USER MOD reduce.3.24.130724 H: found=0, std=0, add=1036, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 1065 hydrogens (21 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 Single : A 19 SER OG : rot 30:sc= 0.223 USER MOD Single : A 20 ASN : amide:sc= -0.405 X(o=-0.41,f=-0.59) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= -5.91! C(o=-5.9!,f=-8.2!) USER MOD Single : A 37 HIS : no HD1:sc= -9.89! C(o=-9.9!,f=-12!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot 33:sc= 0.216 USER MOD Single : B 20 ASN : amide:sc= -0.299 X(o=-0.3,f=-0.51) USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 SER OG : rot 180:sc= 0 USER MOD Single : B 31 ASN : amide:sc= -6.11! C(o=-6.1!,f=-9.1!) USER MOD Single : B 37 HIS : no HD1:sc= -10.1! C(o=-10!,f=-12!) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 19 SER OG : rot 35:sc= 0.23 USER MOD Single : C 20 ASN : amide:sc= -0.402 X(o=-0.4,f=-0.54) USER MOD Single : C 22 SER OG : rot 180:sc= 0 USER MOD Single : C 23 SER OG : rot 180:sc= 0 USER MOD Single : C 31 ASN : amide:sc= -6.26! C(o=-6.3!,f=-8.1!) USER MOD Single : C 37 HIS : no HD1:sc= -9.93! C(o=-9.9!,f=-12!) USER MOD Single : C 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 19 SER OG : rot 26:sc= 0.217 USER MOD Single : D 20 ASN : amide:sc= -0.28 X(o=-0.28,f=-0.47) USER MOD Single : D 22 SER OG : rot 180:sc= 0 USER MOD Single : D 23 SER OG : rot 180:sc= 0 USER MOD Single : D 31 ASN : amide:sc= -6! C(o=-6!,f=-8.3!) USER MOD Single : D 37 HIS : no HD1:sc= -9.94! C(o=-9.9!,f=-12!) USER MOD Single : D 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 19 -11.287 26.205 1.660 1.00 0.00 N ATOM 2 CA SER A 19 -10.342 26.171 2.811 1.00 0.00 C ATOM 3 C SER A 19 -9.586 24.846 2.808 1.00 0.00 C ATOM 4 O SER A 19 -9.978 23.898 2.127 1.00 0.00 O ATOM 5 CB SER A 19 -11.126 26.319 4.114 1.00 0.00 C ATOM 6 OG SER A 19 -11.946 27.477 4.040 1.00 0.00 O ATOM 0 HA SER A 19 -9.629 26.991 2.725 1.00 0.00 H new ATOM 0 HB2 SER A 19 -11.740 25.435 4.285 1.00 0.00 H new ATOM 0 HB3 SER A 19 -10.440 26.398 4.957 1.00 0.00 H new ATOM 0 HG SER A 19 -12.206 27.635 3.108 1.00 0.00 H new ATOM 14 N ASN A 20 -8.499 24.790 3.569 1.00 0.00 N ATOM 15 CA ASN A 20 -7.693 23.577 3.647 1.00 0.00 C ATOM 16 C ASN A 20 -7.236 23.148 2.256 1.00 0.00 C ATOM 17 O ASN A 20 -7.216 21.959 1.937 1.00 0.00 O ATOM 18 CB ASN A 20 -8.505 22.450 4.290 1.00 0.00 C ATOM 19 CG ASN A 20 -7.583 21.300 4.677 1.00 0.00 C ATOM 20 OD1 ASN A 20 -7.640 20.226 4.079 1.00 0.00 O ATOM 21 ND2 ASN A 20 -6.730 21.461 5.653 1.00 0.00 N ATOM 0 H ASN A 20 -8.157 25.565 4.137 1.00 0.00 H new ATOM 0 HA ASN A 20 -6.815 23.785 4.258 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -9.025 22.823 5.172 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -9.268 22.098 3.595 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -6.110 20.696 5.920 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -6.684 22.352 6.148 1.00 0.00 H new ATOM 28 N ASP A 21 -6.871 24.126 1.432 1.00 0.00 N ATOM 29 CA ASP A 21 -6.414 23.842 0.074 1.00 0.00 C ATOM 30 C ASP A 21 -4.953 23.407 0.081 1.00 0.00 C ATOM 31 O ASP A 21 -4.391 23.066 -0.959 1.00 0.00 O ATOM 32 CB ASP A 21 -6.573 25.088 -0.800 1.00 0.00 C ATOM 33 CG ASP A 21 -8.052 25.413 -0.979 1.00 0.00 C ATOM 34 OD1 ASP A 21 -8.859 24.509 -0.833 1.00 0.00 O ATOM 35 OD2 ASP A 21 -8.355 26.562 -1.257 1.00 0.00 O ATOM 0 H ASP A 21 -6.882 25.116 1.678 1.00 0.00 H new ATOM 0 HA ASP A 21 -7.020 23.032 -0.332 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -6.059 25.933 -0.341 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -6.108 24.923 -1.772 1.00 0.00 H new ATOM 40 N SER A 22 -4.344 23.427 1.262 1.00 0.00 N ATOM 41 CA SER A 22 -2.945 23.039 1.396 1.00 0.00 C ATOM 42 C SER A 22 -2.763 21.561 1.064 1.00 0.00 C ATOM 43 O SER A 22 -1.648 21.103 0.820 1.00 0.00 O ATOM 44 CB SER A 22 -2.463 23.305 2.823 1.00 0.00 C ATOM 45 OG SER A 22 -3.265 22.566 3.736 1.00 0.00 O ATOM 0 H SER A 22 -4.793 23.706 2.134 1.00 0.00 H new ATOM 0 HA SER A 22 -2.356 23.632 0.697 1.00 0.00 H new ATOM 0 HB2 SER A 22 -1.417 23.017 2.925 1.00 0.00 H new ATOM 0 HB3 SER A 22 -2.524 24.370 3.047 1.00 0.00 H new ATOM 0 HG SER A 22 -2.957 22.733 4.651 1.00 0.00 H new ATOM 51 N SER A 23 -3.867 20.818 1.055 1.00 0.00 N ATOM 52 CA SER A 23 -3.823 19.392 0.747 1.00 0.00 C ATOM 53 C SER A 23 -5.111 18.968 0.050 1.00 0.00 C ATOM 54 O SER A 23 -6.209 19.203 0.555 1.00 0.00 O ATOM 55 CB SER A 23 -3.650 18.588 2.036 1.00 0.00 C ATOM 56 OG SER A 23 -3.576 17.204 1.720 1.00 0.00 O ATOM 0 H SER A 23 -4.800 21.179 1.257 1.00 0.00 H new ATOM 0 HA SER A 23 -2.978 19.200 0.085 1.00 0.00 H new ATOM 0 HB2 SER A 23 -2.745 18.903 2.556 1.00 0.00 H new ATOM 0 HB3 SER A 23 -4.486 18.775 2.710 1.00 0.00 H new ATOM 0 HG SER A 23 -3.463 16.686 2.544 1.00 0.00 H new ATOM 62 N ASP A 24 -4.966 18.348 -1.112 1.00 0.00 N ATOM 63 CA ASP A 24 -6.125 17.903 -1.875 1.00 0.00 C ATOM 64 C ASP A 24 -6.762 16.674 -1.210 1.00 0.00 C ATOM 65 O ASP A 24 -6.079 15.905 -0.530 1.00 0.00 O ATOM 66 CB ASP A 24 -5.696 17.563 -3.318 1.00 0.00 C ATOM 67 CG ASP A 24 -5.722 18.814 -4.199 1.00 0.00 C ATOM 68 OD1 ASP A 24 -5.121 19.804 -3.813 1.00 0.00 O ATOM 69 OD2 ASP A 24 -6.347 18.762 -5.245 1.00 0.00 O ATOM 0 H ASP A 24 -4.066 18.142 -1.545 1.00 0.00 H new ATOM 0 HA ASP A 24 -6.863 18.705 -1.899 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -4.693 17.136 -3.313 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -6.363 16.807 -3.732 1.00 0.00 H new ATOM 74 N PRO A 25 -8.047 16.474 -1.396 1.00 0.00 N ATOM 75 CA PRO A 25 -8.773 15.309 -0.803 1.00 0.00 C ATOM 76 C PRO A 25 -8.301 13.981 -1.401 1.00 0.00 C ATOM 77 O PRO A 25 -8.502 12.922 -0.807 1.00 0.00 O ATOM 78 CB PRO A 25 -10.248 15.583 -1.145 1.00 0.00 C ATOM 79 CG PRO A 25 -10.209 16.480 -2.341 1.00 0.00 C ATOM 80 CD PRO A 25 -8.949 17.330 -2.185 1.00 0.00 C ATOM 0 HA PRO A 25 -8.598 15.214 0.269 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -10.781 14.657 -1.363 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -10.764 16.059 -0.311 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -10.177 15.900 -3.263 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.100 17.107 -2.389 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -8.515 17.585 -3.152 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -9.160 18.269 -1.673 1.00 0.00 H new ATOM 88 N LEU A 26 -7.686 14.045 -2.578 1.00 0.00 N ATOM 89 CA LEU A 26 -7.204 12.835 -3.237 1.00 0.00 C ATOM 90 C LEU A 26 -6.137 12.153 -2.387 1.00 0.00 C ATOM 91 O LEU A 26 -6.145 10.932 -2.229 1.00 0.00 O ATOM 92 CB LEU A 26 -6.621 13.181 -4.614 1.00 0.00 C ATOM 93 CG LEU A 26 -6.142 11.907 -5.331 1.00 0.00 C ATOM 94 CD1 LEU A 26 -7.310 10.927 -5.530 1.00 0.00 C ATOM 95 CD2 LEU A 26 -5.550 12.297 -6.691 1.00 0.00 C ATOM 0 H LEU A 26 -7.511 14.910 -3.090 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.045 12.153 -3.362 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -7.375 13.684 -5.219 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.789 13.876 -4.499 1.00 0.00 H new ATOM 0 HG LEU A 26 -5.384 11.414 -4.722 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -6.951 10.032 -6.039 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -7.723 10.652 -4.560 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -8.084 11.401 -6.133 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -5.207 11.401 -7.209 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -6.313 12.793 -7.291 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -4.709 12.974 -6.541 1.00 0.00 H new ATOM 107 N VAL A 27 -5.220 12.946 -1.844 1.00 0.00 N ATOM 108 CA VAL A 27 -4.152 12.402 -1.014 1.00 0.00 C ATOM 109 C VAL A 27 -4.728 11.761 0.246 1.00 0.00 C ATOM 110 O VAL A 27 -4.309 10.676 0.648 1.00 0.00 O ATOM 111 CB VAL A 27 -3.170 13.516 -0.631 1.00 0.00 C ATOM 112 CG1 VAL A 27 -2.155 12.988 0.385 1.00 0.00 C ATOM 113 CG2 VAL A 27 -2.432 13.988 -1.887 1.00 0.00 C ATOM 0 H VAL A 27 -5.194 13.959 -1.962 1.00 0.00 H new ATOM 0 HA VAL A 27 -3.624 11.637 -1.583 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.720 14.347 -0.189 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -1.460 13.784 0.653 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.678 12.647 1.278 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -1.602 12.156 -0.051 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.732 14.780 -1.622 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -1.885 13.152 -2.324 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -3.153 14.368 -2.611 1.00 0.00 H new ATOM 123 N VAL A 28 -5.687 12.440 0.859 1.00 0.00 N ATOM 124 CA VAL A 28 -6.314 11.933 2.073 1.00 0.00 C ATOM 125 C VAL A 28 -7.002 10.599 1.799 1.00 0.00 C ATOM 126 O VAL A 28 -6.896 9.661 2.589 1.00 0.00 O ATOM 127 CB VAL A 28 -7.337 12.942 2.597 1.00 0.00 C ATOM 128 CG1 VAL A 28 -8.009 12.384 3.855 1.00 0.00 C ATOM 129 CG2 VAL A 28 -6.626 14.258 2.930 1.00 0.00 C ATOM 0 H VAL A 28 -6.047 13.339 0.538 1.00 0.00 H new ATOM 0 HA VAL A 28 -5.540 11.783 2.825 1.00 0.00 H new ATOM 0 HB VAL A 28 -8.096 13.123 1.836 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -8.738 13.104 4.228 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -8.514 11.448 3.613 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -7.254 12.202 4.620 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -7.352 14.980 3.304 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -5.867 14.079 3.692 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -6.152 14.653 2.031 1.00 0.00 H new ATOM 139 N ALA A 29 -7.711 10.522 0.677 1.00 0.00 N ATOM 140 CA ALA A 29 -8.412 9.297 0.318 1.00 0.00 C ATOM 141 C ALA A 29 -7.443 8.123 0.258 1.00 0.00 C ATOM 142 O ALA A 29 -7.755 7.027 0.720 1.00 0.00 O ATOM 143 CB ALA A 29 -9.089 9.461 -1.045 1.00 0.00 C ATOM 0 H ALA A 29 -7.814 11.285 0.008 1.00 0.00 H new ATOM 0 HA ALA A 29 -9.165 9.099 1.080 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.611 8.540 -1.305 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -9.804 10.283 -1.000 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.335 9.677 -1.802 1.00 0.00 H new ATOM 149 N ALA A 30 -6.267 8.355 -0.310 1.00 0.00 N ATOM 150 CA ALA A 30 -5.268 7.298 -0.417 1.00 0.00 C ATOM 151 C ALA A 30 -4.860 6.801 0.966 1.00 0.00 C ATOM 152 O ALA A 30 -4.719 5.598 1.186 1.00 0.00 O ATOM 153 CB ALA A 30 -4.033 7.817 -1.154 1.00 0.00 C ATOM 0 H ALA A 30 -5.983 9.254 -0.700 1.00 0.00 H new ATOM 0 HA ALA A 30 -5.705 6.470 -0.975 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -3.293 7.021 -1.229 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -4.317 8.144 -2.154 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -3.608 8.657 -0.605 1.00 0.00 H new ATOM 159 N ASN A 31 -4.672 7.733 1.896 1.00 0.00 N ATOM 160 CA ASN A 31 -4.279 7.370 3.251 1.00 0.00 C ATOM 161 C ASN A 31 -5.388 6.576 3.938 1.00 0.00 C ATOM 162 O ASN A 31 -5.121 5.584 4.620 1.00 0.00 O ATOM 163 CB ASN A 31 -3.978 8.632 4.061 1.00 0.00 C ATOM 164 CG ASN A 31 -3.535 8.261 5.472 1.00 0.00 C ATOM 165 OD1 ASN A 31 -3.891 7.198 5.980 1.00 0.00 O ATOM 166 ND2 ASN A 31 -2.769 9.079 6.138 1.00 0.00 N ATOM 0 H ASN A 31 -4.784 8.734 1.738 1.00 0.00 H new ATOM 0 HA ASN A 31 -3.385 6.750 3.196 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -3.198 9.211 3.568 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -4.865 9.264 4.105 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -2.464 8.838 7.081 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -2.475 9.960 5.716 1.00 0.00 H new ATOM 173 N ILE A 32 -6.629 7.018 3.760 1.00 0.00 N ATOM 174 CA ILE A 32 -7.767 6.342 4.372 1.00 0.00 C ATOM 175 C ILE A 32 -7.920 4.933 3.803 1.00 0.00 C ATOM 176 O ILE A 32 -8.149 3.978 4.542 1.00 0.00 O ATOM 177 CB ILE A 32 -9.050 7.144 4.126 1.00 0.00 C ATOM 178 CG1 ILE A 32 -8.972 8.467 4.896 1.00 0.00 C ATOM 179 CG2 ILE A 32 -10.265 6.345 4.613 1.00 0.00 C ATOM 180 CD1 ILE A 32 -10.104 9.389 4.441 1.00 0.00 C ATOM 0 H ILE A 32 -6.871 7.836 3.201 1.00 0.00 H new ATOM 0 HA ILE A 32 -7.590 6.270 5.445 1.00 0.00 H new ATOM 0 HB ILE A 32 -9.154 7.341 3.059 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -9.048 8.282 5.967 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -8.008 8.945 4.723 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -11.174 6.920 4.435 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -10.321 5.401 4.070 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -10.165 6.145 5.680 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -10.049 10.330 4.988 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -10.007 9.584 3.373 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -11.064 8.911 4.637 1.00 0.00 H new ATOM 192 N ILE A 33 -7.788 4.816 2.486 1.00 0.00 N ATOM 193 CA ILE A 33 -7.911 3.522 1.826 1.00 0.00 C ATOM 194 C ILE A 33 -6.818 2.570 2.305 1.00 0.00 C ATOM 195 O ILE A 33 -7.080 1.398 2.572 1.00 0.00 O ATOM 196 CB ILE A 33 -7.826 3.706 0.306 1.00 0.00 C ATOM 197 CG1 ILE A 33 -9.074 4.438 -0.193 1.00 0.00 C ATOM 198 CG2 ILE A 33 -7.729 2.341 -0.380 1.00 0.00 C ATOM 199 CD1 ILE A 33 -8.838 4.921 -1.626 1.00 0.00 C ATOM 0 H ILE A 33 -7.597 5.597 1.858 1.00 0.00 H new ATOM 0 HA ILE A 33 -8.878 3.088 2.080 1.00 0.00 H new ATOM 0 HB ILE A 33 -6.939 4.292 0.067 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -9.937 3.774 -0.158 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -9.297 5.285 0.456 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -7.669 2.480 -1.459 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -6.837 1.821 -0.031 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -8.612 1.749 -0.139 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -9.725 5.443 -1.985 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -7.985 5.599 -1.645 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -8.635 4.065 -2.270 1.00 0.00 H new ATOM 211 N GLY A 34 -5.593 3.075 2.406 1.00 0.00 N ATOM 212 CA GLY A 34 -4.477 2.247 2.849 1.00 0.00 C ATOM 213 C GLY A 34 -4.726 1.685 4.246 1.00 0.00 C ATOM 214 O GLY A 34 -4.462 0.512 4.509 1.00 0.00 O ATOM 0 H GLY A 34 -5.349 4.042 2.190 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -4.327 1.428 2.146 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -3.561 2.837 2.850 1.00 0.00 H new ATOM 218 N ILE A 35 -5.234 2.528 5.139 1.00 0.00 N ATOM 219 CA ILE A 35 -5.515 2.102 6.507 1.00 0.00 C ATOM 220 C ILE A 35 -6.601 1.026 6.518 1.00 0.00 C ATOM 221 O ILE A 35 -6.498 0.032 7.238 1.00 0.00 O ATOM 222 CB ILE A 35 -5.961 3.305 7.346 1.00 0.00 C ATOM 223 CG1 ILE A 35 -4.787 4.274 7.506 1.00 0.00 C ATOM 224 CG2 ILE A 35 -6.409 2.829 8.732 1.00 0.00 C ATOM 225 CD1 ILE A 35 -5.284 5.602 8.084 1.00 0.00 C ATOM 0 H ILE A 35 -5.459 3.504 4.943 1.00 0.00 H new ATOM 0 HA ILE A 35 -4.605 1.683 6.937 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.790 3.806 6.846 