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 Set 1.1: D 20 ASN : amide:sc= -1.45 K(o=-0.5,f=-2.8!) USER MOD Set 1.2: D 22 SER OG : rot -67:sc= 0.942 USER MOD Set 2.1: C 20 ASN : amide:sc= -1.6 K(o=-0.36,f=-1.9!) USER MOD Set 2.2: C 22 SER OG : rot -106:sc= 1.23 USER MOD Set 3.1: B 20 ASN : amide:sc= -1.45 K(o=-0.19,f=-1.7) USER MOD Set 3.2: B 22 SER OG : rot -68:sc= 1.26 USER MOD Set 4.1: A 20 ASN : amide:sc= -1.54 K(o=-0.25,f=-1.9!) USER MOD Set 4.2: A 22 SER OG : rot -87:sc= 1.29 USER MOD Single : A 19 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= -1.7 X(o=-1.7,f=-1.4) USER MOD Single : A 37 HIS : no HD1:sc= -10! C(o=-10!,f=-12!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 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= -1.28 X(o=-1.3,f=-1.2) USER MOD Single : B 37 HIS : no HD1:sc= -9.87! C(o=-9.9!,f=-12!) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 19 SER OG : rot 180:sc= 0 USER MOD Single : C 23 SER OG : rot -29:sc= 0.223 USER MOD Single : C 31 ASN : amide:sc= -2.35! X(o=-2.4!,f=-1.9) USER MOD Single : C 37 HIS : no HD1:sc= -9.81! C(o=-9.8!,f=-11!) USER MOD Single : C 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 19 SER OG : rot 180:sc= 0 USER MOD Single : D 23 SER OG : rot -32:sc= 0.164 USER MOD Single : D 31 ASN : amide:sc= -1.79 X(o=-1.8,f=-1.4) USER MOD Single : D 37 HIS : no HD1:sc= -9.92! C(o=-9.9!,f=-11!) USER MOD Single : D 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 19 -3.742 27.648 3.060 1.00 0.00 N ATOM 2 CA SER A 19 -2.278 27.405 3.183 1.00 0.00 C ATOM 3 C SER A 19 -2.030 25.927 3.468 1.00 0.00 C ATOM 4 O SER A 19 -0.961 25.398 3.169 1.00 0.00 O ATOM 5 CB SER A 19 -1.716 28.254 4.324 1.00 0.00 C ATOM 6 OG SER A 19 -0.403 27.807 4.639 1.00 0.00 O ATOM 0 HA SER A 19 -1.782 27.679 2.252 1.00 0.00 H new ATOM 0 HB2 SER A 19 -1.695 29.305 4.035 1.00 0.00 H new ATOM 0 HB3 SER A 19 -2.359 28.177 5.201 1.00 0.00 H new ATOM 0 HG SER A 19 -0.039 28.350 5.369 1.00 0.00 H new ATOM 14 N ASN A 20 -3.026 25.266 4.055 1.00 0.00 N ATOM 15 CA ASN A 20 -2.906 23.848 4.381 1.00 0.00 C ATOM 16 C ASN A 20 -3.347 22.988 3.200 1.00 0.00 C ATOM 17 O ASN A 20 -4.540 22.840 2.938 1.00 0.00 O ATOM 18 CB ASN A 20 -3.772 23.519 5.599 1.00 0.00 C ATOM 19 CG ASN A 20 -3.524 22.080 6.039 1.00 0.00 C ATOM 20 OD1 ASN A 20 -2.391 21.601 5.988 1.00 0.00 O ATOM 21 ND2 ASN A 20 -4.522 21.359 6.471 1.00 0.00 N ATOM 0 H ASN A 20 -3.919 25.687 4.313 1.00 0.00 H new ATOM 0 HA ASN A 20 -1.861 23.633 4.605 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -3.541 24.203 6.416 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -4.825 23.658 5.355 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -4.365 20.396 6.768 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -5.460 21.759 6.512 1.00 0.00 H new ATOM 28 N ASP A 21 -2.374 22.419 2.493 1.00 0.00 N ATOM 29 CA ASP A 21 -2.669 21.571 1.343 1.00 0.00 C ATOM 30 C ASP A 21 -3.020 20.156 1.797 1.00 0.00 C ATOM 31 O ASP A 21 -3.427 19.320 0.993 1.00 0.00 O ATOM 32 CB ASP A 21 -1.460 21.523 0.406 1.00 0.00 C ATOM 33 CG ASP A 21 -1.846 20.852 -0.907 1.00 0.00 C ATOM 34 OD1 ASP A 21 -3.034 20.735 -1.162 1.00 0.00 O ATOM 35 OD2 ASP A 21 -0.951 20.466 -1.639 1.00 0.00 O ATOM 0 H ASP A 21 -1.380 22.529 2.695 1.00 0.00 H new ATOM 0 HA ASP A 21 -3.523 21.993 0.813 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -1.097 22.533 0.215 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -0.645 20.975 0.878 1.00 0.00 H new ATOM 40 N SER A 22 -2.858 19.901 3.089 1.00 0.00 N ATOM 41 CA SER A 22 -3.159 18.586 3.647 1.00 0.00 C ATOM 42 C SER A 22 -4.627 18.238 3.428 1.00 0.00 C ATOM 43 O SER A 22 -4.977 17.075 3.231 1.00 0.00 O ATOM 44 CB SER A 22 -2.844 18.563 5.142 1.00 0.00 C ATOM 45 OG SER A 22 -1.434 18.568 5.323 1.00 0.00 O ATOM 0 H SER A 22 -2.521 20.583 3.769 1.00 0.00 H new ATOM 0 HA SER A 22 -2.540 17.847 3.138 1.00 0.00 H new ATOM 0 HB2 SER A 22 -3.289 19.429 5.633 1.00 0.00 H new ATOM 0 HB3 SER A 22 -3.279 17.677 5.604 1.00 0.00 H new ATOM 0 HG SER A 22 -1.099 17.647 5.307 1.00 0.00 H new ATOM 51 N SER A 23 -5.478 19.256 3.467 1.00 0.00 N ATOM 52 CA SER A 23 -6.906 19.050 3.276 1.00 0.00 C ATOM 53 C SER A 23 -7.161 18.327 1.962 1.00 0.00 C ATOM 54 O SER A 23 -8.245 17.792 1.741 1.00 0.00 O ATOM 55 CB SER A 23 -7.637 20.393 3.265 1.00 0.00 C ATOM 56 OG SER A 23 -9.038 20.165 3.154 1.00 0.00 O ATOM 0 H SER A 23 -5.206 20.226 3.628 1.00 0.00 H new ATOM 0 HA SER A 23 -7.280 18.443 4.100 1.00 0.00 H new ATOM 0 HB2 SER A 23 -7.418 20.947 4.178 1.00 0.00 H new ATOM 0 HB3 SER A 23 -7.289 21.003 2.431 1.00 0.00 H new ATOM 0 HG SER A 23 -9.510 21.024 3.148 1.00 0.00 H new ATOM 62 N ASP A 24 -6.153 18.320 1.087 1.00 0.00 N ATOM 63 CA ASP A 24 -6.287 17.667 -0.212 1.00 0.00 C ATOM 64 C ASP A 24 -7.009 16.319 -0.063 1.00 0.00 C ATOM 65 O ASP A 24 -6.417 15.348 0.407 1.00 0.00 O ATOM 66 CB ASP A 24 -4.906 17.431 -0.829 1.00 0.00 C ATOM 67 CG ASP A 24 -5.068 16.801 -2.209 1.00 0.00 C ATOM 68 OD1 ASP A 24 -6.200 16.640 -2.633 1.00 0.00 O ATOM 69 OD2 ASP A 24 -4.059 16.488 -2.820 1.00 0.00 O ATOM 0 H ASP A 24 -5.245 18.755 1.254 1.00 0.00 H new ATOM 0 HA ASP A 24 -6.871 18.318 -0.862 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -4.365 18.374 -0.909 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.315 16.778 -0.186 1.00 0.00 H new ATOM 74 N PRO A 25 -8.270 16.237 -0.441 1.00 0.00 N ATOM 75 CA PRO A 25 -9.058 14.973 -0.327 1.00 0.00 C ATOM 76 C PRO A 25 -8.333 13.781 -0.947 1.00 0.00 C ATOM 77 O PRO A 25 -8.453 12.651 -0.472 1.00 0.00 O ATOM 78 CB PRO A 25 -10.361 15.277 -1.089 1.00 0.00 C ATOM 79 CG PRO A 25 -10.503 16.764 -1.046 1.00 0.00 C ATOM 80 CD PRO A 25 -9.084 17.326 -1.022 1.00 0.00 C ATOM 0 HA PRO A 25 -9.224 14.693 0.713 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -10.310 14.916 -2.116 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -11.214 14.786 -0.621 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -11.051 17.128 -1.915 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.061 17.077 -0.163 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -8.742 17.587 -2.024 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -9.025 18.232 -0.419 1.00 0.00 H new ATOM 88 N LEU A 26 -7.605 14.035 -2.024 1.00 0.00 N ATOM 89 CA LEU A 26 -6.900 12.962 -2.708 1.00 0.00 C ATOM 90 C LEU A 26 -5.876 12.317 -1.774 1.00 0.00 C ATOM 91 O LEU A 26 -5.810 11.093 -1.658 1.00 0.00 O ATOM 92 CB