ATOM 486 OE1 GLU A 29 32.309 -6.572 5.726 1.00 22.24 O ATOM 487 OE2 GLU A 29 30.881 -5.776 4.258 1.00 41.21 O ATOM 0 H GLU A 29 29.896 -10.570 7.319 1.00 11.31 H new ATOM 0 HA GLU A 29 28.652 -8.627 5.732 1.00 33.24 H new ATOM 0 HB2 GLU A 29 30.972 -8.490 6.519 1.00 23.14 H new ATOM 0 HB3 GLU A 29 31.409 -9.904 5.581 1.00 23.14 H new ATOM 0 HG2 GLU A 29 31.928 -8.575 3.862 1.00 24.10 H new ATOM 0 HG3 GLU A 29 30.244 -8.109 3.733 1.00 24.10 H new ATOM 494 N MET A 30 29.308 -11.467 4.207 1.00 44.22 N ATOM 495 CA MET A 30 29.037 -12.244 3.003 1.00 33.01 C ATOM 496 C MET A 30 27.535 -12.382 2.772 1.00 2.43 C ATOM 497 O MET A 30 27.049 -12.187 1.659 1.00 71.23 O ATOM 498 CB MET A 30 29.677 -13.629 3.109 1.00 23.33 C ATOM 499 CG MET A 30 31.195 -13.605 3.022 1.00 33.44 C ATOM 500 SD MET A 30 31.920 -15.255 3.090 1.00 43.31 S ATOM 501 CE MET A 30 33.649 -14.854 3.330 1.00 24.34 C ATOM 0 H MET A 30 29.780 -11.986 4.947 1.00 44.22 H new ATOM 0 HA MET A 30 29.471 -11.715 2.154 1.00 33.01 H new ATOM 0 HB2 MET A 30 29.383 -14.085 4.054 1.00 23.33 H new ATOM 0 HB3 MET A 30 29.286 -14.263 2.314 1.00 23.33 H new ATOM 0 HG2 MET A 30 31.494 -13.119 2.094 1.00 33.44 H new ATOM 0 HG3 MET A 30 31.593 -13.004 3.839 1.00 33.44 H new ATOM 0 HE1 MET A 30 34.268 -15.582 2.805 1.00 24.34 H new ATOM 0 HE2 MET A 30 33.849 -13.857 2.937 1.00 24.34 H new ATOM 0 HE3 MET A 30 33.884 -14.878 4.394 1.00 24.34 H new ATOM 511 N MET A 31 26.807 -12.718 3.832 1.00 75.25 N ATOM 512 CA MET A 31 25.360 -12.881 3.743 1.00 0.31 C ATOM 513 C MET A 31 24.666 -11.526 3.639 1.00 62.32 C ATOM 514 O MET A 31 23.619 -11.402 3.006 1.00 74.41 O ATOM 515 CB MET A 31 24.836 -13.643 4.961 1.00 34.05 C ATOM 516 CG MET A 31 25.382 -15.057 5.075 1.00 73.11 C ATOM 517 SD MET A 31 24.513 -16.040 6.312 1.00 71.01 S ATOM 518 CE MET A 31 25.289 -17.637 6.081 1.00 25.54 C ATOM 0 H MET A 31 27.194 -12.883 4.761 1.00 75.25 H new ATOM 0 HA MET A 31 25.138 -13.453 2.842 1.00 0.31 H new ATOM 0 HB2 MET A 31 25.093 -13.089 5.864 1.00 34.05 H new ATOM 0 HB3 MET A 31 23.748 -13.685 4.912 1.00 34.05 H new ATOM 0 HG2 MET A 31 25.307 -15.551 4.106 1.00 73.11 H new ATOM 0 HG3 MET A 31 26.441 -15.014 5.329 1.00 73.11 H new ATOM 0 HE1 MET A 31 24.921 -18.333 6.835 1.00 25.54 H new ATOM 0 HE2 MET A 31 25.049 -18.018 5.088 1.00 25.54 H new ATOM 0 HE3 MET A 31 26.370 -17.534 6.179 1.00 25.54 H new ATOM 528 N ASN A 32 25.257 -10.514 4.265 1.00 45.35 N ATOM 529 CA ASN A 32 24.695 -9.168 4.242 1.00 30.34 C ATOM 530 C ASN A 32 24.602 -8.641 2.814 1.00 72.13 C ATOM 531 O ASN A 32 23.602 -8.035 2.430 1.00 43.40 O ATOM 532 CB ASN A 32 25.546 -8.223 5.092 1.00 5.12 C ATOM 533 CG ASN A 32 24.994 -6.811 5.116 1.00 42.24 C ATOM 534 OD1 ASN A 32 24.927 -6.141 4.085 1.00 63.45 O ATOM 535 ND2 ASN A 32 24.596 -6.351 6.296 1.00 74.01 N ATOM 0 H ASN A 32 26.125 -10.600 4.794 1.00 45.35 H new ATOM 0 HA ASN A 32 23.689 -9.214 4.659 1.00 30.34 H new ATOM 0 HB2 ASN A 32 25.601 -8.606 6.111 1.00 5.12 H new ATOM 0 HB3 ASN A 32 26.564 -8.206 4.702 1.00 5.12 H new ATOM 0 HD21 ASN A 32 24.216 -5.407 6.374 1.00 74.01 H new ATOM 0 HD22 ASN A 32 24.670 -6.941 7.125 1.00 74.01 H new ATOM 542 N GLU A 33 25.650 -8.878 2.032 1.00 45.23 N ATOM 543 CA GLU A 33 25.686 -8.426 0.646 1.00 63.44 C ATOM 544 C GLU A 33 24.891 -9.368 -0.254 1.00 64.40 C ATOM 545 O GLU A 33 24.366 -8.958 -1.290 1.00 25.42 O ATOM 546 CB GLU A 33 27.132 -8.333 0.154 1.00 41.23 C ATOM 547 CG GLU A 33 27.910 -9.630 0.301 1.00 43.52 C ATOM 548 CD GLU A 33 29.408 -9.428 0.176 1.00 21.42 C ATOM 549 OE1 GLU A 33 29.859 -8.986 -0.901 1.00 50.41 O ATOM 550 OE2 GLU A 33 30.129 -9.714 1.155 1.00 41.21 O ATOM 0 H GLU A 33 26.485 -9.380 2.334 1.00 45.23 H new ATOM 0 HA GLU A 33 25.230 -7.437 0.601 1.00 63.44 H new ATOM 0 HB2 GLU A 33 27.132 -8.036 -0.895 1.00 41.23 H new ATOM 0 HB3 GLU A 33 27.645 -7.547 0.707 1.00 41.23 H new ATOM 0 HG2 GLU A 33 27.687 -10.076 1.270 1.00 43.52 H new ATOM 0 HG3 GLU A 33 27.578 -10.337 -0.459 1.00 43.52 H new ATOM 557 N ILE A 34 24.808 -10.632 0.149 1.00 41.21 N ATOM 558 CA ILE A 34 24.077 -11.632 -0.620 1.00 4.32 C ATOM 559 C ILE A 34 22.571 -11.424 -0.501 1.00 24.14 C ATOM 560 O ILE A 34 21.848 -11.461 -1.496 1.00 40.41 O ATOM 561 CB ILE A 34 24.425 -13.060 -0.160 1.00 44.14 C ATOM 562 CG1 ILE A 34 25.836 -13.437 -0.617 1.00 42.54 C ATOM 563 CG2 ILE A 34 23.406 -14.053 -0.698 1.00 53.54 C ATOM 564 CD1 ILE A 34 26.448 -14.568 0.179 1.00 14.22 C ATOM 0 H ILE A 34 25.238 -10.988 1.003 1.00 41.21 H new ATOM 0 HA ILE A 34 24.377 -11.511 -1.661 1.00 4.32 H new ATOM 0 HB ILE A 34 24.395 -13.092 0.929 1.00 44.14 H new ATOM 0 HG12 ILE A 34 25.805 -13.720 -1.669 1.00 42.54 H new ATOM 0 HG13 ILE A 34 26.480 -12.561 -0.541 1.00 42.54 H new ATOM 0 HG21 ILE A 34 23.666 -15.058 -0.364 1.00 53.54 H new ATOM 0 HG22 ILE A 34 22.414 -13.793 -0.328 1.00 53.54 H new ATOM 0 HG23 ILE A 34 23.407 -14.021 -1.788 1.00 53.54 H new ATOM 0 HD11 ILE A 34 27.447 -14.781 -0.200 1.00 14.22 H new ATOM 0 HD12 ILE A 34 26.512 -14.281 1.229 1.00 14.22 H new ATOM 0 HD13 ILE A 34 25.826 -15.458 0.083 1.00 14.22 H new ATOM 576 N VAL A 35 22.105 -11.204 0.725 1.00 71.44 N ATOM 577 CA VAL A 35 20.685 -10.988 0.974 1.00 11.35 C ATOM 578 C VAL A 35 20.252 -9.599 0.518 1.00 43.02 C ATOM 579 O VAL A 35 19.098 -9.388 0.145 1.00 63.52 O ATOM 580 CB VAL A 35 20.346 -11.154 2.468 1.00 41.32 C ATOM 581 CG1 VAL A 35 18.841 -11.114 2.682 1.00 53.34 C ATOM 582 CG2 VAL A 35 20.935 -12.449 3.007 1.00 42.35 C ATOM 0 H VAL A 35 22.690 -11.171 1.560 1.00 71.44 H new ATOM 0 HA VAL A 35 20.145 -11.741 0.400 1.00 11.35 H new ATOM 0 HB VAL A 35 20.789 -10.323 3.018 1.00 41.32 H new ATOM 0 HG11 VAL A 35 18.621 -11.233 3.743 1.00 53.34 H new ATOM 0 HG12 VAL A 35 18.449 -10.158 2.335 1.00 53.34 H new ATOM 0 HG13 VAL A 35 18.372 -11.923 2.122 1.00 53.34 H new ATOM 0 HG21 VAL A 35 20.686 -12.550 4.063 1.00 42.35 H new ATOM 0 HG22 VAL A 35 20.523 -13.294 2.455 1.00 42.35 H new ATOM 0 HG23 VAL A 35 22.019 -12.432 2.890 1.00 42.35 H new ATOM 592 N SER A 36 21.186 -8.654 0.549 1.00 4.15 N ATOM 593 CA SER A 36 20.901 -7.283 0.142 1.00 61.22 C ATOM 594 C SER A 36 20.735 -7.190 -1.372 1.00 31.10 C ATOM 595 O SER A 36 19.734 -6.673 -1.868 1.00 51.22 O ATOM 596 CB SER A 36 22.021 -6.348 0.602 1.00 63.33 C ATOM 597 OG SER A 36 22.111 -5.209 -0.236 1.00 40.03 O ATOM 0 H SER A 36 22.147 -8.813 0.852 1.00 4.15 H new ATOM 0 HA SER A 36 19.967 -6.977 0.613 1.00 61.22 H new ATOM 0 HB2 SER A 36 21.838 -6.034 1.629 1.00 63.33 H new ATOM 0 HB3 SER A 36 22.971 -6.883 0.597 1.00 63.33 H new ATOM 0 HG SER A 36 22.833 -4.627 0.080 1.00 40.03 H new ATOM 603 N LYS A 37 21.724 -7.695 -2.101 1.00 41.15 N ATOM 604 CA LYS A 37 21.690 -7.671 -3.559 1.00 34.31 C ATOM 605 C LYS A 37 20.512 -8.484 -4.089 1.00 2.54 C ATOM 606 O LYS A 37 19.740 -8.005 -4.919 1.00 31.32 O ATOM 607 CB LYS A 37 22.999 -8.220 -4.129 1.00 63.05 C ATOM 608 CG LYS A 37 23.925 -7.144 -4.672 1.00 34.44 C ATOM 609 CD LYS A 37 23.255 -6.334 -5.769 1.00 10.13 C ATOM 610 CE LYS A 37 24.184 -5.260 -6.314 1.00 14.20 C ATOM 611 NZ LYS A 37 23.446 -4.015 -6.666 1.00 33.12 N ATOM 0 H LYS A 37 22.560 -8.126 -1.706 1.00 41.15 H new ATOM 0 HA LYS A 37 21.568 -6.636 -3.878 1.00 34.31 H new ATOM 0 HB2 LYS A 37 23.520 -8.776 -3.350 1.00 63.05 H new ATOM 0 HB3 LYS A 37 22.770 -8.927 -4.926 1.00 63.05 H new ATOM 0 HG2 LYS A 37 24.228 -6.481 -3.862 1.00 34.44 H new ATOM 0 HG3 LYS A 37 24.832 -7.606 -5.062 1.00 34.44 H new ATOM 0 HD2 LYS A 37 22.950 -6.998 -6.578 1.00 10.13 H new ATOM 0 HD3 LYS A 37 22.349 -5.870 -5.379 1.00 10.13 H new ATOM 0 HE2 LYS A 37 24.949 -5.031 -5.572 1.00 14.20 H new ATOM 0 HE3 LYS A 37 24.699 -5.639 -7.197 1.00 14.20 H new ATOM 0 HZ1 LYS A 37 24.114 -3.220 -6.722 1.00 33.12 H new ATOM 0 HZ2 LYS A 37 22.976 -4.138 -7.586 1.00 33.12 H new ATOM 0 HZ3 LYS A 37 22.732 -3.817 -5.936 1.00 33.12 H new ATOM 625 N MET A 38 20.381 -9.713 -3.602 1.00 31.21 N ATOM 626 CA MET A 38 19.295 -10.590 -4.025 1.00 63.21 C ATOM 627 C MET A 38 17.942 -9.915 -3.826 1.00 30.32 C ATOM 628 O MET A 38 17.036 -10.065 -4.646 1.00 63.11 O ATOM 629 CB MET A 38 19.341 -11.906 -3.247 1.00 25.53 C ATOM 630 CG MET A 38 18.665 -11.833 -1.887 1.00 41.44 C ATOM 631 SD MET A 38 18.563 -13.439 -1.074 1.00 52.33 S ATOM 632 CE MET A 38 20.252 -14.010 -1.239 1.00 63.15 C ATOM 0 H MET A 38 21.013 -10.124 -2.915 1.00 31.21 H new ATOM 0 HA MET A 38 19.424 -10.800 -5.087 1.00 63.21 H new ATOM 0 HB2 MET A 38 18.863 -12.686 -3.840 1.00 25.53 H new ATOM 0 HB3 MET A 38 20.381 -12.202 -3.111 1.00 25.53 H new ATOM 0 HG2 MET A 38 19.215 -11.142 -1.249 1.00 41.44 H new ATOM 0 HG3 MET A 38 17.661 -11.426 -2.006 1.00 41.44 H new ATOM 0 HE1 MET A 38 20.254 -15.051 -1.561 1.00 63.15 H new ATOM 0 HE2 MET A 38 20.772 -13.400 -1.978 1.00 63.15 H new ATOM 0 HE3 MET A 38 20.760 -13.926 -0.278 1.00 63.15 H new ATOM 642 N ASP A 39 17.812 -9.173 -2.732 1.00 14.01 N ATOM 643 CA ASP A 39 16.569 -8.474 -2.425 1.00 73.45 C ATOM 644 C ASP A 39 16.326 -7.339 -3.415 1.00 15.13 C ATOM 645 O ASP A 39 15.181 -6.981 -3.695 1.00 64.12 O ATOM 646 CB ASP A 39 16.606 -7.925 -0.999 1.00 32.25 C ATOM 647 CG ASP A 39 15.254 -7.417 -0.538 1.00 74.04 C ATOM 648 OD1 ASP A 39 14.248 -7.709 -1.218 1.00 72.40 O ATOM 649 OD2 ASP A 39 15.201 -6.726 0.501 1.00 63.12 O ATOM 0 H ASP A 39 18.552 -9.040 -2.043 1.00 14.01 H new ATOM 0 HA ASP A 39 15.749 -9.187 -2.509 1.00 73.45 H new ATOM 0 HB2 ASP A 39 16.947 -8.707 -0.321 1.00 32.25 H new ATOM 0 HB3 ASP A 39 17.333 -7.115 -0.944 1.00 32.25 H new ATOM 654 N ASP A 40 17.408 -6.776 -3.939 1.00 5.21 N ATOM 655 CA ASP A 40 17.313 -5.680 -4.897 1.00 22.51 C ATOM 656 C ASP A 40 16.732 -6.166 -6.221 1.00 41.13 C ATOM 657 O ASP A 40 15.822 -5.549 -6.776 1.00 5.44 O ATOM 658 CB ASP A 40 18.690 -5.056 -5.128 1.00 51.32 C ATOM 659 CG ASP A 40 18.632 -3.852 -6.048 1.00 63.24 C ATOM 660 OD1 ASP A 40 18.083 -2.811 -5.631 1.00 34.33 O ATOM 661 OD2 ASP A 40 19.138 -3.951 -7.186 1.00 13.11 O ATOM 0 H ASP A 40 18.362 -7.060 -3.717 1.00 5.21 H new ATOM 0 HA ASP A 40 16.645 -4.924 -4.483 1.00 22.51 H new ATOM 0 HB2 ASP A 40 19.116 -4.758 -4.170 1.00 51.32 H new ATOM 0 HB3 ASP A 40 19.358 -5.804 -5.555 1.00 51.32 H new ATOM 666 N PHE A 41 17.264 -7.275 -6.724 1.00 44.00 N ATOM 667 CA PHE A 41 16.800 -7.842 -7.985 1.00 23.44 C ATOM 668 C PHE A 41 15.371 -8.360 -7.854 1.00 70.53 C ATOM 669 O PHE A 41 14.555 -8.200 -8.763 1.00 12.43 O ATOM 670 CB PHE A 41 17.727 -8.976 -8.430 1.00 51.52 C ATOM 671 CG PHE A 41 18.030 -8.959 -9.901 1.00 42.41 C ATOM 672 CD1 PHE A 41 18.333 -7.770 -10.546 1.00 24.32 C ATOM 673 CD2 PHE A 41 18.012 -10.131 -10.639 1.00 74.12 C ATOM 674 CE1 PHE A 41 18.613 -7.751 -11.899 1.00 63.22 C ATOM 675 CE2 PHE A 41 18.291 -10.118 -11.993 1.00 22.23 C ATOM 676 CZ PHE A 41 18.591 -8.927 -12.624 1.00 1.33 C ATOM 0 H PHE A 41 18.017 -7.799 -6.278 1.00 44.00 H new ATOM 0 HA PHE A 41 16.815 -7.053 -8.737 1.00 23.44 H new ATOM 0 HB2 PHE A 41 18.662 -8.910 -7.874 1.00 51.52 H new ATOM 0 HB3 PHE A 41 17.269 -9.931 -8.172 1.00 51.52 H new ATOM 0 HD1 PHE A 41 18.350 -6.848 -9.984 1.00 24.32 H new ATOM 0 HD2 PHE A 41 17.777 -11.066 -10.151 1.00 74.12 H new ATOM 0 HE1 PHE A 41 18.849 -6.818 -12.389 1.00 63.22 H new ATOM 0 HE2 PHE A 41 18.274 -11.039 -12.557 1.00 22.23 H new ATOM 0 HZ PHE A 41 18.808 -8.915 -13.682 1.00 1.33 H new ATOM 686 N LEU A 42 15.075 -8.984 -6.719 1.00 4.51 N ATOM 687 CA LEU A 42 13.745 -9.527 -6.468 1.00 52.42 C ATOM 688 C LEU A 42 12.740 -8.408 -6.210 1.00 20.51 C ATOM 689 O LEU A 42 11.562 -8.529 -6.546 1.00 64.13 O ATOM 690 CB LEU A 42 13.779 -10.483 -5.275 1.00 2.34 C ATOM 691 CG LEU A 42 13.111 -11.842 -5.484 1.00 22.10 C ATOM 692 CD1 LEU A 42 11.597 -11.703 -5.455 1.00 1.12 C ATOM 693 CD2 LEU A 42 13.566 -12.464 -6.796 1.00 44.54 C ATOM 0 H LEU A 42 15.739 -9.126 -5.958 1.00 4.51 H new ATOM 0 HA LEU A 42 13.430 -10.076 -7.356 1.00 52.42 H new ATOM 0 HB2 LEU A 42 14.820 -10.651 -4.999 1.00 2.34 H new ATOM 0 HB3 LEU A 42 13.300 -9.992 -4.428 1.00 2.34 H new ATOM 0 HG LEU A 42 13.410 -12.501 -4.669 1.00 22.10 H new ATOM 0 HD11 LEU A 42 11.139 -12.681 -5.605 1.00 1.12 H new ATOM 0 HD12 LEU A 42 11.287 -11.302 -4.490 1.00 1.12 H new ATOM 0 HD13 LEU A 42 11.278 -11.027 -6.249 1.00 1.12 H new ATOM 0 HD21 LEU A 42 13.080 -13.431 -6.928 1.00 44.54 H new ATOM 0 HD22 LEU A 42 13.297 -11.807 -7.623 1.00 44.54 H new ATOM 0 HD23 LEU A 42 14.647 -12.601 -6.778 1.00 44.54 H new ATOM 705 N MET A 43 13.214 -7.320 -5.612 1.00 62.24 N ATOM 706 CA MET A 43 12.358 -6.179 -5.312 1.00 55.24 C ATOM 707 C MET A 43 11.898 -5.492 -6.595 1.00 32.33 C ATOM 708 O MET A 43 10.739 -5.094 -6.717 1.00 22.00 O ATOM 709 CB MET A 43 13.097 -5.179 -4.422 1.00 2.13 C ATOM 710 CG MET A 43 12.315 -3.902 -4.161 1.00 74.13 C ATOM 711 SD MET A 43 13.191 -2.759 -3.077 1.00 21.13 S ATOM 712 CE MET A 43 14.330 -2.001 -4.233 1.00 31.21 C ATOM 0 H MET A 43 14.186 -7.205 -5.326 1.00 62.24 H new ATOM 0 HA MET A 43 11.479 -6.546 -4.782 1.00 55.24 H new ATOM 0 HB2 MET A 43 13.328 -5.655 -3.469 1.00 2.13 H new ATOM 0 HB3 MET A 43 14.048 -4.924 -4.889 1.00 2.13 H new ATOM 0 HG2 MET A 43 12.106 -3.408 -5.110 1.00 74.13 H new ATOM 0 HG3 MET A 43 11.353 -4.155 -3.715 1.00 74.13 H new ATOM 0 HE1 MET A 43 14.944 -1.267 -3.711 1.00 31.21 H new ATOM 0 HE2 MET A 43 14.972 -2.768 -4.667 1.00 31.21 H new ATOM 0 HE3 MET A 43 13.769 -1.506 -5.025 1.00 31.21 H new ATOM 722 N LYS A 44 12.813 -5.356 -7.548 1.00 72.35 N ATOM 723 CA LYS A 44 12.502 -4.719 -8.822 1.00 51.24 C ATOM 724 C LYS A 44 11.596 -5.608 -9.669 1.00 3.41 C ATOM 725 O LYS A 44 10.739 -5.117 -10.404 1.00 34.33 O ATOM 726 CB LYS A 44 13.790 -4.408 -9.588 1.00 72.14 C ATOM 727 CG LYS A 44 14.644 -5.633 -9.865 1.00 31.34 C ATOM 728 CD LYS A 44 15.777 -5.318 -10.826 1.00 41.14 C ATOM 729 CE LYS A 44 16.713 -4.262 -10.258 1.00 71.11 C ATOM 730 NZ LYS A 44 17.972 -4.154 -11.047 1.00 33.44 N ATOM 0 H LYS A 44 13.777 -5.679 -7.462 1.00 72.35 H new ATOM 0 HA LYS A 44 11.976 -3.787 -8.615 1.00 51.24 H new ATOM 0 HB2 LYS A 44 13.534 -3.932 -10.535 1.00 72.14 H new ATOM 0 HB3 LYS A 44 14.377 -3.688 -9.018 1.00 72.14 H new ATOM 0 HG2 LYS A 44 15.055 -6.010 -8.929 1.00 31.34 H new ATOM 0 HG3 LYS A 44 14.022 -6.425 -10.282 1.00 31.34 H new ATOM 0 HD2 LYS A 44 16.339 -6.228 -11.038 1.00 41.14 H new ATOM 0 HD3 LYS A 44 15.366 -4.969 -11.773 1.00 41.14 H new ATOM 0 HE2 LYS A 44 16.207 -3.296 -10.247 1.00 71.11 H new ATOM 0 HE3 LYS A 44 16.953 -4.508 -9.223 1.00 71.11 H new ATOM 0 HZ1 LYS A 44 18.631 -3.512 -10.563 1.00 33.44 H new ATOM 0 HZ2 LYS A 44 18.407 -5.094 -11.137 1.00 33.44 H new ATOM 0 HZ3 LYS A 44 17.758 -3.780 -11.994 1.00 33.44 H new ATOM 744 N LYS A 45 11.791 -6.917 -9.560 1.00 63.42 N ATOM 745 CA LYS A 45 10.991 -7.876 -10.313 1.00 52.31 C ATOM 746 C LYS A 45 9.525 -7.806 -9.897 1.00 51.44 C ATOM 747 O LYS A 45 8.639 -7.646 -10.737 1.00 31.21 O ATOM 748 CB LYS A 45 11.525 -9.294 -10.102 1.00 75.41 C ATOM 749 CG LYS A 45 10.579 -10.379 -10.590 1.00 1.44 C ATOM 750 CD LYS A 45 10.701 -10.591 -12.089 1.00 74.52 C ATOM 751 CE LYS A 45 9.677 -11.596 -12.594 1.00 75.33 C ATOM 752 NZ LYS A 45 9.269 -11.314 -13.998 1.00 75.34 N ATOM 0 H LYS A 45 12.497 -7.339 -8.957 1.00 63.42 H new ATOM 0 HA LYS A 45 11.063 -7.621 -11.370 1.00 52.31 H new ATOM 0 HB2 LYS A 45 12.479 -9.395 -10.620 1.00 75.41 H new ATOM 0 HB3 LYS A 45 11.721 -9.445 -9.041 1.00 75.41 H new ATOM 0 HG2 LYS A 45 10.796 -11.313 -10.071 1.00 1.44 H new ATOM 0 HG3 LYS A 45 9.553 -10.107 -10.342 1.00 1.44 H new ATOM 0 HD2 LYS A 45 10.564 -9.640 -12.604 1.00 74.52 H new ATOM 0 HD3 LYS A 45 11.705 -10.942 -12.328 1.00 74.52 H new ATOM 0 HE2 LYS A 45 10.094 -12.601 -12.532 1.00 75.33 H new ATOM 0 HE3 LYS A 45 8.798 -11.575 -11.949 1.00 75.33 H new ATOM 0 HZ1 LYS A 45 8.376 -11.805 -14.205 1.00 75.34 H new ATOM 0 HZ2 LYS A 45 9.138 -10.290 -14.122 1.00 75.34 H new ATOM 0 HZ3 LYS A 45 10.008 -11.650 -14.648 1.00 75.34 H new ATOM 766 N SER A 46 9.277 -7.924 -8.597 1.00 31.30 N ATOM 767 CA SER A 46 7.918 -7.877 -8.071 1.00 12.45 C ATOM 768 C SER A 46 7.287 -6.509 -8.317 1.00 63.53 C ATOM 769 O SER A 46 6.065 -6.379 -8.383 1.00 52.14 O ATOM 770 CB SER A 46 7.917 -8.188 -6.573 1.00 23.33 C ATOM 771 OG SER A 46 6.734 -8.870 -6.194 1.00 63.42 O ATOM 0 H SER A 46 9.999 -8.053 -7.888 1.00 31.30 H new ATOM 0 HA SER A 46 7.327 -8.630 -8.592 1.00 12.45 H new ATOM 0 HB2 SER A 46 8.787 -8.796 -6.324 1.00 23.33 H new ATOM 0 HB3 SER A 46 8.004 -7.261 -6.006 1.00 23.33 H new ATOM 0 HG SER A 46 6.759 -9.058 -5.233 1.00 63.42 H new ATOM 777 N LYS A 47 8.131 -5.492 -8.453 1.00 12.20 N ATOM 778 CA LYS A 47 7.659 -4.133 -8.694 1.00 21.32 C ATOM 779 C LYS A 47 7.150 -3.980 -10.123 1.00 41.54 C ATOM 780 O LYS A 47 6.268 -3.164 -10.393 1.00 50.15 O ATOM 781 CB LYS A 47 8.782 -3.127 -8.430 1.00 32.41 C ATOM 782 CG LYS A 47 9.352 -2.507 -9.694 1.00 12.34 C ATOM 783 CD LYS A 47 8.502 -1.343 -10.175 1.00 51.15 C ATOM 784 CE LYS A 47 9.353 -0.121 -10.483 1.00 45.32 C ATOM 785 NZ LYS A 47 10.370 -0.403 -11.535 1.00 34.25 N ATOM 0 H LYS A 47 9.146 -5.583 -8.400 1.00 12.20 H new ATOM 0 HA LYS A 47 6.834 -3.934 -8.010 1.00 21.32 H new ATOM 0 HB2 LYS A 47 8.404 -2.334 -7.785 1.00 32.41 H new ATOM 0 HB3 LYS A 47 9.584 -3.625 -7.886 1.00 32.41 H new ATOM 0 HG2 LYS A 47 10.369 -2.163 -9.505 1.00 12.34 H new ATOM 0 HG3 LYS A 47 9.412 -3.263 -10.477 1.00 12.34 H new ATOM 0 HD2 LYS A 47 7.951 -1.638 -11.068 1.00 51.15 H new ATOM 0 HD3 LYS A 47 7.764 -1.091 -9.414 1.00 51.15 H new ATOM 0 HE2 LYS A 47 8.710 0.696 -10.810 1.00 45.32 H new ATOM 0 HE3 LYS A 47 9.854 0.211 -9.574 1.00 45.32 H new ATOM 0 HZ1 LYS A 47 10.740 0.494 -11.909 1.00 34.25 H new ATOM 0 HZ2 LYS A 47 11.150 -0.956 -11.125 1.00 34.25 H new ATOM 0 HZ3 LYS A 47 9.930 -0.945 -12.306 1.00 34.25 H new ATOM 799 N ILE A 48 7.710 -4.769 -11.034 1.00 41.41 N ATOM 800 CA ILE A 48 7.310 -4.721 -12.435 1.00 22.00 C ATOM 801 C ILE A 48 6.046 -5.540 -12.674 1.00 0.41 C ATOM 802 O ILE A 48 5.234 -5.209 -13.539 1.00 35.42 O ATOM 803 CB ILE A 48 8.428 -5.242 -13.357 1.00 71.44 C ATOM 804 CG1 ILE A 48 9.650 -4.325 -13.283 1.00 51.43 C ATOM 805 CG2 ILE A 48 7.926 -5.350 -14.789 1.00 74.14 C ATOM 806 CD1 ILE A 48 10.967 -5.069 -13.306 1.00 13.32 C ATOM 0 H ILE A 48 8.442 -5.449 -10.827 1.00 41.41 H new ATOM 0 HA ILE A 48 7.113 -3.675 -12.672 1.00 22.00 H new ATOM 0 HB ILE A 48 8.723 -6.236 -13.020 1.00 71.44 H new ATOM 0 HG12 ILE A 48 9.622 -3.627 -14.120 1.00 51.43 H new ATOM 0 HG13 ILE A 48 9.594 -3.731 -12.371 1.00 51.43 H new ATOM 0 HG21 ILE A 48 8.728 -5.720 -15.429 1.00 74.14 H new ATOM 0 HG22 ILE A 48 7.083 -6.040 -14.828 1.00 74.14 H new ATOM 0 HG23 ILE A 48 7.607 -4.368 -15.138 1.00 74.14 H new ATOM 0 HD11 ILE A 48 11.789 -4.355 -13.251 1.00 13.32 H new ATOM 0 HD12 ILE A 48 11.017 -5.747 -12.454 1.00 13.32 H new ATOM 0 HD13 ILE A 48 11.045 -5.642 -14.230 1.00 13.32 H new ATOM 818 N LEU A 49 5.885 -6.608 -11.901 1.00 11.10 N ATOM 819 CA LEU A 49 4.718 -7.474 -12.027 1.00 33.14 C ATOM 820 C LEU A 49 3.436 -6.711 -11.708 1.00 42.52 C ATOM 821 O LEU A 49 2.343 -7.125 -12.092 1.00 2.40 O ATOM 822 CB LEU A 49 4.851 -8.680 -11.096 1.00 31.45 C ATOM 823 CG LEU A 49 6.195 -9.408 -11.128 1.00 4.14 C ATOM 824 CD1 LEU A 49 6.045 -10.831 -10.613 1.00 12.15 C ATOM 825 CD2 LEU A 49 6.769 -9.407 -12.537 1.00 52.12 C ATOM 0 H LEU A 49 6.548 -6.895 -11.181 1.00 11.10 H new ATOM 0 HA LEU A 49 4.665 -7.822 -13.059 1.00 33.14 H new ATOM 0 HB2 LEU A 49 4.665 -8.347 -10.075 1.00 31.45 H new ATOM 0 HB3 LEU A 49 4.067 -9.395 -11.346 1.00 31.45 H new ATOM 0 HG LEU A 49 6.888 -8.878 -10.474 1.00 4.14 H new ATOM 0 HD11 LEU A 49 7.012 -11.333 -10.644 1.00 12.15 H new ATOM 0 HD12 LEU A 49 5.679 -10.810 -9.586 1.00 12.15 H new ATOM 0 HD13 LEU A 49 5.336 -11.372 -11.240 1.00 12.15 H new ATOM 0 HD21 LEU A 49 7.726 -9.929 -12.541 1.00 52.12 H new ATOM 0 HD22 LEU A 49 6.078 -9.911 -13.212 1.00 52.12 H new ATOM 0 HD23 LEU A 49 6.916 -8.379 -12.869 1.00 52.12 H new ATOM 837 N GLY A 50 3.579 -5.591 -11.005 1.00 64.10 N ATOM 838 CA GLY A 50 2.426 -4.786 -10.649 1.00 34.22 C ATOM 839 C GLY A 50 2.366 -3.484 -11.422 1.00 42.30 C ATOM 840 O GLY A 50 1.285 -3.006 -11.767 1.00 1.02 O ATOM 0 H GLY A 50 4.473 -5.227 -10.676 1.00 64.10 H new ATOM 0 HA2 GLY A 50 1.517 -5.357 -10.835 1.00 34.22 H new ATOM 0 HA3 GLY A 50 2.454 -4.570 -9.581 1.00 34.22 H new ATOM 844 N LYS A 51 3.531 -2.906 -11.695 1.00 2.35 N ATOM 845 CA LYS A 51 3.609 -1.650 -12.431 1.00 70.05 C ATOM 846 C LYS A 51 2.854 -1.747 -13.753 1.00 63.45 C ATOM 847 O LYS A 51 2.373 -2.817 -14.129 1.00 22.11 O ATOM 848 CB LYS A 51 5.070 -1.278 -12.692 1.00 42.35 C ATOM 849 CG LYS A 51 5.484 0.041 -12.063 1.00 55.52 C ATOM 850 CD LYS A 51 5.218 0.053 -10.567 1.00 64.11 C ATOM 851 CE LYS A 51 5.863 1.256 -9.896 1.00 25.31 C ATOM 852 NZ LYS A 51 5.724 1.205 -8.414 1.00 40.11 N ATOM 0 H LYS A 51 4.435 -3.288 -11.417 1.00 2.35 H new ATOM 0 HA LYS A 51 3.146 -0.872 -11.824 1.00 70.05 H new ATOM 0 HB2 LYS A 51 5.712 -2.071 -12.309 1.00 42.35 H new ATOM 0 HB3 LYS A 51 5.236 -1.226 -13.768 1.00 42.35 H new ATOM 0 HG2 LYS A 51 6.544 0.216 -12.246 1.00 55.52 H new ATOM 0 HG3 LYS A 51 4.940 0.858 -12.537 1.00 55.52 H new ATOM 0 HD2 LYS A 51 4.143 0.068 -10.388 1.00 64.11 H new ATOM 0 HD3 LYS A 51 5.603 -0.864 -10.121 1.00 64.11 H new ATOM 0 HE2 LYS A 51 6.920 1.296 -10.161 1.00 25.31 H new ATOM 0 HE3 LYS A 51 5.405 2.171 -10.272 1.00 25.31 H new ATOM 0 HZ1 LYS A 51 6.176 2.042 -7.994 1.00 40.11 H new ATOM 0 HZ2 LYS A 51 4.716 1.192 -8.160 1.00 40.11 H new ATOM 0 HZ3 LYS A 51 6.183 0.345 -8.052 1.00 40.11 H new ATOM 866 N THR A 52 2.755 -0.624 -14.457 1.00 51.23 N ATOM 867 CA THR A 52 2.059 -0.583 -15.737 1.00 43.23 C ATOM 868 C THR A 52 3.031 -0.326 -16.883 1.00 43.12 C ATOM 869 O THR A 52 4.185 0.037 -16.661 1.00 3.41 O ATOM 870 CB THR A 52 0.970 0.506 -15.750 1.00 35.32 C ATOM 871 OG1 THR A 52 0.253 0.468 -16.989 1.00 64.23 O ATOM 872 CG2 THR A 52 1.580 1.885 -15.553 1.00 41.11 C ATOM 0 H THR A 52 3.148 0.270 -14.162 1.00 51.23 H new ATOM 0 HA THR A 52 1.590 -1.557 -15.873 1.00 43.23 H new ATOM 0 HB THR A 52 0.283 0.310 -14.927 1.00 35.32 H new ATOM 0 HG1 THR A 52 -0.612 0.915 -16.880 1.00 64.23 H new ATOM 0 HG21 THR A 52 0.791 2.637 -15.566 1.00 41.11 H new ATOM 0 HG22 THR A 52 2.099 1.920 -14.595 1.00 41.11 H new ATOM 0 HG23 THR A 52 2.288 2.088 -16.357 1.00 41.11 H new ATOM 880 N ASN A 53 2.556 -0.517 -18.110 1.00 4.32 N ATOM 881 CA ASN A 53 3.385 -0.305 -19.292 1.00 34.25 C ATOM 882 C ASN A 53 3.860 1.142 -19.371 1.00 0.45 C ATOM 883 O ASN A 53 4.875 1.441 -20.000 1.00 61.11 O ATOM 884 CB ASN A 53 2.605 -0.668 -20.557 1.00 45.44 C ATOM 885 CG ASN A 53 2.386 -2.162 -20.693 1.00 15.00 C ATOM 886 OD1 ASN A 53 3.260 -2.962 -20.360 1.00 32.14 O ATOM 887 ND2 ASN A 53 1.213 -2.545 -21.185 1.00 20.01 N ATOM 0 H ASN A 53 1.602 -0.818 -18.312 1.00 4.32 H new ATOM 0 HA ASN A 53 4.259 -0.951 -19.214 1.00 34.25 H new ATOM 0 HB2 ASN A 53 1.640 -0.162 -20.543 1.00 45.44 H new ATOM 0 HB3 ASN A 53 3.144 -0.302 -21.431 1.00 45.44 H new ATOM 0 HD21 ASN A 53 1.008 -3.538 -21.300 1.00 20.01 H new ATOM 0 HD22 ASN A 53 0.518 -1.847 -21.448 1.00 20.01 H new ATOM 894 N LYS A 54 3.120 2.038 -18.727 1.00 12.43 N ATOM 895 CA LYS A 54 3.465 3.455 -18.721 1.00 41.02 C ATOM 896 C LYS A 54 4.634 3.726 -17.780 1.00 2.41 C ATOM 897 O LYS A 54 5.518 4.525 -18.089 1.00 12.45 O ATOM 898 CB LYS A 54 2.255 4.294 -18.304 1.00 42.33 C ATOM 899 CG LYS A 54 0.968 3.897 -19.006 1.00 21.42 C ATOM 900 CD LYS A 54 -0.146 4.893 -18.733 1.00 74.30 C ATOM 901 CE LYS A 54 -0.782 4.659 -17.371 1.00 60.11 C ATOM 902 NZ LYS A 54 -1.761 3.537 -17.401 1.00 64.11 N ATOM 0 H LYS A 54 2.276 1.808 -18.202 1.00 12.43 H new ATOM 0 HA LYS A 54 3.762 3.735 -19.731 1.00 41.02 H new ATOM 0 HB2 LYS A 54 2.114 4.203 -17.227 1.00 42.33 H new ATOM 0 HB3 LYS A 54 2.463 5.344 -18.511 1.00 42.33 H new ATOM 0 HG2 LYS A 54 1.144 3.831 -20.080 1.00 21.42 H new ATOM 0 HG3 LYS A 54 0.661 2.906 -18.672 1.00 21.42 H new ATOM 0 HD2 LYS A 54 0.251 5.907 -18.781 1.00 74.30 H new ATOM 0 HD3 LYS A 54 -0.907 4.812 -19.510 1.00 74.30 H new ATOM 0 HE2 LYS A 54 -0.004 4.442 -16.639 1.00 60.11 H new ATOM 0 HE3 LYS A 54 -1.283 5.570 -17.043 1.00 60.11 H new ATOM 0 HZ1 LYS A 54 -2.172 3.410 -16.454 1.00 64.11 H new ATOM 0 HZ2 LYS A 54 -2.518 3.755 -18.081 1.00 64.11 H new ATOM 0 HZ3 LYS A 54 -1.278 2.662 -17.689 1.00 64.11 H new ATOM 916 N GLN A 55 4.632 3.055 -16.633 1.00 3.44 N ATOM 917 CA GLN A 55 5.694 3.225 -15.647 1.00 71.25 C ATOM 918 C GLN A 55 6.905 2.367 -15.999 1.00 72.12 C ATOM 919 O GLN A 55 8.045 2.735 -15.711 1.00 75.12 O ATOM 920 CB GLN A 55 5.185 2.862 -14.251 1.00 44.21 C ATOM 921 CG GLN A 55 6.235 3.015 -13.163 1.00 4.15 C ATOM 922 CD GLN A 55 6.672 4.454 -12.971 1.00 0.12 C ATOM 923 OE1 GLN A 55 7.768 4.842 -13.378 1.00 14.04 O ATOM 924 NE2 GLN A 55 5.815 5.255 -12.349 1.00 10.24 N ATOM 0 H GLN A 55 3.908 2.389 -16.363 1.00 3.44 H new ATOM 0 HA GLN A 55 5.999 4.272 -15.654 1.00 71.25 H new ATOM 0 HB2 GLN A 55 4.329 3.492 -14.010 1.00 44.21 H new ATOM 0 HB3 GLN A 55 4.830 1.832 -14.259 1.00 44.21 H new ATOM 0 HG2 GLN A 55 5.837 2.632 -12.223 1.00 4.15 H new ATOM 0 HG3 GLN A 55 7.104 2.406 -13.414 1.00 4.15 H new ATOM 0 HE21 GLN