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -4.033 3.841 8.163 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -4.309 4.443 6.541 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -6.725 3.686 9.326 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.242 2.133 8.626 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -5.579 2.328 9.231 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -4.444 6.287 8.196 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -6.022 6.039 7.411 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.741 5.427 9.058 1.00 0.00 H new ATOM 237 N LEU A 36 -7.641 1.241 5.719 1.00 0.00 N ATOM 238 CA LEU A 36 -8.749 0.294 5.640 1.00 0.00 C ATOM 239 C LEU A 36 -8.259 -1.059 5.130 1.00 0.00 C ATOM 240 O LEU A 36 -8.678 -2.108 5.620 1.00 0.00 O ATOM 241 CB LEU A 36 -9.832 0.842 4.705 1.00 0.00 C ATOM 242 CG LEU A 36 -10.515 2.062 5.342 1.00 0.00 C ATOM 243 CD1 LEU A 36 -11.342 2.780 4.272 1.00 0.00 C ATOM 244 CD2 LEU A 36 -11.438 1.633 6.498 1.00 0.00 C ATOM 0 H LEU A 36 -7.740 2.060 5.119 1.00 0.00 H new ATOM 0 HA LEU A 36 -9.167 0.159 6.638 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -9.390 1.122 3.749 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -10.571 0.068 4.500 1.00 0.00 H new ATOM 0 HG LEU A 36 -9.749 2.727 5.742 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -11.832 3.648 4.713 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -10.687 3.104 3.463 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -12.096 2.099 3.878 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -11.910 2.514 6.933 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -12.207 0.959 6.119 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -10.852 1.122 7.261 1.00 0.00 H new ATOM 256 N HIS A 37 -7.365 -1.030 4.147 1.00 0.00 N ATOM 257 CA HIS A 37 -6.825 -2.262 3.589 1.00 0.00 C ATOM 258 C HIS A 37 -6.136 -3.080 4.677 1.00 0.00 C ATOM 259 O HIS A 37 -6.284 -4.300 4.736 1.00 0.00 O ATOM 260 CB HIS A 37 -5.816 -1.940 2.491 1.00 0.00 C ATOM 261 CG HIS A 37 -5.310 -3.227 1.897 1.00 0.00 C ATOM 262 ND1 HIS A 37 -5.511 -3.556 0.570 1.00 0.00 N ATOM 263 CD2 HIS A 37 -4.625 -4.283 2.443 1.00 0.00 C ATOM 264 CE1 HIS A 37 -4.959 -4.763 0.364 1.00 0.00 C ATOM 265 NE2 HIS A 37 -4.404 -5.251 1.471 1.00 0.00 N ATOM 0 H HIS A 37 -7.003 -0.175 3.724 1.00 0.00 H new ATOM 0 HA HIS A 37 -7.649 -2.840 3.171 1.00 0.00 H new ATOM 0 HB2 HIS A 37 -6.282 -1.327 1.720 1.00 0.00 H new ATOM 0 HB3 HIS A 37 -4.987 -1.362 2.899 1.00 0.00 H new ATOM 0 HD2 HIS A 37 -4.306 -4.351 3.472 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -4.965 -5.276 -0.586 1.00 0.00 H new ATOM 0 HE2 HIS A 37 -3.921 -6.143 1.582 1.00 0.00 H new ATOM 273 N LEU A 38 -5.376 -2.401 5.533 1.00 0.00 N ATOM 274 CA LEU A 38 -4.662 -3.082 6.611 1.00 0.00 C ATOM 275 C LEU A 38 -5.628 -3.792 7.544 1.00 0.00 C ATOM 276 O LEU A 38 -5.355 -4.903 7.985 1.00 0.00 O ATOM 277 CB LEU A 38 -3.799 -2.069 7.407 1.00 0.00 C ATOM 278 CG LEU A 38 -2.363 -2.024 6.844 1.00 0.00 C ATOM 279 CD1 LEU A 38 -1.684 -0.711 7.237 1.00 0.00 C ATOM 280 CD2 LEU A 38 -1.547 -3.200 7.414 1.00 0.00 C ATOM 0 H LEU A 38 -5.239 -1.391 5.503 1.00 0.00 H new ATOM 0 HA LEU A 38 -4.009 -3.831 6.163 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.249 -1.078 7.353 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -3.775 -2.351 8.460 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.410 -2.096 5.757 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -0.671 -0.690 6.834 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.252 0.127 6.834 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.644 -0.633 8.323 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -0.533 -3.166 7.015 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.512 -3.126 8.501 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.018 -4.141 7.130 1.00 0.00 H new ATOM 292 N ILE A 39 -6.745 -3.159 7.849 1.00 0.00 N ATOM 293 CA ILE A 39 -7.717 -3.769 8.739 1.00 0.00 C ATOM 294 C ILE A 39 -8.250 -5.068 8.135 1.00 0.00 C ATOM 295 O ILE A 39 -8.389 -6.074 8.826 1.00 0.00 O ATOM 296 CB ILE A 39 -8.868 -2.795 8.985 1.00 0.00 C ATOM 297 CG1 ILE A 39 -8.346 -1.595 9.779 1.00 0.00 C ATOM 298 CG2 ILE A 39 -9.973 -3.496 9.779 1.00 0.00 C ATOM 299 CD1 ILE A 39 -9.420 -0.508 9.830 1.00 0.00 C ATOM 0 H ILE A 39 -7.001 -2.235 7.500 1.00 0.00 H new ATOM 0 HA ILE A 39 -7.232 -4.002 9.687 1.00 0.00 H new ATOM 0 HB ILE A 39 -9.273 -2.456 8.032 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.078 -1.903 10.790 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -7.441 -1.204 9.314 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -10.793 -2.800 9.954 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -10.339 -4.353 9.214 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -9.575 -3.835 10.735 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -9.047 0.346 10.396 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -9.666 -0.192 8.816 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -10.313 -0.902 10.314 1.00 0.00 H new ATOM 311 N LEU A 40 -8.561 -5.043 6.849 1.00 0.00 N ATOM 312 CA LEU A 40 -9.077 -6.231 6.184 1.00 0.00 C ATOM 313 C LEU A 40 -7.974 -7.266 5.964 1.00 0.00 C ATOM 314 O LEU A 40 -8.185 -8.463 6.171 1.00 0.00 O ATOM 315 CB LEU A 40 -9.697 -5.833 4.848 1.00 0.00 C ATOM 316 CG LEU A 40 -10.909 -4.924 5.095 1.00 0.00 C ATOM 317 CD1 LEU A 40 -11.397 -4.381 3.751 1.00 0.00 C ATOM 318 CD2 LEU A 40 -12.042 -5.705 5.790 1.00 0.00 C ATOM 0 H LEU A 40 -8.467 -4.223 6.249 1.00 0.00 H new ATOM 0 HA LEU A 40 -9.836 -6.684 6.822 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -8.960 -5.316 4.233 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -10.003 -6.723 4.298 1.00 0.00 H new ATOM 0 HG LEU A 40 -10.616 -4.101 5.747 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -12.259 -3.733 3.912 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -10.598 -3.811 3.277 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -11.683 -5.211 3.105 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -12.892 -5.043 5.956 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -12.350 -6.539 5.159 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -11.687 -6.087 6.747 1.00 0.00 H new ATOM 330 N TRP A 41 -6.803 -6.804 5.530 1.00 0.00 N ATOM 331 CA TRP A 41 -5.681 -7.703 5.273 1.00 0.00 C ATOM 332 C TRP A 41 -5.155 -8.325 6.567 1.00 0.00 C ATOM 333 O TRP A 41 -4.910 -9.529 6.628 1.00 0.00 O ATOM 334 CB TRP A 41 -4.558 -6.934 4.565 1.00 0.00 C ATOM 335 CG TRP A 41 -3.327 -7.784 4.488 1.00 0.00 C ATOM 336 CD1 TRP A 41 -3.070 -8.704 3.529 1.00 0.00 C ATOM 337 CD2 TRP A 41 -2.169 -7.780 5.368 1.00 0.00 C ATOM 338 NE1 TRP A 41 -1.843 -9.286 3.785 1.00 0.00 N ATOM 339 CE2 TRP A 41 -1.246 -8.741 4.902 1.00 0.00 C ATOM 340 CE3 TRP A 41 -1.836 -7.045 6.520 1.00 0.00 C ATOM 341 CZ2 TRP A 41 -0.036 -8.964 5.554 1.00 0.00 C ATOM 342 CZ3 TRP A 41 -0.614 -7.262 7.174 1.00 0.00 C ATOM 343 CH2 TRP A 41 0.281 -8.221 6.692 1.00 0.00 C ATOM 0 H TRP A 41 -6.607 -5.819 5.350 1.00 0.00 H new ATOM 0 HA TRP A 41 -6.032 -8.513 4.633 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -4.877 -6.649 3.562 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -4.341 -6.012 5.104 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -3.718 -8.944 2.699 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -1.430 -10.027 3.218 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -2.526 -6.308 6.904 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 0.653 -9.707 5.181 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -0.364 -6.686 8.053 1.00 0.00 H new ATOM 0 HH2 TRP A 41 1.219 -8.387 7.201 1.00 0.00 H new ATOM 354 N ILE A 42 -4.966 -7.499 7.590 1.00 0.00 N ATOM 355 CA ILE A 42 -4.446 -7.992 8.861 1.00 0.00 C ATOM 356 C ILE A 42 -5.429 -8.974 9.493 1.00 0.00 C ATOM 357 O ILE A 42 -5.032 -10.007 10.029 1.00 0.00 O ATOM 358 CB ILE A 42 -4.183 -6.810 9.817 1.00 0.00 C ATOM 359 CG1 ILE A 42 -3.283 -7.263 10.989 1.00 0.00 C ATOM 360 CG2 ILE A 42 -5.514 -6.283 10.374 1.00 0.00 C ATOM 361 CD1 ILE A 42 -1.804 -7.210 10.585 1.00 0.00 C ATOM 0 H ILE A 42 -5.162 -6.498 7.567 1.00 0.00 H new ATOM 0 HA ILE A 42 -3.507 -8.513 8.677 1.00 0.00 H new ATOM 0 HB ILE A 42 -3.680 -6.018 9.262 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -3.453 -6.622 11.854 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -3.548 -8.277 11.287 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -5.321 -5.449 11.048 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -6.145 -5.947 9.551 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -6.022 -7.079 10.918 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -1.186 -7.532 11.423 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -1.635 -7.871 9.735 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -1.538 -6.189 10.310 1.00 0.00 H new ATOM 373 N LEU A 43 -6.712 -8.642 9.420 1.00 0.00 N ATOM 374 CA LEU A 43 -7.748 -9.498 9.983 1.00 0.00 C ATOM 375 C LEU A 43 -7.776 -10.847 9.270 1.00 0.00 C ATOM 376 O LEU A 43 -7.947 -11.889 9.901 1.00 0.00 O ATOM 377 CB LEU A 43 -9.115 -8.809 9.861 1.00 0.00 C ATOM 378 CG LEU A 43 -9.279 -7.747 10.965 1.00 0.00 C ATOM 379 CD1 LEU A 43 -10.530 -6.908 10.677 1.00 0.00 C ATOM 380 CD2 LEU A 43 -9.408 -8.419 12.352 1.00 0.00 C ATOM 0 H LEU A 43 -7.059 -7.790 8.979 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.525 -9.670 11.036 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.208 -8.342 8.881 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -9.911 -9.549 9.938 1.00 0.00 H new ATOM 0 HG LEU A 43 -8.398 -7.106 10.973 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -10.650 -6.155 11.456 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -10.424 -6.416 9.710 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -11.407 -7.556 10.660 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -9.523 -7.652 13.118 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -10.280 -9.073 12.360 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -8.512 -9.005 12.557 1.00 0.00 H new ATOM 392 N ASP A 44 -7.612 -10.825 7.954 1.00 0.00 N ATOM 393 CA ASP A 44 -7.632 -12.057 7.180 1.00 0.00 C ATOM 394 C ASP A 44 -6.565 -13.020 7.684 1.00 0.00 C ATOM 395 O ASP A 44 -6.818 -14.212 7.852 1.00 0.00 O ATOM 396 CB ASP A 44 -7.376 -11.739 5.705 1.00 0.00 C ATOM 397 CG ASP A 44 -8.598 -11.054 5.103 1.00 0.00 C ATOM 398 OD1 ASP A 44 -9.652 -11.126 5.710 1.00 0.00 O ATOM 399 OD2 ASP A 44 -8.460 -10.462 4.044 1.00 0.00 O ATOM 0 H ASP A 44 -7.465 -9.977 7.406 1.00 0.00 H new ATOM 0 HA ASP A 44 -8.610 -12.525 7.292 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -6.503 -11.094 5.609 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -7.156 -12.656 5.159 1.00 0.00 H new ATOM 404 N ARG A 45 -5.375 -12.493 7.934 1.00 0.00 N ATOM 405 CA ARG A 45 -4.280 -13.315 8.428 1.00 0.00 C ATOM 406 C ARG A 45 -4.594 -13.842 9.821 1.00 0.00 C ATOM 407 O ARG A 45 -4.252 -14.976 10.161 1.00 0.00 O ATOM 408 CB ARG A 45 -2.994 -12.492 8.469 1.00 0.00 C ATOM 409 CG ARG A 45 -2.644 -11.980 7.064 1.00 0.00 C ATOM 410 CD ARG A 45 -2.244 -13.138 6.140 1.00 0.00 C ATOM 411 NE ARG A 45 -1.293 -14.019 6.810 1.00 0.00 N ATOM 412 CZ ARG A 45 0.011 -13.756 6.806 1.00 0.00 C ATOM 413 NH1 ARG A 45 0.464 -12.714 6.163 1.00 0.00 N ATOM 414 NH2 ARG A 45 0.834 -14.543 7.442 1.00 0.00 N ATOM 0 H ARG A 45 -5.144 -11.508 7.804 1.00 0.00 H new ATOM 0 HA ARG A 45 -4.150 -14.162 7.754 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -3.115 -11.650 9.151 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -2.177 -13.101 8.856 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -3.499 -11.452 6.642 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -1.826 -11.262 7.128 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -3.130 -13.703 5.850 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -1.802 -12.745 5.224 1.00 0.00 H new ATOM 0 HE ARG A 45 -1.634 -14.852 7.290 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -0.182 -12.102 5.664 1.00 0.00 H new ATOM 0 HH12 ARG A 45 1.464 -12.512 6.160 1.00 0.00 H new ATOM 0 HH21 ARG A 45 0.477 -15.358 7.941 1.00 0.00 H new ATOM 0 HH22 ARG A 45 1.834 -14.343 7.440 1.00 0.00 H new ATOM 428 N LEU A 46 -5.241 -13.013 10.629 1.00 0.00 N ATOM 429 CA LEU A 46 -5.586 -13.410 11.984 1.00 0.00 C ATOM 430 C LEU A 46 -6.528 -14.608 11.974 1.00 0.00 C ATOM 431 O LEU A 46 -6.346 -15.558 12.735 1.00 0.00 O ATOM 432 CB LEU A 46 -6.252 -12.232 12.715 1.00 0.00 C ATOM 433 CG LEU A 46 -6.623 -12.632 14.167 1.00 0.00 C ATOM 434 CD1 LEU A 46 -6.312 -11.477 15.126 1.00 0.00 C ATOM 435 CD2 LEU A 46 -8.122 -12.958 14.274 1.00 0.00 C ATOM 0 H LEU A 46 -5.534 -12.071 10.372 1.00 0.00 H new ATOM 0 HA LEU A 46 -4.672 -13.694 12.505 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -5.577 -11.377 12.729 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -7.148 -11.922 12.177 1.00 0.00 H new ATOM 0 HG LEU A 46 -6.037 -13.512 14.432 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -6.576 -11.767 16.143 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -5.249 -11.242 15.080 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -6.890 -10.599 14.838 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -8.361 -13.236 15.300 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -8.706 -12.083 13.990 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -8.363 -13.787 13.608 1.00 0.00 H new ATOM 447 N PHE A 47 -7.538 -14.561 11.110 1.00 0.00 N ATOM 448 CA PHE A 47 -8.498 -15.657 11.026 1.00 0.00 C ATOM 449 C PHE A 47 -7.870 -16.886 10.377 1.00 0.00 C ATOM 450 O PHE A 47 -7.866 -17.975 10.954 1.00 0.00 O ATOM 451 CB PHE A 47 -9.723 -15.222 10.216 1.00 0.00 C ATOM 452 CG PHE A 47 -10.540 -14.236 11.022 1.00 0.00 C ATOM 453 CD1 PHE A 47 -11.185 -14.661 12.189 1.00 0.00 C ATOM 454 CD2 PHE A 47 -10.650 -12.902 10.609 1.00 0.00 C ATOM 455 CE1 PHE A 47 -11.940 -13.754 12.943 1.00 0.00 C ATOM 456 CE2 PHE A 47 -11.405 -11.993 11.364 1.00 0.00 C ATOM 457 CZ PHE A 47 -12.050 -12.422 12.531 1.00 0.00 C ATOM 0 H PHE A 47 -7.712 -13.788 10.467 1.00 0.00 H new ATOM 0 HA PHE A 47 -8.803 -15.916 12.040 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -9.408 -14.767 9.277 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -10.330 -16.091 9.961 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -11.100 -15.689 12.508 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -10.153 -12.573 9.708 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -12.438 -14.083 13.843 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -11.489 -10.964 11.046 1.00 0.00 H new ATOM 0 HZ PHE A 47 -12.633 -11.724 13.113 1.00 0.00 H new ATOM 467 N PHE A 48 -7.338 -16.704 9.169 1.00 0.00 N ATOM 468 CA PHE A 48 -6.702 -17.798 8.432 1.00 0.00 C ATOM 469 C PHE A 48 -5.398 -17.329 7.803 1.00 0.00 C ATOM 470 O PHE A 48 -5.267 -16.171 7.412 