LEU A 26 -6.191 13.529 -3.954 1.00 0.00 C ATOM 93 CG LEU A 26 -6.093 12.455 -5.055 1.00 0.00 C ATOM 94 CD1 LEU A 26 -5.412 11.200 -4.495 1.00 0.00 C ATOM 95 CD2 LEU A 26 -7.508 12.102 -5.583 1.00 0.00 C ATOM 0 H LEU A 26 -7.488 14.960 -2.438 1.00 0.00 H new ATOM 0 HA LEU A 26 -7.619 12.201 -3.012 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -6.738 14.394 -4.329 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.193 13.875 -3.686 1.00 0.00 H new ATOM 0 HG LEU A 26 -5.498 12.845 -5.881 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -5.345 10.443 -5.277 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -4.410 11.454 -4.148 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -5.996 10.810 -3.662 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -7.427 11.342 -6.360 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -8.117 11.720 -4.764 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -7.976 12.996 -5.996 1.00 0.00 H new ATOM 107 N VAL A 27 -5.092 13.147 -1.107 1.00 0.00 N ATOM 108 CA VAL A 27 -4.085 12.646 -0.187 1.00 0.00 C ATOM 109 C VAL A 27 -4.746 11.945 0.994 1.00 0.00 C ATOM 110 O VAL A 27 -4.299 10.881 1.427 1.00 0.00 O ATOM 111 CB VAL A 27 -3.210 13.798 0.308 1.00 0.00 C ATOM 112 CG1 VAL A 27 -2.227 13.274 1.356 1.00 0.00 C ATOM 113 CG2 VAL A 27 -2.432 14.386 -0.871 1.00 0.00 C ATOM 0 H VAL A 27 -5.132 14.163 -1.184 1.00 0.00 H new ATOM 0 HA VAL A 27 -3.459 11.925 -0.713 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.838 14.570 0.752 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -1.602 14.094 1.710 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.780 12.851 2.194 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -1.597 12.504 0.911 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.807 15.208 -0.521 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -1.802 13.614 -1.313 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -3.132 14.756 -1.620 1.00 0.00 H new ATOM 123 N VAL A 28 -5.807 12.552 1.510 1.00 0.00 N ATOM 124 CA VAL A 28 -6.523 11.984 2.646 1.00 0.00 C ATOM 125 C VAL A 28 -7.113 10.624 2.285 1.00 0.00 C ATOM 126 O VAL A 28 -7.024 9.673 3.062 1.00 0.00 O ATOM 127 CB VAL A 28 -7.646 12.930 3.080 1.00 0.00 C ATOM 128 CG1 VAL A 28 -8.451 12.283 4.210 1.00 0.00 C ATOM 129 CG2 VAL A 28 -7.039 14.245 3.573 1.00 0.00 C ATOM 0 H VAL A 28 -6.189 13.432 1.163 1.00 0.00 H new ATOM 0 HA VAL A 28 -5.818 11.854 3.467 1.00 0.00 H new ATOM 0 HB VAL A 28 -8.304 13.127 2.234 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -9.250 12.956 4.519 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -8.882 11.345 3.859 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -7.795 12.086 5.058 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -7.837 14.920 3.883 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -6.382 14.047 4.420 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -6.466 14.705 2.768 1.00 0.00 H new ATOM 139 N ALA A 29 -7.718 10.536 1.104 1.00 0.00 N ATOM 140 CA ALA A 29 -8.320 9.286 0.660 1.00 0.00 C ATOM 141 C ALA A 29 -7.276 8.177 0.612 1.00 0.00 C ATOM 142 O ALA A 29 -7.543 7.044 1.004 1.00 0.00 O ATOM 143 CB ALA A 29 -8.931 9.466 -0.734 1.00 0.00 C ATOM 0 H ALA A 29 -7.803 11.309 0.443 1.00 0.00 H new ATOM 0 HA ALA A 29 -9.100 9.010 1.369 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -9.379 8.527 -1.059 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -9.697 10.240 -0.698 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.152 9.759 -1.438 1.00 0.00 H new ATOM 149 N ALA A 30 -6.083 8.510 0.134 1.00 0.00 N ATOM 150 CA ALA A 30 -5.012 7.527 0.045 1.00 0.00 C ATOM 151 C ALA A 30 -4.707 6.939 1.418 1.00 0.00 C ATOM 152 O ALA A 30 -4.574 5.722 1.565 1.00 0.00 O ATOM 153 CB ALA A 30 -3.752 8.182 -0.520 1.00 0.00 C ATOM 0 H ALA A 30 -5.835 9.443 -0.195 1.00 0.00 H new ATOM 0 HA ALA A 30 -5.335 6.724 -0.617 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -2.955 7.442 -0.584 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -3.962 8.577 -1.514 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -3.440 8.996 0.135 1.00 0.00 H new ATOM 159 N ASN A 31 -4.598 7.803 2.421 1.00 0.00 N ATOM 160 CA ASN A 31 -4.306 7.350 3.776 1.00 0.00 C ATOM 161 C ASN A 31 -5.444 6.490 4.317 1.00 0.00 C ATOM 162 O ASN A 31 -5.209 5.454 4.938 1.00 0.00 O ATOM 163 CB ASN A 31 -4.102 8.556 4.694 1.00 0.00 C ATOM 164 CG ASN A 31 -3.824 8.087 6.118 1.00 0.00 C ATOM 165 OD1 ASN A 31 -2.916 7.289 6.343 1.00 0.00 O ATOM 166 ND2 ASN A 31 -4.557 8.538 7.098 1.00 0.00 N ATOM 0 H ASN A 31 -4.706 8.813 2.323 1.00 0.00 H new ATOM 0 HA ASN A 31 -3.396 6.751 3.747 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -3.271 9.162 4.333 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -4.989 9.190 4.678 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -4.378 8.229 8.053 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -5.310 9.200 6.909 1.00 0.00 H new ATOM 173 N ILE A 32 -6.677 6.929 4.079 1.00 0.00 N ATOM 174 CA ILE A 32 -7.842 6.191 4.553 1.00 0.00 C ATOM 175 C ILE A 32 -7.923 4.825 3.874 1.00 0.00 C ATOM 176 O ILE A 32 -8.183 3.812 4.524 1.00 0.00 O ATOM 177 CB ILE A 32 -9.119 6.987 4.263 1.00 0.00 C ATOM 178 CG1 ILE A 32 -9.131 8.256 5.121 1.00 0.00 C ATOM 179 CG2 ILE A 32 -10.347 6.135 4.599 1.00 0.00 C ATOM 180 CD1 ILE A 32 -10.260 9.178 4.656 1.00 0.00 C ATOM 0 H ILE A 32 -6.893 7.784 3.566 1.00 0.00 H new ATOM 0 HA ILE A 32 -7.744 6.044 5.629 1.00 0.00 H new ATOM 0 HB ILE A 32 -9.145 7.256 3.207 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -9.269 7.996 6.171 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -8.173 8.769 5.043 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -11.253 6.705 4.391 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -10.340 5.230 3.991 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -10.323 5.863 5.654 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -10.268 10.081 5.267 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -10.102 9.448 3.612 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -11.215 8.663 4.757 1.00 0.00 H new ATOM 192 N ILE A 33 -7.701 4.808 2.565 1.00 0.00 N ATOM 193 CA ILE A 33 -7.755 3.564 1.807 1.00 0.00 C ATOM 194 C ILE A 33 -6.652 2.611 2.263 1.00 0.00 C ATOM 195 O ILE A 33 -6.885 1.415 2.437 1.00 0.00 O ATOM 196 CB ILE A 33 -7.603 3.857 0.312 1.00 0.00 C ATOM 197 CG1 ILE A 33 -8.840 4.610 -0.188 1.00 0.00 C ATOM 198 CG2 ILE A 33 -7.469 2.544 -0.462 1.00 0.00 C ATOM 199 CD1 ILE A 33 -8.543 5.230 -1.555 1.00 0.00 C ATOM 0 H ILE A 33 -7.483 5.635 2.010 1.00 0.00 H new ATOM 0 HA ILE A 33 -8.721 3.091 1.985 1.00 0.00 H new ATOM 0 HB ILE A 33 -6.712 4.464 0.155 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -9.688 3.929 -0.262 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -9.117 5.388 0.523 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -7.361 2.758 -1.525 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -6.591 2.002 -0.110 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -8.359 1.935 -0.303 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -9.423 5.766 -1.911 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -7.707 5.924 -1.466 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -8.287 4.443 -2.264 1.00 0.00 H new ATOM 211 N GLY A 34 -5.451 3.148 2.448 1.00 0.00 N ATOM 212 CA GLY A 34 -4.321 2.331 2.873 1.00 0.00 C ATOM 213 C GLY A 34 -4.591 1.692 4.231 1.00 0.00 C ATOM 214 O GLY A 34 -4.383 0.492 4.419 1.00 0.00 O ATOM 0 H GLY A 34 -5.236 4.136 2.312 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -4.130 1.554 2.133 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -3.423 2.946 2.928 1.00 0.00 H new ATOM 218 N ILE A 35 -5.058 2.502 5.173 1.00 0.00 N ATOM 219 CA ILE A 35 -5.356 2.008 6.510 1.00 0.00 C ATOM 220 C ILE A 35 -6.475 0.976 6.453 1.00 0.00 C ATOM 221 O ILE A 35 -6.410 -0.059 7.112 1.00 0.00 O ATOM 222 CB ILE A 35 -5.767 3.169 7.421 1.00 0.00 C ATOM 223 CG1 ILE A 35 -4.564 4.083 7.646 1.00 0.00 C ATOM 224 CG2 ILE A 35 -6.237 2.622 8.773 1.00 0.00 C ATOM 225 CD1 ILE A 35 -5.023 5.390 8.295 1.00 0.00 C ATOM 0 H ILE A 35 -5.237 3.497 5.037 1.00 0.00 H new ATOM 0 HA ILE A 35 -4.460 1.537 6.915 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.577 3.727 6.951 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.832 3.587 8.283 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -4.071 4.291 6.697 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -6.529 3.450 9.419 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.091 1.962 8.621 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -5.426 2.064 9.242 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -4.162 6.039 8.454 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -5.738 5.889 7.641 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.496 5.174 9.253 1.00 0.00 H new ATOM 237 N LEU A 36 -7.502 1.269 5.664 1.00 0.00 N ATOM 238 CA LEU A 36 -8.635 0.361 5.537 1.00 0.00 C ATOM 239 C LEU A 36 -8.174 -0.999 5.024 1.00 0.00 C ATOM 240 O LEU A 36 -8.625 -2.039 5.506 1.00 0.00 O ATOM 241 CB LEU A 36 -9.677 0.950 4.575 1.00 0.00 C ATOM 242 CG LEU A 36 -10.821 -0.054 4.349 1.00 0.00 C ATOM 243 CD1 LEU A 36 -11.448 -0.453 5.693 1.00 0.00 C ATOM 244 CD2 LEU A 36 -11.885 0.587 3.451 1.00 0.00 C ATOM 0 H LEU A 36 -7.574 2.121 5.107 1.00 0.00 H new ATOM 0 HA LEU A 36 -9.086 0.232 6.521 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -10.075 1.879 4.983 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -9.206 1.196 3.623 1.00 0.00 H new ATOM 0 HG LEU A 36 -10.425 -0.948 3.868 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -12.256 -1.164 5.521 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -10.689 -0.913 6.326 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -11.844 0.434 6.187 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -12.698 -0.121 3.288 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -12.276 1.483 3.933 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -11.439 0.855 2.493 1.00 0.00 H new ATOM 256 N HIS A 37 -7.279 -0.985 4.045 1.00 0.00 N ATOM 257 CA HIS A 37 -6.774 -2.221 3.472 1.00 0.00 C ATOM 258 C HIS A 37 -6.126 -3.079 4.551 1.00 0.00 C ATOM 259 O HIS A 37 -6.292 -4.299 4.570 1.00 0.00 O ATOM 260 CB HIS A 37 -5.751 -1.912 2.383 1.00 0.00 C ATOM 261 CG HIS A 37 -5.254 -3.201 1.793 1.00 0.00 C ATOM 262 ND1 HIS A 37 -5.454 -3.532 0.465 1.00 0.00 N ATOM 263 CD2 HIS A 37 -4.571 -4.255 2.340 1.00 0.00 C ATOM 264 CE1 HIS A 37 -4.901 -4.740 0.262 1.00 0.00 C ATOM 265 NE2 HIS A 37 -4.347 -5.225 1.372 1.00 0.00 N ATOM 0 H HIS A 37 -6.891 -0.136 3.634 1.00 0.00 H new ATOM 0 HA HIS A 37 -7.610 -2.769 3.037 1.00 0.00 H new ATOM 0 HB2 HIS A 37 -6.203 -1.294 1.608 1.00 0.00 H new ATOM 0 HB3 HIS A 37 -4.919 -1.344 2.799 1.00 0.00 H new ATOM 0 HD2 HIS A 37 -4.254 -4.322 3.370 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -4.905 -5.256 -0.687 1.00 0.00 H new ATOM 0 HE2 HIS A 37 -3.863 -6.116 1.486 1.00 0.00 H new ATOM 273 N LEU A 38 -5.391 -2.435 5.448 1.00 0.00 N ATOM 274 CA LEU A 38 -4.721 -3.153 6.527 1.00 0.00 C ATOM 275 C LEU A 38 -5.732 -3.863 7.413 1.00 0.00 C ATOM 276 O LEU A 38 -5.506 -4.986 7.849 1.00 0.00 O ATOM 277 CB LEU A 38 -3.882 -2.169 7.370 1.00 0.00 C ATOM 278 CG LEU A 38 -2.451 -2.062 6.803 1.00 0.00 C ATOM 279 CD1 LEU A 38 -1.807 -0.747 7.249 1.00 0.00 C ATOM 280 CD2 LEU A 38 -1.600 -3.238 7.310 1.00 0.00 C ATOM 0 H LEU A 38 -5.244 -1.426 5.452 1.00 0.00 H new ATOM 0 HA LEU A 38 -4.064 -3.903 6.086 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.354 -1.187 7.371 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -3.846 -2.506 8.406 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.502 -2.089 5.715 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -0.797 -0.681 6.844 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.400 0.091 6.884 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.764 -0.714 8.338 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -0.591 -3.157 6.906 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.558 -3.214 8.399 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.047 -4.177 6.984 1.00 0.00 H new ATOM 292 N ILE A 39 -6.846 -3.213 7.687 1.00 0.00 N ATOM 293 CA ILE A 39 -7.849 -3.822 8.536 1.00 0.00 C ATOM 294 C ILE A 39 -8.304 -5.152 7.946 1.00 0.00 C ATOM 295 O ILE A 39 -8.362 -6.164 8.646 1.00 0.00 O ATOM 296 CB ILE A 39 -9.046 -2.881 8.668 1.00 0.00 C ATOM 297 CG1 ILE A 39 -8.573 -1.542 9.248 1.00 0.00 C ATOM 298 CG2 ILE A 39 -10.094 -3.506 9.588 1.00 0.00 C ATOM 299 CD1 ILE A 39 -9.724 -0.528 9.235 1.00 0.00 C ATOM 0 H ILE A 39 -7.077 -2.281 7.342 1.00 0.00 H new ATOM 0 HA ILE A 39 -7.417 -4.004 9.520 1.00 0.00 H new ATOM 0 HB ILE A 39 -9.491 -2.714 7.687 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -8.215 -1.684 10.267 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -7.734 -1.160 8.666 