A 55 4.918 4.891 -12.028 1.00 10.24 H new ATOM 0 HE22 GLN A 55 6.054 6.234 -12.192 1.00 10.24 H new ATOM 933 N LEU A 56 6.651 1.222 -16.623 1.00 21.32 N ATOM 934 CA LEU A 56 7.721 0.310 -17.014 1.00 12.20 C ATOM 935 C LEU A 56 8.800 1.044 -17.804 1.00 11.03 C ATOM 936 O LEU A 56 8.500 1.853 -18.683 1.00 22.13 O ATOM 937 CB LEU A 56 7.157 -0.841 -17.848 1.00 33.51 C ATOM 938 CG LEU A 56 8.164 -1.600 -18.713 1.00 50.10 C ATOM 939 CD1 LEU A 56 7.774 -3.066 -18.825 1.00 5.30 C ATOM 940 CD2 LEU A 56 8.266 -0.966 -20.093 1.00 34.32 C ATOM 0 H LEU A 56 5.714 0.903 -16.869 1.00 21.32 H new ATOM 0 HA LEU A 56 8.171 -0.093 -16.107 1.00 12.20 H new ATOM 0 HB2 LEU A 56 6.679 -1.552 -17.174 1.00 33.51 H new ATOM 0 HB3 LEU A 56 6.377 -0.444 -18.498 1.00 33.51 H new ATOM 0 HG LEU A 56 9.142 -1.541 -18.235 1.00 50.10 H new ATOM 0 HD11 LEU A 56 8.502 -3.590 -19.444 1.00 5.30 H new ATOM 0 HD12 LEU A 56 7.753 -3.514 -17.832 1.00 5.30 H new ATOM 0 HD13 LEU A 56 6.787 -3.146 -19.280 1.00 5.30 H new ATOM 0 HD21 LEU A 56 8.987 -1.519 -20.695 1.00 34.32 H new ATOM 0 HD22 LEU A 56 7.291 -0.993 -20.579 1.00 34.32 H new ATOM 0 HD23 LEU A 56 8.593 0.069 -19.995 1.00 34.32 H new ATOM 952 N THR A 57 10.058 0.755 -17.486 1.00 42.03 N ATOM 953 CA THR A 57 11.182 1.386 -18.166 1.00 42.12 C ATOM 954 C THR A 57 12.010 0.359 -18.930 1.00 31.30 C ATOM 955 O THR A 57 11.673 -0.825 -18.960 1.00 61.02 O ATOM 956 CB THR A 57 12.096 2.128 -17.172 1.00 75.21 C ATOM 957 OG1 THR A 57 11.424 2.292 -15.918 1.00 71.51 O ATOM 958 CG2 THR A 57 12.498 3.489 -17.719 1.00 50.11 C ATOM 0 H THR A 57 10.324 0.088 -16.762 1.00 42.03 H new ATOM 0 HA THR A 57 10.762 2.105 -18.869 1.00 42.12 H new ATOM 0 HB THR A 57 12.997 1.532 -17.026 1.00 75.21 H new ATOM 0 HG1 THR A 57 12.012 2.763 -15.291 1.00 71.51 H new ATOM 0 HG21 THR A 57 13.143 3.994 -17.000 1.00 50.11 H new ATOM 0 HG22 THR A 57 13.034 3.359 -18.659 1.00 50.11 H new ATOM 0 HG23 THR A 57 11.605 4.090 -17.891 1.00 50.11 H new ATOM 966 N ARG A 58 13.094 0.819 -19.545 1.00 63.33 N ATOM 967 CA ARG A 58 13.970 -0.061 -20.310 1.00 21.23 C ATOM 968 C ARG A 58 14.546 -1.160 -19.422 1.00 31.43 C ATOM 969 O ARG A 58 14.587 -2.328 -19.810 1.00 14.14 O ATOM 970 CB ARG A 58 15.106 0.742 -20.946 1.00 53.14 C ATOM 971 CG ARG A 58 16.044 -0.099 -21.797 1.00 0.43 C ATOM 972 CD ARG A 58 15.473 -0.338 -23.186 1.00 4.31 C ATOM 973 NE ARG A 58 15.590 0.844 -24.036 1.00 61.23 N ATOM 974 CZ ARG A 58 14.931 0.994 -25.180 1.00 2.11 C ATOM 975 NH1 ARG A 58 14.113 0.043 -25.607 1.00 71.43 N ATOM 976 NH2 ARG A 58 15.090 2.098 -25.898 1.00 50.43 N ATOM 0 H ARG A 58 13.387 1.796 -19.529 1.00 63.33 H new ATOM 0 HA ARG A 58 13.378 -0.526 -21.098 1.00 21.23 H new ATOM 0 HB2 ARG A 58 14.679 1.533 -21.563 1.00 53.14 H new ATOM 0 HB3 ARG A 58 15.681 1.228 -20.158 1.00 53.14 H new ATOM 0 HG2 ARG A 58 17.009 0.402 -21.880 1.00 0.43 H new ATOM 0 HG3 ARG A 58 16.223 -1.056 -21.306 1.00 0.43 H new ATOM 0 HD2 ARG A 58 15.994 -1.174 -23.653 1.00 4.31 H new ATOM 0 HD3 ARG A 58 14.424 -0.623 -23.103 1.00 4.31 H new ATOM 0 HE ARG A 58 16.211 1.595 -23.735 1.00 61.23 H new ATOM 0 HH11 ARG A 58 13.988 -0.807 -25.057 1.00 71.43 H new ATOM 0 HH12 ARG A 58 13.608 0.161 -26.486 1.00 71.43 H new ATOM 0 HH21 ARG A 58 15.718 2.832 -25.572 1.00 50.43 H new ATOM 0 HH22 ARG A 58 14.584 2.213 -26.776 1.00 50.43 H new ATOM 990 N SER A 59 14.990 -0.778 -18.229 1.00 23.23 N ATOM 991 CA SER A 59 15.568 -1.730 -17.287 1.00 71.33 C ATOM 992 C SER A 59 14.572 -2.837 -16.953 1.00 53.45 C ATOM 993 O SER A 59 14.953 -3.990 -16.750 1.00 53.51 O ATOM 994 CB SER A 59 16.001 -1.014 -16.006 1.00 75.43 C ATOM 995 OG SER A 59 16.489 -1.936 -15.047 1.00 33.20 O ATOM 0 H SER A 59 14.961 0.184 -17.892 1.00 23.23 H new ATOM 0 HA SER A 59 16.443 -2.181 -17.756 1.00 71.33 H new ATOM 0 HB2 SER A 59 16.775 -0.282 -16.238 1.00 75.43 H new ATOM 0 HB3 SER A 59 15.157 -0.464 -15.590 1.00 75.43 H new ATOM 0 HG SER A 59 16.761 -1.454 -14.238 1.00 33.20 H new ATOM 1001 N ASP A 60 13.294 -2.477 -16.899 1.00 2.31 N ATOM 1002 CA ASP A 60 12.242 -3.438 -16.591 1.00 14.11 C ATOM 1003 C ASP A 60 11.985 -4.362 -17.777 1.00 65.12 C ATOM 1004 O ASP A 60 11.637 -5.530 -17.603 1.00 15.20 O ATOM 1005 CB ASP A 60 10.952 -2.709 -16.208 1.00 63.34 C ATOM 1006 CG ASP A 60 11.122 -1.840 -14.978 1.00 53.21 C ATOM 1007 OD1 ASP A 60 12.044 -2.113 -14.181 1.00 14.43 O ATOM 1008 OD2 ASP A 60 10.333 -0.886 -14.813 1.00 61.00 O ATOM 0 H ASP A 60 12.962 -1.527 -17.065 1.00 2.31 H new ATOM 0 HA ASP A 60 12.573 -4.043 -15.747 1.00 14.11 H new ATOM 0 HB2 ASP A 60 10.626 -2.090 -17.044 1.00 63.34 H new ATOM 0 HB3 ASP A 60 10.165 -3.441 -16.026 1.00 63.34 H new ATOM 1013 N ARG A 61 12.160 -3.831 -18.983 1.00 22.11 N ATOM 1014 CA ARG A 61 11.946 -4.608 -20.198 1.00 52.41 C ATOM 1015 C ARG A 61 13.092 -5.589 -20.426 1.00 1.42 C ATOM 1016 O ARG A 61 12.869 -6.751 -20.760 1.00 73.51 O ATOM 1017 CB ARG A 61 11.809 -3.678 -21.405 1.00 55.03 C ATOM 1018 CG ARG A 61 10.537 -3.905 -22.207 1.00 43.40 C ATOM 1019 CD ARG A 61 10.037 -2.613 -22.835 1.00 20.11 C ATOM 1020 NE ARG A 61 9.032 -2.859 -23.866 1.00 1.13 N ATOM 1021 CZ ARG A 61 7.800 -3.281 -23.605 1.00 12.21 C ATOM 1022 NH1 ARG A 61 7.422 -3.502 -22.353 1.00 42.03 N ATOM 1023 NH2 ARG A 61 6.942 -3.482 -24.597 1.00 41.32 N ATOM 0 H ARG A 61 12.449 -2.866 -19.145 1.00 22.11 H new ATOM 0 HA ARG A 61 11.024 -5.176 -20.078 1.00 52.41 H new ATOM 0 HB2 ARG A 61 11.832 -2.644 -21.061 1.00 55.03 H new ATOM 0 HB3 ARG A 61 12.670 -3.816 -22.059 1.00 55.03 H new ATOM 0 HG2 ARG A 61 10.725 -4.642 -22.988 1.00 43.40 H new ATOM 0 HG3 ARG A 61 9.765 -4.318 -21.558 1.00 43.40 H new ATOM 0 HD2 ARG A 61 9.613 -1.974 -22.061 1.00 20.11 H new ATOM 0 HD3 ARG A 61 10.878 -2.072 -23.270 1.00 20.11 H new ATOM 0 HE ARG A 61 9.290 -2.698 -24.839 1.00 1.13 H new ATOM 0 HH11 ARG A 61 8.078 -3.348 -21.587 1.00 42.03 H new ATOM 0 HH12 ARG A 61 6.475 -3.826 -22.156 1.00 42.03 H new ATOM 0 HH21 ARG A 61 7.228 -3.312 -25.561 1.00 41.32 H new ATOM 0 HH22 ARG A 61 5.996 -3.806 -24.395 1.00 41.32 H new ATOM 1037 N GLU A 62 14.319 -5.110 -20.243 1.00 31.34 N ATOM 1038 CA GLU A 62 15.499 -5.945 -20.430 1.00 25.44 C ATOM 1039 C GLU A 62 15.521 -7.091 -19.421 1.00 41.43 C ATOM 1040 O GLU A 62 15.852 -8.226 -19.762 1.00 73.50 O ATOM 1041 CB GLU A 62 16.772 -5.107 -20.293 1.00 12.55 C ATOM 1042 CG GLU A 62 16.945 -4.484 -18.917 1.00 64.32 C ATOM 1043 CD GLU A 62 18.177 -3.604 -18.826 1.00 71.32 C ATOM 1044 OE1 GLU A 62 18.477 -2.899 -19.812 1.00 14.43 O ATOM 1045 OE2 GLU A 62 18.841 -3.622 -17.768 1.00 53.54 O ATOM 0 H GLU A 62 14.521 -4.149 -19.966 1.00 31.34 H new ATOM 0 HA GLU A 62 15.457 -6.368 -21.434 1.00 25.44 H new ATOM 0 HB2 GLU A 62 17.636 -5.736 -20.509 1.00 12.55 H new ATOM 0 HB3 GLU A 62 16.758 -4.315 -21.042 1.00 12.55 H new ATOM 0 HG2 GLU A 62 16.062 -3.892 -18.676 1.00 64.32 H new ATOM 0 HG3 GLU A 62 17.012 -5.275 -18.170 1.00 64.32 H new ATOM 1052 N VAL A 63 15.167 -6.783 -18.178 1.00 33.04 N ATOM 1053 CA VAL A 63 15.145 -7.785 -17.119 1.00 34.30 C ATOM 1054 C VAL A 63 14.035 -8.805 -17.351 1.00 22.02 C ATOM 1055 O VAL A 63 14.202 -9.994 -17.076 1.00 65.12 O ATOM 1056 CB VAL A 63 14.950 -7.136 -15.736 1.00 34.53 C ATOM 1057 CG1 VAL A 63 16.125 -6.231 -15.400 1.00 55.43 C ATOM 1058 CG2 VAL A 63 13.640 -6.364 -15.690 1.00 10.10 C ATOM 0 H VAL A 63 14.891 -5.847 -17.879 1.00 33.04 H new ATOM 0 HA VAL A 63 16.110 -8.291 -17.142 1.00 34.30 H new ATOM 0 HB VAL A 63 14.906 -7.926 -14.986 1.00 34.53 H new ATOM 0 HG11 VAL A 63 15.969 -5.781 -14.419 1.00 55.43 H new ATOM 0 HG12 VAL A 63 17.044 -6.817 -15.389 1.00 55.43 H new ATOM 0 HG13 VAL A 63 16.205 -5.445 -16.151 1.00 55.43 H new ATOM 0 HG21 VAL A 63 13.518 -5.912 -14.706 1.00 10.10 H new ATOM 0 HG22 VAL A 63 13.652 -5.582 -16.449 1.00 10.10 H new ATOM 0 HG23 VAL A 63 12.810 -7.044 -15.882 1.00 10.10 H new ATOM 1068 N LEU A 64 12.902 -8.333 -17.858 1.00 50.12 N ATOM 1069 CA LEU A 64 11.763 -9.204 -18.128 1.00 42.33 C ATOM 1070 C LEU A 64 12.113 -10.245 -19.187 1.00 53.51 C ATOM 1071 O LEU A 64 11.729 -11.409 -19.078 1.00 32.13 O ATOM 1072 CB LEU A 64 10.561 -8.377 -18.587 1.00 50.40 C ATOM 1073 CG LEU A 64 9.329 -8.425 -17.683 1.00 11.53 C ATOM 1074 CD1 LEU A 64 9.725 -8.214 -16.230 1.00 12.14 C ATOM 1075 CD2 LEU A 64 8.308 -7.382 -18.116 1.00 25.10 C ATOM 0 H LEU A 64 12.747 -7.352 -18.091 1.00 50.12 H new ATOM 0 HA LEU A 64 11.507 -9.724 -17.205 1.00 42.33 H new ATOM 0 HB2 LEU A 64 10.876 -7.338 -18.684 1.00 50.40 H new ATOM 0 HB3 LEU A 64 10.271 -8.716 -19.581 1.00 50.40 H new ATOM 0 HG LEU A 64 8.873 -9.411 -17.775 1.00 11.53 H new ATOM 0 HD11 LEU A 64 8.835 -8.251 -15.601 1.00 12.14 H new ATOM 0 HD12 LEU A 64 10.418 -8.997 -15.924 1.00 12.14 H new ATOM 0 HD13 LEU A 64 10.205 -7.242 -16.121 1.00 12.14 H new ATOM 0 HD21 LEU A 64 7.438 -7.431 -17.461 1.00 25.10 H new ATOM 0 HD22 LEU A 64 8.753 -6.389 -18.054 1.00 25.10 H new ATOM 0 HD23 LEU A 64 8.001 -7.578 -19.143 1.00 25.10 H new ATOM 1087 N ASP A 65 12.844 -9.817 -20.210 1.00 65.22 N ATOM 1088 CA ASP A 65 13.249 -10.713 -21.288 1.00 1.24 C ATOM 1089 C ASP A 65 14.294 -11.711 -20.800 1.00 64.54 C ATOM 1090 O ASP A 65 14.310 -12.865 -21.227 1.00 24.44 O ATOM 1091 CB ASP A 65 13.803 -9.910 -22.466 1.00 32.11 C ATOM 1092 CG ASP A 65 13.088 -10.222 -23.766 1.00 22.40 C ATOM 1093 OD1 ASP A 65 12.942 -11.420 -24.089 1.00 53.52 O ATOM 1094 OD2 ASP A 65 12.676 -9.270 -24.461 1.00 1.34 O ATOM 0 H ASP A 65 13.168 -8.856 -20.316 1.00 65.22 H new ATOM 0 HA ASP A 65 12.370 -11.267 -21.618 1.00 1.24 H new ATOM 0 HB2 ASP A 65 13.712 -8.845 -22.251 1.00 32.11 H new ATOM 0 HB3 ASP A 65 14.866 -10.123 -22.579 1.00 32.11 H new ATOM 1099 N ASN A 66 15.166 -11.258 -19.906 1.00 24.44 N ATOM 1100 CA ASN A 66 16.217 -12.112 -19.362 1.00 15.14 C ATOM 1101 C ASN A 66 15.640 -13.119 -18.371 1.00 3.23 C ATOM 1102 O ASN A 66 15.978 -14.302 -18.405 1.00 44.13 O ATOM 1103 CB ASN A 66 17.289 -11.263 -18.677 1.00 44.42 C ATOM 1104 CG ASN A 66 18.518 -12.071 -18.309 1.00 5.25 C ATOM 1105 OD1 ASN A 66 19.506 -12.090 -19.043 1.00 51.05 O ATOM 1106 ND2 ASN A 66 18.463 -12.744 -17.165 1.00 12.51 N ATOM 0 H ASN A 66 15.166 -10.305 -19.542 1.00 24.44 H new ATOM 0 HA ASN A 66 16.670 -12.660 -20.188 1.00 15.14 H new ATOM 0 HB2 ASN A 66 17.579 -10.446 -19.338 1.00 44.42 H new ATOM 0 HB3 ASN A 66 16.871 -10.812 -17.777 1.00 44.42 H new ATOM 0 HD21 ASN A 66 19.260 -13.305 -16.864 1.00 12.51 H new ATOM 0 HD22 ASN A 66 17.624 -12.700 -16.587 1.00 12.51 H new ATOM 1113 N TRP A 67 14.769 -12.641 -17.490 1.00 1.23 N ATOM 1114 CA TRP A 67 14.145 -13.499 -16.489 1.00 61.32 C ATOM 1115 C TRP A 67 13.327 -14.602 -17.152 1.00 21.10 C ATOM 1116 O TRP A 67 13.349 -15.752 -16.714 1.00 21.42 O ATOM 1117 CB TRP A 67 13.253 -12.672 -15.563 1.00 14.04 C ATOM 1118 CG TRP A 67 14.012 -11.966 -14.480 1.00 63.44 C ATOM 1119 CD1 TRP A 67 15.090 -12.444 -13.790 1.00 53.13 C ATOM 1120 CD2 TRP A 67 13.750 -10.657 -13.963 1.00 63.23 C ATOM 1121 NE1 TRP A 67 15.513 -11.510 -12.875 1.00 63.43 N ATOM 1122 CE2 TRP A 67 14.709 -10.405 -12.962 1.00 72.23 C ATOM 1123 CE3 TRP A 67 12.801 -9.673 -14.250 1.00 1.41 C ATOM 1124 CZ2 TRP A 67 14.742 -9.211 -12.248 1.00 42.50 C ATOM 1125 CZ3 TRP A 67 12.835 -8.488 -13.540 1.00 4.41 C ATOM 1126 CH2 TRP A 67 13.801 -8.264 -12.549 1.00 72.22 C ATOM 0 H TRP A 67 14.479 -11.664 -17.448 1.00 1.23 H new ATOM 0 HA TRP A 67 14.936 -13.963 -15.900 1.00 61.32 H new ATOM 0 HB2 TRP A 67 12.710 -11.935 -16.156 1.00 14.04 H new ATOM 0 HB3 TRP A 67 12.509 -13.326 -15.108 1.00 14.04 H new ATOM 0 HD1 TRP A 67 15.543 -13.413 -13.941 1.00 53.13 H new ATOM 0 HE1 TRP A 67 16.299 -11.622 -12.235 1.00 63.43 H new ATOM 0 HE3 TRP A 67 12.054 -9.835 -15.013 1.00 1.41 H new ATOM 0 HZ2 TRP A 67 15.484 -9.038 -11.483 1.00 42.50 H new ATOM 0 HZ3 TRP A 67 12.105 -7.721 -13.752 1.00 4.41 H new ATOM 0 HH2 TRP A 67 13.803 -7.326 -12.013 1.00 72.22 H new ATOM 1137 N ARG A 68 12.607 -14.244 -18.210 1.00 33.22 N ATOM 1138 CA ARG A 68 11.781 -15.204 -18.932 1.00 72.31 C ATOM 1139 C ARG A 68 12.642 -16.123 -19.793 1.00 64.31 C ATOM 1140 O ARG A 68 12.225 -17.224 -20.152 1.00 2.13 O ATOM 1141 CB ARG A 68 10.761 -14.475 -19.809 1.00 2.44 C ATOM 1142 CG ARG A 68 9.439 -14.205 -19.109 1.00 72.52 C ATOM 1143 CD ARG A 68 9.643 -13.458 -17.800 1.00 73.54 C ATOM 1144 NE ARG A 68 8.588 -12.477 -17.560 1.00 60.23 N ATOM 1145 CZ ARG A 68 7.348 -12.802 -17.212 1.00 11.41 C ATOM 1146 NH1 ARG A 68 7.009 -14.075 -17.063 1.00 50.24 N ATOM 1147 NH2 ARG A 68 6.444 -11.851 -17.011 1.00 32.42 N ATOM 0 H ARG A 68 12.579 -13.296 -18.586 1.00 33.22 H new ATOM 0 HA