1.00 0.00 O ATOM 471 CB PHE A 48 -7.644 -18.305 7.339 1.00 0.00 C ATOM 472 CG PHE A 48 -8.799 -19.042 7.973 1.00 0.00 C ATOM 473 CD1 PHE A 48 -8.656 -20.392 8.317 1.00 0.00 C ATOM 474 CD2 PHE A 48 -10.006 -18.380 8.222 1.00 0.00 C ATOM 475 CE1 PHE A 48 -9.722 -21.080 8.909 1.00 0.00 C ATOM 476 CE2 PHE A 48 -11.072 -19.068 8.813 1.00 0.00 C ATOM 477 CZ PHE A 48 -10.930 -20.418 9.157 1.00 0.00 C ATOM 0 H PHE A 48 -7.334 -15.809 8.679 1.00 0.00 H new ATOM 0 HA PHE A 48 -6.486 -18.607 9.130 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -8.014 -17.469 6.746 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -7.107 -18.965 6.658 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -7.724 -20.902 8.126 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -10.115 -17.338 7.958 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -9.612 -22.121 9.174 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -12.004 -18.558 9.004 1.00 0.00 H new ATOM 0 HZ PHE A 48 -11.753 -20.948 9.614 1.00 0.00 H new ATOM 487 N LYS A 49 -4.437 -18.240 7.702 1.00 0.00 N ATOM 488 CA LYS A 49 -3.146 -17.911 7.117 1.00 0.00 C ATOM 489 C LYS A 49 -3.303 -17.537 5.646 1.00 0.00 C ATOM 490 O LYS A 49 -2.493 -16.766 5.161 1.00 0.00 O ATOM 491 CB LYS A 49 -2.201 -19.105 7.239 1.00 0.00 C ATOM 492 CG LYS A 49 -1.873 -19.350 8.716 1.00 0.00 C ATOM 493 CD LYS A 49 -0.855 -20.490 8.851 1.00 0.00 C ATOM 494 CE LYS A 49 -1.502 -21.838 8.511 1.00 0.00 C ATOM 495 NZ LYS A 49 -0.616 -22.942 8.987 1.00 0.00 N ATOM 496 OXT LYS A 49 -4.231 -18.031 5.025 1.00 0.00 O ATOM 0 H LYS A 49 -4.528 -19.206 8.016 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.731 -17.059 7.656 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.662 -19.993 6.806 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.285 -18.916 6.679 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.472 -18.440 9.163 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.783 -19.599 9.262 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.009 -20.309 8.188 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.463 -20.515 9.868 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -2.482 -21.914 8.982 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -1.658 -21.919 7.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -1.051 -23.859 8.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 0.309 -22.871 8.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -0.489 -22.866 10.016 1.00 0.00 H new TER 510 LYS A 49 ATOM 511 N SER B 19 0.257 24.159 -15.135 1.00 0.00 N ATOM 512 CA SER B 19 -0.883 24.364 -14.198 1.00 0.00 C ATOM 513 C SER B 19 -0.973 23.179 -13.244 1.00 0.00 C ATOM 514 O SER B 19 -0.374 22.129 -13.482 1.00 0.00 O ATOM 515 CB SER B 19 -2.181 24.488 -14.998 1.00 0.00 C ATOM 516 OG SER B 19 -2.025 25.494 -15.990 1.00 0.00 O ATOM 0 HA SER B 19 -0.727 25.277 -13.623 1.00 0.00 H new ATOM 0 HB2 SER B 19 -2.426 23.534 -15.466 1.00 0.00 H new ATOM 0 HB3 SER B 19 -3.008 24.740 -14.335 1.00 0.00 H new ATOM 0 HG SER B 19 -1.097 25.503 -16.303 1.00 0.00 H new ATOM 524 N ASN B 20 -1.724 23.353 -12.162 1.00 0.00 N ATOM 525 CA ASN B 20 -1.886 22.293 -11.175 1.00 0.00 C ATOM 526 C ASN B 20 -0.527 21.830 -10.657 1.00 0.00 C ATOM 527 O ASN B 20 -0.304 20.639 -10.448 1.00 0.00 O ATOM 528 CB ASN B 20 -2.625 21.107 -11.801 1.00 0.00 C ATOM 529 CG ASN B 20 -3.095 20.152 -10.709 1.00 0.00 C ATOM 530 OD1 ASN B 20 -2.584 19.038 -10.594 1.00 0.00 O ATOM 531 ND2 ASN B 20 -4.045 20.524 -9.894 1.00 0.00 N ATOM 0 H ASN B 20 -2.228 24.214 -11.947 1.00 0.00 H new ATOM 0 HA ASN B 20 -2.466 22.685 -10.340 1.00 0.00 H new ATOM 0 HB2 ASN B 20 -3.479 21.463 -12.377 1.00 0.00 H new ATOM 0 HB3 ASN B 20 -1.968 20.584 -12.496 1.00 0.00 H new ATOM 0 HD21 ASN B 20 -4.365 19.891 -9.161 1.00 0.00 H new ATOM 0 HD22 ASN B 20 -4.467 21.447 -9.991 1.00 0.00 H new ATOM 538 N ASP B 21 0.376 22.784 -10.454 1.00 0.00 N ATOM 539 CA ASP B 21 1.713 22.469 -9.958 1.00 0.00 C ATOM 540 C ASP B 21 1.689 22.272 -8.445 1.00 0.00 C ATOM 541 O ASP B 21 2.706 21.942 -7.837 1.00 0.00 O ATOM 542 CB ASP B 21 2.681 23.600 -10.312 1.00 0.00 C ATOM 543 CG ASP B 21 2.870 23.668 -11.823 1.00 0.00 C ATOM 544 OD1 ASP B 21 2.651 22.661 -12.475 1.00 0.00 O ATOM 545 OD2 ASP B 21 3.228 24.730 -12.307 1.00 0.00 O ATOM 0 H ASP B 21 0.209 23.776 -10.624 1.00 0.00 H new ATOM 0 HA ASP B 21 2.047 21.545 -10.429 1.00 0.00 H new ATOM 0 HB2 ASP B 21 2.295 24.550 -9.942 1.00 0.00 H new ATOM 0 HB3 ASP B 21 3.641 23.434 -9.824 1.00 0.00 H new ATOM 550 N SER B 22 0.522 22.480 -7.848 1.00 0.00 N ATOM 551 CA SER B 22 0.373 22.327 -6.405 1.00 0.00 C ATOM 552 C SER B 22 0.586 20.874 -5.994 1.00 0.00 C ATOM 553 O SER B 22 0.806 20.577 -4.819 1.00 0.00 O ATOM 554 CB SER B 22 -1.020 22.781 -5.971 1.00 0.00 C ATOM 555 OG SER B 22 -2.000 22.005 -6.647 1.00 0.00 O ATOM 0 H SER B 22 -0.331 22.753 -8.336 1.00 0.00 H new ATOM 0 HA SER B 22 1.125 22.946 -5.916 1.00 0.00 H new ATOM 0 HB2 SER B 22 -1.132 22.669 -4.893 1.00 0.00 H new ATOM 0 HB3 SER B 22 -1.157 23.838 -6.198 1.00 0.00 H new ATOM 0 HG SER B 22 -2.894 22.293 -6.369 1.00 0.00 H new ATOM 561 N SER B 23 0.525 19.970 -6.968 1.00 0.00 N ATOM 562 CA SER B 23 0.716 18.548 -6.701 1.00 0.00 C ATOM 563 C SER B 23 1.360 17.871 -7.905 1.00 0.00 C ATOM 564 O SER B 23 0.862 17.970 -9.026 1.00 0.00 O ATOM 565 CB SER B 23 -0.630 17.889 -6.403 1.00 0.00 C ATOM 566 OG SER B 23 -0.427 16.513 -6.112 1.00 0.00 O ATOM 0 H SER B 23 0.345 20.196 -7.946 1.00 0.00 H new ATOM 0 HA SER B 23 1.371 18.438 -5.837 1.00 0.00 H new ATOM 0 HB2 SER B 23 -1.111 18.384 -5.559 1.00 0.00 H new ATOM 0 HB3 SER B 23 -1.297 17.997 -7.258 1.00 0.00 H new ATOM 0 HG SER B 23 -1.289 16.089 -5.919 1.00 0.00 H new ATOM 572 N ASP B 24 2.470 17.189 -7.666 1.00 0.00 N ATOM 573 CA ASP B 24 3.181 16.505 -8.740 1.00 0.00 C ATOM 574 C ASP B 24 2.410 15.251 -9.175 1.00 0.00 C ATOM 575 O ASP B 24 1.680 14.658 -8.381 1.00 0.00 O ATOM 576 CB ASP B 24 4.596 16.121 -8.261 1.00 0.00 C ATOM 577 CG ASP B 24 5.574 17.277 -8.484 1.00 0.00 C ATOM 578 OD1 ASP B 24 5.278 18.375 -8.045 1.00 0.00 O ATOM 579 OD2 ASP B 24 6.606 17.042 -9.095 1.00 0.00 O ATOM 0 H ASP B 24 2.897 17.094 -6.745 1.00 0.00 H new ATOM 0 HA ASP B 24 3.262 17.174 -9.596 1.00 0.00 H new ATOM 0 HB2 ASP B 24 4.569 15.860 -7.203 1.00 0.00 H new ATOM 0 HB3 ASP B 24 4.940 15.238 -8.799 1.00 0.00 H new ATOM 584 N PRO B 25 2.563 14.838 -10.414 1.00 0.00 N ATOM 585 CA PRO B 25 1.868 13.626 -10.948 1.00 0.00 C ATOM 586 C PRO B 25 2.363 12.345 -10.273 1.00 0.00 C ATOM 587 O PRO B 25 1.684 11.319 -10.304 1.00 0.00 O ATOM 588 CB PRO B 25 2.210 13.636 -12.449 1.00 0.00 C ATOM 589 CG PRO B 25 3.473 14.429 -12.552 1.00 0.00 C ATOM 590 CD PRO B 25 3.408 15.473 -11.439 1.00 0.00 C ATOM 0 HA PRO B 25 0.795 13.648 -10.760 1.00 0.00 H new ATOM 0 HB2 PRO B 25 2.347 12.624 -12.829 1.00 0.00 H new ATOM 0 HB3 PRO B 25 1.410 14.090 -13.033 1.00 0.00 H new ATOM 0 HG2 PRO B 25 4.347 13.788 -12.435 1.00 0.00 H new ATOM 0 HG3 PRO B 25 3.556 14.905 -13.529 1.00 0.00 H new ATOM 0 HD2 PRO B 25 4.399 15.708 -11.052 1.00 0.00 H new ATOM 0 HD3 PRO B 25 2.974 16.409 -11.792 1.00 0.00 H new ATOM 598 N LEU B 26 3.550 12.409 -9.675 1.00 0.00 N ATOM 599 CA LEU B 26 4.116 11.241 -9.009 1.00 0.00 C ATOM 600 C LEU B 26 3.227 10.806 -7.847 1.00 0.00 C ATOM 601 O LEU B 26 2.971 9.616 -7.666 1.00 0.00 O ATOM 602 CB LEU B 26 5.523 11.559 -8.488 1.00 0.00 C ATOM 603 CG LEU B 26 6.142 10.321 -7.815 1.00 0.00 C ATOM 604 CD1 LEU B 26 6.247 9.158 -8.818 1.00 0.00 C ATOM 605 CD2 LEU B 26 7.538 10.688 -7.294 1.00 0.00 C ATOM 0 H LEU B 26 4.132 13.246 -9.638 1.00 0.00 H new ATOM 0 HA LEU B 26 4.176 10.429 -9.733 1.00 0.00 H new ATOM 0 HB2 LEU B 26 6.157 11.887 -9.312 1.00 0.00 H new ATOM 0 HB3 LEU B 26 5.476 12.382 -7.775 1.00 0.00 H new ATOM 0 HG LEU B 26 5.507 10.003 -6.988 1.00 0.00 H new ATOM 0 HD11 LEU B 26 6.687 8.291 -8.325 1.00 0.00 H new ATOM 0 HD12 LEU B 26 5.253 8.902 -9.184 1.00 0.00 H new ATOM 0 HD13 LEU B 26 6.876 9.456 -9.657 1.00 0.00 H new ATOM 0 HD21 LEU B 26 7.988 9.818 -6.815 1.00 0.00 H new ATOM 0 HD22 LEU B 26 8.165 11.008 -8.127 1.00 0.00 H new ATOM 0 HD23 LEU B 26 7.455 11.499 -6.570 1.00 0.00 H new ATOM 617 N VAL B 27 2.762 11.774 -7.066 1.00 0.00 N ATOM 618 CA VAL B 27 1.902 11.475 -5.925 1.00 0.00 C ATOM 619 C VAL B 27 0.589 10.856 -6.394 1.00 0.00 C ATOM 620 O VAL B 27 0.105 9.887 -5.812 1.00 0.00 O ATOM 621 CB VAL B 27 1.627 12.757 -5.134 1.00 0.00 C ATOM 622 CG1 VAL B 27 0.578 12.483 -4.051 1.00 0.00 C ATOM 623 CG2 VAL B 27 2.924 13.232 -4.477 1.00 0.00 C ATOM 0 H VAL B 27 2.963 12.765 -7.199 1.00 0.00 H new ATOM 0 HA VAL B 27 2.410 10.758 -5.280 1.00 0.00 H new ATOM 0 HB VAL B 27 1.253 13.526 -5.810 1.00 0.00 H new ATOM 0 HG11 VAL B 27 0.386 13.398 -3.491 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -0.346 12.142 -4.518 1.00 0.00 H new ATOM 0 HG13 VAL B 27 0.947 11.714 -3.373 1.00 0.00 H new ATOM 0 HG21 VAL B 27 2.733 14.145 -3.913 1.00 0.00 H new ATOM 0 HG22 VAL B 27 3.295 12.460 -3.803 1.00 0.00 H new ATOM 0 HG23 VAL B 27 3.670 13.431 -5.246 1.00 0.00 H new ATOM 633 N VAL B 28 0.019 11.425 -7.448 1.00 0.00 N ATOM 634 CA VAL B 28 -1.240 10.927 -7.986 1.00 0.00 C ATOM 635 C VAL B 28 -1.083 9.485 -8.456 1.00 0.00 C ATOM 636 O VAL B 28 -1.946 8.642 -8.202 1.00 0.00 O ATOM 637 CB VAL B 28 -1.693 11.802 -9.155 1.00 0.00 C ATOM 638 CG1 VAL B 28 -2.998 11.248 -9.733 1.00 0.00 C ATOM 639 CG2 VAL B 28 -1.913 13.233 -8.659 1.00 0.00 C ATOM 0 H VAL B 28 0.406 12.227 -7.945 1.00 0.00 H new ATOM 0 HA VAL B 28 -1.992 10.962 -7.198 1.00 0.00 H new ATOM 0 HB VAL B 28 -0.928 11.801 -9.932 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -3.321 11.872 -10.566 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -2.837 10.229 -10.084 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -3.767 11.248 -8.961 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -2.236 13.860 -9.490 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -2.679 13.235 -7.883 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -0.981 13.624 -8.250 1.00 0.00 H new ATOM 649 N ALA B 29 0.018 9.205 -9.144 1.00 0.00 N ATOM 650 CA ALA B 29 0.269 7.858 -9.644 1.00 0.00 C ATOM 651 C ALA B 29 0.246 6.850 -8.501 1.00 0.00 C ATOM 652 O ALA B 29 -0.307 5.761 -8.634 1.00 0.00 O ATOM 653 CB ALA B 29 1.631 7.802 -10.339 1.00 0.00 C ATOM 0 H ALA B 29 0.745 9.885 -9.367 1.00 0.00 H new ATOM 0 HA ALA B 29 -0.516 7.606 -10.357 1.00 0.00 H new ATOM 0 HB1 ALA B 29 1.809 6.792 -10.709 1.00 0.00 H new ATOM 0 HB2 ALA B 29 1.642 8.502 -11.175 1.00 0.00 H new ATOM 0 HB3 ALA B 29 2.413 8.072 -9.629 1.00 0.00 H new ATOM 659 N ALA B 30 0.847 7.217 -7.377 1.00 0.00 N ATOM 660 CA ALA B 30 0.884 6.325 -6.226 1.00 0.00 C ATOM 661 C ALA B 30 -0.529 6.014 -5.742 1.00 0.00 C ATOM 662 O ALA B 30 -0.842 4.869 -5.413 1.00 0.00 O ATOM 663 CB ALA B 30 1.681 6.970 -5.089 1.00 0.00 C ATOM 0 H ALA B 30 1.310 8.115 -7.238 1.00 0.00 H new ATOM 0 HA ALA B 30 1.367 5.396 -6.528 1.00 0.00 H new ATOM 0 HB1 ALA B 30 1.703 6.296 -4.233 1.00 0.00 H new ATOM 0 HB2 ALA B 30 2.700 7.165 -5.424 1.00 0.00 H new ATOM 0 HB3 ALA B 30 1.208 7.909 -4.800 1.00 0.00 H new ATOM 669 N ASN B 31 -1.378 7.037 -5.701 1.00 0.00 N ATOM 670 CA ASN B 31 -2.755 6.850 -5.257 1.00 0.00 C ATOM 671 C ASN B 31 -3.519 5.950 -6.225 1.00 0.00 C ATOM 672 O ASN B 31 -4.270 5.071 -5.806 1.00 0.00 O ATOM 673 CB ASN B 31 -3.456 8.206 -5.155 1.00 0.00 C ATOM 674 CG ASN B 31 -4.890 8.027 -4.665 1.00 0.00 C ATOM 675 OD1 ASN B 31 -5.481 6.961 -4.839 1.00 0.00 O ATOM 676 ND2 ASN B 31 -5.484 9.015 -4.054 1.00 0.00 N ATOM 0 H ASN B 31 -1.141 7.993 -5.966 1.00 0.00 H new ATOM 0 HA ASN B 31 -2.738 6.372 -4.277 1.00 0.00 H new ATOM 0 HB2 ASN B 31 -2.909 8.855 -4.471 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -3.456 8.697 -6.128 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -6.441 8.906 -3.719 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -4.991 9.897 -3.912 1.00 0.00 H new ATOM 683 N ILE B 32 -3.321 6.177 -7.521 1.00 0.00 N ATOM 684 CA ILE B 32 -3.999 5.380 -8.539 1.00 0.00 C ATOM 685 C ILE B 32 -3.547 3.924 -8.469 1.00 0.00 C ATOM 686 O ILE B 32 -4.362 3.008 -8.545 1.00 0.00 O ATOM 687 CB ILE B 32 -3.705 5.951 -9.931 1.00 0.00 C ATOM 688 CG1 ILE B 32 -4.367 7.326 -10.062 1.00 0.00 C ATOM 689 CG2 ILE B 32 -4.269 5.013 -11.006 1.00 0.00 C ATOM 690 CD1 ILE B 32 -3.853 8.020 -11.325 1.00 0.00 C ATOM 0 H ILE B 32 -2.702 6.900 -7.889 1.00 0.00 H new ATOM 0 HA ILE B 32 -5.072 5.420 -8.353 1.00 0.00 H new ATOM 0 HB ILE B 32 -2.627 6.045 -10.063 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -5.451 7.217 -10.109 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -4.146 7.933 -9.184 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -4.058 5.423 -11.994 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -3.804 4.032 -10.913 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -5.347 4.917 -10.876 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -4.323 8.999 -11.419 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -2.772 8.142 -11.259 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -4.097 7.414 -12.198 1.00 0.00 H new ATOM 702 N ILE B 33 -2.242 3.724 -8.319 1.00 0.00 N ATOM 703 CA ILE B 33 -1.691 2.376 -8.240 1.00 0.00 C ATOM 704 C ILE B 33 -2.229 1.649 -7.008 1.00 0.00 C ATOM 705 O ILE B 33 -2.593 0.475 -7.083 1.00 0.00 O ATOM 706 CB ILE B 33 -0.159 2.445 -8.184 1.00 0.00 C ATOM 707 CG1 ILE B 33 0.381 2.930 -9.531 1.00 0.00 C ATOM 708 CG2 ILE B 33 0.415 1.061 -7.876 1.00 0.00 C ATOM 709 CD1 ILE B 33 1.852 3.323 -9.375 1.00 0.00 C ATOM 0 H ILE B 33 -1.551 4.471 -8.250 1.00 0.00 H new ATOM 0 HA ILE B 33 -1.993 1.820 -9.128 1.00 0.00 H new ATOM 0 HB ILE B 33 0.138 3.140 -7.398 1.00 0.00 H new ATOM 0 HG12 ILE B 33 0.280 2.145 -10.280 1.00 0.00 H new ATOM 0 HG13 ILE B 33 -0.200 3.783 -9.883 1.00 0.00 H new ATOM 0 HG21 ILE B 33 1.503 1.118 -7.838 1.00 0.00 H new ATOM 0 HG22 ILE B 33 0.036 0.716 -6.914 1.00 0.00 H new ATOM 0 HG23 ILE B 33 0.116 0.361 -8.656 1.00 0.00 H new ATOM 0 HD11 ILE B 33 2.240 3.669 -10.333 1.00 0.00 H new ATOM 0 HD12 ILE B 33 1.939 4.122 -8.638 1.00 0.00 H new ATOM 0 HD13 ILE B 33 2.426 2.458 -9.042 1.00 0.00 H new ATOM 721 N GLY B 34 -2.274 2.346 -5.879 1.00 0.00 N ATOM 722 CA GLY B 34 -2.767 1.742 -4.646 1.00 0.00 C ATOM 723 C GLY B 34 -4.209 1.265 -4.803 1.00 0.00 C ATOM 724 O GLY B 34 -4.562 0.174 -4.356 1.00 0.00 O ATOM 0 H GLY B 34 -1.979 3.318 -5.791 1.00 0.00 H new ATOM 0 HA2 GLY B 34 -2.131 0.901 -4.370 1.00 0.00 H new ATOM 0 HA3 GLY B 34 -2.707 2.466 -3.834 1.00 0.00 H new ATOM 728 N ILE B 35 -5.036 2.089 -5.438 1.00 0.00 N ATOM 729 CA ILE B 35 -6.438 1.738 -5.647 1.00 0.00 C ATOM 730 C ILE B 35 -6.551 0.510 -6.550 1.00 0.00 C ATOM 731 O ILE B 35 -7.348 -0.394 -6.293 1.00 0.00 O ATOM 732 CB ILE B 35 -7.185 2.920 -6.278 1.00 0.00 C ATOM 733 CG1 ILE B 35 -7.251 4.072 -5.272 1.00 0.00 C ATOM 734 CG2 