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -10.946 -2.832 9.680 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -10.426 -4.456 9.169 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -9.659 -3.676 10.573 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -9.379 0.420 9.649 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -10.062 -0.375 8.210 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -10.550 -0.907 9.837 1.00 0.00 H new ATOM 311 N LEU A 40 -8.627 -5.146 6.660 1.00 0.00 N ATOM 312 CA LEU A 40 -9.075 -6.365 5.998 1.00 0.00 C ATOM 313 C LEU A 40 -7.930 -7.360 5.826 1.00 0.00 C ATOM 314 O LEU A 40 -8.096 -8.559 6.043 1.00 0.00 O ATOM 315 CB LEU A 40 -9.671 -6.013 4.628 1.00 0.00 C ATOM 316 CG LEU A 40 -11.108 -5.491 4.801 1.00 0.00 C ATOM 317 CD1 LEU A 40 -12.058 -6.626 5.249 1.00 0.00 C ATOM 318 CD2 LEU A 40 -11.109 -4.363 5.843 1.00 0.00 C ATOM 0 H LEU A 40 -8.588 -4.322 6.060 1.00 0.00 H new ATOM 0 HA LEU A 40 -9.834 -6.835 6.623 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -9.057 -5.258 4.138 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -9.669 -6.892 3.984 1.00 0.00 H new ATOM 0 HG LEU A 40 -11.465 -5.112 3.843 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -13.067 -6.231 5.364 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -12.061 -7.416 4.498 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -11.716 -7.032 6.201 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -12.124 -3.987 5.972 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -10.741 -4.746 6.795 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -10.463 -3.553 5.503 1.00 0.00 H new ATOM 330 N TRP A 41 -6.772 -6.856 5.422 1.00 0.00 N ATOM 331 CA TRP A 41 -5.616 -7.714 5.209 1.00 0.00 C ATOM 332 C TRP A 41 -5.151 -8.330 6.521 1.00 0.00 C ATOM 333 O TRP A 41 -4.750 -9.493 6.564 1.00 0.00 O ATOM 334 CB TRP A 41 -4.483 -6.922 4.552 1.00 0.00 C ATOM 335 CG TRP A 41 -3.267 -7.783 4.442 1.00 0.00 C ATOM 336 CD1 TRP A 41 -3.030 -8.678 3.454 1.00 0.00 C ATOM 337 CD2 TRP A 41 -2.091 -7.806 5.297 1.00 0.00 C ATOM 338 NE1 TRP A 41 -1.807 -9.282 3.681 1.00 0.00 N ATOM 339 CE2 TRP A 41 -1.189 -8.770 4.800 1.00 0.00 C ATOM 340 CE3 TRP A 41 -1.729 -7.098 6.451 1.00 0.00 C ATOM 341 CZ2 TRP A 41 0.027 -9.021 5.426 1.00 0.00 C ATOM 342 CZ3 TRP A 41 -0.499 -7.343 7.080 1.00 0.00 C ATOM 343 CH2 TRP A 41 0.373 -8.303 6.565 1.00 0.00 C ATOM 0 H TRP A 41 -6.609 -5.866 5.237 1.00 0.00 H new ATOM 0 HA TRP A 41 -5.906 -8.525 4.541 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -4.790 -6.581 3.563 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -4.259 -6.032 5.141 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -3.689 -8.886 2.624 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -1.412 -10.016 3.093 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -2.402 -6.358 6.859 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 0.698 -9.769 5.030 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -0.226 -6.787 7.965 1.00 0.00 H new ATOM 0 HH2 TRP A 41 1.319 -8.489 7.052 1.00 0.00 H new ATOM 354 N ILE A 42 -5.207 -7.550 7.590 1.00 0.00 N ATOM 355 CA ILE A 42 -4.786 -8.036 8.898 1.00 0.00 C ATOM 356 C ILE A 42 -5.667 -9.205 9.331 1.00 0.00 C ATOM 357 O ILE A 42 -5.172 -10.225 9.811 1.00 0.00 O ATOM 358 CB ILE A 42 -4.874 -6.893 9.932 1.00 0.00 C ATOM 359 CG1 ILE A 42 -3.670 -5.955 9.774 1.00 0.00 C ATOM 360 CG2 ILE A 42 -4.890 -7.460 11.355 1.00 0.00 C ATOM 361 CD1 ILE A 42 -3.937 -4.650 10.525 1.00 0.00 C ATOM 0 H ILE A 42 -5.537 -6.585 7.580 1.00 0.00 H new ATOM 0 HA ILE A 42 -3.754 -8.380 8.835 1.00 0.00 H new ATOM 0 HB ILE A 42 -5.797 -6.339 9.759 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -2.770 -6.433 10.162 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -3.492 -5.749 8.718 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -4.952 -6.641 12.072 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -5.753 -8.115 11.476 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -3.976 -8.028 11.531 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -3.082 -3.984 10.413 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -4.826 -4.170 10.116 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -4.094 -4.864 11.582 1.00 0.00 H new ATOM 373 N LEU A 43 -6.972 -9.047 9.164 1.00 0.00 N ATOM 374 CA LEU A 43 -7.911 -10.089 9.551 1.00 0.00 C ATOM 375 C LEU A 43 -7.674 -11.347 8.723 1.00 0.00 C ATOM 376 O LEU A 43 -7.778 -12.462 9.230 1.00 0.00 O ATOM 377 CB LEU A 43 -9.346 -9.597 9.356 1.00 0.00 C ATOM 378 CG LEU A 43 -9.653 -8.477 10.366 1.00 0.00 C ATOM 379 CD1 LEU A 43 -10.953 -7.777 9.956 1.00 0.00 C ATOM 380 CD2 LEU A 43 -9.804 -9.047 11.791 1.00 0.00 C ATOM 0 H LEU A 43 -7.403 -8.213 8.766 1.00 0.00 H new ATOM 0 HA LEU A 43 -7.757 -10.328 10.603 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -9.479 -9.229 8.339 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -10.045 -10.423 9.490 1.00 0.00 H new ATOM 0 HG LEU A 43 -8.826 -7.767 10.366 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -11.178 -6.982 10.667 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -10.838 -7.351 8.959 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -11.769 -8.500 9.950 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -10.021 -8.236 12.486 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -10.621 -9.769 11.810 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -8.878 -9.540 12.086 1.00 0.00 H new ATOM 392 N ASP A 44 -7.358 -11.158 7.453 1.00 0.00 N ATOM 393 CA ASP A 44 -7.113 -12.287 6.571 1.00 0.00 C ATOM 394 C ASP A 44 -5.945 -13.124 7.081 1.00 0.00 C ATOM 395 O ASP A 44 -5.993 -14.355 7.053 1.00 0.00 O ATOM 396 CB ASP A 44 -6.804 -11.784 5.162 1.00 0.00 C ATOM 397 CG ASP A 44 -6.594 -12.967 4.222 1.00 0.00 C ATOM 398 OD1 ASP A 44 -6.552 -14.084 4.708 1.00 0.00 O ATOM 399 OD2 ASP A 44 -6.480 -12.735 3.030 1.00 0.00 O ATOM 0 H ASP A 44 -7.266 -10.243 7.012 1.00 0.00 H new ATOM 0 HA ASP A 44 -8.007 -12.910 6.550 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -7.623 -11.162 4.801 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -5.912 -11.158 5.178 1.00 0.00 H new ATOM 404 N ARG A 45 -4.897 -12.452 7.546 1.00 0.00 N ATOM 405 CA ARG A 45 -3.724 -13.151 8.058 1.00 0.00 C ATOM 406 C ARG A 45 -3.979 -13.665 9.470 1.00 0.00 C ATOM 407 O ARG A 45 -3.325 -14.601 9.927 1.00 0.00 O ATOM 408 CB ARG A 45 -2.518 -12.207 8.067 1.00 0.00 C ATOM 409 