ARG A 68 11.251 -15.812 -18.199 1.00 72.31 H new ATOM 0 HB2 ARG A 68 11.188 -13.528 -20.138 1.00 2.44 H new ATOM 0 HB3 ARG A 68 10.574 -15.068 -20.704 1.00 2.44 H new ATOM 0 HG2 ARG A 68 8.792 -13.622 -19.764 1.00 72.52 H new ATOM 0 HG3 ARG A 68 8.930 -15.149 -18.915 1.00 72.52 H new ATOM 0 HD2 ARG A 68 9.669 -14.171 -16.976 1.00 73.54 H new ATOM 0 HD3 ARG A 68 10.609 -12.954 -17.817 1.00 73.54 H new ATOM 0 HE ARG A 68 8.816 -11.488 -17.665 1.00 60.23 H new ATOM 0 HH11 ARG A 68 7.701 -14.808 -17.216 1.00 50.24 H new ATOM 0 HH12 ARG A 68 6.056 -14.321 -16.796 1.00 50.24 H new ATOM 0 HH21 ARG A 68 6.702 -10.871 -17.124 1.00 32.42 H new ATOM 0 HH22 ARG A 68 5.492 -12.101 -16.744 1.00 32.42 H new ATOM 1161 N GLU A 69 13.846 -15.662 -20.121 1.00 35.52 N ATOM 1162 CA GLU A 69 14.764 -16.443 -20.941 1.00 25.12 C ATOM 1163 C GLU A 69 15.371 -17.590 -20.137 1.00 3.51 C ATOM 1164 O GLU A 69 15.513 -18.707 -20.636 1.00 54.44 O ATOM 1165 CB GLU A 69 15.876 -15.548 -21.493 1.00 22.50 C ATOM 1166 CG GLU A 69 17.026 -16.321 -22.118 1.00 35.32 C ATOM 1167 CD GLU A 69 16.578 -17.206 -23.265 1.00 61.11 C ATOM 1168 OE1 GLU A 69 15.768 -16.739 -24.093 1.00 13.33 O ATOM 1169 OE2 GLU A 69 17.037 -18.365 -23.336 1.00 5.05 O ATOM 0 H GLU A 69 14.207 -14.753 -19.832 1.00 35.52 H new ATOM 0 HA GLU A 69 14.199 -16.865 -21.773 1.00 25.12 H new ATOM 0 HB2 GLU A 69 15.453 -14.876 -22.240 1.00 22.50 H new ATOM 0 HB3 GLU A 69 16.264 -14.925 -20.687 1.00 22.50 H new ATOM 0 HG2 GLU A 69 17.778 -15.619 -22.478 1.00 35.32 H new ATOM 0 HG3 GLU A 69 17.503 -16.936 -21.355 1.00 35.32 H new ATOM 1176 N LEU A 70 15.729 -17.305 -18.890 1.00 32.04 N ATOM 1177 CA LEU A 70 16.321 -18.311 -18.015 1.00 62.31 C ATOM 1178 C LEU A 70 15.258 -19.272 -17.492 1.00 2.34 C ATOM 1179 O LEU A 70 15.513 -20.464 -17.327 1.00 70.24 O ATOM 1180 CB LEU A 70 17.038 -17.638 -16.843 1.00 65.54 C ATOM 1181 CG LEU A 70 16.244 -16.566 -16.097 1.00 24.13 C ATOM 1182 CD1 LEU A 70 15.410 -17.193 -14.990 1.00 63.13 C ATOM 1183 CD2 LEU A 70 17.180 -15.509 -15.528 1.00 54.12 C ATOM 0 H LEU A 70 15.620 -16.386 -18.462 1.00 32.04 H new ATOM 0 HA LEU A 70 17.045 -18.882 -18.597 1.00 62.31 H new ATOM 0 HB2 LEU A 70 17.328 -18.409 -16.129 1.00 65.54 H new ATOM 0 HB3 LEU A 70 17.957 -17.187 -17.216 1.00 65.54 H new ATOM 0 HG LEU A 70 15.569 -16.083 -16.804 1.00 24.13 H new ATOM 0 HD11 LEU A 70 14.852 -16.415 -14.470 1.00 63.13 H new ATOM 0 HD12 LEU A 70 14.714 -17.912 -15.422 1.00 63.13 H new ATOM 0 HD13 LEU A 70 16.066 -17.702 -14.284 1.00 63.13 H new ATOM 0 HD21 LEU A 70 16.598 -14.754 -15.000 1.00 54.12 H new ATOM 0 HD22 LEU A 70 17.880 -15.977 -14.836 1.00 54.12 H new ATOM 0 HD23 LEU A 70 17.734 -15.038 -16.340 1.00 54.12 H new ATOM 1195 N GLU A 71 14.066 -18.743 -17.234 1.00 31.24 N ATOM 1196 CA GLU A 71 12.964 -19.555 -16.730 1.00 41.11 C ATOM 1197 C GLU A 71 12.436 -20.489 -17.815 1.00 42.24 C ATOM 1198 O GLU A 71 11.886 -21.550 -17.522 1.00 12.30 O ATOM 1199 CB GLU A 71 11.834 -18.659 -16.219 1.00 32.34 C ATOM 1200 CG GLU A 71 10.849 -18.245 -17.299 1.00 43.21 C ATOM 1201 CD GLU A 71 9.810 -17.262 -16.795 1.00 72.34 C ATOM 1202 OE1 GLU A 71 10.190 -16.308 -16.086 1.00 14.31 O ATOM 1203 OE2 GLU A 71 8.616 -17.449 -17.112 1.00 10.34 O ATOM 0 H GLU A 71 13.839 -17.757 -17.365 1.00 31.24 H new ATOM 0 HA GLU A 71 13.340 -20.160 -15.905 1.00 41.11 H new ATOM 0 HB2 GLU A 71 11.295 -19.183 -15.429 1.00 32.34 H new ATOM 0 HB3 GLU A 71 12.266 -17.764 -15.771 1.00 32.34 H new ATOM 0 HG2 GLU A 71 11.394 -17.798 -18.130 1.00 43.21 H new ATOM 0 HG3 GLU A 71 10.347 -19.131 -17.687 1.00 43.21 H new ATOM 1210 N MET A 72 12.608 -20.085 -19.070 1.00 20.41 N ATOM 1211 CA MET A 72 12.150 -20.886 -20.199 1.00 73.03 C ATOM 1212 C MET A 72 13.233 -21.860 -20.650 1.00 62.43 C ATOM 1213 O MET A 72 12.938 -22.926 -21.191 1.00 62.32 O ATOM 1214 CB MET A 72 11.746 -19.980 -21.364 1.00 13.22 C ATOM 1215 CG MET A 72 12.929 -19.372 -22.100 1.00 32.12 C ATOM 1216 SD MET A 72 12.442 -18.515 -23.609 1.00 53.24 S ATOM 1217 CE MET A 72 12.249 -19.895 -24.735 1.00 52.41 C ATOM 0 H MET A 72 13.061 -19.209 -19.330 1.00 20.41 H new ATOM 0 HA MET A 72 11.282 -21.460 -19.876 1.00 73.03 H new ATOM 0 HB2 MET A 72 11.146 -20.555 -22.070 1.00 13.22 H new ATOM 0 HB3 MET A 72 11.112 -19.178 -20.987 1.00 13.22 H new ATOM 0 HG2 MET A 72 13.443 -18.673 -21.440 1.00 32.12 H new ATOM 0 HG3 MET A 72 13.641 -20.159 -22.348 1.00 32.12 H new ATOM 0 HE1 MET A 72 12.983 -19.816 -25.537 1.00 52.41 H new ATOM 0 HE2 MET A 72 12.402 -20.829 -24.195 1.00 52.41 H new ATOM 0 HE3 MET A 72 11.245 -19.881 -25.159 1.00 52.41 H new ATOM 1227 N LYS A 73 14.489 -21.488 -20.425 1.00 34.03 N ATOM 1228 CA LYS A 73 15.617 -22.329 -20.807 1.00 11.15 C ATOM 1229 C LYS A 73 15.869 -23.409 -19.760 1.00 22.23 C ATOM 1230 O LYS A 73 16.618 -24.356 -19.999 1.00 41.22 O ATOM 1231 CB LYS A 73 16.875 -21.477 -20.989 1.00 62.23 C ATOM 1232 CG LYS A 73 17.640 -21.236 -19.699 1.00 75.40 C ATOM 1233 CD LYS A 73 18.800 -20.278 -19.909 1.00 30.22 C ATOM 1234 CE LYS A 73 19.914 -20.921 -20.721 1.00 54.03 C ATOM 1235 NZ LYS A 73 20.666 -21.932 -19.928 1.00 71.44 N ATOM 0 H LYS A 73 14.751 -20.609 -19.980 1.00 34.03 H new ATOM 0 HA LYS A 73 15.374 -22.814 -21.752 1.00 11.15 H new ATOM 0 HB2 LYS A 73 17.534 -21.966 -21.706 1.00 62.23 H new ATOM 0 HB3 LYS A 73 16.593 -20.516 -21.419 1.00 62.23 H new ATOM 0 HG2 LYS A 73 16.965 -20.831 -18.945 1.00 75.40 H new ATOM 0 HG3 LYS A 73 18.015 -22.185 -19.315 1.00 75.40 H new ATOM 0 HD2 LYS A 73 18.446 -19.383 -20.420 1.00 30.22 H new ATOM 0 HD3 LYS A 73 19.190 -19.960 -18.942 1.00 30.22 H new ATOM 0 HE2 LYS A 73 19.491 -21.396 -21.606 1.00 54.03 H new ATOM 0 HE3 LYS A 73 20.600 -20.150 -21.070 1.00 54.03 H new ATOM 0 HZ1 LYS A 73 21.683 -21.719 -19.969 1.00 71.44 H new ATOM 0 HZ2 LYS A 73 20.346 -21.905 -18.939 1.00 71.44 H new ATOM 0 HZ3 LYS A 73 20.495 -22.879 -20.321 1.00 71.44 H new ATOM 1249 N ALA A 74 15.238 -23.261 -18.599 1.00 61.55 N ATOM 1250 CA ALA A 74 15.392 -24.227 -17.518 1.00 12.40 C ATOM 1251 C ALA A 74 14.663 -25.528 -17.836 1.00 13.35 C ATOM 1252 O ALA A 74 14.664 -26.463 -17.035 1.00 3.45 O ATOM 1253 CB ALA A 74 14.882 -23.639 -16.210 1.00 61.32 C ATOM 0 H ALA A 74 14.616 -22.482 -18.383 1.00 61.55 H new ATOM 0 HA ALA A 74 16.453 -24.453 -17.413 1.00 12.40 H new ATOM 0 HB1 ALA A 74 15.003 -24.370 -15.411 1.00 61.32 H new ATOM 0 HB2 ALA A 74 15.450 -22.741 -15.969 1.00 61.32 H new ATOM 0 HB3 ALA A 74 13.827 -23.384 -16.312 1.00 61.32 H new ATOM 1259 N ARG A 75 14.040 -25.581 -19.008 1.00 52.54 N ATOM 1260 CA ARG A 75 13.305 -26.767 -19.430 1.00 51.24 C ATOM 1261 C ARG A 75 12.466 -27.323 -18.284 1.00 31.13 C ATOM 1262 O ARG A 75 12.351 -28.537 -18.116 1.00 21.40 O ATOM 1263 CB ARG A 75 14.272 -27.839 -19.936 1.00 10.02 C ATOM 1264 CG ARG A 75 15.186 -28.393 -18.855 1.00 34.31 C ATOM 1265 CD ARG A 75 15.829 -29.702 -19.286 1.00 73.04 C ATOM 1266 NE ARG A 75 16.243 -30.511 -18.143 1.00 61.24 N ATOM 1267 CZ ARG A 75 16.966 -31.620 -18.252 1.00 30.43 C ATOM 1268 NH1 ARG A 75 17.353 -32.050 -19.445 1.00 11.40 N ATOM 1269 NH2 ARG A 75 17.304 -32.302 -17.165 1.00 32.33 N ATOM 0 H ARG A 75 14.029 -24.816 -19.683 1.00 52.54 H new ATOM 0 HA ARG A 75 12.636 -26.480 -20.241 1.00 51.24 H new ATOM 0 HB2 ARG A 75 13.699 -28.658 -20.370 1.00 10.02 H new ATOM 0 HB3 ARG A 75 14.882 -27.418 -20.735 1.00 10.02 H new ATOM 0 HG2 ARG A 75 15.962 -27.664 -18.625 1.00 34.31 H new ATOM 0 HG3 ARG A 75 14.615 -28.551 -17.940 1.00 34.31 H new ATOM 0 HD2 ARG A 75 15.125 -30.269 -19.895 1.00 73.04 H new ATOM 0 HD3 ARG A 75 16.695 -29.491 -19.913 1.00 73.04 H new ATOM 0 HE ARG A 75 15.962 -30.208 -17.210 1.00 61.24 H new ATOM 0 HH11 ARG A 75 17.096 -31.529 -20.283 1.00 11.40 H new ATOM 0 HH12 ARG A 75 17.908 -32.902 -19.525 1.00 11.40 H new ATOM 0 HH21 ARG A 75 17.009 -31.975 -16.245 1.00 32.33 H new ATOM 0 HH22 ARG A 75 17.859 -33.154 -17.249 1.00 32.33 H new ATOM 1283 N LYS A 76 11.881 -26.427 -17.496 1.00 44.31 N ATOM 1284 CA LYS A 76 11.052 -26.826 -16.365 1.00 61.13 C ATOM 1285 C LYS A 76 10.173 -25.670 -15.900 1.00 3.43 C ATOM 1286 O LYS A 76 10.674 -24.614 -15.513 1.00 44.41 O ATOM 1287 CB LYS A 76 11.930 -27.311 -15.209 1.00 74.42 C ATOM 1288 CG LYS A 76 11.360 -28.513 -14.476 1.00 73.52 C ATOM 1289 CD LYS A 76 11.381 -29.759 -15.346 1.00 41.14 C ATOM 1290 CE LYS A 76 11.127 -31.015 -14.528 1.00 30.33 C ATOM 1291 NZ LYS A 76 10.541 -32.107 -15.354 1.00 51.21 N ATOM 0 H LYS A 76 11.966 -25.418 -17.620 1.00 44.31 H new ATOM 0 HA LYS A 76 10.406 -27.642 -16.690 1.00 61.13 H new ATOM 0 HB2 LYS A 76 12.917 -27.566 -15.595 1.00 74.42 H new ATOM 0 HB3 LYS A 76 12.066 -26.495 -14.500 1.00 74.42 H new ATOM 0 HG2 LYS A 76 11.935 -28.693 -13.568 1.00 73.52 H new ATOM 0 HG3 LYS A 76 10.336 -28.300 -14.168 1.00 73.52 H new ATOM 0 HD2 LYS A 76 10.624 -29.672 -16.126 1.00 41.14 H new ATOM 0 HD3 LYS A 76 12.346 -29.838 -15.846 1.00 41.14 H new ATOM 0 HE2 LYS A 76 12.063 -31.356 -14.087 1.00 30.33 H new ATOM 0 HE3 LYS A 76 10.453 -30.781 -13.704 1.00 30.33 H new ATOM 0 HZ1 LYS A 76 10.383 -32.945 -14.759 1.00 51.21 H new ATOM 0 HZ2 LYS A 76 9.635 -31.791 -15.755 1.00 51.21 H new ATOM 0 HZ3 LYS A 76 11.195 -32.348 -16.125 1.00 51.21 H new ATOM 1305 N ARG A 77 8.861 -25.877 -15.938 1.00 41.31 N ATOM 1306 CA ARG A 77 7.913 -24.851 -15.520 1.00 22.03 C ATOM 1307 C ARG A 77 7.844 -24.763 -13.998 1.00 5.41 C ATOM 1308 O ARG A 77 7.054 -25.459 -13.360 1.00 31.11 O ATOM 1309 CB ARG A 77 6.524 -25.148 -16.087 1.00 61.32 C ATOM 1310 CG ARG A 77 6.485 -25.201 -17.606 1.00 0.02 C ATOM 1311 CD ARG A 77 5.290 -25.998 -18.105 1.00 12.30 C ATOM 1312 NE ARG A 77 5.562 -27.432 -18.134 1.00 70.33 N ATOM 1313 CZ ARG A 77 6.335 -28.015 -19.044 1.00 32.20 C ATOM 1314 NH1 ARG A 77 6.909 -27.290 -19.994 1.00 3.14 N ATOM 1315 NH2 ARG A 77 6.535 -29.326 -19.004 1.00 73.45 N ATOM 0 H ARG A 77 8.430 -26.746 -16.254 1.00 41.31 H new ATOM 0 HA ARG A 77 8.259 -23.893 -15.908 1.00 22.03 H new ATOM 0 HB2 ARG A 77 6.175 -26.101 -15.689 1.00 61.32 H new ATOM 0 HB3 ARG A 77 5.828 -24.384 -15.740 1.00 61.32 H new ATOM 0 HG2 ARG A 77 6.440 -24.188 -18.005 1.00 0.02 H new ATOM 0 HG3 ARG A 77 7.405 -25.651 -17.979 1.00 0.02 H new ATOM 0 HD2 ARG A 77 4.431 -25.805 -17.462 1.00 12.30 H new ATOM 0 HD3 ARG A 77 5.021 -25.660 -19.106 1.00 12.30 H new ATOM 0 HE ARG A 77 5.135 -28.018 -17.417 1.00 70.33 H new ATOM 0 HH11 ARG A 77 6.758 -26.282 -20.028 1.00 3.14 H new ATOM 0 HH12 ARG A 77 7.502 -27.740 -20.691 1.00 3.14 H new ATOM 0 HH21 ARG A 77 6.095 -29.887 -18.274 1.00 73.45 H new ATOM 0 HH22 ARG A 77 7.128 -29.773 -19.703 1.00 73.45 H new ATOM 1329 N LEU A 78 8.677 -23.903 -13.422 1.00 45.44 N ATOM 1330 CA LEU A 78 8.712 -23.723 -11.975 1.00 41.11 C ATOM 1331 C LEU A 78 7.348 -23.292 -11.447 1.00 54.31 C ATOM 1332 O LEU A 78 6.504 -22.779 -12.183 1.00 34.33 O ATOM 1333 CB LEU A 78 9.770 -22.685 -11.595 1.00 72.14 C ATOM 1334 CG LEU A 78 11.188 -23.217 -11.387 1.00 60.42 C ATOM 1335 CD1 LEU A 78 11.460 -24.389 -12.318 1.00 24.13 C ATOM 1336 CD2 LEU A 78 12.210 -22.111 -11.606 1.00 22.51 C ATOM 0 H LEU A 78 9.337 -23.319 -13.935 1.00 45.44 H new ATOM 0 HA LEU A 78 8.971 -24.679 -11.521 1.00 41.11 H new ATOM 0 HB2 LEU A 78 9.800 -21.924 -12.375 1.00 72.14 H new ATOM 0 HB3 LEU A 78 9.451 -22.190 -10.678 1.00 72.14 H new ATOM 0 HG LEU A 78 11.277 -23.568 -10.359 1.00 60.42 H new ATOM 0 HD11 LEU A 78 12.474 -24.755 -12.156 1.00 24.13 H new ATOM 0 HD12 LEU A 78 10.749 -25.189 -12.113 1.00 24.13 H new ATOM 0 HD13 LEU A 78 11.353 -24.064 -13.353 1.00 24.13 H new ATOM 0 HD21 LEU A 78 13.214 -22.508 -11.454 1.00 22.51 H new ATOM 0 HD22 LEU A 78 12.121 -21.730 -12.623 1.00 22.51 H new ATOM 0 HD23 LEU A 78 12.028 -21.302 -10.898 1.00 22.51 H new ATOM 1348 N PRO A 79 7.125 -23.501 -10.141 1.00 71.01 N ATOM 1349 CA PRO A 79 5.865 -23.139 -9.485 1.00 3.42 C ATOM 1350 C PRO A 79 5.683 -21.629 -9.374 1.00 52.31 C ATOM 1351 O PRO A 79 4.634 -21.091 -9.731 1.00 35.45 O ATOM 1352 CB PRO A 79 5.997 -23.765 -8.094 1.00 50.41 C ATOM 1353 CG PRO A 79 7.465 -23.857 -7.858 1.00 30.50 C ATOM 1354 CD PRO A 79 8.086 -24.107 -9.204 1.00 60.25 C ATOM 0 HA PRO A 79 4.998 -23.490 -10.045 1.00 3.42 H new ATOM 0 HB2 PRO A 79 5.512 -23.150 -7.336 1.00 50.41 H new ATOM 0 HB3 PRO A 79 5.528 -24.748 -8.056 1.00 50.41 H new ATOM 0 HG2 PRO A 79 7.848 -22.937 -7.417 1.00 30.50 H new ATOM 0 HG3 PRO A 79 7.699 -24.665 -7.164 1.00 30.50 H new ATOM 0 HD2 PRO A 79 9.071 -23.646 -9.284 1.00 60.25 H new ATOM 0 HD3 PRO A 79 8.216 -25.172 -9.395 1.00 60.25 H new ATOM 1362 N THR A 80 6.711 -20.948 -8.878 1.00 2.40 