ILE B 35 -8.609 2.494 -6.646 1.00 0.00 C ATOM 735 CD1 ILE B 35 -7.725 5.347 -5.971 1.00 0.00 C ATOM 0 H ILE B 35 -4.764 2.997 -5.814 1.00 0.00 H new ATOM 0 HA ILE B 35 -6.887 1.505 -4.681 1.00 0.00 H new ATOM 0 HB ILE B 35 -6.658 3.241 -7.176 1.00 0.00 H new ATOM 0 HG12 ILE B 35 -7.931 3.818 -4.459 1.00 0.00 H new ATOM 0 HG13 ILE B 35 -6.269 4.234 -4.827 1.00 0.00 H new ATOM 0 HG21 ILE B 35 -9.136 3.336 -7.094 1.00 0.00 H new ATOM 0 HG22 ILE B 35 -8.570 1.670 -7.359 1.00 0.00 H new ATOM 0 HG23 ILE B 35 -9.136 2.172 -5.748 1.00 0.00 H new ATOM 0 HD11 ILE B 35 -7.770 6.163 -5.249 1.00 0.00 H new ATOM 0 HD12 ILE B 35 -7.028 5.606 -6.768 1.00 0.00 H new ATOM 0 HD13 ILE B 35 -8.716 5.183 -6.395 1.00 0.00 H new ATOM 747 N LEU B 36 -5.752 0.491 -7.611 1.00 0.00 N ATOM 748 CA LEU B 36 -5.763 -0.621 -8.555 1.00 0.00 C ATOM 749 C LEU B 36 -5.357 -1.918 -7.859 1.00 0.00 C ATOM 750 O LEU B 36 -5.935 -2.976 -8.108 1.00 0.00 O ATOM 751 CB LEU B 36 -4.803 -0.328 -9.713 1.00 0.00 C ATOM 752 CG LEU B 36 -5.348 0.818 -10.581 1.00 0.00 C ATOM 753 CD1 LEU B 36 -4.235 1.306 -11.511 1.00 0.00 C ATOM 754 CD2 LEU B 36 -6.548 0.345 -11.422 1.00 0.00 C ATOM 0 H LEU B 36 -5.089 1.232 -7.839 1.00 0.00 H new ATOM 0 HA LEU B 36 -6.774 -0.738 -8.945 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -3.821 -0.062 -9.322 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -4.672 -1.223 -10.321 1.00 0.00 H new ATOM 0 HG LEU B 36 -5.682 1.627 -9.931 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -4.610 2.119 -12.132 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -3.394 1.662 -10.916 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -3.907 0.485 -12.148 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -6.917 1.173 -12.028 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -6.236 -0.471 -12.074 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -7.342 -0.002 -10.760 1.00 0.00 H new ATOM 766 N HIS B 37 -4.365 -1.829 -6.981 1.00 0.00 N ATOM 767 CA HIS B 37 -3.901 -3.002 -6.253 1.00 0.00 C ATOM 768 C HIS B 37 -5.041 -3.610 -5.443 1.00 0.00 C ATOM 769 O HIS B 37 -5.198 -4.830 -5.396 1.00 0.00 O ATOM 770 CB HIS B 37 -2.767 -2.617 -5.308 1.00 0.00 C ATOM 771 CG HIS B 37 -2.272 -3.851 -4.607 1.00 0.00 C ATOM 772 ND1 HIS B 37 -0.978 -4.315 -4.755 1.00 0.00 N ATOM 773 CD2 HIS B 37 -2.891 -4.739 -3.762 1.00 0.00 C ATOM 774 CE1 HIS B 37 -0.863 -5.433 -4.019 1.00 0.00 C ATOM 775 NE2 HIS B 37 -1.999 -5.736 -3.392 1.00 0.00 N ATOM 0 H HIS B 37 -3.871 -0.965 -6.758 1.00 0.00 H new ATOM 0 HA HIS B 37 -3.542 -3.734 -6.976 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -1.955 -2.150 -5.865 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -3.116 -1.885 -4.580 1.00 0.00 H new ATOM 0 HD2 HIS B 37 -3.918 -4.672 -3.434 1.00 0.00 H new ATOM 0 HE1 HIS B 37 0.043 -6.017 -3.944 1.00 0.00 H new ATOM 0 HE2 HIS B 37 -2.175 -6.528 -2.774 1.00 0.00 H new ATOM 783 N LEU B 38 -5.831 -2.753 -4.800 1.00 0.00 N ATOM 784 CA LEU B 38 -6.950 -3.221 -3.986 1.00 0.00 C ATOM 785 C LEU B 38 -7.947 -3.999 -4.830 1.00 0.00 C ATOM 786 O LEU B 38 -8.472 -5.012 -4.383 1.00 0.00 O ATOM 787 CB LEU B 38 -7.649 -2.025 -3.296 1.00 0.00 C ATOM 788 CG LEU B 38 -7.070 -1.802 -1.885 1.00 0.00 C ATOM 789 CD1 LEU B 38 -7.345 -0.371 -1.425 1.00 0.00 C ATOM 790 CD2 LEU B 38 -7.728 -2.782 -0.894 1.00 0.00 C ATOM 0 H LEU B 38 -5.719 -1.740 -4.826 1.00 0.00 H new ATOM 0 HA LEU B 38 -6.558 -3.890 -3.220 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -7.518 -1.124 -3.896 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -8.721 -2.211 -3.230 1.00 0.00 H new ATOM 0 HG LEU B 38 -5.994 -1.973 -1.916 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -6.932 -0.224 -0.427 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -6.879 0.330 -2.118 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -8.421 -0.197 -1.402 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -7.317 -2.622 0.103 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -8.804 -2.611 -0.874 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -7.529 -3.806 -1.209 1.00 0.00 H new ATOM 802 N ILE B 39 -8.214 -3.525 -6.031 1.00 0.00 N ATOM 803 CA ILE B 39 -9.164 -4.208 -6.894 1.00 0.00 C ATOM 804 C ILE B 39 -8.673 -5.619 -7.216 1.00 0.00 C ATOM 805 O ILE B 39 -9.444 -6.574 -7.193 1.00 0.00 O ATOM 806 CB ILE B 39 -9.347 -3.410 -8.183 1.00 0.00 C ATOM 807 CG1 ILE B 39 -10.035 -2.082 -7.856 1.00 0.00 C ATOM 808 CG2 ILE B 39 -10.206 -4.209 -9.165 1.00 0.00 C ATOM 809 CD1 ILE B 39 -10.011 -1.176 -9.089 1.00 0.00 C ATOM 0 H ILE B 39 -7.796 -2.684 -6.429 1.00 0.00 H new ATOM 0 HA ILE B 39 -10.121 -4.285 -6.378 1.00 0.00 H new ATOM 0 HB ILE B 39 -8.375 -3.216 -8.637 1.00 0.00 H new ATOM 0 HG12 ILE B 39 -11.064 -2.261 -7.543 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -9.529 -1.594 -7.023 1.00 0.00 H new ATOM 0 HG21 ILE B 39 -10.335 -3.637 -10.084 1.00 0.00 H new ATOM 0 HG22 ILE B 39 -9.714 -5.155 -9.392 1.00 0.00 H new ATOM 0 HG23 ILE B 39 -11.181 -4.405 -8.719 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -10.501 -0.231 -8.856 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -8.978 -0.987 -9.381 1.00 0.00 H new ATOM 0 HD13 ILE B 39 -10.537 -1.664 -9.910 1.00 0.00 H new ATOM 821 N LEU B 40 -7.392 -5.747 -7.530 1.00 0.00 N ATOM 822 CA LEU B 40 -6.833 -7.051 -7.853 1.00 0.00 C ATOM 823 C LEU B 40 -6.682 -7.915 -6.600 1.00 0.00 C ATOM 824 O LEU B 40 -6.984 -9.109 -6.620 1.00 0.00 O ATOM 825 CB LEU B 40 -5.477 -6.864 -8.529 1.00 0.00 C ATOM 826 CG LEU B 40 -5.668 -6.139 -9.868 1.00 0.00 C ATOM 827 CD1 LEU B 40 -4.292 -5.788 -10.437 1.00 0.00 C ATOM 828 CD2 LEU B 40 -6.439 -7.028 -10.865 1.00 0.00 C ATOM 0 H LEU B 40 -6.727 -4.974 -7.568 1.00 0.00 H new ATOM 0 HA LEU B 40 -7.515 -7.565 -8.530 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -4.813 -6.289 -7.883 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -5.003 -7.832 -8.692 1.00 0.00 H new ATOM 0 HG LEU B 40 -6.249 -5.231 -9.706 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -4.413 -5.272 -11.389 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -3.764 -5.140 -9.738 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -3.718 -6.702 -10.590 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -6.563 -6.495 -11.807 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -5.881 -7.948 -11.040 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -7.419 -7.271 -10.454 1.00 0.00 H new ATOM 840 N TRP B 41 -6.201 -7.311 -5.516 1.00 0.00 N ATOM 841 CA TRP B 41 -6.003 -8.041 -4.267 1.00 0.00 C ATOM 842 C TRP B 41 -7.334 -8.464 -3.648 1.00 0.00 C ATOM 843 O TRP B 41 -7.489 -9.607 -3.217 1.00 0.00 O ATOM 844 CB TRP B 41 -5.222 -7.164 -3.278 1.00 0.00 C ATOM 845 CG TRP B 41 -5.194 -7.814 -1.928 1.00 0.00 C ATOM 846 CD1 TRP B 41 -4.309 -8.757 -1.530 1.00 0.00 C ATOM 847 CD2 TRP B 41 -6.057 -7.557 -0.785 1.00 0.00 C ATOM 848 NE1 TRP B 41 -4.595 -9.115 -0.225 1.00 0.00 N ATOM 849 CE2 TRP B 41 -5.659 -8.395 0.279 1.00 0.00 C ATOM 850 CE3 TRP B 41 -7.141 -6.688 -0.571 1.00 0.00 C ATOM 851 CZ2 TRP B 41 -6.309 -8.373 1.507 1.00 0.00 C ATOM 852 CZ3 TRP B 41 -7.795 -6.658 0.669 1.00 0.00 C ATOM 853 CH2 TRP B 41 -7.379 -7.500 1.704 1.00 0.00 C ATOM 0 H TRP B 41 -5.943 -6.325 -5.477 1.00 0.00 H new ATOM 0 HA TRP B 41 -5.436 -8.945 -4.488 1.00 0.00 H new ATOM 0 HB2 TRP B 41 -4.205 -7.012 -3.639 1.00 0.00 H new ATOM 0 HB3 TRP B 41 -5.685 -6.180 -3.207 1.00 0.00 H new ATOM 0 HD1 TRP B 41 -3.510 -9.164 -2.133 1.00 0.00 H new ATOM 0 HE1 TRP B 41 -4.083 -9.824 0.300 1.00 0.00 H new ATOM 0 HE3 TRP B 41 -7.473 -6.039 -1.368 1.00 0.00 H new ATOM 0 HZ2 TRP B 41 -5.988 -9.028 2.304 1.00 0.00 H new ATOM 0 HZ3 TRP B 41 -8.623 -5.982 0.825 1.00 0.00 H new ATOM 0 HH2 TRP B 41 -7.886 -7.475 2.657 1.00 0.00 H new ATOM 864 N ILE B 42 -8.285 -7.538 -3.588 1.00 0.00 N ATOM 865 CA ILE B 42 -9.586 -7.839 -2.998 1.00 0.00 C ATOM 866 C ILE B 42 -10.307 -8.907 -3.814 1.00 0.00 C ATOM 867 O ILE B 42 -10.921 -9.818 -3.258 1.00 0.00 O ATOM 868 CB ILE B 42 -10.440 -6.555 -2.923 1.00 0.00 C ATOM 869 CG1 ILE B 42 -11.633 -6.766 -1.966 1.00 0.00 C ATOM 870 CG2 ILE B 42 -10.968 -6.199 -4.321 1.00 0.00 C ATOM 871 CD1 ILE B 42 -11.209 -6.512 -0.512 1.00 0.00 C ATOM 0 H ILE B 42 -8.183 -6.584 -3.936 1.00 0.00 H new ATOM 0 HA ILE B 42 -9.433 -8.222 -1.989 1.00 0.00 H new ATOM 0 HB ILE B 42 -9.818 -5.742 -2.549 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -12.447 -6.093 -2.236 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -12.013 -7.783 -2.068 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -11.570 -5.292 -4.263 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -10.128 -6.034 -4.996 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -11.581 -7.018 -4.698 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -12.063 -6.665 0.148 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -10.411 -7.203 -0.240 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -10.852 -5.487 -0.411 1.00 0.00 H new ATOM 883 N LEU B 43 -10.224 -8.787 -5.134 1.00 0.00 N ATOM 884 CA LEU B 43 -10.868 -9.747 -6.022 1.00 0.00 C ATOM 885 C LEU B 43 -10.266 -11.138 -5.838 1.00 0.00 C ATOM 886 O LEU B 43 -10.982 -12.138 -5.843 1.00 0.00 O ATOM 887 CB LEU B 43 -10.707 -9.295 -7.479 1.00 0.00 C ATOM 888 CG LEU B 43 -11.723 -8.183 -7.809 1.00 0.00 C ATOM 889 CD1 LEU B 43 -11.386 -7.580 -9.179 1.00 0.00 C ATOM 890 CD2 LEU B 43 -13.162 -8.752 -7.829 1.00 0.00 C ATOM 0 H LEU B 43 -9.720 -8.039 -5.611 1.00 0.00 H new ATOM 0 HA LEU B 43 -11.928 -9.795 -5.774 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -9.693 -8.931 -7.644 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -10.855 -10.142 -8.148 1.00 0.00 H new ATOM 0 HG LEU B 43 -11.666 -7.411 -7.042 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -12.102 -6.793 -9.416 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -10.380 -7.160 -9.154 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -11.436 -8.358 -9.941 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -13.866 -7.953 -8.063 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -13.234 -9.533 -8.586 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -13.401 -9.171 -6.852 1.00 0.00 H new ATOM 902 N ASP B 44 -8.953 -11.198 -5.678 1.00 0.00 N ATOM 903 CA ASP B 44 -8.279 -12.478 -5.505 1.00 0.00 C ATOM 904 C ASP B 44 -8.847 -13.216 -4.299 1.00 0.00 C ATOM 905 O ASP B 44 -9.113 -14.417 -4.361 1.00 0.00 O ATOM 906 CB ASP B 44 -6.783 -12.243 -5.300 1.00 0.00 C ATOM 907 CG ASP B 44 -6.140 -11.812 -6.615 1.00 0.00 C ATOM 908 OD1 ASP B 44 -6.759 -12.008 -7.646 1.00 0.00 O ATOM 909 OD2 ASP B 44 -5.041 -11.285 -6.570 1.00 0.00 O ATOM 0 H ASP B 44 -8.337 -10.385 -5.664 1.00 0.00 H new ATOM 0 HA ASP B 44 -8.438 -13.084 -6.397 1.00 0.00 H new ATOM 0 HB2 ASP B 44 -6.627 -11.477 -4.541 1.00 0.00 H new ATOM 0 HB3 ASP B 44 -6.309 -13.154 -4.935 1.00 0.00 H new ATOM 914 N ARG B 45 -9.037 -12.492 -3.206 1.00 0.00 N ATOM 915 CA ARG B 45 -9.581 -13.090 -1.996 1.00 0.00 C ATOM 916 C ARG B 45 -11.016 -13.544 -2.225 1.00 0.00 C ATOM 917 O ARG B 45 -11.442 -14.577 -1.707 1.00 0.00 O ATOM 918 CB ARG B 45 -9.539 -12.074 -0.856 1.00 0.00 C ATOM 919 CG ARG B 45 -8.093 -11.627 -0.591 1.00 0.00 C ATOM 920 CD ARG B 45 -7.260 -12.780 -0.012 1.00 0.00 C ATOM 921 NE ARG B 45 -7.984 -13.441 1.069 1.00 0.00 N ATOM 922 CZ ARG B 45 -7.940 -12.977 2.314 1.00 0.00 C ATOM 923 NH1 ARG B 45 -7.212 -11.929 2.593 1.00 0.00 N ATOM 924 NH2 ARG B 45 -8.622 -13.569 3.253 1.00 0.00 N ATOM 0 H ARG B 45 -8.824 -11.497 -3.132 1.00 0.00 H new ATOM 0 HA ARG B 45 -8.977 -13.958 -1.733 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -10.153 -11.210 -1.108 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -9.962 -12.514 0.047 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -7.641 -11.277 -1.519 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -8.089 -10.786 0.103 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -7.030 -13.500 -0.797 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -6.309 -12.399 0.359 1.00 0.00 H new ATOM 0 HE ARG B 45 -8.534 -14.275 0.865 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -6.678 -11.468 1.856 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -7.177 -11.572 3.548 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -9.189 -14.388 3.033 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -8.589 -13.214 4.209 1.00 0.00 H new ATOM 938 N LEU B 46 -11.763 -12.763 -2.993 1.00 0.00 N ATOM 939 CA LEU B 46 -13.150 -13.095 -3.272 1.00 0.00 C ATOM 940 C LEU B 46 -13.248 -14.423 -4.013 1.00 0.00 C ATOM 941 O LEU B 46 -14.083 -15.265 -3.685 1.00 0.00 O ATOM 942 CB LEU B 46 -13.790 -11.981 -4.113 1.00 0.00 C ATOM 943 CG LEU B 46 -15.276 -12.315 -4.420 1.00 0.00 C ATOM 944 CD1 LEU B 46 -16.135 -11.051 -4.295 1.00 0.00 C ATOM 945 CD2 LEU B 46 -15.426 -12.860 -5.850 1.00 0.00 C ATOM 0 H LEU B 46 -11.434 -11.902 -3.430 1.00 0.00 H new ATOM 0 HA LEU B 46 -13.682 -13.188 -2.325 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -13.727 -11.033 -3.579 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -13.239 -11.859 -5.045 1.00 0.00 H new ATOM 0 HG LEU B 46 -15.605 -13.068 -3.704 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -17.175 -11.295 -4.512 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -16.058 -10.658 -3.281 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -15.783 -10.300 -5.003 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -16.474 -13.088 -6.045 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -15.079 -12.112 -6.563 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -14.832 -13.767 -5.958 1.00 0.00 H new ATOM 957 N PHE B 47 -12.395 -14.607 -5.015 1.00 0.00 N ATOM 958 CA PHE B 47 -12.411 -15.842 -5.790 1.00 0.00 C ATOM 959 C PHE B 47 -11.855 -17.007 -4.976 1.00 0.00 C ATOM 960 O PHE B 47 -12.520 -18.029 -4.799 1.00 0.00 O ATOM 961 CB PHE B 47 -11.587 -15.673 -7.070 1.00 0.00 C ATOM 962 CG PHE B 47 -12.322 -14.765 -8.032 1.00 0.00 C ATOM 963 CD1 PHE B 47 -13.527 -15.190 -8.601 1.00 0.00 C ATOM 964 CD2 PHE B 47 -11.805 -13.502 -8.351 1.00 0.00 C ATOM 965 CE1 PHE B 47 -14.215 -14.356 -9.489 1.00 0.00 C ATOM 966 CE2 PHE B 47 -12.494 -12.667 -9.239 1.00 0.00 C ATOM 967 CZ PHE B 47 -13.699 -13.095 -9.808 1.00 0.00 C ATOM 0 H PHE B 47 -11.693 -13.927 -5.307 1.00 0.00 H new ATOM 0 HA PHE B 47 -13.446 -16.062 -6.050 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -10.610 -15.253 -6.832 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -11.412 -16.644 -7.533 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -13.927 -16.163 -8.355 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -10.875 -13.173 -7.912 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -15.145 -14.686 -9.929 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -12.096 -11.694 -9.485 1.00 0.00 H new ATOM 0 HZ PHE B 47 -14.231 -12.452 -10.494 1.00 0.00 H new ATOM 977 N PHE B 48 -10.629 -16.844 -4.483 1.00 0.00 N ATOM 978 CA PHE B 48 -9.974 -17.881 -3.683 1.00 0.00 C ATOM 979 C PHE B 48 -9.292 -17.266 -2.470 1.00 0.00 C ATOM 980 O PHE B 48 -8.806 -16.138 -2.525 1.00 0.00 O ATOM 981 CB PHE B 48 -8.939 -18.619 -4.534 1.00 0.00 C ATOM 982 CG PHE B 48 -9.647 -19.472 -5.557 1.00 0.00 C ATOM 983 CD1 PHE B 48 -10.097 -20.750 -5.206 1.00 0.00 C ATOM 984 CD2 PHE B 48 -9.858 -18.989 -6.855 1.00 0.00 C ATOM 985 CE1 PHE B 48 -10.757 -21.545 -6.149 1.00 0.00 C ATOM 986 CE2 PHE B 48 -10.516 -19.783 -7.799 1.00 0.00 C ATOM 987 CZ PHE B 48 -10.965 -21.063 -7.447 1.00 0.00 C ATOM 0 H PHE B 48 -10.068 -16.004 -4.623 1.00 0.00 H new ATOM 0 HA PHE B 48 -10.732 -18.586 -3.341 1.00 0.00 H new ATOM 0 HB2 PHE B 48 -8.284 -17.903 -5.031 1.00 0.00 H new ATOM 0 HB3 PHE B 48 -8.308 -19.241 -3.900 1.00 0.00 H new ATOM 0 HD1 PHE B 48 -9.934 -21.123 -4.206 1.00 0.00 H new ATOM 0 HD2 PHE B 48 -9.512 -18.003 -7.127 1.00 0.00 H new ATOM 0 HE1 PHE B 48 -11.106 -22.530 -5.876 1.00 0.00 H new ATOM 0 HE2 PHE B 48 -10.678 -19.410 -8.799 1.00 0.00 H new ATOM 0 HZ PHE B 48 -11.471 -21.677 -8.177 1.00 0.00 H new ATOM 997 N LYS B 49 -9.254 -18.018 -1.378 1.00 0.00 N ATOM 998 CA LYS B 49 -8.625 -17.538 -0.154 1.00 0.00 C ATOM 999 C LYS B 49 -7.132 -17.317 -0.370 1.00 0.00 C ATOM 1000 O LYS B 49 -6.576 -16.467 0.307 1.00 0.00 O ATOM 1001 CB LYS B 49 -8.832 -18.555 0.968 1.00 0.00 C ATOM 1002 CG LYS B 49 -10.319 -18.626 1.329 1.00 0.00 C ATOM 1003 CD LYS B 49 -10.532 -19.578 2.514 1.00 0.00 C ATOM 1004 CE LYS B 49 -10.311 -21.035 2.086 1.00 0.00 C ATOM 1005 NZ LYS B 49 -10.861 -21.943 3.136 1.00 0.00 N ATOM 1006 OXT LYS B 49 -6.564 -18.001 -1.206 1.00 0.00 O ATOM 0 H LYS B 49 -9.648 -18.957 -1.314 1.00 0.00 H new ATOM 0 HA LYS B 49 -9.085 -16.589 0.122 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -8.477 -19.536 0.653 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -8.248 -18.270 1.843 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -10.687 -17.632 1.581 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -10.893 -18.970 0.469 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -9.845 -19.322 3.320 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -11.542 -19.458 2.906 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -10.801 -21.225 1.131 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -9.248 -21.227 1.942 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -10.714 -22.932 2.851 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -10.374 -21.766 4.038 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -11.879 -21.764 3.252 1.00 0.00 H new TER 1020 LYS B 49 ATOM 1021 N SER C 19 17.066 22.554 -3.512 1.00 0.00 N ATOM 1022 CA SER C 19 16.130 22.657 -4.667 1.00 0.00 C ATOM 1023 C SER C 19 15.080 21.554 -4.567 1.00 0.00 C ATOM 1024 O SER C 19 15.242 20.595 -3.814 1.00 0.00 O ATOM 1025 CB SER C 19 16.916 22.513 -5.970 1.00 0.00 C ATOM 1026 OG SER C 19 17.987 23.446 -5.978 1.00 0.00 O ATOM 0 HA SER C 19 15.633 23.627 -4.654 1.00 0.00 H new ATOM 0 HB2 SER C 19 17.302 21.498 -6.065 1.00 0.00 H new ATOM 0 HB3 SER C 19 16.261 22.686 -6.824 1.00 0.00 H new ATOM 0 HG SER C 19 18.337 23.550 -5.069 1.00 0.00 H new ATOM 1034 N ASN C 20 14.003 21.700 -5.333 1.00 0.00 N ATOM 1035 CA ASN C 20 12.932 20.711 -5.323 1.00 0.00 C ATOM 1036 C ASN C 20 12.400 20.514 -3.905 1.00 0.00 C ATOM 1037 O ASN C 20 12.096 19.394 -3.497 1.00 0.00 O ATOM 1038 CB ASN C 20 13.446 19.378 -5.868 1.00 0.00 C ATOM 1039 CG ASN C 20 12.273 18.454 -6.174 1.00 0.00 C ATOM 1040 OD1 ASN C 20 12.076 17.450 -5.488 1.00 0.00 O ATOM 1041 ND2 ASN C 20 11.477 18.732 -7.170 1.00 0.00 N ATOM 0 H ASN C 20 13.850 22.487 -5.963 1.00 0.00 H new ATOM 0 HA ASN C 20 12.122 21.072 -5.957 1.00 0.00 H new ATOM 0 HB2 ASN C 20 14.032 19.547 -6.771 1.00 0.00 H new ATOM 0 HB3 ASN C 20 14.109 18.909 -5.141 1.00 0.00 H new ATOM 0 HD21 ASN C 20 10.691 18.118 -7.381 1.00 0.00 H new ATOM 0 HD22 ASN C 20 11.641 19.564 -7.737 1.00 0.00 H new ATOM 1048 N ASP C 21 12.289 21.611 -3.163 1.00 0.00 N ATOM 1049 CA ASP C 21 11.791 21.552 -1.791 1.00 0.00 C ATOM 1050 C ASP C 21 10.269 21.482 -1.779 1.00 0.00 C ATOM 1051 O ASP C 21 9.650 21.367 -0.721 1.00 0.00 O ATOM 1052 CB ASP C 21 12.253 22.786 -1.016 1.00 0.00 C ATOM 1053 CG ASP C 21 13.769 22.759 -0.844 1.00 0.00 C ATOM 1054 OD1 ASP C 21 14.332 21.678 -0.910 1.00 0.00 O ATOM 1055 OD2 ASP C 21 14.344 23.817 -0.653 1.00 0.00 O ATOM 0 H ASP C 21 12.535 22.547 -3.485 1.00 0.00 H new ATOM 0 HA ASP C 21 12.189 20.655 -1.316 1.00 0.00 H new ATOM 0 HB2 ASP C 21 11.955 23.691 -1.546 1.00 0.00 H new ATOM 0 HB3 ASP C 21 11.769 22.815 -0.040 1.00 0.00 H new ATOM 1060 N SER C 22 9.670 21.554 -2.964 1.00 0.00 N ATOM 1061 CA SER C 22 8.219 21.502 -3.082 1.00 0.00 C ATOM 1062 C SER C 22 7.693 20.139 -2.639 1.00 0.00 C ATOM 1063 O SER C 22 6.500 19.982 -2.373 1.00 0.00 O ATOM 1064 CB SER C 22 7.801 21.765 -4.528 1.00 0.00 C ATOM 1065 OG SER C 22 8.393 20.788 -5.375 1.00 0.00 O ATOM 0 H SER C 22 10.165 21.648 -3.851 1.00 0.00 H new ATOM 0 HA SER C 22 7.795 22.271 -2.436 1.00 0.00 H new ATOM 0 HB2 SER C 22 6.715 21.729 -4.617 1.00 0.00 H new ATOM 0 HB3 SER C 22 8.113 22.764 -4.833 1.00 0.00 H new ATOM 0 HG SER C 22 8.125 20.954 -6.303 1.00 0.00 H new ATOM 1071 N SER C 23 8.586 19.158 -2.558 1.00 0.00 N ATOM 1072 CA SER C 23 8.206 17.813 -2.143 1.00 0.00 C ATOM 1073 C SER C 23 9.359 17.146 -1.402 1.00 0.00 C ATOM 1074 O SER C 23 10.477 17.069 -1.914 1.00 0.00 O ATOM 1075 CB SER C 23 7.830 16.977 -3.367 1.00 0.00 C ATOM 1076 OG SER C 23 7.434 15.680 -2.946 1.00 0.00 O ATOM 0 H SER C 23 9.577 19.269 -2.774 1.00 0.00 H new ATOM 0 HA SER C 23 7.347 17.882 -1.476 1.00 0.00 H new ATOM 0 HB2 SER C 23 7.019 17.457 -3.915 1.00 0.00 H new ATOM 0 HB3 SER C 23 8.678 16.908 -4.049 1.00 0.00 H new ATOM 0 HG SER C 23 7.191 15.142 -3.728 1.00 0.00 H new ATOM 1082 N ASP C 24 9.083 16.671 -0.196 1.00 0.00 N ATOM 1083 CA ASP C 24 10.107 16.022 0.610 1.00 0.00 C ATOM 1084 C ASP C 24 10.425 14.629 0.047 1.00 0.00 C ATOM 1085 O ASP C 24 9.572 13.997 -0.579 1.00 0.00 O ATOM 1086 CB ASP C 24 9.622 15.906 2.070 1.00 0.00 C ATOM 1087 CG ASP C 24 9.956 17.179 2.851 1.00 0.00 C ATOM 1088 OD1 ASP C 24 9.608 18.249 2.383 1.00 0.00 O ATOM 1089 OD2 ASP C 24 10.555 17.058 3.908 1.00 0.00 O ATOM 0 H ASP C 24 8.164 16.722 0.244 1.00 0.00 H new ATOM 0 HA ASP C 24 11.016 16.623 0.581 1.00 0.00 H new ATOM 0 HB2 ASP C 24 8.546 15.733 2.089 1.00 0.00 H new ATOM 0 HB3 ASP C 24 10.091 15.046 2.548 1.00 0.00 H new ATOM 1094 N PRO C 25 11.626 14.142 0.257 1.00 0.00 N ATOM 1095 CA PRO C 25 12.048 12.796 -0.238 1.00 0.00 C ATOM 1096 C PRO C 25 11.277 11.670 0.456 1.00 0.00 C ATOM 1097 O PRO C 25 11.212 10.550 -0.051 1.00 0.00 O ATOM 1098 CB PRO C 25 13.550 12.732 0.094 1.00 0.00 C ATOM 1099 CG PRO C 25 13.738 13.701 1.218 1.00 0.00 C ATOM 1100 CD PRO C 25 12.716 14.813 0.989 1.00 0.00 C ATOM 0 HA PRO C 25 11.846 12.665 -1.301 1.00 0.00 H new ATOM 0 HB2 PRO C 25 13.847 11.725 0.387 1.00 0.00 H new ATOM 0 HB3 PRO C 25 14.157 13.005 -0.769 1.00 0.00 H new ATOM 0 HG2 PRO C 25 13.579 13.217 2.182 1.00 0.00 H new ATOM 0 HG3 PRO C 25 14.753 14.099 1.225 1.00 0.00 H new ATOM 0 HD2 PRO C 25 12.365 15.235 1.931 1.00 0.00 H new ATOM 0 HD3 PRO C 25 13.140 15.634 0.411 1.00 0.00 H new ATOM 1108 N LEU C 26 10.707 11.971 1.619 1.00 0.00 N ATOM 1109 CA LEU C 26 9.956 10.965 2.366 1.00 0.00 C ATOM 1110 C LEU C 26 8.748 10.495 1.560 1.00 0.00 C ATOM 1111 O LEU C 26 8.464 9.299 1.498 1.00 0.00 O ATOM 1112 CB LEU C 26 9.486 11.545 3.707 1.00 0.00 C ATOM 1113 CG LEU C 26 8.723 10.481 4.515 1.00 0.00 C ATOM 1114 CD1 LEU C 26 9.629 9.269 4.800 1.00 0.00 C ATOM 1115 CD2 LEU C 26 8.258 11.104 5.836 1.00 0.00 C ATOM 0 H LEU C 26 10.749 12.890 2.061 1.00 0.00 H new ATOM 0 HA LEU C 26 10.611 10.114 2.552 1.00 0.00 H new ATOM 0 HB2 LEU C 26 10.344 11.898 4.278 1.00 0.00 H new ATOM 0 HB3 LEU C 26 8.843 12.408 3.532 1.00 0.00 H new ATOM 0 HG LEU C 26 7.863 10.138 3.940 1.00 0.00 H new ATOM 0 HD11 LEU C 26 9.073 8.526 5.372 1.00 0.00 H new ATOM 0 HD12 LEU C 26 9.957 8.830 3.858 1.00 0.00 H new ATOM 0 HD13 LEU C 26 10.499 9.592 5.372 1.00 0.00 H new ATOM 0 HD21 LEU C 26 7.715 10.359 6.418 1.00 0.00 H new ATOM 0 HD22 LEU C 26 9.125 11.446 6.402 1.00 0.00 H new ATOM 0 HD23 LEU C 26 7.603 11.950 5.629 1.00 0.00 H new ATOM 1127 N VAL C 27 8.042 11.439 0.950 1.00 0.00 N ATOM 1128 CA VAL C 27 6.866 11.105 0.154 1.00 0.00 C ATOM 1129 C VAL C 27 7.261 10.248 -1.046 1.00 0.00 C ATOM 1130 O VAL C 27 6.591 9.266 -1.368 1.00 0.00 O ATOM 1131 CB VAL C 27 6.176 12.386 -0.322 1.00 0.00 C ATOM 1132 CG1 VAL C 27 5.055 12.040 -1.307 1.00 0.00 C ATOM 1133 CG2 VAL C 27 5.581 13.115 0.887 1.00 0.00 C ATOM 0 H VAL C 27 8.260 12.435 0.990 1.00 0.00 H new ATOM 0 HA VAL C 27 6.174 10.537 0.775 1.00 0.00 H new ATOM 0 HB VAL C 27 6.905 13.025 -0.820 1.00 0.00 H new ATOM 0 HG11 VAL C 27 4.569 12.956 -1.641 1.00 0.00 H new ATOM 0 HG12 VAL C 27 5.474 11.517 -2.167 1.00 0.00 H new ATOM 0 HG13 VAL C 27 4.323 11.400 -0.815 1.00 0.00 H new ATOM 0 HG21 VAL C 27 5.088 14.029 0.555 1.00 0.00 H new ATOM 0 HG22 VAL C 27 4.854 12.469 1.380 1.00 0.00 H new ATOM 0 HG23 VAL C 27 6.377 13.367 1.588 1.00 0.00 H new ATOM 1143 N VAL C 28 8.349 10.629 -1.702 1.00 0.00 N ATOM 1144 CA VAL C 28 8.823 9.894 -2.867 1.00 0.00 C ATOM 1145 C VAL C 28 9.176 8.459 -2.484 1.00 0.00 C ATOM 1146 O VAL C 28 8.839 7.516 -3.201 1.00 0.00 O ATOM 1147 CB VAL C 28 10.054 10.584 -3.455 1.00 0.00 C ATOM 1148 CG1 VAL C 28 10.561 9.786 -4.659 1.00 0.00 C ATOM 1149 CG2 VAL C 28 9.677 12.001 -3.897 1.00 0.00 C ATOM 0 H VAL C 28 8.917 11.438 -1.449 1.00 0.00 H new ATOM 0 HA VAL C 28 8.028 9.876 -3.612 1.00 0.00 H new ATOM 0 HB VAL C 28 10.840 10.636 -2.701 1.00 0.00 H new ATOM 0 HG11 VAL C 28 11.439 10.278 -5.078 1.00 0.00 H new ATOM 0 HG12 VAL C 28 10.827 8.778 -4.341 1.00 0.00 H new ATOM 0 HG13 VAL C 28 9.779 9.733 -5.416 1.00 0.00 H new ATOM 0 HG21 VAL C 28 10.553 12.496 -4.317 1.00 0.00 H new ATOM 0 HG22 VAL C 28 8.892 11.950 -4.652 1.00 0.00 H new ATOM 0 HG23 VAL C 28 9.318 12.567 -3.037 1.00 0.00 H new ATOM 1159 N ALA C 29 9.855 8.301 -1.354 1.00 0.00 N ATOM 1160 CA ALA C 29 10.246 6.976 -0.894 1.00 0.00 C ATOM 1161 C ALA C 29 9.024 6.076 -0.753 1.00 0.00 C ATOM 1162 O ALA C 29 9.060 4.905 -1.126 1.00 0.00 O ATOM 1163 CB ALA C 29 10.956 7.077 0.460 1.00 0.00 C ATOM 0 H ALA C 29 10.144 9.067 -0.745 1.00 0.00 H new ATOM 0 HA ALA C 29 10.924 6.546 -1.631 1.00 0.00 H new ATOM 0 HB1 ALA C 29 11.244 6.081 0.795 1.00 0.00 H new ATOM 0 HB2 ALA C 29 11.846 7.697 0.359 1.00 0.00 H new ATOM 0 HB3 ALA C 29 10.283 7.525 1.191 1.00 0.00 H new ATOM 1169 N ALA C 30 7.944 6.627 -0.216 1.00 0.00 N ATOM 1170 CA ALA C 30 6.724 5.850 -0.036 1.00 0.00 C ATOM 1171 C ALA C 30 6.194 5.362 -1.380 1.00 0.00 C ATOM 1172 O ALA C 30 5.768 4.215 -1.507 1.00 0.00 O ATOM 1173 CB ALA C 30 5.657 6.708 0.649 1.00 0.00 C ATOM 0 H ALA C 30 7.886 7.595 0.099 1.00 0.00 H new ATOM 0 HA ALA C 30 6.956 4.986 0.587 1.00 0.00 H new ATOM 0 HB1 ALA C 30 4.748 6.121 0.781 1.00 0.00 H new ATOM 0 HB2 ALA C 30 6.022 7.034 1.623 1.00 0.00 H new ATOM 0 HB3 ALA C 30 5.440 7.580 0.032 1.00 0.00 H new ATOM 1179 N ASN C 31 6.224 6.237 -2.380 1.00 0.00 N ATOM 1180 CA ASN C 31 5.743 5.874 -3.708 1.00 0.00 C ATOM 1181 C ASN C 31 6.621 4.788 -4.321 1.00 0.00 C ATOM 1182 O ASN C 31 6.119 3.840 -4.925 1.00 0.00 O ATOM 1183 CB ASN C 31 5.743 7.106 -4.615 1.00 0.00 C ATOM 1184 CG ASN C 31 5.209 6.745 -5.995 1.00 0.00 C ATOM 1185 OD1 ASN C 31 5.290 5.590 -6.416 1.00 0.00 O ATOM 1186 ND2 ASN C 31 4.659 7.672 -6.732 1.00 0.00 N ATOM 0 H ASN C 31 6.572 7.192 -2.298 1.00 0.00 H new ATOM 0 HA ASN C 31 4.727 5.490 -3.614 1.00 0.00 H new ATOM 0 HB2 ASN C 31 5.129 7.891 -4.174 1.00 0.00 H new ATOM 0 HB3 ASN C 31 6.755 7.503 -4.701 1.00 0.00 H new ATOM 0 HD21 ASN C 31 4.296 7.440 -7.657 1.00 0.00 H new ATOM 0 HD22 ASN C 31 4.592 8.628 -6.383 1.00 0.00 H new ATOM 1193 N ILE C 32 7.934 4.933 -4.164 1.00 0.00 N ATOM 1194 CA ILE C 32 8.872 3.957 -4.712 1.00 0.00 C ATOM 1195 C ILE C 32 8.688 2.602 -4.035 1.00 0.00 C ATOM 1196 O ILE C 32 8.673 1.564 -4.695 1.00 0.00 O ATOM 1197 CB ILE C 32 10.311 4.446 -4.517 1.00 0.00 C ATOM 1198 CG1 ILE C 32 10.547 5.684 -5.386 1.00 0.00 C ATOM 1199 CG2 ILE C 32 11.295 3.344 -4.927 1.00 0.00 C ATOM 1200 CD1 ILE C 32 11.870 6.340 -4.993 1.00 0.00 C ATOM 0 H ILE C 32 8.370 5.709 -3.667 1.00 0.00 H new ATOM 0 HA ILE C 32 8.673 3.845 -5.778 1.00 0.00 H new ATOM 0 HB ILE C 32 10.467 4.696 -3.468 1.00 0.00 H new ATOM 0 HG12 ILE C 32 10.567 5.403 -6.439 1.00 0.00 H new ATOM 0 HG13 ILE C 32 9.727 6.391 -5.260 1.00 0.00 H new ATOM 0 HG21 ILE C 32 12.316 3.697 -4.786 1.00 0.00 H new ATOM 0 HG22 ILE C 32 11.129 2.460 -4.311 1.00 0.00 H new ATOM 0 HG23 ILE C 32 11.140 3.090 -5.976 1.00 0.00 H new ATOM 0 HD11 ILE C 32 12.037 7.221 -5.612 1.00 0.00 H new ATOM 0 HD12 ILE C 32 11.832 6.635 -3.944 1.00 0.00 H new ATOM 0 HD13 ILE C 32 12.685 5.632 -5.142 1.00 0.00 H new ATOM 1212 N ILE C 33 8.544 2.621 -2.715 1.00 0.00 N ATOM 1213 CA ILE C 33 8.360 1.390 -1.957 1.00 0.00 C ATOM 1214 C ILE C 33 7.064 0.693 -2.369 1.00 0.00 C ATOM 1215 O ILE C 33 7.034 -0.525 -2.540 1.00 0.00 O ATOM 1216 CB ILE C 33 8.332 1.704 -0.456 1.00 0.00 C ATOM 1217 CG1 ILE C 33 9.723 2.153 0.000 1.00 0.00 C ATOM 1218 CG2 ILE C 33 7.921 0.458 0.333 1.00 0.00 C ATOM 1219 CD1 ILE C 33 9.625 2.787 1.387 1.00 0.00 C ATOM 0 H ILE C 33 8.551 3.470 -2.150 1.00 0.00 H new ATOM 0 HA ILE C 33 9.194 0.721 -2.170 1.00 0.00 H new ATOM 0 HB ILE C 33 7.610 2.500 -0.274 1.00 0.00 H new ATOM 0 HG12 ILE C 33 10.402 1.301 0.025 1.00 0.00 H new ATOM 0 HG13 ILE C 33 10.137 2.869 -0.710 1.00 0.00 H new ATOM 0 HG21 ILE C 33 7.904 0.691 1.398 1.00 0.00 H new ATOM 0 HG22 ILE C 33 6.929 0.137 0.016 1.00 0.00 H new ATOM 0 HG23 ILE C 33 8.637 -0.342 0.148 1.00 0.00 H new ATOM 0 HD11 ILE C 33 10.615 3.107 1.712 1.00 0.00 H new ATOM 0 HD12 ILE C 33 8.960 3.650 1.346 1.00 0.00 H new ATOM 0 HD13 ILE C 33 9.230 2.057 2.094 1.00 0.00 H new ATOM 1231 N GLY C 34 5.997 1.468 -2.523 1.00 0.00 N ATOM 1232 CA GLY C 34 4.711 0.899 -2.908 1.00 0.00 C ATOM 1233 C GLY C 34 4.802 0.190 -4.258 1.00 0.00 C ATOM 1234 O GLY C 34 4.260 -0.901 -4.432 1.00 0.00 O ATOM 0 H GLY C 34 5.995 2.479 -2.389 1.00 0.00 H new ATOM 0 HA2 GLY C 34 4.380 0.194 -2.146 1.00 0.00 H new ATOM 0 HA3 GLY C 34 3.962 1.689 -2.959 1.00 0.00 H new ATOM 1238 N ILE C 35 5.492 0.815 -5.207 1.00 0.00 N ATOM 1239 CA ILE C 35 5.647 0.230 -6.536 1.00 0.00 C ATOM 1240 C ILE C 35 6.444 -1.071 -6.456 1.00 0.00 C ATOM 1241 O ILE C 35 6.100 -2.065 -7.096 1.00 0.00 O ATOM 1242 CB ILE C 35 6.361 1.222 -7.462 1.00 0.00 C ATOM 1243 CG1 ILE C 35 5.451 2.430 -7.706 1.00 0.00 C ATOM 1244 CG2 ILE C 35 6.669 0.549 -8.800 1.00 0.00 C ATOM 1245 CD1 ILE C 35 6.248 3.549 -8.381 1.00 0.00 C ATOM 0 H ILE C 35 5.949 1.718 -5.083 1.00 0.00 H new ATOM 0 HA ILE C 35 4.658 0.010 -6.938 1.00 