CG ARG A 45 -1.266 -12.975 8.505 1.00 0.00 C ATOM 410 CD ARG A 45 -0.053 -12.044 8.451 1.00 0.00 C ATOM 411 NE ARG A 45 1.149 -12.761 8.862 1.00 0.00 N ATOM 412 CZ ARG A 45 2.308 -12.131 9.006 1.00 0.00 C ATOM 413 NH1 ARG A 45 2.386 -10.848 8.786 1.00 0.00 N ATOM 414 NH2 ARG A 45 3.371 -12.796 9.367 1.00 0.00 N ATOM 0 H ARG A 45 -4.835 -11.434 7.579 1.00 0.00 H new ATOM 0 HA ARG A 45 -3.518 -14.001 7.407 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -2.368 -11.783 7.074 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -2.701 -11.373 8.745 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -1.398 -13.360 9.516 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -1.107 -13.835 7.854 1.00 0.00 H new ATOM 0 HD2 ARG A 45 0.073 -11.657 7.440 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -0.214 -11.186 9.103 1.00 0.00 H new ATOM 0 HE ARG A 45 1.098 -13.764 9.042 1.00 0.00 H new ATOM 0 HH11 ARG A 45 1.556 -10.328 8.503 1.00 0.00 H new ATOM 0 HH12 ARG A 45 3.277 -10.365 8.897 1.00 0.00 H new ATOM 0 HH21 ARG A 45 3.311 -13.800 9.538 1.00 0.00 H new ATOM 0 HH22 ARG A 45 4.262 -12.312 9.478 1.00 0.00 H new ATOM 428 N LEU A 46 -4.927 -13.044 10.165 1.00 0.00 N ATOM 429 CA LEU A 46 -5.234 -13.458 11.529 1.00 0.00 C ATOM 430 C LEU A 46 -5.726 -14.902 11.554 1.00 0.00 C ATOM 431 O LEU A 46 -5.233 -15.723 12.327 1.00 0.00 O ATOM 432 CB LEU A 46 -6.310 -12.540 12.122 1.00 0.00 C ATOM 433 CG LEU A 46 -6.681 -12.990 13.545 1.00 0.00 C ATOM 434 CD1 LEU A 46 -5.435 -12.983 14.443 1.00 0.00 C ATOM 435 CD2 LEU A 46 -7.739 -12.038 14.114 1.00 0.00 C ATOM 0 H LEU A 46 -5.487 -12.267 9.814 1.00 0.00 H new ATOM 0 HA LEU A 46 -4.324 -13.386 12.125 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -5.948 -11.512 12.143 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -7.197 -12.553 11.488 1.00 0.00 H new ATOM 0 HG LEU A 46 -7.081 -14.003 13.511 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -5.709 -13.303 15.448 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -4.689 -13.665 14.036 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -5.021 -11.975 14.483 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -8.006 -12.352 15.123 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -7.338 -11.025 14.143 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -8.626 -12.059 13.481 1.00 0.00 H new ATOM 447 N PHE A 47 -6.701 -15.202 10.703 1.00 0.00 N ATOM 448 CA PHE A 47 -7.252 -16.549 10.633 1.00 0.00 C ATOM 449 C PHE A 47 -6.278 -17.499 9.949 1.00 0.00 C ATOM 450 O PHE A 47 -6.145 -18.659 10.343 1.00 0.00 O ATOM 451 CB PHE A 47 -8.588 -16.530 9.879 1.00 0.00 C ATOM 452 CG PHE A 47 -9.666 -15.962 10.778 1.00 0.00 C ATOM 453 CD1 PHE A 47 -9.692 -14.593 11.061 1.00 0.00 C ATOM 454 CD2 PHE A 47 -10.639 -16.809 11.326 1.00 0.00 C ATOM 455 CE1 PHE A 47 -10.690 -14.067 11.891 1.00 0.00 C ATOM 456 CE2 PHE A 47 -11.637 -16.283 12.156 1.00 0.00 C ATOM 457 CZ PHE A 47 -11.663 -14.912 12.438 1.00 0.00 C ATOM 0 H PHE A 47 -7.123 -14.535 10.057 1.00 0.00 H new ATOM 0 HA PHE A 47 -7.419 -16.905 11.649 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -8.499 -15.928 8.975 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -8.855 -17.539 9.565 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -8.942 -13.941 10.639 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -10.619 -17.867 11.108 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -10.709 -13.009 12.109 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -12.387 -16.935 12.579 1.00 0.00 H new ATOM 0 HZ PHE A 47 -12.433 -14.506 13.077 1.00 0.00 H new ATOM 467 N PHE A 48 -5.604 -17.003 8.915 1.00 0.00 N ATOM 468 CA PHE A 48 -4.645 -17.812 8.165 1.00 0.00 C ATOM 469 C PHE A 48 -3.222 -17.488 8.598 1.00 0.00 C ATOM 470 O PHE A 48 -2.758 -16.357 8.452 1.00 0.00 O ATOM 471 CB PHE A 48 -4.805 -17.533 6.668 1.00 0.00 C ATOM 472 CG PHE A 48 -6.058 -18.208 6.157 1.00 0.00 C ATOM 473 CD1 PHE A 48 -7.314 -17.654 6.438 1.00 0.00 C ATOM 474 CD2 PHE A 48 -5.966 -19.389 5.410 1.00 0.00 C ATOM 475 CE1 PHE A 48 -8.476 -18.282 5.967 1.00 0.00 C ATOM 476 CE2 PHE A 48 -7.125 -20.015 4.939 1.00 0.00 C ATOM 477 CZ PHE A 48 -8.380 -19.461 5.217 1.00 0.00 C ATOM 0 H PHE A 48 -5.703 -16.046 8.577 1.00 0.00 H new ATOM 0 HA PHE A 48 -4.839 -18.866 8.365 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -4.861 -16.459 6.492 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -3.935 -17.900 6.124 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -7.387 -16.745 7.016 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -4.998 -19.818 5.197 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -9.445 -17.857 6.183 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -7.052 -20.925 4.362 1.00 0.00 H new ATOM 0 HZ PHE A 48 -9.275 -19.943 4.853 1.00 0.00 H new ATOM 487 N LYS A 49 -2.534 -18.491 9.126 1.00 0.00 N ATOM 488 CA LYS A 49 -1.160 -18.313 9.578 1.00 0.00 C ATOM 489 C LYS A 49 -0.435 -19.653 9.629 1.00 0.00 C ATOM 490 O LYS A 49 -1.099 -20.655 9.852 1.00 0.00 O ATOM 491 CB LYS A 49 -1.148 -17.666 10.964 1.00 0.00 C ATOM 492 CG LYS A 49 0.296 -17.384 11.383 1.00 0.00 C ATOM 493 CD LYS A 49 0.306 -16.662 12.732 1.00 0.00 C ATOM 494 CE LYS A 49 1.749 -16.370 13.142 1.00 0.00 C ATOM 495 NZ LYS A 49 1.757 -15.617 14.429 1.00 0.00 N ATOM 496 OXT LYS A 49 0.769 -19.662 9.446 1.00 0.00 O ATOM 0 H LYS A 49 -2.903 -19.434 9.252 1.00 0.00 H new ATOM 0 HA LYS A 49 -0.644 -17.663 8.871 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -1.721 -16.739 10.949 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.626 -18.325 11.689 1.00 0.00 H new ATOM 0 HG2 LYS A 49 0.854 -18.318 11.454 1.00 0.00 H new ATOM 0 HG3 LYS A 49 0.792 -16.773 10.628 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.259 -15.732 12.663 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.181 -17.276 13.489 1.00 0.00 H new ATOM 0 HE2 LYS A 49 2.303 -17.302 13.250 1.00 0.00 H new ATOM 0 HE3 LYS A 49 2.249 -15.790 12.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 2.739 -15.418 14.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 1.242 -14.721 14.