N ATOM 1363 CA THR A 80 6.664 -19.500 -8.720 1.00 11.42 C ATOM 1364 C THR A 80 7.306 -18.795 -9.910 1.00 34.23 C ATOM 1365 O THR A 80 7.988 -19.421 -10.722 1.00 21.25 O ATOM 1366 CB THR A 80 7.374 -19.052 -7.428 1.00 64.04 C ATOM 1367 OG1 THR A 80 7.183 -17.647 -7.226 1.00 23.42 O ATOM 1368 CG2 THR A 80 8.862 -19.362 -7.494 1.00 62.40 C ATOM 0 H THR A 80 7.587 -21.376 -8.579 1.00 2.40 H new ATOM 0 HA THR A 80 5.611 -19.223 -8.662 1.00 11.42 H new ATOM 0 HB THR A 80 6.941 -19.601 -6.592 1.00 64.04 H new ATOM 0 HG1 THR A 80 7.869 -17.308 -6.613 1.00 23.42 H new ATOM 0 HG21 THR A 80 9.343 -19.037 -6.571 1.00 62.40 H new ATOM 0 HG22 THR A 80 9.005 -20.435 -7.619 1.00 62.40 H new ATOM 0 HG23 THR A 80 9.306 -18.836 -8.339 1.00 62.40 H new ATOM 1376 N THR A 81 7.084 -17.488 -10.008 1.00 75.11 N ATOM 1377 CA THR A 81 7.640 -16.698 -11.099 1.00 71.44 C ATOM 1378 C THR A 81 8.537 -15.585 -10.571 1.00 30.13 C ATOM 1379 O THR A 81 9.340 -15.016 -11.311 1.00 61.34 O ATOM 1380 CB THR A 81 6.529 -16.078 -11.967 1.00 73.24 C ATOM 1381 OG1 THR A 81 5.642 -17.102 -12.432 1.00 54.42 O ATOM 1382 CG2 THR A 81 7.121 -15.336 -13.155 1.00 42.54 C ATOM 0 H THR A 81 6.523 -16.954 -9.344 1.00 75.11 H new ATOM 0 HA THR A 81 8.232 -17.378 -11.711 1.00 71.44 H new ATOM 0 HB THR A 81 5.974 -15.367 -11.355 1.00 73.24 H new ATOM 0 HG1 THR A 81 4.937 -16.700 -12.982 1.00 54.42 H new ATOM 0 HG21 THR A 81 6.317 -14.907 -13.753 1.00 42.54 H new ATOM 0 HG22 THR A 81 7.773 -14.539 -12.798 1.00 42.54 H new ATOM 0 HG23 THR A 81 7.698 -16.030 -13.767 1.00 42.54 H new ATOM 1390 N LEU A 82 8.397 -15.279 -9.286 1.00 15.42 N ATOM 1391 CA LEU A 82 9.196 -14.233 -8.657 1.00 13.31 C ATOM 1392 C LEU A 82 10.512 -14.796 -8.130 1.00 13.41 C ATOM 1393 O LEU A 82 10.685 -14.973 -6.924 1.00 14.12 O ATOM 1394 CB LEU A 82 8.413 -13.582 -7.515 1.00 55.03 C ATOM 1395 CG LEU A 82 7.630 -12.318 -7.873 1.00 71.12 C ATOM 1396 CD1 LEU A 82 6.718 -11.912 -6.726 1.00 21.02 C ATOM 1397 CD2 LEU A 82 8.581 -11.184 -8.228 1.00 20.41 C ATOM 0 H LEU A 82 7.738 -15.740 -8.659 1.00 15.42 H new ATOM 0 HA LEU A 82 9.421 -13.479 -9.411 1.00 13.31 H new ATOM 0 HB2 LEU A 82 7.714 -14.317 -7.115 1.00 55.03 H new ATOM 0 HB3 LEU A 82 9.112 -13.338 -6.715 1.00 55.03 H new ATOM 0 HG LEU A 82 7.011 -12.532 -8.744 1.00 71.12 H new ATOM 0 HD11 LEU A 82 6.169 -11.011 -6.999 1.00 21.02 H new ATOM 0 HD12 LEU A 82 6.013 -12.717 -6.519 1.00 21.02 H new ATOM 0 HD13 LEU A 82 7.317 -11.716 -5.837 1.00 21.02 H new ATOM 0 HD21 LEU A 82 8.006 -10.293 -8.480 1.00 20.41 H new ATOM 0 HD22 LEU A 82 9.227 -10.971 -7.376 1.00 20.41 H new ATOM 0 HD23 LEU A 82 9.192 -11.475 -9.082 1.00 20.41 H new ATOM 1409 N PHE A 83 11.438 -15.073 -9.042 1.00 10.15 N ATOM 1410 CA PHE A 83 12.740 -15.614 -8.669 1.00 34.53 C ATOM 1411 C PHE A 83 13.852 -14.972 -9.492 1.00 1.00 C ATOM 1412 O PHE A 83 13.612 -14.043 -10.263 1.00 74.04 O ATOM 1413 CB PHE A 83 12.758 -17.132 -8.862 1.00 24.23 C ATOM 1414 CG PHE A 83 12.171 -17.577 -10.170 1.00 75.42 C ATOM 1415 CD1 PHE A 83 12.480 -16.913 -11.346 1.00 13.53 C ATOM 1416 CD2 PHE A 83 11.308 -18.661 -10.224 1.00 42.45 C ATOM 1417 CE1 PHE A 83 11.941 -17.320 -12.552 1.00 12.24 C ATOM 1418 CE2 PHE A 83 10.767 -19.073 -11.427 1.00 54.34 C ATOM 1419 CZ PHE A 83 11.082 -18.401 -12.592 1.00 42.21 C ATOM 0 H PHE A 83 11.311 -14.932 -10.044 1.00 10.15 H new ATOM 0 HA PHE A 83 12.913 -15.386 -7.617 1.00 34.53 H new ATOM 0 HB2 PHE A 83 13.787 -17.486 -8.795 1.00 24.23 H new ATOM 0 HB3 PHE A 83 12.206 -17.600 -8.047 1.00 24.23 H new ATOM 0 HD1 PHE A 83 13.150 -16.067 -11.320 1.00 13.53 H new ATOM 0 HD2 PHE A 83 11.056 -19.189 -9.316 1.00 42.45 H new ATOM 0 HE1 PHE A 83 12.191 -16.794 -13.461 1.00 12.24 H new ATOM 0 HE2 PHE A 83 10.098 -19.920 -11.456 1.00 54.34 H new ATOM 0 HZ PHE A 83 10.657 -18.720 -13.532 1.00 42.21 H new ATOM 1429 N PHE A 84 15.071 -15.473 -9.322 1.00 30.34 N ATOM 1430 CA PHE A 84 16.222 -14.948 -10.047 1.00 31.10 C ATOM 1431 C PHE A 84 17.329 -15.994 -10.140 1.00 42.35 C ATOM 1432 O PHE A 84 17.328 -16.981 -9.405 1.00 25.31 O ATOM 1433 CB PHE A 84 16.752 -13.687 -9.361 1.00 20.41 C ATOM 1434 CG PHE A 84 17.456 -13.962 -8.063 1.00 22.30 C ATOM 1435 CD1 PHE A 84 18.674 -14.624 -8.047 1.00 13.43 C ATOM 1436 CD2 PHE A 84 16.901 -13.559 -6.859 1.00 40.03 C ATOM 1437 CE1 PHE A 84 19.323 -14.878 -6.854 1.00 22.53 C ATOM 1438 CE2 PHE A 84 17.546 -13.811 -5.663 1.00 42.31 C ATOM 1439 CZ PHE A 84 18.759 -14.470 -5.661 1.00 25.54 C ATOM 0 H PHE A 84 15.287 -16.242 -8.688 1.00 30.34 H new ATOM 0 HA PHE A 84 15.899 -14.695 -11.057 1.00 31.10 H new ATOM 0 HB2 PHE A 84 17.439 -13.177 -10.037 1.00 20.41 H new ATOM 0 HB3 PHE A 84 15.921 -13.006 -9.177 1.00 20.41 H new ATOM 0 HD1 PHE A 84 19.120 -14.945 -8.977 1.00 13.43 H new ATOM 0 HD2 PHE A 84 15.953 -13.042 -6.855 1.00 40.03 H new ATOM 0 HE1 PHE A 84 20.271 -15.395 -6.854 1.00 22.53 H new ATOM 0 HE2 PHE A 84 17.102 -13.493 -4.731 1.00 42.31 H new ATOM 0 HZ PHE A 84 19.266 -14.666 -4.728 1.00 25.54 H new ATOM 1449 N ILE A 85 18.271 -15.769 -11.050 1.00 63.21 N ATOM 1450 CA ILE A 85 19.385 -16.691 -11.240 1.00 15.12 C ATOM 1451 C ILE A 85 20.647 -16.176 -10.557 1.00 31.24 C ATOM 1452 O ILE A 85 20.910 -14.974 -10.542 1.00 33.23 O ATOM 1453 CB ILE A 85 19.679 -16.918 -12.734 1.00 42.33 C ATOM 1454 CG1 ILE A 85 20.128 -15.611 -13.392 1.00 24.20 C ATOM 1455 CG2 ILE A 85 18.451 -17.476 -13.438 1.00 21.14 C ATOM 1456 CD1 ILE A 85 20.605 -15.785 -14.817 1.00 51.21 C ATOM 0 H ILE A 85 18.285 -14.957 -11.667 1.00 63.21 H new ATOM 0 HA ILE A 85 19.091 -17.638 -10.788 1.00 15.12 H new ATOM 0 HB ILE A 85 20.486 -17.645 -12.823 1.00 42.33 H new ATOM 0 HG12 ILE A 85 19.299 -14.903 -13.379 1.00 24.20 H new ATOM 0 HG13 ILE A 85 20.931 -15.172 -12.800 1.00 24.20 H new ATOM 0 HG21 ILE A 85 18.676 -17.631 -14.493 1.00 21.14 H new ATOM 0 HG22 ILE A 85 18.171 -18.426 -12.983 1.00 21.14 H new ATOM 0 HG23 ILE A 85 17.625 -16.771 -13.342 1.00 21.14 H new ATOM 0 HD11 ILE A 85 20.907 -14.818 -15.220 1.00 51.21 H new ATOM 0 HD12 ILE A 85 21.455 -16.468 -14.836 1.00 51.21 H new ATOM 0 HD13 ILE A 85 19.797 -16.194 -15.424 1.00 51.21 H new ATOM 1468 N GLU A 86 21.425 -17.095 -9.994 1.00 23.23 N ATOM 1469 CA GLU A 86 22.661 -16.733 -9.310 1.00 23.43 C ATOM 1470 C GLU A 86 23.592 -15.961 -10.240 1.00 50.02 C ATOM 1471 O GLU A 86 24.420 -15.167 -9.791 1.00 74.14 O ATOM 1472 CB GLU A 86 23.368 -17.987 -8.789 1.00 51.21 C ATOM 1473 CG GLU A 86 24.615 -17.688 -7.975 1.00 23.25 C ATOM 1474 CD GLU A 86 24.593 -18.349 -6.610 1.00 60.30 C ATOM 1475 OE1 GLU A 86 23.701 -18.013 -5.803 1.00 70.11 O ATOM 1476 OE2 GLU A 86 25.467 -19.202 -6.349 1.00 0.01 O ATOM 0 H GLU A 86 21.222 -18.095 -9.998 1.00 23.23 H new ATOM 0 HA GLU A 86 22.405 -16.092 -8.467 1.00 23.43 H new ATOM 0 HB2 GLU A 86 22.672 -18.558 -8.175 1.00 51.21 H new ATOM 0 HB3 GLU A 86 23.639 -18.619 -9.635 1.00 51.21 H new ATOM 0 HG2 GLU A 86 25.493 -18.027 -8.525 1.00 23.25 H new ATOM 0 HG3 GLU A 86 24.713 -16.610 -7.851 1.00 23.25 H new ATOM 1483 N THR A 87 23.451 -16.200 -11.540 1.00 50.35 N ATOM 1484 CA THR A 87 24.279 -15.529 -12.535 1.00 31.12 C ATOM 1485 C THR A 87 23.840 -14.082 -12.730 1.00 60.45 C ATOM 1486 O THR A 87 24.494 -13.316 -13.438 1.00 55.22 O ATOM 1487 CB THR A 87 24.228 -16.257 -13.891 1.00 41.04 C ATOM 1488 OG1 THR A 87 23.333 -17.372 -13.816 1.00 20.12 O ATOM 1489 CG2 THR A 87 25.612 -16.738 -14.300 1.00 23.14 C ATOM 0 H THR A 87 22.771 -16.853 -11.929 1.00 50.35 H new ATOM 0 HA THR A 87 25.302 -15.548 -12.160 1.00 31.12 H new ATOM 0 HB THR A 87 23.869 -15.553 -14.642 1.00 41.04 H new ATOM 0 HG1 THR A 87 23.305 -17.828 -14.683 1.00 20.12 H new ATOM 0 HG21 THR A 87 25.550 -17.249 -15.261 1.00 23.14 H new ATOM 0 HG22 THR A 87 26.283 -15.884 -14.386 1.00 23.14 H new ATOM 0 HG23 THR A 87 25.995 -17.426 -13.547 1.00 23.14 H new ATOM 1497 N ASP A 88 22.731 -13.715 -12.099 1.00 35.21 N ATOM 1498 CA ASP A 88 22.205 -12.359 -12.202 1.00 41.23 C ATOM 1499 C ASP A 88 22.607 -11.526 -10.989 1.00 31.54 C ATOM 1500 O ASP A 88 22.711 -10.302 -11.070 1.00 72.24 O ATOM 1501 CB ASP A 88 20.682 -12.388 -12.335 1.00 13.23 C ATOM 1502 CG ASP A 88 20.215 -12.017 -13.728 1.00 75.25 C ATOM 1503 OD1 ASP A 88 20.566 -10.915 -14.198 1.00 11.10 O ATOM 1504 OD2 ASP A 88 19.497 -12.829 -14.350 1.00 33.14 O ATOM 0 H ASP A 88 22.178 -14.338 -11.510 1.00 35.21 H new ATOM 0 HA ASP A 88 22.630 -11.898 -13.093 1.00 41.23 H new ATOM 0 HB2 ASP A 88 20.318 -13.385 -12.086 1.00 13.23 H new ATOM 0 HB3 ASP A 88 20.244 -11.699 -11.613 1.00 13.23 H new ATOM 1509 N ILE A 89 22.830 -12.199 -9.864 1.00 43.44 N ATOM 1510 CA ILE A 89 23.220 -11.521 -8.634 1.00 44.24 C ATOM 1511 C ILE A 89 24.719 -11.653 -8.386 1.00 1.35 C ATOM 1512 O ILE A 89 25.351 -10.745 -7.845 1.00 42.23 O ATOM 1513 CB ILE A 89 22.458 -12.079 -7.418 1.00 3.10 C ATOM 1514 CG1 ILE A 89 20.985 -12.299 -7.768 1.00 43.35 C ATOM 1515 CG2 ILE A 89 22.591 -11.136 -6.232 1.00 1.15 C ATOM 1516 CD1 ILE A 89 20.252 -11.024 -8.124 1.00 61.33 C ATOM 0 H ILE A 89 22.747 -13.212 -9.780 1.00 43.44 H new ATOM 0 HA ILE A 89 22.966 -10.468 -8.759 1.00 44.24 H new ATOM 0 HB ILE A 89 22.894 -13.040 -7.144 1.00 3.10 H new ATOM 0 HG12 ILE A 89 20.919 -12.993 -8.606 1.00 43.35 H new ATOM 0 HG13 ILE A 89 20.486 -12.772 -6.922 1.00 43.35 H new ATOM 0 HG21 ILE A 89 22.047 -11.544 -5.380 1.00 1.15 H new ATOM 0 HG22 ILE A 89 23.644 -11.025 -5.971 1.00 1.15 H new ATOM 0 HG23 ILE A 89 22.178 -10.162 -6.494 1.00 1.15 H new ATOM 0 HD11 ILE A 89 19.213 -11.255 -8.361 1.00 61.33 H new ATOM 0 HD12 ILE A 89 20.287 -10.336 -7.279 1.00 61.33 H new ATOM 0 HD13 ILE A 89 20.727 -10.561 -8.989 1.00 61.33 H new ATOM 1528 N ARG A 90 25.282 -12.789 -8.785 1.00 11.53 N ATOM 1529 CA ARG A 90 26.707 -13.039 -8.606 1.00 32.33 C ATOM 1530 C ARG A 90 27.533 -11.847 -9.080 1.00 75.12 C ATOM 1531 O ARG A 90 28.291 -11.244 -8.321 1.00 23.43 O ATOM 1532 CB ARG A 90 27.125 -14.298 -9.368 1.00 35.32 C ATOM 1533 CG ARG A 90 28.566 -14.268 -9.850 1.00 74.31 C ATOM 1534 CD ARG A 90 29.058 -15.659 -10.220 1.00 4.44 C ATOM 1535 NE ARG A 90 30.447 -15.872 -9.819 1.00 14.30 N ATOM 1536 CZ ARG A 90 31.489 -15.441 -10.521 1.00 74.34 C ATOM 1537 NH1 ARG A 90 31.300 -14.778 -11.654 1.00 4.43 N ATOM 1538 NH2 ARG A 90 32.722 -15.674 -10.091 1.00 61.23 N ATOM 0 H ARG A 90 24.773 -13.550 -9.234 1.00 11.53 H new ATOM 0 HA ARG A 90 26.893 -13.187 -7.542 1.00 32.33 H new ATOM 0 HB2 ARG A 90 26.984 -15.166 -8.724 1.00 35.32 H new ATOM 0 HB3 ARG A 90 26.466 -14.428 -10.227 1.00 35.32 H new ATOM 0 HG2 ARG A 90 28.648 -13.610 -10.715 1.00 74.31 H new ATOM 0 HG3 ARG A 90 29.203 -13.851 -9.070 1.00 74.31 H new ATOM 0 HD2 ARG A 90 28.424 -16.407 -9.743 1.00 4.44 H new ATOM 0 HD3 ARG A 90 28.965 -15.802 -11.297 1.00 4.44 H new ATOM 0 HE ARG A 90 30.626 -16.379 -8.953 1.00 14.30 H new ATOM 0 HH11 ARG A 90 30.353 -14.598 -11.988 1.00 4.43 H new ATOM 0 HH12 ARG A 90 32.102 -14.448 -12.192 1.00 4.43 H new ATOM 0 HH21 ARG A 90 32.871 -16.185 -9.221 1.00 61.23 H new ATOM 0 HH22 ARG A 90 33.522 -15.343 -10.631 1.00 61.23 H new ATOM 1552 N PRO A 91 27.383 -11.498 -10.367 1.00 1.14 N ATOM 1553 CA PRO A 91 28.107 -10.376 -10.971 1.00 55.54 C ATOM 1554 C PRO A 91 27.626 -9.026 -10.448 1.00 30.54 C ATOM 1555 O PRO A 91 28.029 -7.977 -10.948 1.00 54.21 O ATOM 1556 CB PRO A 91 27.792 -10.513 -12.463 1.00 54.00 C ATOM 1557 CG PRO A 91 26.492 -11.241 -12.510 1.00 44.54 C ATOM 1558 CD PRO A 91 26.496 -12.172 -11.330 1.00 11.43 C ATOM 0 HA PRO A 91 29.172 -10.407 -10.741 1.00 55.54 H new ATOM 0 HB2 PRO A 91 27.717 -9.537 -12.943 1.00 54.00 H new ATOM 0 HB3 PRO A 91 28.574 -11.065 -12.984 1.00 54.00 H new ATOM 0 HG2 PRO A 91 25.654 -10.546 -12.456 1.00 44.54 H new ATOM 0 HG3 PRO A 91 26.388 -11.794 -13.443 1.00 44.54 H new ATOM 0 HD2 PRO A 91 25.494 -12.311 -10.924 1.00 11.43 H new ATOM 0 HD3 PRO A 91 26.871 -13.160 -11.599 1.00 11.43 H new ATOM 1566 N MET A 92 26.763 -9.062 -9.437 1.00 64.32 N ATOM 1567 CA MET A 92 26.230 -7.841 -8.845 1.00 34.32 C ATOM 1568 C MET A 92 26.752 -7.653 -7.424 1.00 71.00 C ATOM 1569 O MET A 92 26.859 -6.527 -6.935 1.00 63.43 O ATOM 1570 CB MET A 92 24.700 -7.879 -8.838 1.00 2.32 C ATOM 1571 CG MET A 92 24.068 -7.100 -9.980 1.00 10.44 C ATOM 1572 SD MET A 92 22.700 -6.058 -9.436 1.00 45.31 S ATOM 1573 CE MET A 92 22.970 -4.596 -10.436 1.00 24.14 C ATOM 0 H MET A 92 26.419 -9.923 -9.012 1.00 64.32 H new ATOM 0 HA MET A 92 26.563 -6.998 -9.450 1.00 34.32 H new ATOM 0 HB2 MET A 92 24.370 -8.917 -8.890 1.00 2.32 H new ATOM 0 HB3 MET A 92 24.339 -7.477 -7.891 1.00 2.32 H new ATOM 0 HG2 MET A 92 24.827 -6.478 -10.454 