0.00 H new ATOM 0 HB ILE C 35 7.291 1.546 -6.995 1.00 0.00 H new ATOM 0 HG12 ILE C 35 4.608 2.141 -8.334 1.00 0.00 H new ATOM 0 HG13 ILE C 35 5.038 2.783 -6.761 1.00 0.00 H new ATOM 0 HG21 ILE C 35 7.176 1.257 -9.455 1.00 0.00 H new ATOM 0 HG22 ILE C 35 7.312 -0.315 -8.633 1.00 0.00 H new ATOM 0 HG23 ILE C 35 5.739 0.225 -9.267 1.00 0.00 H new ATOM 0 HD11 ILE C 35 5.597 4.406 -8.553 1.00 0.00 H new ATOM 0 HD12 ILE C 35 7.076 3.845 -7.737 1.00 0.00 H new ATOM 0 HD13 ILE C 35 6.639 3.193 -9.334 1.00 0.00 H new ATOM 1257 N LEU C 36 7.513 -1.053 -5.664 1.00 0.00 N ATOM 1258 CA LEU C 36 8.363 -2.227 -5.502 1.00 0.00 C ATOM 1259 C LEU C 36 7.567 -3.379 -4.892 1.00 0.00 C ATOM 1260 O LEU C 36 7.720 -4.533 -5.295 1.00 0.00 O ATOM 1261 CB LEU C 36 9.555 -1.885 -4.603 1.00 0.00 C ATOM 1262 CG LEU C 36 10.505 -0.917 -5.325 1.00 0.00 C ATOM 1263 CD1 LEU C 36 11.488 -0.337 -4.306 1.00 0.00 C ATOM 1264 CD2 LEU C 36 11.286 -1.644 -6.437 1.00 0.00 C ATOM 0 H LEU C 36 7.810 -0.239 -5.126 1.00 0.00 H new ATOM 0 HA LEU C 36 8.728 -2.534 -6.482 1.00 0.00 H new ATOM 0 HB2 LEU C 36 9.202 -1.435 -3.675 1.00 0.00 H new ATOM 0 HB3 LEU C 36 10.089 -2.796 -4.333 1.00 0.00 H new ATOM 0 HG LEU C 36 9.919 -0.120 -5.782 1.00 0.00 H new ATOM 0 HD11 LEU C 36 12.168 0.352 -4.807 1.00 0.00 H new ATOM 0 HD12 LEU C 36 10.937 0.196 -3.532 1.00 0.00 H new ATOM 0 HD13 LEU C 36 12.061 -1.146 -3.852 1.00 0.00 H new ATOM 0 HD21 LEU C 36 11.952 -0.939 -6.934 1.00 0.00 H new ATOM 0 HD22 LEU C 36 11.873 -2.452 -6.001 1.00 0.00 H new ATOM 0 HD23 LEU C 36 10.586 -2.056 -7.164 1.00 0.00 H new ATOM 1276 N HIS C 37 6.716 -3.063 -3.924 1.00 0.00 N ATOM 1277 CA HIS C 37 5.904 -4.082 -3.277 1.00 0.00 C ATOM 1278 C HIS C 37 5.027 -4.792 -4.303 1.00 0.00 C ATOM 1279 O HIS C 37 4.879 -6.014 -4.266 1.00 0.00 O ATOM 1280 CB HIS C 37 5.012 -3.447 -2.214 1.00 0.00 C ATOM 1281 CG HIS C 37 4.220 -4.524 -1.528 1.00 0.00 C ATOM 1282 ND1 HIS C 37 4.350 -4.789 -0.178 1.00 0.00 N ATOM 1283 CD2 HIS C 37 3.296 -5.423 -1.997 1.00 0.00 C ATOM 1284 CE1 HIS C 37 3.527 -5.810 0.116 1.00 0.00 C ATOM 1285 NE2 HIS C 37 2.858 -6.233 -0.955 1.00 0.00 N ATOM 0 H HIS C 37 6.572 -2.116 -3.573 1.00 0.00 H new ATOM 0 HA HIS C 37 6.572 -4.805 -2.809 1.00 0.00 H new ATOM 0 HB2 HIS C 37 5.619 -2.907 -1.488 1.00 0.00 H new ATOM 0 HB3 HIS C 37 4.341 -2.720 -2.672 1.00 0.00 H new ATOM 0 HD2 HIS C 37 2.960 -5.491 -3.021 1.00 0.00 H new ATOM 0 HE1 HIS C 37 3.421 -6.236 1.103 1.00 0.00 H new ATOM 0 HE2 HIS C 37 2.173 -6.987 -1.001 1.00 0.00 H new ATOM 1293 N LEU C 38 4.444 -4.019 -5.217 1.00 0.00 N ATOM 1294 CA LEU C 38 3.577 -4.590 -6.246 1.00 0.00 C ATOM 1295 C LEU C 38 4.336 -5.582 -7.111 1.00 0.00 C ATOM 1296 O LEU C 38 3.801 -6.626 -7.467 1.00 0.00 O ATOM 1297 CB LEU C 38 2.976 -3.466 -7.125 1.00 0.00 C ATOM 1298 CG LEU C 38 1.596 -3.037 -6.582 1.00 0.00 C ATOM 1299 CD1 LEU C 38 1.251 -1.632 -7.079 1.00 0.00 C ATOM 1300 CD2 LEU C 38 0.517 -4.021 -7.072 1.00 0.00 C ATOM 0 H LEU C 38 4.554 -3.006 -5.267 1.00 0.00 H new ATOM 0 HA LEU C 38 2.767 -5.123 -5.748 1.00 0.00 H new ATOM 0 HB2 LEU C 38 3.650 -2.609 -7.141 1.00 0.00 H new ATOM 0 HB3 LEU C 38 2.877 -3.814 -8.153 1.00 0.00 H new ATOM 0 HG LEU C 38 1.631 -3.039 -5.493 1.00 0.00 H new ATOM 0 HD11 LEU C 38 0.276 -1.338 -6.691 1.00 0.00 H new ATOM 0 HD12 LEU C 38 2.007 -0.928 -6.732 1.00 0.00 H new ATOM 0 HD13 LEU C 38 1.224 -1.628 -8.169 1.00 0.00 H new ATOM 0 HD21 LEU C 38 -0.456 -3.715 -6.687 1.00 0.00 H new ATOM 0 HD22 LEU C 38 0.492 -4.021 -8.162 1.00 0.00 H new ATOM 0 HD23 LEU C 38 0.750 -5.024 -6.714 1.00 0.00 H new ATOM 1312 N ILE C 39 5.570 -5.260 -7.454 1.00 0.00 N ATOM 1313 CA ILE C 39 6.357 -6.153 -8.286 1.00 0.00 C ATOM 1314 C ILE C 39 6.569 -7.491 -7.579 1.00 0.00 C ATOM 1315 O ILE C 39 6.456 -8.552 -8.189 1.00 0.00 O ATOM 1316 CB ILE C 39 7.706 -5.505 -8.597 1.00 0.00 C ATOM 1317 CG1 ILE C 39 7.478 -4.280 -9.486 1.00 0.00 C ATOM 1318 CG2 ILE C 39 8.603 -6.511 -9.322 1.00 0.00 C ATOM 1319 CD1 ILE C 39 8.781 -3.490 -9.611 1.00 0.00 C ATOM 0 H ILE C 39 6.044 -4.401 -7.175 1.00 0.00 H new ATOM 0 HA ILE C 39 5.821 -6.336 -9.217 1.00 0.00 H new ATOM 0 HB ILE C 39 8.191 -5.199 -7.670 1.00 0.00 H new ATOM 0 HG12 ILE C 39 7.134 -4.592 -10.472 1.00 0.00 H new ATOM 0 HG13 ILE C 39 6.697 -3.649 -9.061 1.00 0.00 H new ATOM 0 HG21 ILE C 39 9.565 -6.048 -9.543 1.00 0.00 H new ATOM 0 HG22 ILE C 39 8.758 -7.384 -8.687 1.00 0.00 H new ATOM 0 HG23 ILE C 39 8.126 -6.819 -10.252 1.00 0.00 H new ATOM 0 HD11 ILE C 39 8.618 -2.618 -10.244 1.00 0.00 H new ATOM 0 HD12 ILE C 39 9.106 -3.165 -8.622 1.00 0.00 H new ATOM 0 HD13 ILE C 39 9.549 -4.123 -10.056 1.00 0.00 H new ATOM 1331 N LEU C 40 6.891 -7.440 -6.296 1.00 0.00 N ATOM 1332 CA LEU C 40 7.114 -8.664 -5.537 1.00 0.00 C ATOM 1333 C LEU C 40 5.798 -9.385 -5.246 1.00 0.00 C ATOM 1334 O LEU C 40 5.713 -10.608 -5.356 1.00 0.00 O ATOM 1335 CB LEU C 40 7.826 -8.324 -4.230 1.00 0.00 C ATOM 1336 CG LEU C 40 9.216 -7.752 -4.537 1.00 0.00 C ATOM 1337 CD1 LEU C 40 9.836 -7.239 -3.236 1.00 0.00 C ATOM 1338 CD2 LEU C 40 10.124 -8.831 -5.161 1.00 0.00 C ATOM 0 H LEU C 40 7.003 -6.578 -5.763 1.00 0.00 H new ATOM 0 HA LEU C 40 7.735 -9.334 -6.133 1.00 0.00 H new ATOM 0 HB2 LEU C 40 7.241 -7.600 -3.663 1.00 0.00 H new ATOM 0 HB3 LEU C 40 7.917 -9.216 -3.611 1.00 0.00 H new ATOM 0 HG LEU C 40 9.118 -6.935 -5.252 1.00 0.00 H new ATOM 0 HD11 LEU C 40 10.825 -6.830 -3.441 1.00 0.00 H new ATOM 0 HD12 LEU C 40 9.201 -6.460 -2.813 1.00 0.00 H new ATOM 0 HD13 LEU C 40 9.924 -8.061 -2.526 1.00 0.00 H new ATOM 0 HD21 LEU C 40 11.105 -8.404 -5.371 1.00 0.00 H new ATOM 0 HD22 LEU C 40 10.232 -9.663 -4.465 1.00 0.00 H new ATOM 0 HD23 LEU C 40 9.678 -9.190 -6.089 1.00 0.00 H new ATOM 1350 N TRP C 41 4.777 -8.622 -4.861 1.00 0.00 N ATOM 1351 CA TRP C 41 3.473 -9.204 -4.545 1.00 0.00 C ATOM 1352 C TRP C 41 2.801 -9.779 -5.792 1.00 0.00 C ATOM 1353 O TRP C 41 2.274 -10.891 -5.761 1.00 0.00 O ATOM 1354 CB TRP C 41 2.574 -8.136 -3.911 1.00 0.00 C ATOM 1355 CG TRP C 41 1.175 -8.656 -3.777 1.00 0.00 C ATOM 1356 CD1 TRP C 41 0.715 -9.412 -2.752 1.00 0.00 C ATOM 1357 CD2 TRP C 41 0.044 -8.445 -4.666 1.00 0.00 C ATOM 1358 NE1 TRP C 41 -0.618 -9.700 -2.974 1.00 0.00 N ATOM 1359 CE2 TRP C 41 -1.079 -9.120 -4.137 1.00 0.00 C ATOM 1360 CE3 TRP C 41 -0.115 -7.742 -5.874 1.00 0.00 C ATOM 1361 CZ2 TRP C 41 -2.311 -9.097 -4.781 1.00 0.00 C ATOM 1362 CZ3 TRP C 41 -1.360 -7.713 -6.522 1.00 0.00 C ATOM 1363 CH2 TRP C 41 -2.454 -8.391 -5.974 1.00 0.00 C ATOM 0 H TRP C 41 4.825 -7.608 -4.761 1.00 0.00 H new ATOM 0 HA TRP C 41 3.626 -10.022 -3.841 1.00 0.00 H new ATOM 0 HB2 TRP C 41 2.962 -7.857 -2.931 1.00 0.00 H new ATOM 0 HB3 TRP C 41 2.578 -7.235 -4.524 1.00 0.00 H new ATOM 0 HD1 TRP C 41 1.295 -9.737 -1.901 1.00 0.00 H new ATOM 0 HE1 TRP C 41 -1.191 -10.272 -2.353 1.00 0.00 H new ATOM 0 HE3 TRP C 41 0.727 -7.221 -6.306 1.00 0.00 H new ATOM 0 HZ2 TRP C 41 -3.154 -9.624 -4.358 1.00 0.00 H new ATOM 0 HZ3 TRP C 41 -1.473 -7.166 -7.446 1.00 0.00 H new ATOM 0 HH2 TRP C 41 -3.410 -8.367 -6.476 1.00 0.00 H new ATOM 1374 N ILE C 42 2.804 -9.014 -6.877 1.00 0.00 N ATOM 1375 CA ILE C 42 2.169 -9.466 -8.112 1.00 0.00 C ATOM 1376 C ILE C 42 2.883 -10.701 -8.658 1.00 0.00 C ATOM 1377 O ILE C 42 2.244 -11.647 -9.117 1.00 0.00 O ATOM 1378 CB ILE C 42 2.187 -8.335 -9.158 1.00 0.00 C ATOM 1379 CG1 ILE C 42 1.195 -8.649 -10.301 1.00 0.00 C ATOM 1380 CG2 ILE C 42 3.600 -8.187 -9.744 1.00 0.00 C ATOM 1381 CD1 ILE C 42 -0.226 -8.209 -9.916 1.00 0.00 C ATOM 0 H ILE C 42 3.232 -8.090 -6.929 1.00 0.00 H new ATOM 0 HA ILE C 42 1.134 -9.732 -7.896 1.00 0.00 H new ATOM 0 HB ILE C 42 1.893 -7.406 -8.670 1.00 0.00 H new ATOM 0 HG12 ILE C 42 1.506 -8.137 -11.212 1.00 0.00 H new ATOM 0 HG13 ILE C 42 1.205 -9.717 -10.516 1.00 0.00 H new ATOM 0 HG21 ILE C 42 3.605 -7.386 -10.483 1.00 0.00 H new ATOM 0 HG22 ILE C 42 4.302 -7.949 -8.945 1.00 0.00 H new ATOM 0 HG23 ILE C 42 3.896 -9.122 -10.220 1.00 0.00 H new ATOM 0 HD11 ILE C 42 -0.911 -8.438 -10.732 1.00 0.00 H new ATOM 0 HD12 ILE C 42 -0.541 -8.741 -9.018 1.00 0.00 H new ATOM 0 HD13 ILE C 42 -0.235 -7.136 -9.724 1.00 0.00 H new ATOM 1393 N LEU C 43 4.209 -10.680 -8.599 1.00 0.00 N ATOM 1394 CA LEU C 43 5.004 -11.802 -9.084 1.00 0.00 C ATOM 1395 C LEU C 43 4.715 -13.059 -8.269 1.00 0.00 C ATOM 1396 O LEU C 43 4.625 -14.156 -8.817 1.00 0.00 O ATOM 1397 CB LEU C 43 6.495 -11.454 -9.003 1.00 0.00 C ATOM 1398 CG LEU C 43 6.899 -10.549 -10.184 1.00 0.00 C ATOM 1399 CD1 LEU C 43 8.319 -10.015 -9.949 1.00 0.00 C ATOM 1400 CD2 LEU C 43 6.850 -11.337 -11.513 1.00 0.00 C ATOM 0 H LEU C 43 4.754 -9.904 -8.223 1.00 0.00 H new ATOM 0 HA LEU C 43 4.735 -11.997 -10.122 1.00 0.00 H new ATOM 0 HB2 LEU C 43 6.707 -10.949 -8.060 1.00 0.00 H new ATOM 0 HB3 LEU C 43 7.090 -12.367 -9.016 1.00 0.00 H new ATOM 0 HG LEU C 43 6.198 -9.717 -10.250 1.00 0.00 H new ATOM 0 HD11 LEU C 43 8.609 -9.374 -10.782 1.00 0.00 H new ATOM 0 HD12 LEU C 43 8.343 -9.440 -9.023 1.00 0.00 H new ATOM 0 HD13 LEU C 43 9.014 -10.851 -9.875 1.00 0.00 H new ATOM 0 HD21 LEU C 43 7.138 -10.682 -12.335 1.00 0.00 H new ATOM 0 HD22 LEU C 43 7.539 -12.180 -11.462 1.00 0.00 H new ATOM 0 HD23 LEU C 43 5.838 -11.706 -11.680 1.00 0.00 H new ATOM 1412 N ASP C 44 4.573 -12.895 -6.962 1.00 0.00 N ATOM 1413 CA ASP C 44 4.305 -14.033 -6.092 1.00 0.00 C ATOM 1414 C ASP C 44 3.033 -14.748 -6.534 1.00 0.00 C ATOM 1415 O ASP C 44 2.991 -15.974 -6.604 1.00 0.00 O ATOM 1416 CB ASP C 44 4.144 -13.550 -4.651 1.00 0.00 C ATOM 1417 CG ASP C 44 5.499 -13.134 -4.088 1.00 0.00 C ATOM 1418 OD1 ASP C 44 6.502 -13.497 -4.679 1.00 0.00 O ATOM 1419 OD2 ASP C 44 5.516 -12.454 -3.077 1.00 0.00 O ATOM 0 H ASP C 44 4.638 -11.996 -6.484 1.00 0.00 H new ATOM 0 HA ASP C 44 5.142 -14.728 -6.154 1.00 0.00 H new ATOM 0 HB2 ASP C 44 3.452 -12.709 -4.616 1.00 0.00 H new ATOM 0 HB3 ASP C 44 3.714 -14.343 -4.039 1.00 0.00 H new ATOM 1424 N ARG C 45 2.001 -13.972 -6.833 1.00 0.00 N ATOM 1425 CA ARG C 45 0.736 -14.543 -7.271 1.00 0.00 C ATOM 1426 C ARG C 45 0.903 -15.238 -8.617 1.00 0.00 C ATOM 1427 O ARG C 45 0.294 -16.277 -8.870 1.00 0.00 O ATOM 1428 CB ARG C 45 -0.314 -13.443 -7.390 1.00 0.00 C ATOM 1429 CG ARG C 45 -0.520 -12.752 -6.032 1.00 0.00 C ATOM 1430 CD ARG C 45 -1.179 -13.707 -5.024 1.00 0.00 C ATOM 1431 NE ARG C 45 -2.320 -14.382 -5.634 1.00 0.00 N ATOM 1432 CZ ARG C 45 -3.522 -13.814 -5.660 1.00 0.00 C ATOM 1433 NH1 ARG C 45 -3.706 -12.647 -5.105 1.00 0.00 N ATOM 1434 NH2 ARG C 45 -4.518 -14.427 -6.240 1.00 0.00 N ATOM 0 H ARG C 45 2.014 -12.953 -6.781 1.00 0.00 H new ATOM 0 HA ARG C 45 0.412 -15.277 -6.534 1.00 0.00 H new ATOM 0 HB2 ARG C 45 -0.001 -12.711 -8.134 1.00 0.00 H new ATOM 0 HB3 ARG C 45 -1.257 -13.867 -7.737 1.00 0.00 H new ATOM 0 HG2 ARG C 45 0.440 -12.413 -5.643 1.00 0.00 H new ATOM 0 HG3 ARG C 45 -1.143 -11.867 -6.161 1.00 0.00 H new ATOM 0 HD2 ARG C 45 -0.452 -14.444 -4.683 1.00 0.00 H new ATOM 0 HD3 ARG C 45 -1.505 -13.150 -4.145 1.00 0.00 H new ATOM 0 HE ARG C 45 -2.193 -15.306 -6.048 1.00 0.00 H new ATOM 0 HH11 ARG C 45 -2.927 -12.170 -4.651 1.00 0.00 H new ATOM 0 HH12 ARG C 45 -4.628 -12.212 -5.126 1.00 0.00 H new ATOM 0 HH21 ARG C 45 -4.373 -15.340 -6.672 1.00 0.00 H new ATOM 0 HH22 ARG C 45 -5.441 -13.993 -6.261 1.00 0.00 H new ATOM 1448 N LEU C 46 1.722 -14.653 -9.480 1.00 0.00 N ATOM 1449 CA LEU C 46 1.948 -15.225 -10.797 1.00 0.00 C ATOM 1450 C LEU C 46 2.575 -16.609 -10.684 1.00 0.00 C ATOM 1451 O LEU C 46 2.163 -17.543 -11.372 1.00 0.00 O ATOM 1452 CB LEU C 46 2.870 -14.303 -11.609 1.00 0.00 C ATOM 1453 CG LEU C 46 3.122 -14.891 -13.025 1.00 0.00 C ATOM 1454 CD1 LEU C 46 3.087 -13.772 -14.072 1.00 0.00 C ATOM 1455 CD2 LEU C 46 4.498 -15.573 -13.092 1.00 0.00 C ATOM 0 H LEU C 46 2.236 -13.792 -9.294 1.00 0.00 H new ATOM 0 HA LEU C 46 0.988 -15.321 -11.304 1.00 0.00 H new ATOM 0 HB2 LEU C 46 2.420 -13.314 -11.695 1.00 0.00 H new ATOM 0 HB3 LEU C 46 3.819 -14.177 -11.087 1.00 0.00 H new ATOM 0 HG LEU C 46 2.340 -15.623 -13.228 1.00 0.00 H new ATOM 0 HD11 LEU C 46 3.265 -14.194 -15.061 1.00 0.00 H new ATOM 0 HD12 LEU C 46 2.111 -13.287 -14.054 1.00 0.00 H new ATOM 0 HD13 LEU C 46 3.861 -13.038 -13.846 1.00 0.00 H new ATOM 0 HD21 LEU C 46 4.655 -15.978 -14.092 1.00 0.00 H new ATOM 0 HD22 LEU C 46 5.277 -14.844 -12.870 1.00 0.00 H new ATOM 0 HD23 LEU C 46 4.539 -16.382 -12.362 1.00 0.00 H new ATOM 1467 N PHE C 47 3.575 -16.739 -9.817 1.00 0.00 N ATOM 1468 CA PHE C 47 4.245 -18.022 -9.639 1.00 0.00 C ATOM 1469 C PHE C 47 3.347 -19.013 -8.904 1.00 0.00 C ATOM 1470 O PHE C 47 3.079 -20.109 -9.396 1.00 0.00 O ATOM 1471 CB PHE C 47 5.547 -17.833 -8.854 1.00 0.00 C ATOM 1472 CG PHE C 47 6.567 -17.138 -9.727 1.00 0.00 C ATOM 1473 CD1 PHE C 47 7.084 -17.793 -10.851 1.00 0.00 C ATOM 1474 CD2 PHE C 47 6.998 -15.840 -9.419 1.00 0.00 C ATOM 1475 CE1 PHE C 47 8.026 -17.156 -11.665 1.00 0.00 C ATOM 1476 CE2 PHE C 47 7.941 -15.200 -10.234 1.00 0.00 C ATOM 1477 CZ PHE C 47 8.455 -15.859 -11.357 1.00 0.00 C ATOM 0 H PHE C 47 3.935 -15.983 -9.234 1.00 0.00 H new ATOM 0 HA PHE C 47 4.469 -18.423 -10.627 1.00 0.00 H new ATOM 0 HB2 PHE C 47 5.360 -17.244 -7.956 1.00 0.00 H new ATOM 0 HB3 PHE C 47 5.931 -18.800 -8.527 1.00 0.00 H new ATOM 0 HD1 PHE C 47 6.754 -18.793 -11.090 1.00 0.00 H new ATOM 0 HD2 PHE C 47 6.602 -15.332 -8.552 1.00 0.00 H new ATOM 0 HE1 PHE C 47 8.423 -17.664 -12.531 1.00 0.00 H new ATOM 0 HE2 PHE C 47 8.271 -14.200 -9.996 1.00 0.00 H new ATOM 0 HZ PHE C 47 9.182 -15.367 -11.986 1.00 0.00 H new ATOM 1487 N PHE C 48 2.883 -18.615 -7.721 1.00 0.00 N ATOM 1488 CA PHE C 48 2.013 -19.465 -6.908 1.00 0.00 C ATOM 1489 C PHE C 48 0.864 -18.648 -6.327 1.00 0.00 C ATOM 1490 O PHE C 48 1.018 -17.466 -6.032 1.00 0.00 O ATOM 1491 CB PHE C 48 2.816 -20.096 -5.768 1.00 0.00 C ATOM 1492 CG PHE C 48 3.752 -21.135 -6.333 1.00 0.00 C ATOM 1493 CD1 PHE C 48 3.289 -22.435 -6.572 1.00 0.00 C ATOM 1494 CD2 PHE C 48 5.082 -20.802 -6.620 1.00 0.00 C ATOM 1495 CE1 PHE C 48 4.153 -23.401 -7.097 1.00 0.00 C ATOM 1496 CE2 PHE C 48 5.947 -21.770 -7.145 1.00 0.00 C ATOM 1497 CZ PHE C 48 5.483 -23.069 -7.384 1.00 0.00 C ATOM 0 H PHE C 48 3.095 -17.709 -7.303 1.00 0.00 H new ATOM 0 HA PHE C 48 1.605 -20.251 -7.544 1.00 0.00 H new ATOM 0 HB2 PHE C 48 3.382 -19.329 -5.239 1.00 0.00 H new ATOM 0 HB3 PHE C 48 2.143 -20.553 -5.043 1.00 0.00 H new ATOM 0 HD1 PHE C 48 2.264 -22.692 -6.351 1.00 0.00 H new ATOM 0 HD2 PHE C 48 5.440 -19.800 -6.437 1.00 0.00 H new ATOM 0 HE1 PHE C 48 3.795 -24.403 -7.281 1.00 0.00 H new ATOM 0 HE2 PHE C 48 6.973 -21.514 -7.366 1.00 0.00 H new ATOM 0 HZ PHE C 48 6.150 -23.815 -7.790 1.00 0.00 H new ATOM 1507 N LYS C 49 -0.284 -19.294 -6.164 1.00 0.00 N ATOM 1508 CA LYS C 49 -1.455 -18.619 -5.616 1.00 0.00 C ATOM 1509 C LYS C 49 -1.198 -18.183 -4.178 1.00 0.00 C ATOM 1510 O LYS C 49 -1.796 -17.206 -3.760 1.00 0.00 O ATOM 1511 CB LYS C 49 -2.660 -19.558 -5.656 1.00 0.00 C ATOM 1512 CG LYS C 49 -3.049 -19.831 -7.111 