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 1.295 -16.186 15.167 1.00 0.00 H new TER 510 LYS A 49 ATOM 511 N SER B 19 -0.629 26.888 -8.122 1.00 0.00 N ATOM 512 CA SER B 19 -0.778 26.903 -6.639 1.00 0.00 C ATOM 513 C SER B 19 -1.207 25.520 -6.159 1.00 0.00 C ATOM 514 O SER B 19 -0.971 25.153 -5.009 1.00 0.00 O ATOM 515 CB SER B 19 -1.830 27.940 -6.246 1.00 0.00 C ATOM 516 OG SER B 19 -2.190 27.750 -4.885 1.00 0.00 O ATOM 0 HA SER B 19 0.174 27.164 -6.176 1.00 0.00 H new ATOM 0 HB2 SER B 19 -1.438 28.946 -6.394 1.00 0.00 H new ATOM 0 HB3 SER B 19 -2.709 27.843 -6.884 1.00 0.00 H new ATOM 0 HG SER B 19 -2.863 28.414 -4.629 1.00 0.00 H new ATOM 524 N ASN B 20 -1.837 24.757 -7.049 1.00 0.00 N ATOM 525 CA ASN B 20 -2.297 23.414 -6.705 1.00 0.00 C ATOM 526 C ASN B 20 -1.203 22.389 -6.993 1.00 0.00 C ATOM 527 O ASN B 20 -0.965 22.028 -8.146 1.00 0.00 O ATOM 528 CB ASN B 20 -3.546 23.067 -7.518 1.00 0.00 C ATOM 529 CG ASN B 20 -4.124 21.739 -7.041 1.00 0.00 C ATOM 530 OD1 ASN B 20 -4.117 21.455 -5.843 1.00 0.00 O ATOM 531 ND2 ASN B 20 -4.622 20.903 -7.911 1.00 0.00 N ATOM 0 H ASN B 20 -2.040 25.043 -8.007 1.00 0.00 H new ATOM 0 HA ASN B 20 -2.537 23.390 -5.642 1.00 0.00 H new ATOM 0 HB2 ASN B 20 -4.290 23.856 -7.412 1.00 0.00 H new ATOM 0 HB3 ASN B 20 -3.295 23.005 -8.577 1.00 0.00 H new ATOM 0 HD21 ASN B 20 -5.007 20.011 -7.599 1.00 0.00 H new ATOM 0 HD22 ASN B 20 -4.626 21.141 -8.903 1.00 0.00 H new ATOM 538 N ASP B 21 -0.543 21.923 -5.937 1.00 0.00 N ATOM 539 CA ASP B 21 0.524 20.939 -6.085 1.00 0.00 C ATOM 540 C ASP B 21 -0.057 19.535 -6.208 1.00 0.00 C ATOM 541 O ASP B 21 0.666 18.575 -6.473 1.00 0.00 O ATOM 542 CB ASP B 21 1.462 21.002 -4.879 1.00 0.00 C ATOM 543 CG ASP B 21 2.703 20.158 -5.139 1.00 0.00 C ATOM 544 OD1 ASP B 21 2.932 19.817 -6.289 1.00 0.00 O ATOM 545 OD2 ASP B 21 3.407 19.864 -4.188 1.00 0.00 O ATOM 0 H ASP B 21 -0.727 22.209 -4.975 1.00 0.00 H new ATOM 0 HA ASP B 21 1.083 21.169 -6.992 1.00 0.00 H new ATOM 0 HB2 ASP B 21 1.749 22.035 -4.685 1.00 0.00 H new ATOM 0 HB3 ASP B 21 0.947 20.642 -3.988 1.00 0.00 H new ATOM 550 N SER B 22 -1.366 19.423 -6.015 1.00 0.00 N ATOM 551 CA SER B 22 -2.040 18.132 -6.106 1.00 0.00 C ATOM 552 C SER B 22 -1.863 17.536 -7.498 1.00 0.00 C ATOM 553 O SER B 22 -1.771 16.318 -7.656 1.00 0.00 O ATOM 554 CB SER B 22 -3.527 18.293 -5.802 1.00 0.00 C ATOM 555 OG SER B 22 -3.696 18.560 -4.416 1.00 0.00 O ATOM 0 H SER B 22 -1.980 20.207 -5.795 1.00 0.00 H new ATOM 0 HA SER B 22 -1.595 17.458 -5.374 1.00 0.00 H new ATOM 0 HB2 SER B 22 -3.945 19.107 -6.395 1.00 0.00 H new ATOM 0 HB3 SER B 22 -4.067 17.387 -6.078 1.00 0.00 H new ATOM 0 HG SER B 22 -3.459 17.763 -3.898 1.00 0.00 H new ATOM 561 N SER B 23 -1.822 18.403 -8.502 1.00 0.00 N ATOM 562 CA SER B 23 -1.659 17.954 -9.877 1.00 0.00 C ATOM 563 C SER B 23 -0.416 17.086 -10.001 1.00 0.00 C ATOM 564 O SER B 23 -0.252 16.365 -10.985 1.00 0.00 O ATOM 565 CB SER B 23 -1.530 19.157 -10.813 1.00 0.00 C ATOM 566 OG SER B 23 -1.462 18.701 -12.159 1.00 0.00 O ATOM 0 H SER B 23 -1.899 19.414 -8.391 1.00 0.00 H new ATOM 0 HA SER B 23 -2.537 17.371 -10.156 1.00 0.00 H new ATOM 0 HB2 SER B 23 -2.382 19.824 -10.686 1.00 0.00 H new ATOM 0 HB3 SER B 23 -0.637 19.730 -10.566 1.00 0.00 H new ATOM 0 HG SER B 23 -1.381 19.470 -12.761 1.00 0.00 H new ATOM 572 N ASP B 24 0.461 17.161 -8.998 1.00 0.00 N ATOM 573 CA ASP B 24 1.695 16.381 -9.014 1.00 0.00 C ATOM 574 C ASP B 24 1.419 14.954 -9.513 1.00 0.00 C ATOM 575 O ASP B 24 0.866 14.137 -8.779 1.00 0.00 O ATOM 576 CB ASP B 24 2.298 16.314 -7.611 1.00 0.00 C ATOM 577 CG ASP B 24 3.614 15.546 -7.660 1.00 0.00 C ATOM 578 OD1 ASP B 24 4.015 15.169 -8.748 1.00 0.00 O ATOM 579 OD2 ASP B 24 4.204 15.349 -6.609 1.00 0.00 O ATOM 0 H ASP B 24 0.340 17.748 -8.173 1.00 0.00 H new ATOM 0 HA ASP B 24 2.398 16.870 -9.688 1.00 0.00 H new ATOM 0 HB2 ASP B 24 2.466 17.320 -7.227 1.00 0.00 H new ATOM 0 HB3 ASP B 24 1.604 15.824 -6.928 1.00 0.00 H new ATOM 584 N PRO B 25 1.780 14.637 -10.743 1.00 0.00 N ATOM 585 CA PRO B 25 1.544 13.278 -11.318 1.00 0.00 C ATOM 586 C PRO B 25 2.062 12.168 -10.408 1.00 0.00 C ATOM 587 O PRO B 25 1.486 11.082 -10.350 1.00 0.00 O ATOM 588 CB PRO B 25 2.319 13.300 -12.649 1.00 0.00 C ATOM 589 CG PRO B 25 2.416 14.742 -13.028 1.00 0.00 C ATOM 590 CD PRO B 25 2.451 15.526 -11.715 1.00 0.00 C ATOM 0 HA PRO B 25 0.481 13.070 -11.442 1.00 0.00 H new ATOM 0 HB2 PRO B 25 3.308 12.856 -12.535 1.00 0.00 H new ATOM 0 HB3 PRO B 25 1.799 12.726 -13.416 1.00 0.00 H new ATOM 0 HG2 PRO B 25 3.313 14.930 -13.618 1.00 0.00 H new ATOM 0 HG3 PRO B 25 1.564 15.042 -13.638 1.00 0.00 H new ATOM 0 HD2 PRO B 25 3.474 15.748 -11.411 1.00 0.00 H new ATOM 0 HD3 PRO B 25 1.931 16.480 -11.807 1.00 0.00 H new ATOM 598 N LEU B 26 3.161 12.438 -9.721 1.00 0.00 N ATOM 599 CA LEU B 26 3.750 11.434 -8.847 1.00 0.00 C ATOM 600 C LEU B 26 2.770 11.049 -7.742 1.00 0.00 C ATOM 601 O LEU B 26 2.538 9.866 -7.485 1.00 0.00 O ATOM 602 CB LEU B 26 5.048 11.993 -8.229 1.00 0.00 C ATOM 603 CG LEU B 26 6.046 10.852 -7.950 1.00 0.00 C ATOM 604 CD1 LEU B 26 5.376 9.779 -7.079 1.00 0.00 C ATOM 605 CD2 LEU B 26 6.531 10.230 -9.287 1.00 0.00 C ATOM 0 H LEU B 26 3.657 13.329 -9.749 1.00 0.00 H new ATOM 0 HA LEU B 26 3.979 10.543 -9.431 1.00 0.00 H new ATOM 0 HB2 LEU B 26 5.497 12.720 -8.906 1.00 0.00 H new ATOM 0 HB3 LEU B 26 4.820 12.519 -7.302 1.00 0.00 H new ATOM 0 HG LEU B 26 6.909 11.254 -7.418 1.00 0.00 H new ATOM 0 HD11 LEU B 26 6.085 8.974 -6.884 1.00 0.00 H new ATOM 0 HD12 LEU B 26 5.061 10.222 -6.134 1.00 0.00 H new ATOM 0 HD13 LEU B 26 4.506 9.378 -7.600 1.00 0.00 H new ATOM 0 HD21 LEU B 26 7.236 9.425 -9.079 1.00 0.00 H new ATOM 0 HD22 LEU B 26 5.676 9.832 -9.834 1.00 0.00 H new ATOM 0 HD23 LEU B 26 7.022 10.996 -9.888 1.00 0.00 H new ATOM 617 N VAL B 27 2.190 12.050 -7.099 1.00 0.00 N ATOM 618 CA VAL B 27 1.238 11.801 -6.030 1.00 0.00 C ATOM 619 C VAL B 27 -0.004 11.109 -6.578 1.00 0.00 C ATOM 620 O VAL B 27 -0.523 10.171 -5.972 1.00 0.00 O ATOM 621 CB VAL B 27 0.851 13.118 -5.357 1.00 0.00 C ATOM 622 CG1 VAL B 27 -0.234 12.858 -4.312 1.00 0.00 C ATOM 623 CG2 VAL B 27 2.083 13.718 -4.672 1.00 0.00 C ATOM 0 H VAL B 27 2.361 13.036 -7.297 1.00 0.00 H new ATOM 0 HA VAL B 27 1.704 11.149 -5.291 1.00 0.00 H new ATOM 0 HB VAL B 27 0.474 13.813 -6.107 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -0.510 13.797 -3.832 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -1.110 12.427 -4.797 1.00 0.00 H new ATOM 0 HG13 VAL B 27 0.143 12.164 -3.561 1.00 0.00 H new ATOM 0 HG21 VAL B 27 1.811 14.657 -4.191 1.00 0.00 H new ATOM 0 HG22 VAL B 27 2.458 13.022 -3.922 1.00 0.00 H new ATOM 0 HG23 VAL B 27 2.859 13.903 -5.415 1.00 0.00 H new ATOM 633 N VAL B 28 -0.476 11.585 -7.724 1.00 0.00 N ATOM 634 CA VAL B 28 -1.663 11.013 -8.346 1.00 0.00 C ATOM 635 C VAL B 28 -1.428 9.549 -8.707 1.00 0.00 C ATOM 636 O VAL B 28 -2.286 8.699 -8.470 1.00 0.00 O ATOM 637 CB VAL B 28 -2.022 11.801 -9.608 1.00 0.00 C ATOM 638 CG1 VAL B 28 -3.214 11.138 -10.303 1.00 0.00 C ATOM 639 CG2 VAL B 28 -2.385 13.237 -9.225 1.00 0.00 C ATOM 0 H VAL B 28 -0.058 12.360 -8.238 1.00 0.00 H new ATOM 0 HA VAL B 28 -2.487 11.071 -7.634 1.00 0.00 H new ATOM 0 HB VAL B 28 -1.169 11.811 -10.286 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -3.470 11.699 -11.202 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -2.953 10.115 -10.576 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -4.069 11.127 -9.627 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -2.641 13.799 -10.123 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -3.238 13.228 -8.547 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -1.535 13.708 -8.732 1.00 0.00 H new ATOM 649 N ALA B 29 -0.266 9.263 -9.284 1.00 0.00 N ATOM 650 CA ALA B 29 0.061 7.898 -9.676 1.00 0.00 C ATOM 651 C ALA B 29 0.022 6.972 -8.466 1.00 0.00 C ATOM 652 O ALA B 29 -0.456 5.844 -8.553 1.00 0.00 O ATOM 653 CB ALA B 29 1.458 7.856 -10.303 1.00 0.00 C ATOM 0 H ALA B 29 0.459 9.951 -9.489 1.00 0.00 H new ATOM 0 HA ALA B 29 -0.677 7.562 -10.404 1.00 0.00 H new ATOM 0 HB1 ALA B 29 1.696 6.833 -10.594 1.00 0.00 H new ATOM 0 HB2 ALA B 29 1.481 8.498 -11.184 1.00 0.00 H new ATOM 0 HB3 ALA B 29 2.193 8.207 -9.579 1.00 0.00 H new ATOM 659 N ALA B 30 0.526 7.454 -7.337 1.00 0.00 N ATOM 660 CA ALA B 30 0.539 6.653 -6.121 1.00 0.00 C ATOM 661 C ALA B 30 -0.878 6.242 -5.731 1.00 0.00 C ATOM 662 O ALA B 30 -1.129 5.083 -5.398 1.00 0.00 O ATOM 663 CB ALA B 30 1.174 7.447 -4.981 1.00 0.00 C ATOM 0 H ALA B 30 0.927 8.387 -7.238 1.00 0.00 H new ATOM 0 HA ALA B 30 1.125 5.753 -6.308 1.00 0.00 H new ATOM 0 HB1 ALA B 30 1.180 6.841 -4.075 1.00 0.00 H new ATOM 0 HB2 ALA B 30 2.197 7.711 -5.248 1.00 0.00 H new ATOM 0 HB3 ALA B 30 0.598 8.356 -4.806 1.00 0.00 H new ATOM 669 N ASN B 31 -1.799 7.197 -5.768 1.00 0.00 N ATOM 670 CA ASN B 31 -3.186 6.916 -5.414 1.00 0.00 C ATOM 671 C ASN B 31 -3.812 5.937 -6.403 1.00 0.00 C ATOM 672 O ASN B 31 -4.524 5.013 -6.007 1.00 0.00 O ATOM 673 CB ASN B 31 -3.991 8.214 -5.408 1.00 0.00 C ATOM 674 CG ASN B 31 -5.452 7.924 -5.079 1.00 0.00 C ATOM 675 OD1 ASN B 31 -5.748 7.309 -4.056 1.00 0.00 O ATOM 676 ND2 ASN B 31 -6.389 8.332 -5.892 1.00 0.00 N ATOM 0 H ASN B 31 -1.614 8.164 -6.037 1.00 0.00 H new ATOM 0 HA ASN B 31 -3.201 6.467 -4.421 1.00 0.00 H new ATOM 0 HB2 ASN B 31 -3.575 8.905 -4.675 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -3.919 8.700 -6.381 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -7.368 8.141 -5.679 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -6.142 8.842 -6.740 1.00 0.00 H new ATOM 683 N ILE B 32 -3.548 6.148 -7.689 1.00 0.00 N ATOM 684 CA ILE B 32 -4.098 5.277 -8.721 1.00 0.00 C ATOM 685 C ILE B 32 -3.547 3.860 -8.576 1.00 0.00 C ATOM 686 O ILE B 32 -4.288 2.883 -8.671 1.00 0.00 O ATOM 687 CB ILE B 32 -3.746 5.827 -10.108 1.00 0.00 C ATOM 688 CG1 ILE B 32 -4.487 7.149 -10.332 1.00 0.00 C ATOM 689 CG2 ILE B 32 -4.170 4.822 -11.185 1.00 0.00 C ATOM 690 CD1 ILE B 32 -3.947 7.831 -11.591 1.00 0.00 C ATOM 0 H ILE B 32 -2.963 6.907 -8.039 1.00 0.00 H new ATOM 0 HA ILE B 32 -5.182 5.245 -8.607 1.00 0.00 H new ATOM 0 HB ILE B 32 -2.670 5.992 -10.169 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -5.556 6.965 -10.435 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -4.358 7.801 -9.468 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -3.918 5.216 -12.170 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -3.648 3.878 -11.028 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -5.246 4.656 -11.125 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -4.474 8.772 -11.750 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -2.882 8.028 -11.470 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -4.099 7.180 -12.452 1.00 0.00 H new ATOM 702 N ILE B 33 -2.242 3.760 -8.348 1.00 0.00 N ATOM 703 CA ILE B 33 -1.603 2.459 -8.195 1.00 0.00 C ATOM 704 C ILE B 33 -2.133 1.745 -6.954 1.00 0.00 C ATOM 705 O ILE B 33 -2.418 0.548 -6.991 1.00 0.00 O ATOM 706 CB ILE B 33 -0.085 2.637 -8.086 1.00 0.00 C ATOM 707 CG1 ILE B 33 0.470 3.130 -9.426 1.00 0.00 C ATOM 708 CG2 ILE B 33 0.568 1.295 -7.735 1.00 0.00 C ATOM 709 CD1 ILE B 33 1.887 3.670 -9.224 1.00 0.00 C ATOM 0 H ILE B 33 -1.611 4.557 -8.266 1.00 0.00 H new ATOM 0 HA ILE B 33 -1.833 1.851 -9.070 1.00 0.00 H new ATOM 0 HB ILE B 33 0.135 3.366 -7.306 1.00 0.00 H new ATOM 0 HG12 ILE B 33 0.480 2.315 -10.150 1.00 0.00 H new ATOM 0 HG13 ILE B 33 -0.173 3.910 -9.833 1.00 0.00 H new ATOM 0 HG21 ILE B 33 1.648 1.425 -7.658 1.00 0.00 H new ATOM 0 HG22 ILE B 33 0.177 0.938 -6.782 1.00 0.00 H new ATOM 0 HG23 ILE B 33 0.345 0.567 -8.515 1.00 0.00 H new ATOM 0 HD11 ILE B 33 2.282 4.021 -10.177 1.00 0.00 H new ATOM 0 HD12 ILE B 33 1.863 4.497 -8.515 1.00 0.00 H new ATOM 0 HD13 ILE B 33 2.527 2.877 -8.836 1.00 0.00 H new ATOM 721 N GLY B 34 -2.254 2.484 -5.857 1.00 0.00 N ATOM 722 CA GLY B 34 -2.742 1.903 -4.612 1.00 0.00 C ATOM 723 C GLY B 34 -4.154 1.356 -4.783 1.00 0.00 C ATOM 724 O GLY B 34 -4.448 0.229 -4.381 1.00 0.00 O ATOM 0 H GLY B 34 -2.024 3.476 -5.804 1.00 0.00 H new ATOM 0 HA2 GLY B 34 -2.074 1.103 -4.293 1.00 0.00 H new ATOM 0 HA3 GLY B 34 -2.733 2.658 -3.826 1.00 0.00 H new ATOM 728 N ILE B 35 -5.021 2.161 -5.384 1.00 0.00 N ATOM 729 CA ILE B 35 -6.401 1.750 -5.607 1.00 0.00 C ATOM 730 C ILE B 35 -6.445 0.549 -6.545 1.00 0.00 C ATOM 731 O ILE B 35 -7.195 -0.397 -6.317 1.00 0.00 O ATOM 732 CB ILE B 35 -7.205 2.905 -6.207 1.00 0.00 C ATOM 733 CG1 ILE B 35 -7.333 4.022 -5.168 1.00 0.00 C ATOM 734 CG2 ILE B 35 -8.605 2.415 -6.587 1.00 0.00 C ATOM 735 CD1 ILE B 35 -7.883 5.285 -5.833 1.00 0.00 C ATOM 0 H ILE B 35 -4.795 3.096 -5.724 1.00 0.00 H new ATOM 0 HA ILE B 35 -6.841 1.471 -4.650 1.00 0.00 H new ATOM 0 HB ILE B 35 -6.695 3.278 -7.095 1.00 0.00 H new ATOM 0 HG12 ILE B 35 -7.994 3.707 -4.361 1.00 0.00 H new ATOM 0 HG13 ILE B 35 -6.361 4.229 -4.721 1.00 0.00 H new ATOM 0 HG21 ILE B 35 -9.176 3.240 -7.014 1.00 0.00 H new ATOM 0 HG22 ILE B 35 -8.523 1.612 -7.320 1.00 0.00 H new ATOM 0 HG23 ILE B 35 -9.114 2.044 -5.698 1.00 0.00 H new ATOM 0 HD11 ILE B 35 -7.973 6.078 -5.090 1.00 0.00 H new ATOM 0 HD12 ILE B 35 -7.205 5.604 -6.624 1.00 0.00 H new ATOM 0 HD13 ILE B 35 -8.864 