1.00 10.44 H new ATOM 0 HG3 MET A 92 23.710 -7.798 -10.736 1.00 10.44 H new ATOM 0 HE1 MET A 92 22.201 -3.856 -10.213 1.00 24.14 H new ATOM 0 HE2 MET A 92 23.952 -4.178 -10.212 1.00 24.14 H new ATOM 0 HE3 MET A 92 22.921 -4.863 -11.492 1.00 24.14 H new ATOM 1583 N LEU A 93 27.075 -8.761 -6.766 1.00 12.33 N ATOM 1584 CA LEU A 93 27.586 -8.717 -5.400 1.00 31.50 C ATOM 1585 C LEU A 93 28.956 -8.049 -5.352 1.00 40.12 C ATOM 1586 O LEU A 93 29.093 -6.870 -5.679 1.00 62.40 O ATOM 1587 CB LEU A 93 27.675 -10.131 -4.823 1.00 22.40 C ATOM 1588 CG LEU A 93 26.357 -10.900 -4.722 1.00 41.24 C ATOM 1589 CD1 LEU A 93 26.619 -12.381 -4.496 1.00 55.23 C ATOM 1590 CD2 LEU A 93 25.493 -10.332 -3.606 1.00 31.42 C ATOM 0 H LEU A 93 26.992 -9.700 -7.156 1.00 12.33 H new ATOM 0 HA LEU A 93 26.894 -8.128 -4.798 1.00 31.50 H new ATOM 0 HB2 LEU A 93 28.364 -10.710 -5.438 1.00 22.40 H new ATOM 0 HB3 LEU A 93 28.113 -10.068 -3.827 1.00 22.40 H new ATOM 0 HG LEU A 93 25.819 -10.787 -5.663 1.00 41.24 H new ATOM 0 HD11 LEU A 93 25.670 -12.912 -4.427 1.00 55.23 H new ATOM 0 HD12 LEU A 93 27.198 -12.779 -5.329 1.00 55.23 H new ATOM 0 HD13 LEU A 93 27.178 -12.514 -3.570 1.00 55.23 H new ATOM 0 HD21 LEU A 93 24.559 -10.891 -3.548 1.00 31.42 H new ATOM 0 HD22 LEU A 93 26.024 -10.414 -2.658 1.00 31.42 H new ATOM 0 HD23 LEU A 93 25.276 -9.284 -3.811 1.00 31.42 H new ATOM 1602 N GLN A 94 29.966 -8.810 -4.945 1.00 24.41 N ATOM 1603 CA GLN A 94 31.326 -8.291 -4.856 1.00 61.23 C ATOM 1604 C GLN A 94 32.331 -9.302 -5.398 1.00 62.33 C ATOM 1605 O GLN A 94 32.166 -10.510 -5.225 1.00 42.05 O ATOM 1606 CB GLN A 94 31.668 -7.942 -3.407 1.00 14.42 C ATOM 1607 CG GLN A 94 33.159 -7.803 -3.150 1.00 4.13 C ATOM 1608 CD GLN A 94 33.478 -6.728 -2.129 1.00 24.50 C ATOM 1609 OE1 GLN A 94 33.984 -5.660 -2.473 1.00 14.50 O ATOM 1610 NE2 GLN A 94 33.184 -7.007 -0.864 1.00 41.24 N ATOM 0 H GLN A 94 29.869 -9.788 -4.672 1.00 24.41 H new ATOM 0 HA GLN A 94 31.383 -7.387 -5.463 1.00 61.23 H new ATOM 0 HB2 GLN A 94 31.173 -7.008 -3.141 1.00 14.42 H new ATOM 0 HB3 GLN A 94 31.265 -8.714 -2.751 1.00 14.42 H new ATOM 0 HG2 GLN A 94 33.554 -8.757 -2.802 1.00 4.13 H new ATOM 0 HG3 GLN A 94 33.665 -7.570 -4.087 1.00 4.13 H new ATOM 0 HE21 GLN A 94 32.765 -7.906 -0.624 1.00 41.24 H new ATOM 0 HE22 GLN A 94 33.377 -6.323 -0.133 1.00 41.24 H new ATOM 1619 N ASP A 95 33.372 -8.801 -6.054 1.00 52.13 N ATOM 1620 CA ASP A 95 34.404 -9.660 -6.621 1.00 65.43 C ATOM 1621 C ASP A 95 35.175 -10.382 -5.521 1.00 24.34 C ATOM 1622 O ASP A 95 35.523 -11.555 -5.659 1.00 73.23 O ATOM 1623 CB ASP A 95 35.367 -8.839 -7.480 1.00 51.34 C ATOM 1624 CG ASP A 95 34.708 -8.302 -8.736 1.00 10.12 C ATOM 1625 OD1 ASP A 95 33.578 -8.735 -9.045 1.00 61.42 O ATOM 1626 OD2 ASP A 95 35.322 -7.448 -9.409 1.00 13.45 O ATOM 0 H ASP A 95 33.523 -7.804 -6.206 1.00 52.13 H new ATOM 0 HA ASP A 95 33.916 -10.406 -7.248 1.00 65.43 H new ATOM 0 HB2 ASP A 95 35.754 -8.007 -6.892 1.00 51.34 H new ATOM 0 HB3 ASP A 95 36.220 -9.458 -7.757 1.00 51.34 H new ATOM 1631 N ARG A 96 35.440 -9.673 -4.428 1.00 64.32 N ATOM 1632 CA ARG A 96 36.172 -10.246 -3.305 1.00 3.33 C ATOM 1633 C ARG A 96 35.218 -10.904 -2.313 1.00 12.44 C ATOM 1634 O ARG A 96 35.556 -11.098 -1.144 1.00 43.32 O ATOM 1635 CB ARG A 96 36.993 -9.165 -2.599 1.00 51.51 C ATOM 1636 CG ARG A 96 36.144 -8.105 -1.916 1.00 4.24 C ATOM 1637 CD ARG A 96 36.850 -7.525 -0.700 1.00 32.24 C ATOM 1638 NE ARG A 96 38.230 -7.149 -0.995 1.00 13.20 N ATOM 1639 CZ ARG A 96 39.126 -6.849 -0.061 1.00 54.33 C ATOM 1640 NH1 ARG A 96 38.788 -6.881 1.221 1.00 63.14 N ATOM 1641 NH2 ARG A 96 40.362 -6.516 -0.409 1.00 40.30 N ATOM 0 H ARG A 96 35.159 -8.701 -4.297 1.00 64.32 H new ATOM 0 HA ARG A 96 36.846 -11.009 -3.695 1.00 3.33 H new ATOM 0 HB2 ARG A 96 37.637 -9.636 -1.857 1.00 51.51 H new ATOM 0 HB3 ARG A 96 37.645 -8.683 -3.327 1.00 51.51 H new ATOM 0 HG2 ARG A 96 35.919 -7.306 -2.623 1.00 4.24 H new ATOM 0 HG3 ARG A 96 35.192 -8.540 -1.612 1.00 4.24 H new ATOM 0 HD2 ARG A 96 36.304 -6.650 -0.347 1.00 32.24 H new ATOM 0 HD3 ARG A 96 36.839 -8.256 0.109 1.00 32.24 H new ATOM 0 HE ARG A 96 38.522 -7.115 -1.972 1.00 13.20 H new ATOM 0 HH11 ARG A 96 37.838 -7.136 1.492 1.00 63.14 H new ATOM 0 HH12 ARG A 96 39.478 -6.650 1.936 1.00 63.14 H new ATOM 0 HH21 ARG A 96 40.625 -6.490 -1.394 1.00 40.30 H new ATOM 0 HH22 ARG A 96 41.049 -6.286 0.309 1.00 40.30 H new ATOM 1655 N LEU A 97 34.024 -11.244 -2.785 1.00 71.02 N ATOM 1656 CA LEU A 97 33.019 -11.880 -1.940 1.00 3.11 C ATOM 1657 C LEU A 97 33.243 -13.387 -1.868 1.00 71.12 C ATOM 1658 O LEU A 97 32.751 -14.055 -0.958 1.00 44.21 O ATOM 1659 CB LEU A 97 31.616 -11.586 -2.473 1.00 12.24 C ATOM 1660 CG LEU A 97 30.464 -12.284 -1.749 1.00 55.23 C ATOM 1661 CD1 LEU A 97 30.641 -12.185 -0.242 1.00 42.12 C ATOM 1662 CD2 LEU A 97 29.129 -11.686 -2.171 1.00 61.22 C ATOM 0 H LEU A 97 33.728 -11.090 -3.749 1.00 71.02 H new ATOM 0 HA LEU A 97 33.112 -11.469 -0.935 1.00 3.11 H new ATOM 0 HB2 LEU A 97 31.449 -10.510 -2.426 1.00 12.24 H new ATOM 0 HB3 LEU A 97 31.582 -11.869 -3.525 1.00 12.24 H new ATOM 0 HG LEU A 97 30.472 -13.338 -2.026 1.00 55.23 H new ATOM 0 HD11 LEU A 97 29.811 -12.687 0.256 1.00 42.12 H new ATOM 0 HD12 LEU A 97 31.579 -12.660 0.046 1.00 42.12 H new ATOM 0 HD13 LEU A 97 30.660 -11.136 0.054 1.00 42.12 H new ATOM 0 HD21 LEU A 97 28.320 -12.195 -1.646 1.00 61.22 H new ATOM 0 HD22 LEU A 97 29.111 -10.625 -1.923 1.00 61.22 H new ATOM 0 HD23 LEU A 97 28.998 -11.810 -3.246 1.00 61.22 H new ATOM 1674 N ARG A 98 33.989 -13.916 -2.832 1.00 41.14 N ATOM 1675 CA ARG A 98 34.279 -15.344 -2.878 1.00 11.01 C ATOM 1676 C ARG A 98 32.994 -16.155 -3.016 1.00 31.32 C ATOM 1677 O ARG A 98 31.894 -15.674 -2.741 1.00 25.32 O ATOM 1678 CB ARG A 98 35.033 -15.773 -1.618 1.00 61.52 C ATOM 1679 CG ARG A 98 36.531 -15.523 -1.690 1.00 33.40 C ATOM 1680 CD ARG A 98 37.198 -16.427 -2.715 1.00 52.12 C ATOM 1681 NE ARG A 98 38.642 -16.220 -2.770 1.00 4.34 N ATOM 1682 CZ ARG A 98 39.213 -15.175 -3.358 1.00 43.34 C ATOM 1683 NH1 ARG A 98 38.466 -14.247 -3.939 1.00 55.34 N ATOM 1684 NH2 ARG A 98 40.535 -15.056 -3.366 1.00 72.23 N ATOM 0 H ARG A 98 34.404 -13.377 -3.592 1.00 41.14 H new ATOM 0 HA ARG A 98 34.904 -15.535 -3.750 1.00 11.01 H new ATOM 0 HB2 ARG A 98 34.625 -15.238 -0.761 1.00 61.52 H new ATOM 0 HB3 ARG A 98 34.858 -16.835 -1.444 1.00 61.52 H new ATOM 0 HG2 ARG A 98 36.715 -14.480 -1.949 1.00 33.40 H new ATOM 0 HG3 ARG A 98 36.977 -15.692 -0.710 1.00 33.40 H new ATOM 0 HD2 ARG A 98 36.990 -17.468 -2.469 1.00 52.12 H new ATOM 0 HD3 ARG A 98 36.767 -16.239 -3.699 1.00 52.12 H new ATOM 0 HE ARG A 98 39.246 -16.916 -2.333 1.00 4.34 H new ATOM 0 HH11 ARG A 98 37.450 -14.334 -3.935 1.00 55.34 H new ATOM 0 HH12 ARG A 98 38.907 -13.446 -4.390 1.00 55.34 H new ATOM 0 HH21 ARG A 98 41.114 -15.768 -2.920 1.00 72.23 H new ATOM 0 HH22 ARG A 98 40.972 -14.253 -3.818 1.00 72.23 H new ATOM 1698 N PRO A 99 33.134 -17.416 -3.452 1.00 53.24 N ATOM 1699 CA PRO A 99 31.995 -18.321 -3.637 1.00 1.52 C ATOM 1700 C PRO A 99 31.371 -18.745 -2.312 1.00 3.23 C ATOM 1701 O PRO A 99 31.477 -19.903 -1.908 1.00 13.23 O ATOM 1702 CB PRO A 99 32.612 -19.527 -4.348 1.00 24.30 C ATOM 1703 CG PRO A 99 34.049 -19.506 -3.953 1.00 53.32 C ATOM 1704 CD PRO A 99 34.414 -18.055 -3.799 1.00 61.22 C ATOM 0 HA PRO A 99 31.186 -17.849 -4.194 1.00 1.52 H new ATOM 0 HB2 PRO A 99 32.131 -20.456 -4.042 1.00 24.30 H new ATOM 0 HB3 PRO A 99 32.498 -19.450 -5.429 1.00 24.30 H new ATOM 0 HG2 PRO A 99 34.206 -20.049 -3.021 1.00 53.32 H new ATOM 0 HG3 PRO A 99 34.669 -19.986 -4.710 1.00 53.32 H new ATOM 0 HD2 PRO A 99 35.161 -17.909 -3.018 1.00 61.22 H new ATOM 0 HD3 PRO A 99 34.831 -17.646 -4.719 1.00 61.22 H new ATOM 1712 N SER A 100 30.721 -17.800 -1.640 1.00 20.24 N ATOM 1713 CA SER A 100 30.083 -18.076 -0.358 1.00 12.12 C ATOM 1714 C SER A 100 28.588 -18.323 -0.537 1.00 40.11 C ATOM 1715 O SER A 100 27.954 -18.988 0.282 1.00 22.14 O ATOM 1716 CB SER A 100 30.306 -16.911 0.608 1.00 5.13 C ATOM 1717 OG SER A 100 29.282 -15.940 0.483 1.00 73.34 O ATOM 0 H SER A 100 30.622 -16.837 -1.962 1.00 20.24 H new ATOM 0 HA SER A 100 30.535 -18.976 0.058 1.00 12.12 H new ATOM 0 HB2 SER A 100 30.334 -17.284 1.632 1.00 5.13 H new ATOM 0 HB3 SER A 100 31.274 -16.451 0.410 1.00 5.13 H new ATOM 0 HG SER A 100 29.676 -15.080 0.226 1.00 73.34 H new ATOM 1723 N PHE A 101 28.031 -17.782 -1.615 1.00 54.04 N ATOM 1724 CA PHE A 101 26.610 -17.942 -1.903 1.00 40.25 C ATOM 1725 C PHE A 101 26.206 -19.412 -1.849 1.00 21.31 C ATOM 1726 O PHE A 101 25.259 -19.781 -1.155 1.00 23.50 O ATOM 1727 CB PHE A 101 26.279 -17.361 -3.280 1.00 15.14 C ATOM 1728 CG PHE A 101 24.901 -16.769 -3.364 1.00 75.45 C ATOM 1729 CD1 PHE A 101 23.798 -17.481 -2.919 1.00 42.22 C ATOM 1730 CD2 PHE A 101 24.708 -15.502 -3.890 1.00 54.11 C ATOM 1731 CE1 PHE A 101 22.529 -16.939 -2.995 1.00 73.24 C ATOM 1732 CE2 PHE A 101 23.441 -14.955 -3.968 1.00 73.14 C ATOM 1733 CZ PHE A 101 22.350 -15.675 -3.522 1.00 31.02 C ATOM 0 H PHE A 101 28.541 -17.229 -2.304 1.00 54.04 H new ATOM 0 HA PHE A 101 26.047 -17.401 -1.142 1.00 40.25 H new ATOM 0 HB2 PHE A 101 27.012 -16.593 -3.527 1.00 15.14 H new ATOM 0 HB3 PHE A 101 26.375 -18.146 -4.030 1.00 15.14 H new ATOM 0 HD1 PHE A 101 23.932 -18.471 -2.508 1.00 42.22 H new ATOM 0 HD2 PHE A 101 25.557 -14.935 -4.243 1.00 54.11 H new ATOM 0 HE1 PHE A 101 21.678 -17.503 -2.643 1.00 73.24 H new ATOM 0 HE2 PHE A 101 23.304 -13.965 -4.378 1.00 73.14 H new ATOM 0 HZ PHE A 101 21.359 -15.250 -3.585 1.00 31.02 H new ATOM 1743 N ALA A 102 26.931 -20.247 -2.587 1.00 3.44 N ATOM 1744 CA ALA A 102 26.650 -21.676 -2.622 1.00 23.53 C ATOM 1745 C ALA A 102 26.659 -22.272 -1.218 1.00 65.41 C ATOM 1746 O ALA A 102 26.078 -23.331 -0.978 1.00 10.44 O ATOM 1747 CB ALA A 102 27.660 -22.391 -3.507 1.00 63.22 C ATOM 0 H ALA A 102 27.717 -19.957 -3.169 1.00 3.44 H new ATOM 0 HA ALA A 102 25.653 -21.815 -3.041 1.00 23.53 H new ATOM 0 HB1 ALA A 102 27.438 -23.458 -3.524 1.00 63.22 H new ATOM 0 HB2 ALA A 102 27.603 -21.992 -4.520 1.00 63.22 H new ATOM 0 HB3 ALA A 102 28.664 -22.236 -3.112 1.00 63.22 H new ATOM 1753 N LYS A 103 27.324 -21.587 -0.294 1.00 13.03 N ATOM 1754 CA LYS A 103 27.409 -22.047 1.087 1.00 32.51 C ATOM 1755 C LYS A 103 26.350 -21.371 1.952 1.00 20.53 C ATOM 1756 O LYS A 103 25.991 -21.875 3.016 1.00 11.44 O ATOM 1757 CB LYS A 103 28.802 -21.767 1.655 1.00 50.10 C ATOM 1758 CG LYS A 103 29.783 -22.909 1.452 1.00 12.20 C ATOM 1759 CD LYS A 103 30.170 -23.058 -0.010 1.00 32.33 C ATOM 1760 CE LYS A 103 31.363 -23.987 -0.178 1.00 52.43 C ATOM 1761 NZ LYS A 103 31.972 -23.866 -1.532 1.00 22.53 N ATOM 0 H LYS A 103 27.812 -20.710 -0.477 1.00 13.03 H new ATOM 0 HA LYS A 103 27.229 -23.122 1.097 1.00 32.51 H new ATOM 0 HB2 LYS A 103 29.202 -20.868 1.186 1.00 50.10 H new ATOM 0 HB3 LYS A 103 28.715 -21.559 2.721 1.00 50.10 H new ATOM 0 HG2 LYS A 103 30.677 -22.732 2.050 1.00 12.20 H new ATOM 0 HG3 LYS A 103 29.340 -23.839 1.809 1.00 12.20 H new ATOM 0 HD2 LYS A 103 29.322 -23.447 -0.574 1.00 32.33 H new ATOM 0 HD3 LYS A 103 30.408 -22.079 -0.426 1.00 32.33 H new ATOM 0 HE2 LYS A 103 32.112 -23.757 0.579 1.00 52.43 H new ATOM 0 HE3 LYS A 103 31.048 -25.017 -0.012 1.00 52.43 H new ATOM 0 HZ1 LYS A 103 32.782 -24.514 -1.608 1.00 22.53 H new ATOM 0 HZ2 LYS A 103 31.264 -24.110 -2.254 1.00 22.53 H new ATOM 0 HZ3 LYS A 103 32.296 -22.889 -1.681 1.00 22.53 H new ATOM 1775 N ALA A 104 25.853 -20.230 1.488 1.00 43.33 N ATOM 1776 CA ALA A 104 24.833 -19.487 2.218 1.00 62.34 C ATOM 1777 C ALA A 104 23.436 -19.998 1.881 1.00 23.11 C ATOM 1778 O ALA A 104 22.493 -19.802 2.647 1.00 34.35 O ATOM 1779 CB ALA A 104 24.942 -18.001 1.911 1.00 13.13 C ATOM 0 H ALA A 104 26.140 -19.799 0.609 1.00 43.33 H new ATOM 0 HA ALA A 104 25.000 -19.640 3.284 1.00 62.34 H new ATOM 0 HB1 ALA A 104 24.174 -17.458 2.463 1.00 13.13 H new ATOM 0 HB2 ALA A 104 25.926 -17.639 2.208 1.00 13.13 H new ATOM 0 HB3 ALA A 104 24.803 -17.839 0.842 1.00 13.13 H new ATOM 1785 N ILE A 105 23.312 -20.652 0.731 1.00 33.34 N ATOM 1786 CA ILE A 105 22.030 -21.191 0.295 1.00 73.03 C ATOM 1787 C ILE A 105 21.338 -21.947 1.424 1.00 71.33 C ATOM 1788 O ILE A 105 20.173 -21.709 1.742 1.00 53.54 O ATOM 1789 CB ILE A 105 22.197 -22.133 -0.912 1.00 74.03 C ATOM 1790 CG1 ILE A 105 22.618 -21.340 -2.151 1.00 74.23 C ATOM 1791 CG2 ILE A 105 20.904 -22.891 -1.176 1.00 11.35 C ATOM 1792 CD1 ILE A 105 21.809 -20.080 -2.366 1.00 73.11 C ATOM 0 H ILE A 105 24.083 -20.821 0.085 1.00 33.34 H new ATOM 0 HA ILE A 105 21.414 -20.341 0.000 1.00 73.03 H new ATOM 0 HB ILE A 105 22.979 -22.857 -0.683 1.00 74.03 H new ATOM 0 HG12 ILE A 105 23.672 -21.075 -2.062 1.00 74.23 H new ATOM 0 HG13 ILE A 105 22.523 -21.978 -3.030 1.00 74.23 H new ATOM 0 HG21 ILE A 105 21.038 -23.552 -2.032 1.00 11.35 H new ATOM 0 HG22 ILE A 105 20.643 -23.482 -0.298 1.00 11.35 H new ATOM 0 HG23 ILE A 105 20.103 -22.182 -1.387 1.00 11.35 H new ATOM 0 HD11 ILE A 105 22.162 -19.569 -3.262 1.00 73.11 H new ATOM 0 HD12 ILE A 105 20.757 -20.339 -2.487 1.00 73.11 H new ATOM 0 HD13 ILE A 105 21.924 -19.423 -1.504 1.00 73.11 H new ATOM 1804 N PRO A 106 22.072 -22.881 2.047 1.00 73.32 N ATOM 1805 CA PRO A 106 21.550 -23.690 3.152 1.00 21.43 C ATOM 1806 C PRO A 106 21.338 -22.871 4.421 1.00 51.14 C ATOM 1807 O PRO A 106 20.544 -23.243 5.286 1.00 42.02 O ATOM 1808 CB PRO A 106 22.643 -24.740 3.370 1.00 1.33 C ATOM 1809 CG PRO A 106 23.889 -24.100 2.864 1.00 3.50 C ATOM 1810 CD PRO A 106 23.467 -23.219 1.720 1.00 24.04 C ATOM 0 HA PRO A 106 20.573 -24.113 2.921 1.00 21.43 H new ATOM 0 HB2 PRO A 106 22.733 -25.004 4.424 1.00 1.33 H new ATOM 0 HB3 PRO A 106 22.422 -25.660 2.828 1.00 1.33 H new ATOM 0 HG2 PRO A 106 24.374 -23.517 3.647 1.00 3.50 H new ATOM 0 HG3 PRO A 106 24.607 -24.851 2.534 1.00 3.50 H new ATOM 0 HD2 PRO A 106 24.090 -22.328 1.648 1.00 24.04 H new ATOM 0 HD3 PRO A 106 23.541 -23.738 0.764 1.00 24.04 H new ATOM 1818 N CYS A 107 22.051 -21.755 4.524 1.00 31.05 N ATOM 1819 CA CYS A 107 21.940 -20.883 5.688 1.00 5.42 C ATOM 1820 C CYS A 107 20.736 -19.955 5.560 1.00 24.32 C ATOM 1821 O CYS A 107 20.177 -19.504 6.561 1.00 64.02 O ATOM 1822 CB CYS A 107 23.218 -20.059 5.857 1.00 20.13 C ATOM 1823 SG CYS A 107 24.742 -21.015 5.675 1.00 30.13 S ATOM 0 H CYS A 107 22.711 -21.433 3.817 1.00 31.05 H new ATOM 0 HA CYS A 107 21.801 -21.510 6.569 1.00 5.42 H new ATOM 0 HB2 CYS A 107 23.218 -19.253 5.123 1.00 20.13 H new ATOM 0 HB3 CYS A 107 23.210 -19.593 6.842 1.00 20.13 H new ATOM 0 HG CYS A 107 24.885 -21.371 4.433 1.00 30.13 H new ATOM 1829 N LEU A 108 20.343 -19.673 4.323 1.00 35.23 N ATOM 1830 CA LEU A 108 19.205 -18.798 4.063 1.00 0.45 C ATOM 1831 C LEU A 108 17.889 -19.544 4.253 1.00 75.44 C ATOM 1832 O LEU A 108 16.921 -18.994 4.778 1.00 51.41 O ATOM 1833 CB LEU A 108 19.285 -18.233 2.644 1.00 13.21 C ATOM 1834 CG LEU A 108 20.555 -17.453 2.302 1.00 30.23 C ATOM 1835 CD1 LEU A 108 20.238 -16.303 1.359 1.00 31.21 C ATOM 1836 CD2 LEU A 108 21.222 -16.938 3.569 1.00 13.15 C ATOM 0 H LEU A 108 20.795 -20.037 3.484 1.00 35.23 H new ATOM 0 HA LEU A 108 19.240 -17.975 4.777 1.00 0.45 H new ATOM 0 HB2 LEU A 108 19.190 -19.059 1.940 1.00 13.21 H new ATOM 0 HB3 LEU A 108 18.427 -17.579 2.486 1.00 13.21 H new ATOM 0 HG LEU A 108 21.248 -18.127 1.799 1.00 30.23 H new ATOM 0 HD11 LEU A 108 21.154 -15.760 1.127 1.00 31.21 H new ATOM 0 HD12 LEU A 108 19.806 -16.696 0.439 1.00 31.21 H new ATOM 0 HD13 LEU A 108 19.526 -15.628 1.835 1.00 31.21 H new ATOM 0 HD21 LEU A 108 22.124 -16.385 3.306 1.00 13.15 H new ATOM 0 HD22 LEU A 108 20.535 -16.279 4.100 1.00 13.15 H new ATOM 0 HD23 LEU A 108 21.486 -17.780 4.209 1.00 13.15 H new ATOM 1848 N ARG A 109 17.860 -20.802 3.823 1.00 45.30 N ATOM 1849 CA ARG A 109 16.663 -21.625 3.946 1.00 42.40 C ATOM 1850 C ARG A 109 16.505 -22.145 5.372 1.00 64.03 C ATOM 1851 O ARG A 109 15.390 -22.380 5.838 1.00 21.01 O ATOM 1852 CB ARG A 109 16.723 -22.798 2.967 1.00 75.42 C ATOM 1853 CG ARG A 109 17.945 -23.683 3.149 1.00 4.52 C ATOM 1854 CD ARG A 109 18.055 -24.718 2.041 1.00 53.34 C ATOM 1855 NE ARG A 109 17.392 -25.970 2.394 1.00 74.11 N ATOM 1856 CZ ARG A 109 16.108 -26.215 2.155 1.00 41.13 C ATOM 1857 NH1 ARG A 109 15.354 -25.298 1.564 1.00 33.24 N ATOM 1858 NH2 ARG A 109 15.577 -27.379 2.506 1.00 72.12 N ATOM 0 H ARG A 109 18.652 -21.273 3.386 1.00 45.30 H new ATOM 0 HA ARG A 109 15.799 -21.005 3.707 1.00 42.40 H new ATOM 0 HB2 ARG A 109 15.825 -23.405 3.085 1.00 75.42 H new ATOM 0 HB3 ARG A 109 16.714 -22.410 1.948 1.00 75.42 H new ATOM 0 HG2 ARG A 109 18.843 -23.066 3.162 1.00 4.52 H new ATOM 0 HG3 ARG A 109 17.890 -24.187 4.114 1.00 4.52 H new ATOM 0 HD2 ARG A 109 17.614 -24.319 1.127 1.00 53.34 H new ATOM 0 HD3 ARG A 109 19.106 -24.912 1.829 1.00 53.34 H new ATOM 0 HE ARG A 109 17.945 -26.696 2.849 1.00 74.11 H new ATOM 0 HH11 ARG A 109 15.759 -24.402 1.292 1.00 33.24 H new ATOM 0 HH12 ARG A 109 14.369 -25.488 1.382 1.00 33.24 H new ATOM 0 HH21 ARG A 109 16.154 -28.087 2.960 1.00 72.12 H new ATOM 0 HH22 ARG A 109 14.591 -27.566 2.322 1.00 72.12 H new ATOM 1872 N HIS A 110 17.629 -22.324 6.059 1.00 41.41 N ATOM 1873 CA HIS A 110 17.616 -22.816 7.432 1.00 73.33 C ATOM 1874 C HIS A 110 16.757 -21.923 8.321 1.00 14.32 C ATOM 1875 O HIS A 110 16.284 -22.350 9.375 1.00 24.01 O ATOM 1876 CB HIS A 110 19.040 -22.888 7.984 1.00 35.01 C ATOM 1877 CG HIS A 110 19.110 -23.383 9.396 1.00 10.30 C ATOM 1878 ND1 HIS A 110 19.470 -22.580 10.458 1.00 42.13 N ATOM 1879 CD2 HIS A 110 18.862 -24.606 9.919 1.00 60.42 C ATOM 1880 CE1 HIS A 110 19.443 -23.289 11.572 1.00 14.21 C ATOM 1881 NE2 HIS A 110 19.076 -24.522 11.273 1.00 40.24 N ATOM 0 H HIS A 110 18.560 -22.136 5.687 1.00 41.41 H new ATOM 0 HA HIS A 110 17.185 -23.817 7.429 1.00 73.33 H new ATOM 0 HB2 HIS A 110 19.635 -23.543 7.348 1.00 35.01 H new ATOM 0 HB3 HIS A 110 19.492 -21.897 7.932 1.00 35.01 H new ATOM 0 HD2 HIS A 110 18.553 -25.485 9.373 1.00 60.42 H new ATOM 0 HE1 HIS A 110 19.681 -22.923 12.560 1.00 14.21 H new ATOM 0 HE2 HIS A 110 18.969 -25.287 11.939 1.00 40.24 H new ATOM 1889 N ILE A 111 16.559 -20.681 7.890 1.00 23.42 N ATOM 1890 CA ILE A 111 15.757 -19.729 8.648 1.00 42.24 C ATOM 1891 C ILE A 111 14.386 -19.535 8.009 1.00 32.05 C ATOM 1892 O ILE A 111 13.518 -18.865 8.570 1.00 44.33 O ATOM 1893 CB ILE A 111 16.459 -18.362 8.755 1.00 52.13 C ATOM 1894 CG1 ILE A 111 16.316 -17.587 7.443 1.00 13.45 C ATOM 1895 CG2 ILE A 111 17.927 -18.546 9.110 1.00 75.40 C ATOM 1896 CD1 ILE A 111 17.585 -16.884 7.015 1.00 1.14 C ATOM 0 H ILE A 111 16.943 -20.311 7.020 1.00 23.42 H new ATOM 0 HA ILE A 111 15.634 -20.145 9.648 1.00 42.24 H new ATOM 0 HB ILE A 111 15.983 -17.787 9.549 1.00 52.13 H new ATOM 0 HG12 ILE A 111 16.008 -18.275 6.656 1.00 13.45 H new ATOM 0 HG13 ILE A 111 15.520 -16.850 7.551 1.00 13.45 H new ATOM 0 HG21 ILE A 111 18.409 -17.571 9.182 1.00 75.40 H new ATOM 0 HG22 ILE A 111 18.008 -19.062 10.067 1.00 75.40 H new ATOM 0 HG23 ILE A 111 18.417 -19.137 8.336 1.00 75.40 H new ATOM 0 HD11 ILE A 111 17.410 -16.355 6.078 1.00 1.14 H new ATOM 0 HD12 ILE A 111 17.883 -16.171 7.784 1.00 1.14 H new ATOM 0 HD13 ILE A 111 18.378 -17.618 6.875 1.00 1.14 H new ATOM 1908 N ARG A 112 14.197 -20.128 6.835 1.00 14.22 N ATOM 1909 CA ARG A 112 12.930 -20.021 6.121 1.00 62.12 C ATOM 1910 C ARG A 112 12.699 -18.593 5.635 1.00 34.31 C ATOM 1911 O ARG A 112 11.682 -17.976 5.953 1.00 31.12 O ATOM 1912 CB ARG A 112 11.774 -20.459 7.021 1.00 13.24 C ATOM 1913 CG ARG A 112 12.067 -21.718 7.821 1.00 40.31 C ATOM 1914 CD ARG A 112 12.268 -21.407 9.296 1.00 40.21 C ATOM 1915 NE ARG A 112 11.784 -22.485 10.153 1.00 22.35 N ATOM 1916 CZ ARG A 112 11.963 -22.514 11.469 1.00 34.05 C ATOM 1917 NH1 ARG A 112 12.610 -21.528 12.076 1.00 71.53 N ATOM 1918 NH2 ARG A 112 11.493 -23.530 12.182 1.00 74.01 N ATOM 0 H ARG A 112 14.904 -20.687 6.358 1.00 14.22 H new ATOM 0 HA ARG A 112 12.974 -20.679 5.253 1.00 62.12 H new ATOM 0 HB2 ARG A 112 11.534 -19.649 7.710 1.00 13.24 H new ATOM 0 HB3 ARG A 112 10.890 -20.627 6.406 1.00 13.24 H new ATOM 0 HG2 ARG A 112 11.244 -22.423 7.706 1.00 40.31 H new ATOM 0 HG3 ARG A 112 12.960 -22.202 7.425 1.00 40.31 H new ATOM 0 HD2 ARG A 112 13.327 -21.238 9.490 1.00 40.21 H new ATOM 0 HD3 ARG A 112 11.746 -20.483 9.546 1.00 40.21 H new ATOM 0 HE ARG A 112 11.281 -23.258 9.718 1.00 22.35 H new ATOM 0 HH11 ARG A 112 12.972 -20.745 11.532 1.00 71.53 H new ATOM 0 HH12 ARG A 112 12.746 -21.553 13.087 1.00 71.53 H new ATOM 0 HH21 ARG A 112 10.994 -24.290 11.720 1.00 74.01 H new ATOM 0 HH22 ARG A 112 11.631 -23.551 13.192 1.00 74.01 H new ATOM 1932 N ARG A 113 13.648 -18.075 4.864 1.00 45.33 N ATOM 1933 CA ARG A 113 13.549 -16.719 4.336 1.00 72.42 C ATOM 1934 C ARG A 113 13.539 -16.730 2.810 1.00 41.41 C ATOM 1935 O ARG A 113 12.935 -15.863 2.178 1.00 51.24 O ATOM 1936 CB ARG A 113 14.712 -15.865 4.843 1.00 13.22 C ATOM 1937 CG ARG A 113 14.706 -14.445 4.302 1.00 54.44 C ATOM 1938 CD ARG A 113 14.492 -13.426 5.411 1.00 61.43 C ATOM 1939 NE ARG A 113 13.274 -13.692 6.171 1.00 73.23 N ATOM 1940 CZ ARG A 113 12.056 -13.384 5.739 1.00 50.14 C ATOM 1941 NH1 ARG A 113 11.895 -12.803 4.558 1.00 44.51 N ATOM 1942 NH2 ARG A 113 10.996 -13.658 6.488 1.00 53.30 N ATOM 0 H ARG A 113 14.495 -18.573 4.590 1.00 45.33 H new ATOM 0 HA ARG A 113 12.611 -16.287 4.686 1.00 72.42 H new ATOM 0 HB2 ARG A 113 14.678 -15.830 5.932 1.00 13.22 H new ATOM 0 HB3 ARG A 113 15.651 -16.345 4.568 1.00 13.22 H new ATOM 0 HG2 ARG A 113 15.651 -14.243 3.798 1.00 54.44 H new ATOM 0 HG3 ARG A 113 13.918 -14.342 3.555 1.00 54.44 H new ATOM 0 HD2 ARG A 113 15.349 -13.438 6.084 1.00 61.43 H new ATOM 0 HD3 ARG A 113 14.439 -12.426 4.980 1.00 61.43 H new ATOM 0 HE ARG A 113 13.363 -14.139 7.084 1.00 73.23 H new ATOM 0 HH11 ARG A 113 12.707 -12.591 3.979 1.00 44.51 H new ATOM 0 HH12 ARG A 113 10.959 -12.568 4.229 1.00 44.51 H new ATOM 0 HH21 ARG A 113 11.116 -14.106 7.397 1.00 53.30 H new ATOM 0 HH22 ARG A 113 10.061 -13.421 6.155 1.00 53.30 H new ATOM 1956 N ILE A 114 14.212 -17.715 2.226 1.00 62.12 N ATOM 1957 CA ILE A 114 14.280 -17.838 0.775 1.00 43.10 C ATOM 1958 C ILE A 114 14.278 -19.301 0.346 1.00 32.44 C ATOM 1959 O ILE A 114 14.310 -20.204 1.183 1.00 13.22 O ATOM 1960 CB ILE A 114 15.538 -17.151 0.210 1.00 31.42 C ATOM 1961 CG1 ILE A 114 16.784 -17.980 0.529 1.00 3.52 C ATOM 1962 CG2 ILE A 114 15.672 -15.745 0.774 1.00 54.54 C ATOM 1963 CD1 ILE A 114 17.201 -18.902 -0.595 1.00 42.42 C ATOM 0 H ILE A 114 14.718 -18.440 2.735 1.00 62.12 H new ATOM 0 HA ILE A 114 13.395 -17.344 0.375 1.00 43.10 H new ATOM 0 HB ILE A 114 15.440 -17.079 -0.873 1.00 31.42 H new ATOM 0 HG12 ILE A 114 17.609 -17.306 0.760 1.00 3.52 H new ATOM 0 HG13 ILE A 114 16.596 -18.573 1.424 1.00 3.52 H new ATOM 0 HG21 ILE A 114 16.565 -15.273 0.365 1.00 54.54 H new ATOM 0 HG22 ILE A 114 14.795 -15.158 0.501 1.00 54.54 H new ATOM 0 HG23 ILE A 114 15.752 -15.795 1.860 1.00 54.54 H new ATOM 0 HD11 ILE A 114 18.091 -19.458 -0.299 1.00 42.42 H new ATOM 0 HD12 ILE A 114 16.392 -19.600 -0.812 1.00 42.42 H new ATOM 0 HD13 ILE A 114 17.421 -18.313 -1.486 1.00 42.42 H new ATOM 1975 N ARG A 115 14.242 -19.529 -0.962 1.00 54.14 N ATOM 1976 CA ARG A 115 14.236 -20.883 -1.503 1.00 32.04 C ATOM 1977 C ARG A 115 15.136 -20.982 -2.731 1.00 20.33 C ATOM 1978 O ARG A 115 15.682 -19.982 -3.193 1.00 44.44 O ATOM 1979 CB ARG A 115 12.811 -21.304 -1.866 1.00 53.23 C ATOM 1980 CG ARG A 115 12.067 -21.983 -0.728 1.00 12.41 C ATOM 1981 CD ARG A 115 11.259 -23.173 -1.222 1.00 0.34 C ATOM 1982 NE ARG A 115 11.086 -24.185 -0.183 1.00 72.24 N ATOM 1983 CZ ARG A 115 10.127 -25.104 -0.206 1.00 61.40 C ATOM 1984 NH1 ARG A 115 9.260 -25.138 -1.209 1.00 23.53 N ATOM 1985 NH2 ARG A 115 10.034 -25.992 0.776 1.00 65.44 N ATOM 0 H ARG A 115 14.217 -18.793 -1.668 1.00 54.14 H new ATOM 0 HA ARG A 115 14.622 -21.555 -0.736 1.00 32.04 H new ATOM 0 HB2 ARG A 115 12.250 -20.424 -2.181 1.00 53.23 H new ATOM 0 HB3 ARG A 115 12.848 -21.981 -2.720 1.00 53.23 H new ATOM 0 HG2 ARG A 115 12.779 -22.314 0.028 1.00 12.41 H new ATOM 0 HG3 ARG A 115 11.403 -21.265 -0.247 1.00 12.41 H new ATOM 0 HD2 ARG A 115 10.281 -22.832 -1.562 1.00 0.34 H new ATOM 0 HD3 ARG A 115 11.758 -23.618 -2.083 1.00 0.34 H new ATOM 0 HE ARG A 115 11.737 -24.186 0.603 1.00 72.24 H new ATOM 0 HH11 ARG A 115 9.328 -24.457 -1.966 1.00 23.53 H new ATOM 0 HH12 ARG A 115 8.525 -25.845 -1.224 1.00 23.53 H new ATOM 0 HH21 ARG A 115 10.699 -25.969 1.549 1.00 65.44 H new ATOM 0 HH22 ARG A 115 9.297 -26.697 0.758 1.00 65.44 H new ATOM 1999 N GLU A 116 15.285 -22.196 -3.252 1.00 42.03 N ATOM 2000 CA GLU A 116 16.120 -22.425 -4.425 1.00 63.15 C ATOM 2001 C GLU A 116 15.682 -23.684 -5.168 1.00 20.33 C ATOM 2002 O GLU A 116 15.507 -24.743 -4.565 1.00 13.52 O ATOM 2003 CB GLU A 116 17.590 -22.546 -4.017 1.00 50.02 C ATOM 2004 CG GLU A 116 17.838 -23.585 -2.937 1.00 20.22 C ATOM 2005 CD GLU A 116 18.317 -24.909 -3.500 1.00 20.22 C ATOM 2006 OE1 GLU A 116 19.216 -24.896 -4.366 1.00 52.45 O ATOM 2007 OE2 GLU A 116 17.793 -25.959 -3.073 1.00 34.21 O ATOM 0 H GLU A 116 14.839 -23.035 -2.881 1.00 42.03 H new ATOM 0 HA GLU A 116 16.005 -21.571 -5.093 1.00 63.15 H new ATOM 0 HB2 GLU A 116 18.183 -22.799 -4.896 