1.00 0.00 C ATOM 1513 CD LYS C 49 -4.313 -20.701 -7.166 1.00 0.00 C ATOM 1514 CE LYS C 49 -4.004 -22.135 -6.717 1.00 0.00 C ATOM 1515 NZ LYS C 49 -5.133 -23.028 -7.115 1.00 0.00 N ATOM 1516 OXT LYS C 49 -0.407 -18.834 -3.511 1.00 0.00 O ATOM 0 H LYS C 49 -0.429 -20.275 -6.401 1.00 0.00 H new ATOM 0 HA LYS C 49 -1.659 -17.735 -6.221 1.00 0.00 H new ATOM 0 HB2 LYS C 49 -2.422 -20.494 -5.151 1.00 0.00 H new ATOM 0 HB3 LYS C 49 -3.499 -19.112 -5.122 1.00 0.00 H new ATOM 0 HG2 LYS C 49 -3.224 -18.889 -7.632 1.00 0.00 H new ATOM 0 HG3 LYS C 49 -2.230 -20.333 -7.626 1.00 0.00 H new ATOM 0 HD2 LYS C 49 -5.084 -20.272 -6.526 1.00 0.00 H new ATOM 0 HD3 LYS C 49 -4.710 -20.710 -8.181 1.00 0.00 H new ATOM 0 HE2 LYS C 49 -3.075 -22.479 -7.171 1.00 0.00 H new ATOM 0 HE3 LYS C 49 -3.862 -22.168 -5.637 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 -4.928 -24.002 -6.813 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 -6.010 -22.702 -6.661 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 -5.248 -23.003 -8.148 1.00 0.00 H new TER 1530 LYS C 49 ATOM 1531 N SER D 19 5.617 24.609 13.312 1.00 0.00 N ATOM 1532 CA SER D 19 6.763 24.460 12.372 1.00 0.00 C ATOM 1533 C SER D 19 6.555 23.219 11.512 1.00 0.00 C ATOM 1534 O SER D 19 5.725 22.366 11.826 1.00 0.00 O ATOM 1535 CB SER D 19 8.060 24.331 13.171 1.00 0.00 C ATOM 1536 OG SER D 19 8.162 25.416 14.083 1.00 0.00 O ATOM 0 HA SER D 19 6.826 25.336 11.726 1.00 0.00 H new ATOM 0 HB2 SER D 19 8.075 23.385 13.711 1.00 0.00 H new ATOM 0 HB3 SER D 19 8.917 24.326 12.497 1.00 0.00 H new ATOM 0 HG SER D 19 7.265 25.745 14.302 1.00 0.00 H new ATOM 1544 N ASN D 20 7.316 23.124 10.427 1.00 0.00 N ATOM 1545 CA ASN D 20 7.206 21.982 9.526 1.00 0.00 C ATOM 1546 C ASN D 20 5.771 21.824 9.033 1.00 0.00 C ATOM 1547 O ASN D 20 5.262 20.709 8.915 1.00 0.00 O ATOM 1548 CB ASN D 20 7.644 20.706 10.246 1.00 0.00 C ATOM 1549 CG ASN D 20 7.856 19.583 9.234 1.00 0.00 C ATOM 1550 OD1 ASN D 20 7.088 18.621 9.204 1.00 0.00 O ATOM 1551 ND2 ASN D 20 8.856 19.650 8.400 1.00 0.00 N ATOM 0 H ASN D 20 8.011 23.818 10.151 1.00 0.00 H new ATOM 0 HA ASN D 20 7.855 22.156 8.668 1.00 0.00 H new ATOM 0 HB2 ASN D 20 8.566 20.888 10.798 1.00 0.00 H new ATOM 0 HB3 ASN D 20 6.889 20.412 10.975 1.00 0.00 H new ATOM 0 HD21 ASN D 20 9.004 18.904 7.720 1.00 0.00 H new ATOM 0 HD22 ASN D 20 9.490 20.448 8.427 1.00 0.00 H new ATOM 1558 N ASP D 21 5.123 22.951 8.744 1.00 0.00 N ATOM 1559 CA ASP D 21 3.745 22.930 8.263 1.00 0.00 C ATOM 1560 C ASP D 21 3.705 22.619 6.771 1.00 0.00 C ATOM 1561 O ASP D 21 2.633 22.502 6.180 1.00 0.00 O ATOM 1562 CB ASP D 21 3.083 24.284 8.523 1.00 0.00 C ATOM 1563 CG ASP D 21 2.933 24.513 10.023 1.00 0.00 C ATOM 1564 OD1 ASP D 21 2.922 23.534 10.751 1.00 0.00 O ATOM 1565 OD2 ASP D 21 2.834 25.660 10.421 1.00 0.00 O ATOM 0 H ASP D 21 5.527 23.883 8.834 1.00 0.00 H new ATOM 0 HA ASP D 21 3.202 22.151 8.799 1.00 0.00 H new ATOM 0 HB2 ASP D 21 3.682 25.081 8.083 1.00 0.00 H new ATOM 0 HB3 ASP D 21 2.105 24.318 8.042 1.00 0.00 H new ATOM 1570 N SER D 22 4.882 22.490 6.169 1.00 0.00 N ATOM 1571 CA SER D 22 4.974 22.196 4.744 1.00 0.00 C ATOM 1572 C SER D 22 4.412 20.812 4.443 1.00 0.00 C ATOM 1573 O SER D 22 4.113 20.489 3.291 1.00 0.00 O ATOM 1574 CB SER D 22 6.432 22.264 4.287 1.00 0.00 C ATOM 1575 OG SER D 22 7.202 21.327 5.029 1.00 0.00 O ATOM 0 H SER D 22 5.781 22.584 6.642 1.00 0.00 H new ATOM 0 HA SER D 22 4.388 22.940 4.204 1.00 0.00 H new ATOM 0 HB2 SER D 22 6.501 22.046 3.221 1.00 0.00 H new ATOM 0 HB3 SER D 22 6.824 23.271 4.433 1.00 0.00 H new ATOM 0 HG SER D 22 8.137 21.367 4.737 1.00 0.00 H new ATOM 1581 N SER D 23 4.265 19.994 5.482 1.00 0.00 N ATOM 1582 CA SER D 23 3.733 18.645 5.322 1.00 0.00 C ATOM 1583 C SER D 23 2.956 18.238 6.567 1.00 0.00 C ATOM 1584 O SER D 23 3.474 18.295 7.683 1.00 0.00 O ATOM 1585 CB SER D 23 4.877 17.660 5.087 1.00 0.00 C ATOM 1586 OG SER D 23 4.343 16.356 4.897 1.00 0.00 O ATOM 0 H SER D 23 4.506 20.242 6.442 1.00 0.00 H new ATOM 0 HA SER D 23 3.063 18.631 4.463 1.00 0.00 H new ATOM 0 HB2 SER D 23 5.456 17.959 4.213 1.00 0.00 H new ATOM 0 HB3 SER D 23 5.558 17.666 5.938 1.00 0.00 H new ATOM 0 HG SER D 23 5.075 15.722 4.744 1.00 0.00 H new ATOM 1592 N ASP D 24 1.708 17.833 6.370 1.00 0.00 N ATOM 1593 CA ASP D 24 0.864 17.428 7.485 1.00 0.00 C ATOM 1594 C ASP D 24 1.313 16.060 8.024 1.00 0.00 C ATOM 1595 O ASP D 24 1.869 15.249 7.283 1.00 0.00 O ATOM 1596 CB ASP D 24 -0.608 17.360 7.026 1.00 0.00 C ATOM 1597 CG ASP D 24 -1.273 18.732 7.149 1.00 0.00 C ATOM 1598 OD1 ASP D 24 -0.722 19.689 6.631 1.00 0.00 O ATOM 1599 OD2 ASP D 24 -2.325 18.803 7.763 1.00 0.00 O ATOM 0 H ASP D 24 1.261 17.777 5.455 1.00 0.00 H new ATOM 0 HA ASP D 24 0.956 18.163 8.284 1.00 0.00 H new ATOM 0 HB2 ASP D 24 -0.657 17.017 5.992 1.00 0.00 H new ATOM 0 HB3 ASP D 24 -1.150 16.632 7.629 1.00 0.00 H new ATOM 1604 N PRO D 25 1.078 15.791 9.287 1.00 0.00 N ATOM 1605 CA PRO D 25 1.462 14.493 9.920 1.00 0.00 C ATOM 1606 C PRO D 25 0.664 13.320 9.340 1.00 0.00 C ATOM 1607 O PRO D 25 1.075 12.167 9.457 1.00 0.00 O ATOM 1608 CB PRO D 25 1.147 14.700 11.411 1.00 0.00 C ATOM 1609 CG PRO D 25 0.112 15.778 11.442 1.00 0.00 C ATOM 1610 CD PRO D 25 0.420 16.689 10.255 1.00 0.00 C ATOM 0 HA PRO D 25 2.507 14.240 9.742 1.00 0.00 H new ATOM 0 HB2 PRO D 25 0.775 13.782 11.867 1.00 0.00 H new ATOM 0 HB3 PRO D 25 2.038 14.993 11.966 1.00 0.00 H new ATOM 0 HG2 PRO D 25 -0.891 15.359 11.363 1.00 0.00 H new ATOM 0 HG3 PRO D 25 0.153 16.332 12.380 1.00 0.00 H new ATOM 0 HD2 PRO D 25 -0.488 17.128 9.841 1.00 0.00 H new ATOM 0 HD3 PRO D 25 1.071 17.515 10.542 1.00 0.00 H new ATOM 1618 N LEU D 26 -0.478 13.625 8.728 1.00 0.00 N ATOM 1619 CA LEU D 26 -1.317 12.580 8.148 1.00 0.00 C ATOM 1620 C LEU D 26 -0.571 11.855 7.032 1.00 0.00 C ATOM 1621 O LEU D 26 -0.613 10.629 6.943 1.00 0.00 O ATOM 1622 CB LEU D 26 -2.610 13.188 7.591 1.00 0.00 C ATOM 1623 CG LEU D 26 -3.515 12.090 7.007 1.00 0.00 C ATOM 1624 CD1 LEU D 26 -3.889 11.065 8.095 1.00 0.00 C ATOM 1625 CD2 LEU D 26 -4.788 12.742 6.447 1.00 0.00 C ATOM 0 H LEU D 26 -0.840 14.573 8.622 1.00 0.00 H new ATOM 0 HA LEU D 26 -1.565 11.864 8.932 1.00 0.00 H new ATOM 0 HB2 LEU D 26 -3.138 13.720 8.382 1.00 0.00 H new ATOM 0 HB3 LEU D 26 -2.371 13.919 6.819 1.00 0.00 H new ATOM 0 HG LEU D 26 -2.982 11.568 6.212 1.00 0.00 H new ATOM 0 HD11 LEU D 26 -4.530 10.295 7.665 1.00 0.00 H new ATOM 0 HD12 LEU D 26 -2.983 10.605 8.488 1.00 0.00 H new ATOM 0 HD13 LEU D 26 -4.420 11.569 8.903 1.00 0.00 H new ATOM 0 HD21 LEU D 26 -5.438 11.973 6.030 1.00 0.00 H new ATOM 0 HD22 LEU D 26 -5.312 13.264 7.248 1.00 0.00 H new ATOM 0 HD23 LEU D 26 -4.519 13.453 5.665 1.00 0.00 H new ATOM 1637 N VAL D 27 0.108 12.619 6.183 1.00 0.00 N ATOM 1638 CA VAL D 27 0.857 12.033 5.077 1.00 0.00 C ATOM 1639 C VAL D 27 1.985 11.153 5.604 1.00 0.00 C ATOM 1640 O VAL D 27 2.215 10.053 5.103 1.00 0.00 O ATOM 1641 CB VAL D 27 1.430 13.143 4.190 1.00 0.00 C ATOM 1642 CG1 VAL D 27 2.365 12.539 3.140 1.00 0.00 C ATOM 1643 CG2 VAL D 27 0.279 13.867 3.487 1.00 0.00 C ATOM 0 H VAL D 27 0.155 13.636 6.238 1.00 0.00 H new ATOM 0 HA VAL D 27 0.181 11.415 4.486 1.00 0.00 H new ATOM 0 HB VAL D 27 1.990 13.846 4.806 1.00 0.00 H new ATOM 0 HG11 VAL D 27 2.769 13.333 2.513 1.00 0.00 H new ATOM 0 HG12 VAL D 27 3.183 12.018 3.638 1.00 0.00 H new ATOM 0 HG13 VAL D 27 1.810 11.834 2.521 1.00 0.00 H new ATOM 0 HG21 VAL D 27 0.680 14.659 2.854 1.00 0.00 H new ATOM 0 HG22 VAL D 27 -0.276 13.158 2.873 1.00 0.00 H new ATOM 0 HG23 VAL D 27 -0.387 14.301 4.233 1.00 0.00 H new ATOM 1653 N VAL D 28 2.687 11.646 6.617 1.00 0.00 N ATOM 1654 CA VAL D 28 3.791 10.900 7.205 1.00 0.00 C ATOM 1655 C VAL D 28 3.294 9.579 7.783 1.00 0.00 C ATOM 1656 O VAL D 28 3.924 8.536 7.603 1.00 0.00 O ATOM 1657 CB VAL D 28 4.451 11.728 8.309 1.00 0.00 C ATOM 1658 CG1 VAL D 28 5.588 10.924 8.942 1.00 0.00 C ATOM 1659 CG2 VAL D 28 5.005 13.021 7.708 1.00 0.00 C ATOM 0 H VAL D 28 2.512 12.555 7.046 1.00 0.00 H new ATOM 0 HA VAL D 28 4.522 10.690 6.424 1.00 0.00 H new ATOM 0 HB VAL D 28 3.714 11.970 9.075 1.00 0.00 H new ATOM 0 HG11 VAL D 28 6.058 11.515 9.728 1.00 0.00 H new ATOM 0 HG12 VAL D 28 5.189 10.004 9.369 1.00 0.00 H new ATOM 0 HG13 VAL D 28 6.329 10.680 8.181 1.00 0.00 H new ATOM 0 HG21 VAL D 28 5.476 13.614 8.492 1.00 0.00 H new ATOM 0 HG22 VAL D 28 5.743 12.780 6.943 1.00 0.00 H new ATOM 0 HG23 VAL D 28 4.191 13.592 7.261 1.00 0.00 H new ATOM 1669 N ALA D 29 2.163 9.627 8.478 1.00 0.00 N ATOM 1670 CA ALA D 29 1.598 8.425 9.078 1.00 0.00 C ATOM 1671 C ALA D 29 1.367 7.357 8.017 1.00 0.00 C ATOM 1672 O ALA D 29 1.642 6.179 8.240 1.00 0.00 O ATOM 1673 CB ALA D 29 0.268 8.753 9.761 1.00 0.00 C ATOM 0 H ALA D 29 1.624 10.478 8.639 1.00 0.00 H new ATOM 0 HA ALA D 29 2.305 8.048 9.817 1.00 0.00 H new ATOM 0 HB1 ALA D 29 -0.145 7.848 10.206 1.00 0.00 H new ATOM 0 HB2 ALA D 29 0.433 9.498 10.540 1.00 0.00 H new ATOM 0 HB3 ALA D 29 -0.432 9.147 9.024 1.00 0.00 H new ATOM 1679 N ALA D 30 0.863 7.770 6.862 1.00 0.00 N ATOM 1680 CA ALA D 30 0.602 6.829 5.782 1.00 0.00 C ATOM 1681 C ALA D 30 1.894 6.148 5.339 1.00 0.00 C ATOM 1682 O ALA D 30 1.918 4.940 5.101 1.00 0.00 O ATOM 1683 CB ALA D 30 -0.025 7.558 4.593 1.00 0.00 C ATOM 0 H ALA D 30 0.629 8.740 6.650 1.00 0.00 H new ATOM 0 HA ALA D 30 -0.089 6.070 6.148 1.00 0.00 H new ATOM 0 HB1 ALA D 30 -0.217 6.846 3.790 1.00 0.00 H new ATOM 0 HB2 ALA D 30 -0.964 8.018 4.902 1.00 0.00 H new ATOM 0 HB3 ALA D 30 0.658 8.330 4.238 1.00 0.00 H new ATOM 1689 N ASN D 31 2.964 6.928 5.227 1.00 0.00 N ATOM 1690 CA ASN D 31 4.250 6.382 4.811 1.00 0.00 C ATOM 1691 C ASN D 31 4.783 5.402 5.853 1.00 0.00 C ATOM 1692 O ASN D 31 5.298 4.339 5.509 1.00 0.00 O ATOM 1693 CB ASN D 31 5.257 7.517 4.615 1.00 0.00 C ATOM 1694 CG ASN D 31 6.596 6.960 4.148 1.00 0.00 C ATOM 1695 OD1 ASN D 31 6.919 5.800 4.408 1.00 0.00 O ATOM 1696 ND2 ASN D 31 7.405 7.723 3.463 1.00 0.00 N ATOM 0 H ASN D 31 2.967 7.930 5.416 1.00 0.00 H new ATOM 0 HA ASN D 31 4.110 5.850 3.870 1.00 0.00 H new ATOM 0 HB2 ASN D 31 4.876 8.228 3.882 1.00 0.00 H new ATOM 0 HB3 ASN D 31 5.388 8.062 5.550 1.00 0.00 H new ATOM 0 HD21 ASN D 31 8.303 7.358 3.144 1.00 0.00 H new ATOM 0 HD22 ASN D 31 7.139 8.684 3.247 1.00 0.00 H new ATOM 1703 N ILE D 32 4.657 5.768 7.125 1.00 0.00 N ATOM 1704 CA ILE D 32 5.133 4.911 8.207 1.00 0.00 C ATOM 1705 C ILE D 32 4.342 3.606 8.244 1.00 0.00 C ATOM 1706 O ILE D 32 4.911 2.527 8.396 1.00 0.00 O ATOM 1707 CB ILE D 32 4.999 5.639 9.549 1.00 0.00 C ATOM 1708 CG1 ILE D 32 5.975 6.819 9.583 1.00 0.00 C ATOM 1709 CG2 ILE D 32 5.330 4.677 10.698 1.00 0.00 C ATOM 1710 CD1 ILE D 32 5.655 7.710 10.785 1.00 0.00 C ATOM 0 H ILE D 32 4.233 6.644 7.431 1.00 0.00 H new ATOM 0 HA ILE D 32 6.183 4.678 8.028 1.00 0.00 H new ATOM 0 HB ILE D 32 3.977 5.999 9.663 1.00 0.00 H new ATOM 0 HG12 ILE D 32 7.000 6.455 9.649 1.00 0.00 H new ATOM 0 HG13 ILE D 32 5.900 7.394 8.660 1.00 0.00 H new ATOM 0 HG21 ILE D 32 5.233 5.200 11.650 1.00 0.00 H new ATOM 0 HG22 ILE D 32 4.641 3.833 10.676 1.00 0.00 H new ATOM 0 HG23 ILE D 32 6.352 4.314 10.586 1.00 0.00 H new ATOM 0 HD11 ILE D 32 6.349 8.550 10.810 1.00 0.00 H new ATOM 0 HD12 ILE D 32 4.635 8.084 10.699 1.00 0.00 H new ATOM 0 HD13 ILE D 32 5.753 7.131 11.703 1.00 0.00 H new ATOM 1722 N ILE D 33 3.026 3.715 8.097 1.00 0.00 N ATOM 1723 CA ILE D 33 2.164 2.540 8.116 1.00 0.00 C ATOM 1724 C ILE D 33 2.499 1.612 6.948 1.00 0.00 C ATOM 1725 O ILE D 33 2.570 0.395 7.117 1.00 0.00 O ATOM 1726 CB ILE D 33 0.692 2.974 8.037 1.00 0.00 C ATOM 1727 CG1 ILE D 33 0.297 3.677 9.338 1.00 0.00 C ATOM 1728 CG2 ILE D 33 -0.202 1.749 7.833 1.00 0.00 C ATOM 1729 CD1 ILE D 33 -1.032 4.405 9.137 1.00 0.00 C ATOM 0 H ILE D 33 2.536 4.600 7.964 1.00 0.00 H new ATOM 0 HA ILE D 33 2.330 1.998 9.047 1.00 0.00 H new ATOM 0 HB ILE D 33 0.566 3.656 7.197 1.00 0.00 H new ATOM 0 HG12 ILE D 33 0.208 2.950 10.145 1.00 0.00 H new ATOM 0 HG13 ILE D 33 1.072 4.385 9.632 1.00 0.00 H new ATOM 0 HG21 ILE D 33 -1.244 2.064 7.778 1.00 0.00 H new ATOM 0 HG22 ILE D 33 0.075 1.247 6.906 1.00 0.00 H new ATOM 0 HG23 ILE D 33 -0.074 1.062 8.670 1.00 0.00 H new ATOM 0 HD11 ILE D 33 -1.316 4.907 10.062 1.00 0.00 H new ATOM 0 HD12 ILE D 33 -0.926 5.143 8.342 1.00 0.00 H new ATOM 0 HD13 ILE D 33 -1.803 3.685 8.863 1.00 0.00 H new ATOM 1741 N GLY D 34 2.702 2.188 5.770 1.00 0.00 N ATOM 1742 CA GLY D 34 3.023 1.391 4.592 1.00 0.00 C ATOM 1743 C GLY D 34 4.308 0.592 4.800 1.00 0.00 C ATOM 1744 O GLY D 34 4.383 -0.583 4.443 1.00 0.00 O ATOM 0 H GLY D 34 2.651 3.193 5.605 1.00 0.00 H new ATOM 0 HA2 GLY D 34 2.200 0.711 4.374 1.00 0.00 H new ATOM 0 HA3 GLY D 34 3.134 2.044 3.727 1.00 0.00 H new ATOM 1748 N ILE D 35 5.317 1.237 5.379 1.00 0.00 N ATOM 1749 CA ILE D 35 6.593 0.573 5.629 1.00 0.00 C ATOM 1750 C ILE D 35 6.413 -0.572 6.623 1.00 0.00 C ATOM 1751 O ILE D 35 6.963 -1.660 6.444 1.00 0.00 O ATOM 1752 CB ILE D 35 7.608 1.585 6.175 1.00 0.00 C ATOM 1753 CG1 ILE D 35 7.941 2.606 5.084 1.00 0.00 C ATOM 1754 CG2 ILE D 35 8.891 0.858 6.588 1.00 0.00 C ATOM 1755 CD1 ILE D 35 8.716 3.779 5.688 1.00 0.00 C ATOM 0 H ILE D 35 5.277 2.210 5.682 1.00 0.00 H new ATOM 0 HA ILE D 35 6.964 0.163 4.690 1.00 0.00 H new ATOM 0 HB ILE D 35 7.182 2.092 7.041 1.00 0.00 H new ATOM 0 HG12 ILE D 35 8.532 2.133 4.300 1.00 0.00 H new ATOM 0 HG13 ILE D 35 7.024 2.966 4.618 1.00 0.00 H new ATOM 0 HG21 ILE D 35 9.610 1.580 6.975 1.00 0.00 H new ATOM 0 HG22 ILE D 35 8.661 0.125 7.361 1.00 0.00 H new ATOM 0 HG23 ILE D 35 9.317 0.351 5.722 1.00 0.00 H new ATOM 0 HD11 ILE D 35 8.950 4.502 4.906 1.00 0.00 H new ATOM 0 HD12 ILE D 35 8.110 4.259 6.456 1.00 0.00 H new ATOM 0 HD13 ILE D 35 9.642 3.413 6.132 1.00 0.00 H new ATOM 1767 N LEU D 36 5.643 -0.316 7.675 1.00 0.00 N ATOM 1768 CA LEU D 36 5.393 -1.322 8.702 1.00 0.00 C ATOM 1769 C LEU D 36 4.678 -2.529 8.101 1.00 0.00 C ATOM 1770 O LEU D 36 4.987 -3.675 8.435 1.00 0.00 O ATOM 1771 CB LEU D 36 4.542 -0.717 9.821 1.00 0.00 C ATOM 1772 CG LEU D 36 5.355 0.327 10.604 1.00 0.00 C ATOM 1773 CD1 LEU D 36 4.401 1.139 11.483 1.00 0.00 C ATOM 1774 CD2 LEU D 36 6.414 -0.357 11.491 1.00 0.00 C ATOM 0 H LEU D 36 5.181 0.579 7.839 1.00 0.00 H new ATOM 0 HA LEU D 36 6.348 -1.651 9.112 1.00 0.00 H new ATOM 0 HB2 LEU D 36 3.651 -0.252 9.399 1.00 0.00 H new ATOM 0 HB3 LEU D 36 4.202 -1.504 10.495 1.00 0.00 H new ATOM 0 HG LEU D 36 5.868 0.980 9.898 1.00 0.00 H new ATOM 0 HD11 LEU D 36 4.967 1.883 12.043 1.00 0.00 H new ATOM 0 HD12 LEU D 36 3.665 1.641 10.854 1.00 0.00 H new ATOM 0 HD13 LEU D 36 3.890 0.472 12.178 1.00 0.00 H new ATOM 0 HD21 LEU D 36 6.977 0.401 12.036 1.00 0.00 H new ATOM 0 HD22 LEU D 36 5.920 -1.022 12.200 1.00 0.00 H new ATOM 0 HD23 LEU D 36 7.094 -0.935 10.865 1.00 0.00 H new ATOM 1786 N HIS D 37 3.729 -2.271 7.208 1.00 0.00 N ATOM 1787 CA HIS D 37 2.987 -3.349 6.569 1.00 0.00 C ATOM 1788 C HIS D 37 3.939 -4.276 5.819 1.00 0.00 C ATOM 1789 O HIS D 37 3.797 -5.498 5.868 1.00 0.00 O ATOM 1790 CB HIS D 37 1.972 -2.774 5.586 1.00 0.00 C ATOM 1791 CG HIS D 37 1.187 -3.901 4.976 1.00 0.00 C ATOM 1792 ND1 HIS D 37 -0.179 -4.025 5.146 1.00 0.00 N ATOM 1793 CD2 HIS D 37 1.565 -4.974 4.208 1.00 0.00 C ATOM 1794 CE1 HIS D 37 -0.568 -5.135 4.497 1.00 0.00 C ATOM 1795 NE2 HIS D 37 0.456 -5.751 3.906 1.00 0.00 N ATOM 0 H HIS D 37 3.458 -1.333 6.913 1.00 0.00 H new ATOM 0 HA HIS D 37 2.468 -3.914 7.343 1.00 0.00 H new ATOM 0 HB2 HIS D 37 1.302 -2.083 6.098 1.00 0.00 H new ATOM 0 HB3 HIS D 37 2.482 -2.206 4.808 1.00 0.00 H new ATOM 0 HD2 HIS D 37 2.575 -5.182 3.887 1.00 0.00 H new ATOM 0 HE1 HIS D 37 -1.589 -5.486 4.459 1.00 0.00 H new ATOM 0 HE2 HIS D 37 0.430 -6.607 3.352 1.00 0.00 H new ATOM 1803 N LEU D 38 4.907 -3.686 5.120 1.00 0.00 N ATOM 1804 CA LEU D 38 5.875 -4.474 4.356 1.00 0.00 C ATOM 1805 C LEU D 38 6.662 -5.403 5.266 1.00 0.00 C ATOM 1806 O LEU D 38 6.921 -6.544 4.903 1.00 0.00 O ATOM 1807 CB LEU D 38 6.837 -3.539 3.582 1.00 0.00 C ATOM 1808 CG LEU D 38 6.313 -3.287 2.153 1.00 0.00 C ATOM 1809 CD1 LEU D 38 6.922 -2.001 1.588 1.00 0.00 C ATOM 1810 CD2 LEU D 38 6.704 -4.468 1.241 1.00 0.00 C ATOM 0 H LEU D 38 5.042 -2.676 5.066 1.00 0.00 H new ATOM 0 HA LEU D 38 5.325 -5.086 3.641 1.00 0.00 H new ATOM 0 HB2 LEU D 38 6.937 -2.591 4.111 1.00 0.00 H new ATOM 0 HB3 LEU D 38 7.830 -3.986 3.538 1.00 0.00 H new ATOM 0 HG LEU D 38 5.228 -3.190 2.190 1.00 0.00 H new ATOM 0 HD11 LEU D 38 6.545 -1.833 0.579 1.00 0.00 H new ATOM 0 HD12 LEU D 38 6.647 -1.159 2.223 1.00 0.00 H new ATOM 0 HD13 LEU D 38 8.008 -2.095 1.559 1.00 0.00 H new ATOM 0 HD21 LEU D 38 6.333 -4.287 0.232 1.00 0.00 H new ATOM 0 HD22 LEU D 38 7.789 -4.565 1.216 1.00 0.00 H new ATOM 0 HD23 LEU D 38 6.267 -5.388 1.629 1.00 0.00 H new ATOM 1822 N ILE D 39 7.047 -4.918 6.431 1.00 0.00 N ATOM 1823 CA ILE D 39 7.810 -5.740 7.354 1.00 0.00 C ATOM 1824 C ILE D 39 6.995 -6.962 7.776 1.00 0.00 C ATOM 1825 O ILE D 39 7.514 -8.074 7.836 1.00 0.00 O ATOM 1826 CB ILE D 39 8.190 -4.914 8.581 1.00 0.00 C ATOM 1827 CG1 ILE D 39 9.178 -3.820 8.160 1.00 0.00 C ATOM 1828 CG2 ILE D 39 8.841 -5.818 9.629 1.00 0.00 C ATOM 1829 CD1 ILE D 39 9.385 -2.845 9.319 1.00 0.00 C ATOM 0 H ILE D 39 6.848 -3.973 6.759 1.00 0.00 H new ATOM 0 HA ILE D 39 8.717 -6.084 6.857 1.00 0.00 H new ATOM 0 HB ILE D 39 7.297 -4.459 9.008 1.00 0.00 H new ATOM 0 HG12 ILE D 39 10.130 -4.266 7.872 1.00 0.00 H new ATOM 0 HG13 ILE D 39 8.798 -3.289 7.287 1.00 0.00 H new ATOM 0 HG21 ILE D 39 9.111 -5.226 10.503 1.00 0.00 H new ATOM 0 HG22 ILE D 39 8.139 -6.599 9.922 1.00 0.00 H new ATOM 0 HG23 ILE D 39 9.737 -6.275 9.209 1.00 0.00 H new ATOM 0 HD11 ILE D 39 10.088 -2.067 9.019 1.00 0.00 H new ATOM 0 HD12 ILE D 39 8.431 -2.389 9.586 1.00 0.00 H new ATOM 0 HD13 ILE D 39 9.784 -3.382 10.180 1.00 0.00 H new ATOM 1841 N LEU D 40 5.726 -6.753 8.086 1.00 0.00 N ATOM 1842 CA LEU D 40 4.869 -7.854 8.502 1.00 0.00 C ATOM 1843 C LEU D 40 4.502 -8.749 7.318 1.00 0.00 C ATOM 1844 O LEU D 40 4.509 -9.976 7.430 1.00 0.00 O ATOM 1845 CB LEU D 40 3.604 -7.295 9.148 1.00 0.00 C ATOM 1846 CG LEU D 40 3.975 -6.536 10.429 1.00 0.00 C ATOM 1847 CD1 LEU D 40 2.730 -5.822 10.956 1.00 0.00 C ATOM 1848 CD2 LEU D 40 4.517 -7.507 11.499 1.00 0.00 C ATOM 0 H LEU D 40 5.269 -5.842 8.059 1.00 0.00 H new ATOM 0 HA LEU D 40 5.413 -8.463 9.224 1.00 0.00 H new ATOM 0 HB2 LEU D 40 3.092 -6.629 8.453 1.00 0.00 H new ATOM 0 HB3 LEU D 40 2.913 -8.105 9.380 1.00 0.00 H new ATOM 0 HG LEU D 40 4.755 -5.809 10.204 1.00 0.00 H new ATOM 0 HD11 LEU D 40 2.981 -5.278 11.867 1.00 0.00 H new ATOM 0 HD12 LEU D 40 2.366 -5.122 10.204 1.00 0.00 H new ATOM 0 HD13 LEU D 40 1.954 -6.556 11.173 1.00 0.00 H new ATOM 0 HD21 LEU D 40 4.774 -6.949 12.399 1.00 0.00 H new ATOM 0 HD22 LEU D 40 3.754 -8.249 11.737 1.00 0.00 H new ATOM 0 HD23 LEU D 40 5.406 -8.010 11.117 1.00 0.00 H new ATOM 1860 N TRP D 41 4.168 -8.131 6.188 1.00 0.00 N ATOM 1861 CA TRP D 41 3.787 -8.882 4.994 1.00 0.00 C ATOM 1862 C TRP D 41 4.972 -9.663 4.423 1.00 0.00 C ATOM 1863 O TRP D 41 4.840 -10.838 4.082 1.00 0.00 O ATOM 1864 CB TRP D 41 3.233 -7.922 3.935 1.00 0.00 C ATOM 1865 CG TRP D 41 3.037 -8.646 2.638 1.00 0.00 C ATOM 1866 CD1 TRP D 41 1.948 -9.375 2.304 1.00 0.00 C ATOM 1867 CD2 TRP D 41 3.928 -8.692 1.487 1.00 0.00 C ATOM 1868 NE1 TRP D 41 2.125 -9.890 1.035 1.00 0.00 N ATOM 1869 CE2 TRP D 41 3.327 -9.489 0.486 1.00 0.00 C ATOM 1870 CE3 TRP D 41 5.188 -8.129 1.219 1.00 0.00 C ATOM 1871 CZ2 TRP D 41 3.954 -9.719 -0.734 1.00 0.00 C ATOM 1872 CZ3 TRP D 41 5.816 -8.355 -0.014 1.00 0.00 C ATOM 1873 CH2 TRP D 41 5.201 -9.148 -0.986 1.00 0.00 C ATOM 0 H TRP D 41 4.153 -7.118 6.074 1.00 0.00 H new ATOM 0 HA TRP D 41 3.018 -9.601 5.276 1.00 0.00 H new ATOM 0 HB2 TRP D 41 2.286 -7.502 4.273 1.00 0.00 H new ATOM 0 HB3 TRP D 41 3.920 -7.087 3.795 1.00 0.00 H new ATOM 0 HD1 TRP D 41 1.081 -9.529 2.929 1.00 0.00 H new ATOM 0 HE1 TRP D 41 1.451 -10.492 0.562 1.00 0.00 H new ATOM 0 HE3 TRP D 41 5.674 -7.520 1.966 1.00 0.00 H new ATOM 0 HZ2 TRP D 41 3.478 -10.336 -1.482 1.00 0.00 H new ATOM 0 HZ3 TRP D 41 6.781 -7.913 -0.214 1.00 0.00 H new ATOM 0 HH2 TRP D 41 5.692 -9.319 -1.933 1.00 0.00 H new ATOM 1884 N ILE D 42 6.117 -9.000 4.304 1.00 0.00 N ATOM 1885 CA ILE D 42 7.300 -9.652 3.751 1.00 0.00 C ATOM 1886 C ILE D 42 7.749 -10.797 4.653 1.00 0.00 C ATOM 1887 O ILE D 42 8.118 -11.870 4.174 1.00 0.00 O ATOM 1888 CB ILE D 42 8.440 -8.625 3.584 1.00 0.00 C ATOM 1889 CG1 ILE D 42 9.536 -9.190 2.658 1.00 0.00 C ATOM 1890 CG2 ILE D 42 9.052 -8.299 4.956 1.00 0.00 C ATOM 1891 CD1 ILE D 42 9.173 -8.952 1.186 1.00 0.00 C ATOM 0 H ILE D 42 6.252 -8.027 4.578 1.00 0.00 H new ATOM 0 HA ILE D 42 7.048 -10.062 2.773 1.00 0.00 H new ATOM 0 HB ILE D 42 8.030 -7.717 3.141 1.00 0.00 H new ATOM 0 HG12 ILE D 42 10.491 -8.716 2.884 1.00 0.00 H new ATOM 0 HG13 ILE D 42 9.659 -10.258 2.840 1.00 0.00 H new ATOM 0 HG21 ILE D 42 9.856 -7.574 4.833 1.00 0.00 H new ATOM 0 HG22 ILE D 42 8.284 -7.882 5.607 1.00 0.00 H new ATOM 0 HG23 ILE D 42 9.450 -9.210 5.402 1.00 0.00 H new ATOM 0 HD11 ILE D 42 9.958 -9.357 0.548 1.00 0.00 H new ATOM 0 HD12 ILE D 42 8.229 -9.447 0.959 1.00 0.00 H new ATOM 0 HD13 ILE D 42 9.074 -7.882 1.004 1.00 0.00 H new ATOM 1903 N LEU D 43 7.711 -10.561 5.959 1.00 0.00 N ATOM 1904 CA LEU D 43 8.111 -11.577 6.924 1.00 0.00 C ATOM 1905 C LEU D 43 7.188 -12.791 6.839 1.00 0.00 C ATOM 1906 O LEU D 43 7.642 -13.932 6.927 1.00 0.00 O ATOM 1907 CB LEU D 43 8.078 -10.990 8.342 1.00 0.00 C ATOM 1908 CG LEU D 43 9.337 -10.137 8.594 1.00 0.00 C ATOM 1909 CD1 LEU D 43 9.166 -9.365 9.910 1.00 0.00 C ATOM 1910 CD2 LEU D 43 10.594 -11.034 8.673 1.00 0.00 C ATOM 0 H LEU D 43 7.409 -9.679 6.373 1.00 0.00 H new ATOM 0 HA LEU D 43 9.126 -11.898 6.692 1.00 0.00 H new ATOM 0 HB2 LEU D 43 7.184 -10.379 8.470 1.00 0.00 H new ATOM 0 HB3 LEU D 43 8.022 -11.794 9.075 1.00 0.00 H new ATOM 0 HG LEU D 43 9.465 -9.438 7.768 1.00 0.00 H new ATOM 0 HD11 LEU D 43 10.053 -8.759 10.094 1.00 0.00 H new ATOM 0 HD12 LEU D 43 8.292 -8.717 9.841 1.00 0.00 H new ATOM 0 HD13 LEU D 43 9.031 -10.070 10.730 1.00 0.00 H new ATOM 0 HD21 LEU D 43 11.473 -10.414 8.851 1.00 0.00 H new ATOM 0 HD22 LEU D 43 10.481 -11.747 9.490 1.00 0.00 H new ATOM 0 HD23 LEU D 43 10.715 -11.574 7.734 1.00 0.00 H new ATOM 1922 N ASP D 44 5.897 -12.542 6.674 1.00 0.00 N ATOM 1923 CA ASP D 44 4.933 -13.629 6.591 1.00 0.00 C ATOM 1924 C ASP D 44 5.294 -14.573 5.450 1.00 0.00 C ATOM 1925 O ASP D 44 5.262 -15.793 5.608 1.00 0.00 O ATOM 1926 CB ASP D 44 3.536 -13.054 6.357 1.00 0.00 C ATOM 1927 CG ASP D 44 3.033 -12.380 7.629 1.00 0.00 C ATOM 1928 OD1 ASP D 44 3.596 -12.643 8.679 1.00 0.00 O ATOM 1929 OD2 ASP D 44 2.096 -11.605 7.536 1.00 0.00 O ATOM 0 H ASP D 44 5.496 -11.607 6.596 1.00 0.00 H new ATOM 0 HA ASP D 44 4.949 -14.187 7.527 1.00 0.00 H new ATOM 0 HB2 ASP D 44 3.562 -12.334 5.539 1.00 0.00 H new ATOM 0 HB3 ASP D 44 2.851 -13.848 6.061 1.00 0.00 H new ATOM 1934 N ARG D 45 5.644 -14.002 4.309 1.00 0.00 N ATOM 1935 CA ARG D 45 6.017 -14.804 3.153 1.00 0.00 C ATOM 1936 C ARG D 45 7.300 -15.575 3.429 1.00 0.00 C ATOM 1937 O ARG D 45 7.458 -16.717 2.998 1.00 0.00 O ATOM 1938 CB ARG D 45 6.212 -13.899 1.938 1.00 0.00 C ATOM 1939 CG ARG D 45 4.915 -13.139 1.626 1.00 0.00 C ATOM 1940 CD ARG D 45 3.822 -14.096 1.127 1.00 0.00 C ATOM 1941 NE ARG D 45 4.356 -14.992 0.108 1.00 0.00 N ATOM 1942 CZ ARG D 45 4.410 -14.630 -1.169 1.00 0.00 C ATOM 1943 NH1 ARG D 45 3.950 -13.466 -1.538 1.00 0.00 N ATOM 1944 NH2 ARG D 45 4.923 -15.441 -2.054 1.00 0.00 N ATOM 0 H ARG D 45 5.678 -12.994 4.158 1.00 0.00 H new ATOM 0 HA ARG D 45 5.217 -15.517 2.951 1.00 0.00 H new ATOM 0 HB2 ARG D 45 7.019 -13.192 2.129 1.00 0.00 H new ATOM 0 HB3 ARG D 45 6.508 -14.496 1.075 1.00 0.00 H new ATOM 0 HG2 ARG D 45 4.569 -12.621 2.520 1.00 0.00 H new ATOM 0 HG3 ARG D 45 5.109 -12.377 0.871 1.00 0.00 H new ATOM 0 HD2 ARG D 45 3.430 -14.677 1.962 1.00 0.00 H new ATOM 0 HD3 ARG D 45 2.989 -13.525 0.717 1.00 0.00 H new ATOM 0 HE ARG D 45 4.695 -15.915 0.381 1.00 0.00 H new ATOM 0 HH11 ARG D 45 3.549 -12.833 -0.846 1.00 0.00 H new ATOM 0 HH12 ARG D 45 3.992 -13.189 -2.519 1.00 0.00 H new ATOM 0 HH21 ARG D 45 5.282 -16.351 -1.765 1.00 0.00 H new ATOM 0 HH22 ARG D 45 4.965 -15.165 -3.035 1.00 0.00 H new ATOM 1958 N LEU D 46 8.221 -14.941 4.144 1.00 0.00 N ATOM 1959 CA LEU D 46 9.489 -15.579 4.460 1.00 0.00 C ATOM 1960 C LEU D 46 9.269 -16.830 5.302 1.00 0.00 C ATOM 1961 O LEU D 46 9.871 -17.873 5.047 1.00 0.00 O ATOM 1962 CB LEU D 46 10.388 -14.591 5.221 1.00 0.00 C ATOM 1963 CG LEU D 46 11.751 -15.252 5.566 1.00 0.00 C ATOM 1964 CD1 LEU D 46 12.889 -14.247 5.351 1.00 0.00 C ATOM 1965 CD2 LEU D 46 11.779 -15.707 7.033 1.00 0.00 C ATOM 0 H LEU D 46 8.114 -13.996 4.512 1.00 0.00 H new ATOM 0 HA LEU D 46 9.973 -15.871 3.528 1.00 0.00 H new ATOM 0 HB2 LEU D 46 10.552 -13.699 4.616 1.00 0.00 H new ATOM 0 HB3 LEU D 46 9.891 -14.269 6.136 1.00 0.00 H new ATOM 0 HG LEU D 46 11.880 -16.116 4.914 1.00 0.00 H new ATOM 0 HD11 LEU D 46 13.841 -14.718 5.595 1.00 0.00 H new ATOM 0 HD12 LEU D 46 12.899 -13.926 4.309 1.00 0.00 H new ATOM 0 HD13 LEU D 46 12.737 -13.381 5.996 1.00 0.00 H new ATOM 0 HD21 LEU D 46 12.742 -16.167 7.253 1.00 0.00 H new ATOM 0 HD22 LEU D 46 11.631 -14.845 7.684 1.00 0.00 H new ATOM 0 HD23 LEU D 46 10.983 -16.432 7.204 1.00 0.00 H new ATOM 1977 N PHE D 47 8.405 -16.725 6.308 1.00 0.00 N ATOM 1978 CA PHE D 47 8.128 -17.864 7.175 1.00 0.00 C ATOM 1979 C PHE D 47 7.300 -18.918 6.446 1.00 0.00 C ATOM 1980 O PHE D 47 7.696 -20.081 6.355 1.00 0.00 O ATOM 1981 CB PHE D 47 7.381 -17.402 8.429 1.00 0.00 C ATOM 1982 CG PHE D 47 8.321 -16.628 9.326 1.00 0.00 C ATOM 1983 CD1 PHE D 47 9.393 -17.288 9.939 1.00 0.00 C ATOM 1984 CD2 PHE D 47 8.129 -15.257 9.540 1.00 0.00 C ATOM 1985 CE1 PHE D 47 10.271 -16.579 10.768 1.00 0.00 C ATOM 1986 CE2 PHE D 47 9.008 -14.548 10.368 1.00 0.00 C ATOM 1987 CZ PHE D 47 10.077 -15.209 10.982 1.00 0.00 C ATOM 0 H PHE D 47 7.891 -15.875 6.540 1.00 0.00 H new ATOM 0 HA PHE D 47 9.081 -18.309 7.462 1.00 0.00 H new ATOM 0 HB2 PHE D 47 6.533 -16.777 8.149 1.00 0.00 H new ATOM 0 HB3 PHE D 47 6.980 -18.263 8.963 1.00 0.00 H new ATOM 0 HD1 PHE D 47 9.543 -18.345 9.772 1.00 0.00 H new ATOM 0 HD2 PHE D 47 7.303 -14.747 9.066 1.00 0.00 H new ATOM 0 HE1 PHE D 47 11.097 -17.088 11.242 1.00 0.00 H new ATOM 0 HE2 PHE D 47 8.861 -13.491 10.533 1.00 0.00 H new ATOM 0 HZ PHE D 47 10.754 -14.662 11.622 1.00 0.00 H new ATOM 1997 N PHE D 48 6.147 -18.502 5.929 1.00 0.00 N ATOM 1998 CA PHE D 48 5.254 -19.408 5.204 1.00 0.00 C ATOM 1999 C PHE D 48 4.730 -18.741 3.939 1.00 0.00 C ATOM 2000 O PHE D 48 4.535 -17.527 3.901 1.00 0.00 O ATOM 2001 CB PHE D 48 4.076 -19.804 6.097 1.00 0.00 C ATOM 2002 CG PHE D 48 4.564 -20.724 7.190 1.00 0.00 C ATOM 2003 CD1 PHE D 48 4.686 -22.094 6.943 1.00 0.00 C ATOM 2004 CD2 PHE D 48 4.897 -20.205 8.449 1.00 0.00 C ATOM 2005 CE1 PHE D 48 5.140 -22.950 7.953 1.00 0.00 C ATOM 2006 CE2 PHE D 48 5.351 -21.062 9.459 1.00 0.00 C ATOM 2007 CZ PHE D 48 5.473 -22.435 9.211 1.00 0.00 C ATOM 0 H PHE D 48 5.807 -17.543 5.998 1.00 0.00 H new ATOM 0 HA PHE D 48 5.817 -20.299 4.927 1.00 0.00 H new ATOM 0 HB2 PHE D 48 3.620 -18.915 6.532 1.00 0.00 H new ATOM 0 HB3 PHE D 48 3.307 -20.300 5.505 1.00 0.00 H new ATOM 0 HD1 PHE D 48 4.430 -22.492 5.972 1.00 0.00 H new ATOM 0 HD2 PHE D 48 4.804 -19.146 8.640 1.00 0.00 H new ATOM 0 HE1 PHE D 48 5.233 -24.009 7.761 1.00 0.00 H new ATOM 0 HE2 PHE D 48 5.607 -20.664 10.430 1.00 0.00 H new ATOM 0 HZ PHE D 48 5.824 -23.096 9.990 1.00 0.00 H new ATOM 2017 N LYS D 49 4.498 -19.545 2.909 1.00 0.00 N ATOM 2018 CA LYS D 49 3.994 -19.023 1.645 1.00 0.00 C ATOM 2019 C LYS D 49 2.600 -18.429 1.828 1.00 0.00 C ATOM 2020 O LYS D 49 2.259 -17.527 1.080 1.00 0.00 O ATOM 2021 CB LYS D 49 3.938 -20.141 0.607 1.00 0.00 C ATOM 2022 CG LYS D 49 5.360 -20.597 0.267 1.00 0.00 C ATOM 2023 CD LYS D 49 5.326 -21.660 -0.840 1.00 0.00 C ATOM 2024 CE LYS D 49 4.765 -22.982 -0.303 1.00 0.00 C ATOM 2025 NZ LYS D 49 5.070 -24.075 -1.274 1.00 0.00 N ATOM 2026 OXT LYS D 49 1.893 -18.887 2.711 1.00 0.00 O ATOM 0 H LYS D 49 4.649 -20.554 2.923 1.00 0.00 H new ATOM 0 HA LYS D 49 4.669 -18.239 1.302 1.00 0.00 H new ATOM 0 HB2 LYS D 49 3.358 -20.980 0.992 1.00 0.00 H new ATOM 0 HB3 LYS D 49 3.432 -19.791 -0.293 1.00 0.00 H new ATOM 0 HG2 LYS D 49 5.956 -19.743 -0.057 1.00 0.00 H new ATOM 0 HG3 LYS D 49 5.842 -21.003 1.156 1.00 0.00 H new ATOM 0 HD2 LYS D 49 4.713 -21.309 -1.670 1.00 0.00 H new ATOM 0 HD3 LYS D 49 6.331 -21.818 -1.231 1.00 0.00 H new ATOM 0 HE2 LYS D 49 5.204 -23.209 0.668 1.00 0.00 H new ATOM 0 HE3 LYS D 49 3.688 -22.901 -0.155 1.00 0.00 H new ATOM 0 HZ1 LYS D 49 4.691 -24.974 -0.914 1.00 0.00 H new ATOM 0 HZ2 LYS D 49 4.631 -23.857 -2.191 1.00 0.00 H new ATOM 0 HZ3 LYS D 49 6.100 -24.156 -1.393 1.00 0.00 H new TER 2040 LYS D 49 HETATM 2041 S 3LW C 100 2.179 7.624 -1.859 1.00 0.00 S HETATM 2042 BR 3LW C 100 3.357 9.620 -3.715 1.00 0.00 BR HETATM 2043 C1 3LW C 100 2.303 9.031 -2.247 1.00 0.00 C HETATM 2044 C2 3LW C 100 1.592 9.841 -1.454 1.00 0.00 C HETATM 2045 N2 3LW C 100 1.524 5.468 -0.177 1.00 0.00 N HETATM 2046 C3 3LW C 100 0.976 9.099 -0.533 1.00 0.00 C HETATM 2047 C5 3LW C 100 0.759 6.681 0.140 1.00 0.00 C HETATM 2048 C10 3LW C 100 0.861 4.147 -0.041 1.00 0.00 C HETATM 2049 C12 3LW C 100 1.274 7.804 -0.709 1.00 0.00 C HETATM 2050 C61 3LW C 100 0.413 3.862 1.422 1.00 0.00 C HETATM 2051 C62 3LW C 100 1.829 2.999 -0.446 1.00 0.00 C HETATM 2052 C63 3LW C 100 -0.394 4.013 -0.954 1.00 0.00 C HETATM 2053 C71 3LW C 100 -0.256 2.474 1.548 1.00 0.00 C HETATM 2054 C72 3LW C 100 1.159 1.613 -0.306 1.00 0.00 C HETATM 2055 C73 3LW C 100 -1.058 2.625 -0.806 1.00 0.00 C HETATM 2056 C81 3LW C 100 0.731 1.380 1.143 1.00 0.00 C HETATM 2057 C82 3LW C 100 -0.072 1.526 -1.211 1.00 0.00 C HETATM 2058 C83 3LW C 100 -1.495 2.408 0.646 1.00 0.00 C