1.00 50.02 H new ATOM 0 HB3 GLU A 116 17.941 -21.576 -3.664 1.00 50.02 H new ATOM 0 HG2 GLU A 116 18.579 -23.204 -2.235 1.00 20.22 H new ATOM 0 HG3 GLU A 116 16.918 -23.745 -2.374 1.00 20.22 H new ATOM 2014 N GLU A 117 15.507 -23.560 -6.480 1.00 33.14 N ATOM 2015 CA GLU A 117 15.088 -24.688 -7.304 1.00 14.33 C ATOM 2016 C GLU A 117 16.204 -25.113 -8.253 1.00 3.31 C ATOM 2017 O GLU A 117 16.652 -24.330 -9.091 1.00 60.33 O ATOM 2018 CB GLU A 117 13.834 -24.326 -8.103 1.00 41.31 C ATOM 2019 CG GLU A 117 12.927 -25.512 -8.384 1.00 24.22 C ATOM 2020 CD GLU A 117 13.681 -26.827 -8.418 1.00 64.32 C ATOM 2021 OE1 GLU A 117 14.276 -27.144 -9.470 1.00 10.33 O ATOM 2022 OE2 GLU A 117 13.677 -27.540 -7.393 1.00 31.14 O ATOM 0 H GLU A 117 15.649 -22.691 -6.995 1.00 33.14 H new ATOM 0 HA GLU A 117 14.860 -25.524 -6.642 1.00 14.33 H new ATOM 0 HB2 GLU A 117 13.271 -23.570 -7.556 1.00 41.31 H new ATOM 0 HB3 GLU A 117 14.134 -23.877 -9.050 1.00 41.31 H new ATOM 0 HG2 GLU A 117 12.152 -25.561 -7.619 1.00 24.22 H new ATOM 0 HG3 GLU A 117 12.423 -25.361 -9.339 1.00 24.22 H new ATOM 2029 N ARG A 118 16.649 -26.357 -8.114 1.00 25.23 N ATOM 2030 CA ARG A 118 17.715 -26.886 -8.957 1.00 33.32 C ATOM 2031 C ARG A 118 17.148 -27.461 -10.252 1.00 24.01 C ATOM 2032 O ARG A 118 16.597 -28.562 -10.265 1.00 60.31 O ATOM 2033 CB ARG A 118 18.499 -27.965 -8.207 1.00 72.25 C ATOM 2034 CG ARG A 118 19.279 -28.896 -9.121 1.00 71.31 C ATOM 2035 CD ARG A 118 20.208 -28.123 -10.043 1.00 42.51 C ATOM 2036 NE ARG A 118 21.205 -27.357 -9.299 1.00 61.50 N ATOM 2037 CZ ARG A 118 22.340 -26.917 -9.830 1.00 41.13 C ATOM 2038 NH1 ARG A 118 22.620 -27.164 -11.102 1.00 42.24 N ATOM 2039 NH2 ARG A 118 23.197 -26.227 -9.089 1.00 24.14 N ATOM 0 H ARG A 118 16.288 -27.018 -7.426 1.00 25.23 H new ATOM 0 HA ARG A 118 18.388 -26.066 -9.207 1.00 33.32 H new ATOM 0 HB2 ARG A 118 19.191 -27.485 -7.515 1.00 72.25 H new ATOM 0 HB3 ARG A 118 17.806 -28.555 -7.607 1.00 72.25 H new ATOM 0 HG2 ARG A 118 19.860 -29.595 -8.520 1.00 71.31 H new ATOM 0 HG3 ARG A 118 18.585 -29.489 -9.716 1.00 71.31 H new ATOM 0 HD2 ARG A 118 20.712 -28.818 -10.715 1.00 42.51 H new ATOM 0 HD3 ARG A 118 19.621 -27.447 -10.665 1.00 42.51 H new ATOM 0 HE ARG A 118 21.019 -27.149 -8.318 1.00 61.50 H new ATOM 0 HH11 ARG A 118 21.963 -27.693 -11.675 1.00 42.24 H new ATOM 0 HH12 ARG A 118 23.492 -26.825 -11.507 1.00 42.24 H new ATOM 0 HH21 ARG A 118 22.985 -26.034 -8.110 1.00 24.14 H new ATOM 0 HH22 ARG A 118 24.068 -25.890 -9.498 1.00 24.14 H new ATOM 2053 N CYS A 119 17.288 -26.708 -11.338 1.00 32.55 N ATOM 2054 CA CYS A 119 16.789 -27.142 -12.638 1.00 31.22 C ATOM 2055 C CYS A 119 17.889 -27.076 -13.692 1.00 41.20 C ATOM 2056 O CYS A 119 18.083 -26.047 -14.338 1.00 1.45 O ATOM 2057 CB CYS A 119 15.602 -26.278 -13.066 1.00 43.22 C ATOM 2058 SG CYS A 119 13.995 -26.920 -12.545 1.00 34.13 S ATOM 0 H CYS A 119 17.743 -25.795 -11.344 1.00 32.55 H new ATOM 0 HA CYS A 119 16.461 -28.177 -12.547 1.00 31.22 H new ATOM 0 HB2 CYS A 119 15.730 -25.276 -12.658 1.00 43.22 H new ATOM 0 HB3 CYS A 119 15.608 -26.183 -14.152 1.00 43.22 H new ATOM 0 HG CYS A 119 13.983 -27.064 -11.253 1.00 34.13 H new ATOM 2064 N GLY A 120 18.609 -28.181 -13.860 1.00 35.41 N ATOM 2065 CA GLY A 120 19.682 -28.227 -14.836 1.00 12.14 C ATOM 2066 C GLY A 120 20.778 -27.223 -14.539 1.00 11.20 C ATOM 2067 O GLY A 120 21.034 -26.873 -13.387 1.00 31.35 O ATOM 0 H GLY A 120 18.468 -29.046 -13.337 1.00 35.41 H new ATOM 0 HA2 GLY A 120 20.108 -29.230 -14.856 1.00 12.14 H new ATOM 0 HA3 GLY A 120 19.275 -28.033 -15.828 1.00 12.14 H new ATOM 2071 N PRO A 121 21.448 -26.743 -15.597 1.00 41.30 N ATOM 2072 CA PRO A 121 22.535 -25.767 -15.470 1.00 13.14 C ATOM 2073 C PRO A 121 22.032 -24.393 -15.041 1.00 2.44 C ATOM 2074 O PRO A 121 22.519 -23.366 -15.516 1.00 41.12 O ATOM 2075 CB PRO A 121 23.123 -25.704 -16.881 1.00 73.55 C ATOM 2076 CG PRO A 121 22.004 -26.112 -17.776 1.00 73.23 C ATOM 2077 CD PRO A 121 21.196 -27.115 -16.999 1.00 65.13 C ATOM 0 HA PRO A 121 23.256 -26.058 -14.706 1.00 13.14 H new ATOM 0 HB2 PRO A 121 23.474 -24.700 -17.119 1.00 73.55 H new ATOM 0 HB3 PRO A 121 23.977 -26.373 -16.984 1.00 73.55 H new ATOM 0 HG2 PRO A 121 21.395 -25.252 -18.055 1.00 73.23 H new ATOM 0 HG3 PRO A 121 22.383 -26.548 -18.700 1.00 73.23 H new ATOM 0 HD2 PRO A 121 20.136 -27.055 -17.246 1.00 65.13 H new ATOM 0 HD3 PRO A 121 21.515 -28.136 -17.207 1.00 65.13 H new ATOM 2085 N LEU A 122 21.056 -24.380 -14.139 1.00 44.43 N ATOM 2086 CA LEU A 122 20.488 -23.130 -13.645 1.00 71.22 C ATOM 2087 C LEU A 122 20.074 -23.261 -12.183 1.00 1.01 C ATOM 2088 O LEU A 122 19.991 -24.366 -11.646 1.00 23.03 O ATOM 2089 CB LEU A 122 19.282 -22.725 -14.494 1.00 53.12 C ATOM 2090 CG LEU A 122 19.576 -22.367 -15.951 1.00 44.32 C ATOM 2091 CD1 LEU A 122 18.287 -22.290 -16.753 1.00 73.55 C ATOM 2092 CD2 LEU A 122 20.337 -21.051 -16.034 1.00 34.12 C ATOM 0 H LEU A 122 20.642 -25.220 -13.735 1.00 44.43 H new ATOM 0 HA LEU A 122 21.253 -22.357 -13.719 1.00 71.22 H new ATOM 0 HB2 LEU A 122 18.562 -23.543 -14.480 1.00 53.12 H new ATOM 0 HB3 LEU A 122 18.801 -21.869 -14.021 1.00 53.12 H new ATOM 0 HG LEU A 122 20.199 -23.152 -16.379 1.00 44.32 H new ATOM 0 HD11 LEU A 122 18.517 -22.034 -17.787 1.00 73.55 H new ATOM 0 HD12 LEU A 122 17.781 -23.255 -16.722 1.00 73.55 H new ATOM 0 HD13 LEU A 122 17.638 -21.526 -16.326 1.00 73.55 H new ATOM 0 HD21 LEU A 122 20.538 -20.812 -17.078 1.00 34.12 H new ATOM 0 HD22 LEU A 122 19.739 -20.256 -15.588 1.00 34.12 H new ATOM 0 HD23 LEU A 122 21.280 -21.141 -15.495 1.00 34.12 H new ATOM 2104 N THR A 123 19.813 -22.125 -11.543 1.00 73.23 N ATOM 2105 CA THR A 123 19.406 -22.112 -10.144 1.00 22.32 C ATOM 2106 C THR A 123 18.566 -20.881 -9.827 1.00 11.44 C ATOM 2107 O THR A 123 19.056 -19.752 -9.879 1.00 73.23 O ATOM 2108 CB THR A 123 20.626 -22.143 -9.204 1.00 63.21 C ATOM 2109 OG1 THR A 123 21.697 -22.873 -9.815 1.00 14.43 O ATOM 2110 CG2 THR A 123 20.267 -22.782 -7.871 1.00 14.41 C ATOM 0 H THR A 123 19.876 -21.202 -11.972 1.00 73.23 H new ATOM 0 HA THR A 123 18.808 -23.008 -9.981 1.00 22.32 H new ATOM 0 HB THR A 123 20.943 -21.116 -9.023 1.00 63.21 H new ATOM 0 HG1 THR A 123 22.469 -22.887 -9.212 1.00 14.43 H new ATOM 0 HG21 THR A 123 21.144 -22.792 -7.224 1.00 14.41 H new ATOM 0 HG22 THR A 123 19.472 -22.208 -7.395 1.00 14.41 H new ATOM 0 HG23 THR A 123 19.927 -23.804 -8.037 1.00 14.41 H new ATOM 2118 N PHE A 124 17.298 -21.104 -9.496 1.00 42.14 N ATOM 2119 CA PHE A 124 16.389 -20.011 -9.171 1.00 22.24 C ATOM 2120 C PHE A 124 16.307 -19.803 -7.661 1.00 65.41 C ATOM 2121 O PHE A 124 16.787 -20.629 -6.883 1.00 54.40 O ATOM 2122 CB PHE A 124 14.995 -20.294 -9.734 1.00 61.20 C ATOM 2123 CG PHE A 124 14.995 -20.611 -11.202 1.00 52.33 C ATOM 2124 CD1 PHE A 124 15.478 -21.825 -11.663 1.00 32.03 C ATOM 2125 CD2 PHE A 124 14.511 -19.694 -12.122 1.00 20.30 C ATOM 2126 CE1 PHE A 124 15.479 -22.118 -13.013 1.00 64.33 C ATOM 2127 CE2 PHE A 124 14.510 -19.982 -13.474 1.00 33.21 C ATOM 2128 CZ PHE A 124 14.994 -21.196 -13.920 1.00 34.41 C ATOM 0 H PHE A 124 16.877 -22.032 -9.446 1.00 42.14 H new ATOM 0 HA PHE A 124 16.779 -19.100 -9.626 1.00 22.24 H new ATOM 0 HB2 PHE A 124 14.555 -21.130 -9.190 1.00 61.20 H new ATOM 0 HB3 PHE A 124 14.358 -19.428 -9.557 1.00 61.20 H new ATOM 0 HD1 PHE A 124 15.858 -22.550 -10.959 1.00 32.03 H new ATOM 0 HD2 PHE A 124 14.130 -18.744 -11.778 1.00 20.30 H new ATOM 0 HE1 PHE A 124 15.859 -23.068 -13.359 1.00 64.33 H new ATOM 0 HE2 PHE A 124 14.131 -19.258 -14.181 1.00 33.21 H new ATOM 0 HZ PHE A 124 14.993 -21.424 -14.976 1.00 34.41 H new ATOM 2138 N TYR A 125 15.698 -18.695 -7.255 1.00 31.31 N ATOM 2139 CA TYR A 125 15.556 -18.376 -5.839 1.00 74.43 C ATOM 2140 C TYR A 125 14.332 -17.497 -5.599 1.00 45.44 C ATOM 2141 O TYR A 125 14.252 -16.375 -6.102 1.00 33.51 O ATOM 2142 CB TYR A 125 16.813 -17.673 -5.325 1.00 14.14 C ATOM 2143 CG TYR A 125 18.090 -18.430 -5.610 1.00 31.03 C ATOM 2144 CD1 TYR A 125 18.584 -19.362 -4.706 1.00 24.32 C ATOM 2145 CD2 TYR A 125 18.803 -18.213 -6.782 1.00 52.42 C ATOM 2146 CE1 TYR A 125 19.751 -20.056 -4.962 1.00 4.04 C ATOM 2147 CE2 TYR A 125 19.970 -18.903 -7.047 1.00 52.31 C ATOM 2148 CZ TYR A 125 20.440 -19.823 -6.134 1.00 21.13 C ATOM 2149 OH TYR A 125 21.603 -20.511 -6.393 1.00 60.52 O ATOM 0 H TYR A 125 15.295 -18.002 -7.886 1.00 31.31 H new ATOM 0 HA TYR A 125 15.422 -19.310 -5.293 1.00 74.43 H new ATOM 0 HB2 TYR A 125 16.878 -16.684 -5.779 1.00 14.14 H new ATOM 0 HB3 TYR A 125 16.721 -17.524 -4.249 1.00 14.14 H new ATOM 0 HD1 TYR A 125 18.047 -19.547 -3.788 1.00 24.32 H new ATOM 0 HD2 TYR A 125 18.439 -17.492 -7.499 1.00 52.42 H new ATOM 0 HE1 TYR A 125 20.122 -20.777 -4.248 1.00 4.04 H new ATOM 0 HE2 TYR A 125 20.511 -18.723 -7.964 1.00 52.31 H new ATOM 0 HH TYR A 125 22.371 -19.919 -6.252 1.00 60.52 H new ATOM 2159 N TYR A 126 13.383 -18.013 -4.827 1.00 70.14 N ATOM 2160 CA TYR A 126 12.162 -17.277 -4.521 1.00 3.20 C ATOM 2161 C TYR A 126 12.001 -17.092 -3.015 1.00 41.12 C ATOM 2162 O TYR A 126 12.493 -17.883 -2.210 1.00 75.43 O ATOM 2163 CB TYR A 126 10.945 -18.007 -5.090 1.00 33.34 C ATOM 2164 CG TYR A 126 11.148 -19.498 -5.238 1.00 60.24 C ATOM 2165 CD1 TYR A 126 11.769 -20.026 -6.364 1.00 11.13 C ATOM 2166 CD2 TYR A 126 10.720 -20.379 -4.253 1.00 31.12 C ATOM 2167 CE1 TYR A 126 11.956 -21.387 -6.504 1.00 31.30 C ATOM 2168 CE2 TYR A 126 10.904 -21.742 -4.384 1.00 21.01 C ATOM 2169 CZ TYR A 126 11.522 -22.241 -5.511 1.00 60.24 C ATOM 2170 OH TYR A 126 11.708 -23.598 -5.647 1.00 12.02 O ATOM 0 H TYR A 126 13.435 -18.938 -4.401 1.00 70.14 H new ATOM 0 HA TYR A 126 12.235 -16.293 -4.984 1.00 3.20 H new ATOM 0 HB2 TYR A 126 10.088 -17.828 -4.441 1.00 33.34 H new ATOM 0 HB3 TYR A 126 10.700 -17.584 -6.064 1.00 33.34 H new ATOM 0 HD1 TYR A 126 12.111 -19.360 -7.143 1.00 11.13 H new ATOM 0 HD2 TYR A 126 10.235 -19.992 -3.369 1.00 31.12 H new ATOM 0 HE1 TYR A 126 12.439 -21.781 -7.386 1.00 31.30 H new ATOM 0 HE2 TYR A 126 10.566 -22.413 -3.608 1.00 21.01 H new ATOM 0 HH TYR A 126 11.347 -24.058 -4.861 1.00 12.02 H new ATOM 2180 N PRO A 127 11.295 -16.021 -2.624 1.00 53.10 N ATOM 2181 CA PRO A 127 11.050 -15.706 -1.213 1.00 61.03 C ATOM 2182 C PRO A 127 10.097 -16.697 -0.555 1.00 32.41 C ATOM 2183 O PRO A 127 8.884 -16.491 -0.540 1.00 2.25 O ATOM 2184 CB PRO A 127 10.420 -14.312 -1.265 1.00 71.01 C ATOM 2185 CG PRO A 127 9.799 -14.227 -2.617 1.00 31.04 C ATOM 2186 CD PRO A 127 10.680 -15.035 -3.529 1.00 31.12 C ATOM 0 HA PRO A 127 11.963 -15.754 -0.620 1.00 61.03 H new ATOM 0 HB2 PRO A 127 9.676 -14.184 -0.479 1.00 71.01 H new ATOM 0 HB3 PRO A 127 11.170 -13.533 -1.124 1.00 71.01 H new ATOM 0 HG2 PRO A 127 8.783 -14.622 -2.605 1.00 31.04 H new ATOM 0 HG3 PRO A 127 9.735 -13.192 -2.953 1.00 31.04 H new ATOM 0 HD2 PRO A 127 10.105 -15.518 -4.319 1.00 31.12 H new ATOM 0 HD3 PRO A 127 11.431 -14.414 -4.016 1.00 31.12 H new ATOM 2194 N GLY A 128 10.654 -17.775 -0.011 1.00 31.31 N ATOM 2195 CA GLY A 128 9.838 -18.782 0.642 1.00 62.51 C ATOM 2196 C GLY A 128 8.613 -19.152 -0.170 1.00 52.13 C ATOM 2197 O GLY A 128 7.554 -19.440 0.387 1.00 30.32 O ATOM 0 H GLY A 128 11.655 -17.969 -0.011 1.00 31.31 H new ATOM 0 HA2 GLY A 128 10.438 -19.675 0.815 1.00 62.51 H new ATOM 0 HA3 GLY A 128 9.525 -18.414 1.619 1.00 62.51 H new ATOM 2201 N SER A 129 8.756 -19.142 -1.492 1.00 14.12 N ATOM 2202 CA SER A 129 7.650 -19.473 -2.383 1.00 33.13 C ATOM 2203 C SER A 129 7.600 -20.974 -2.652 1.00 32.12 C ATOM 2204 O SER A 129 8.622 -21.658 -2.607 1.00 30.35 O ATOM 2205 CB SER A 129 7.784 -18.711 -3.702 1.00 64.14 C ATOM 2206 OG SER A 129 6.512 -18.415 -4.252 1.00 44.04 O ATOM 0 H SER A 129 9.627 -18.908 -1.969 1.00 14.12 H new ATOM 0 HA SER A 129 6.721 -19.178 -1.894 1.00 33.13 H new ATOM 0 HB2 SER A 129 8.336 -17.786 -3.537 1.00 64.14 H new ATOM 0 HB3 SER A 129 8.361 -19.304 -4.411 1.00 64.14 H new ATOM 0 HG SER A 129 6.617 -17.794 -5.003 1.00 44.04 H new ATOM 2212 N SER A 130 6.403 -21.479 -2.932 1.00 34.11 N ATOM 2213 CA SER A 130 6.217 -22.900 -3.205 1.00 10.53 C ATOM 2214 C SER A 130 5.777 -23.122 -4.649 1.00 24.44 C ATOM 2215 O SER A 130 5.005 -22.340 -5.200 1.00 64.14 O ATOM 2216 CB SER A 130 5.182 -23.493 -2.247 1.00 62.41 C ATOM 2217 OG SER A 130 5.709 -23.612 -0.937 1.00 32.31 O ATOM 0 H SER A 130 5.547 -20.926 -2.976 1.00 34.11 H new ATOM 0 HA SER A 130 7.172 -23.403 -3.053 1.00 10.53 H new ATOM 0 HB2 SER A 130 4.294 -22.861 -2.229 1.00 62.41 H new ATOM 0 HB3 SER A 130 4.868 -24.473 -2.607 1.00 62.41 H new ATOM 0 HG SER A 130 5.028 -23.992 -0.344 1.00 32.31 H new TER 2223 SER A 130