5.074 -6.259 1.00 0.00 H new ATOM 747 N LEU B 36 -5.639 0.598 -7.598 1.00 0.00 N ATOM 748 CA LEU B 36 -5.603 -0.492 -8.567 1.00 0.00 C ATOM 749 C LEU B 36 -5.211 -1.799 -7.887 1.00 0.00 C ATOM 750 O LEU B 36 -5.786 -2.851 -8.167 1.00 0.00 O ATOM 751 CB LEU B 36 -4.599 -0.171 -9.683 1.00 0.00 C ATOM 752 CG LEU B 36 -4.475 -1.363 -10.648 1.00 0.00 C ATOM 753 CD1 LEU B 36 -5.857 -1.733 -11.209 1.00 0.00 C ATOM 754 CD2 LEU B 36 -3.532 -0.986 -11.797 1.00 0.00 C ATOM 0 H LEU B 36 -5.007 1.372 -7.803 1.00 0.00 H new ATOM 0 HA LEU B 36 -6.598 -0.603 -8.997 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -4.922 0.715 -10.229 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -3.625 0.059 -9.251 1.00 0.00 H new ATOM 0 HG LEU B 36 -4.073 -2.222 -10.111 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -5.759 -2.578 -11.891 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -6.522 -2.004 -10.389 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -6.272 -0.880 -11.746 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -3.441 -1.827 -12.484 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -3.934 -0.125 -12.330 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -2.550 -0.738 -11.395 1.00 0.00 H new ATOM 766 N HIS B 37 -4.230 -1.726 -6.999 1.00 0.00 N ATOM 767 CA HIS B 37 -3.765 -2.912 -6.294 1.00 0.00 C ATOM 768 C HIS B 37 -4.913 -3.552 -5.525 1.00 0.00 C ATOM 769 O HIS B 37 -5.042 -4.776 -5.490 1.00 0.00 O ATOM 770 CB HIS B 37 -2.651 -2.535 -5.321 1.00 0.00 C ATOM 771 CG HIS B 37 -2.170 -3.777 -4.620 1.00 0.00 C ATOM 772 ND1 HIS B 37 -0.879 -4.254 -4.755 1.00 0.00 N ATOM 773 CD2 HIS B 37 -2.804 -4.655 -3.780 1.00 0.00 C ATOM 774 CE1 HIS B 37 -0.782 -5.372 -4.014 1.00 0.00 C ATOM 775 NE2 HIS B 37 -1.926 -5.658 -3.397 1.00 0.00 N ATOM 0 H HIS B 37 -3.743 -0.865 -6.751 1.00 0.00 H new ATOM 0 HA HIS B 37 -3.383 -3.624 -7.025 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -1.828 -2.062 -5.857 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -3.016 -1.810 -4.594 1.00 0.00 H new ATOM 0 HD2 HIS B 37 -3.834 -4.577 -3.464 1.00 0.00 H new ATOM 0 HE1 HIS B 37 0.116 -5.966 -3.930 1.00 0.00 H new ATOM 0 HE2 HIS B 37 -2.116 -6.445 -2.776 1.00 0.00 H new ATOM 783 N LEU B 38 -5.744 -2.720 -4.912 1.00 0.00 N ATOM 784 CA LEU B 38 -6.879 -3.218 -4.144 1.00 0.00 C ATOM 785 C LEU B 38 -7.832 -4.000 -5.035 1.00 0.00 C ATOM 786 O LEU B 38 -8.366 -5.027 -4.632 1.00 0.00 O ATOM 787 CB LEU B 38 -7.623 -2.040 -3.484 1.00 0.00 C ATOM 788 CG LEU B 38 -7.036 -1.748 -2.085 1.00 0.00 C ATOM 789 CD1 LEU B 38 -7.354 -0.310 -1.668 1.00 0.00 C ATOM 790 CD2 LEU B 38 -7.642 -2.716 -1.053 1.00 0.00 C ATOM 0 H LEU B 38 -5.656 -1.704 -4.930 1.00 0.00 H new ATOM 0 HA LEU B 38 -6.505 -3.887 -3.369 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -7.542 -1.153 -4.112 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -8.684 -2.274 -3.399 1.00 0.00 H new ATOM 0 HG LEU B 38 -5.955 -1.882 -2.126 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -6.935 -0.116 -0.680 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -6.919 0.382 -2.389 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -8.435 -0.171 -1.637 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -7.225 -2.506 -0.068 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -8.724 -2.586 -1.024 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -7.407 -3.742 -1.335 1.00 0.00 H new ATOM 802 N ILE B 39 -8.055 -3.517 -6.241 1.00 0.00 N ATOM 803 CA ILE B 39 -8.963 -4.202 -7.139 1.00 0.00 C ATOM 804 C ILE B 39 -8.499 -5.637 -7.370 1.00 0.00 C ATOM 805 O ILE B 39 -9.288 -6.577 -7.269 1.00 0.00 O ATOM 806 CB ILE B 39 -9.021 -3.458 -8.472 1.00 0.00 C ATOM 807 CG1 ILE B 39 -9.474 -2.015 -8.224 1.00 0.00 C ATOM 808 CG2 ILE B 39 -10.002 -4.157 -9.412 1.00 0.00 C ATOM 809 CD1 ILE B 39 -9.378 -1.201 -9.520 1.00 0.00 C ATOM 0 H ILE B 39 -7.629 -2.670 -6.617 1.00 0.00 H new ATOM 0 HA ILE B 39 -9.956 -4.223 -6.689 1.00 0.00 H new ATOM 0 HB ILE B 39 -8.033 -3.455 -8.932 1.00 0.00 H new ATOM 0 HG12 ILE B 39 -10.500 -2.006 -7.855 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -8.854 -1.559 -7.452 1.00 0.00 H new ATOM 0 HG21 ILE B 39 -10.040 -3.623 -10.361 1.00 0.00 H new ATOM 0 HG22 ILE B 39 -9.673 -5.182 -9.585 1.00 0.00 H new ATOM 0 HG23 ILE B 39 -10.994 -4.166 -8.961 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -9.702 -0.178 -9.332 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -8.346 -1.196 -9.871 1.00 0.00 H new ATOM 0 HD13 ILE B 39 -10.017 -1.650 -10.280 1.00 0.00 H new ATOM 821 N LEU B 40 -7.220 -5.800 -7.684 1.00 0.00 N ATOM 822 CA LEU B 40 -6.675 -7.130 -7.926 1.00 0.00 C ATOM 823 C LEU B 40 -6.584 -7.938 -6.635 1.00 0.00 C ATOM 824 O LEU B 40 -6.906 -9.124 -6.608 1.00 0.00 O ATOM 825 CB LEU B 40 -5.286 -7.002 -8.565 1.00 0.00 C ATOM 826 CG LEU B 40 -5.426 -6.703 -10.067 1.00 0.00 C ATOM 827 CD1 LEU B 40 -5.984 -7.930 -10.823 1.00 0.00 C ATOM 828 CD2 LEU B 40 -6.362 -5.500 -10.252 1.00 0.00 C ATOM 0 H LEU B 40 -6.548 -5.038 -7.776 1.00 0.00 H new ATOM 0 HA LEU B 40 -7.346 -7.659 -8.602 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -4.724 -6.205 -8.078 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -4.723 -7.924 -8.420 1.00 0.00 H new ATOM 0 HG LEU B 40 -4.443 -6.474 -10.477 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -6.074 -7.694 -11.883 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -5.307 -8.775 -10.695 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -6.965 -8.188 -10.424 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -6.467 -5.281 -11.315 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -7.340 -5.732 -9.831 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -5.944 -4.632 -9.742 1.00 0.00 H new ATOM 840 N TRP B 41 -6.127 -7.291 -5.570 1.00 0.00 N ATOM 841 CA TRP B 41 -5.982 -7.967 -4.290 1.00 0.00 C ATOM 842 C TRP B 41 -7.342 -8.380 -3.739 1.00 0.00 C ATOM 843 O TRP B 41 -7.486 -9.454 -3.154 1.00 0.00 O ATOM 844 CB TRP B 41 -5.247 -7.068 -3.297 1.00 0.00 C ATOM 845 CG TRP B 41 -5.206 -7.727 -1.956 1.00 0.00 C ATOM 846 CD1 TRP B 41 -4.306 -8.664 -1.576 1.00 0.00 C ATOM 847 CD2 TRP B 41 -6.051 -7.484 -0.798 1.00 0.00 C ATOM 848 NE1 TRP B 41 -4.580 -9.041 -0.275 1.00 0.00 N ATOM 849 CE2 TRP B 41 -5.639 -8.331 0.249 1.00 0.00 C ATOM 850 CE3 TRP B 41 -7.131 -6.620 -0.564 1.00 0.00 C ATOM 851 CZ2 TRP B 41 -6.278 -8.324 1.482 1.00 0.00 C ATOM 852 CZ3 TRP B 41 -7.771 -6.603 0.684 1.00 0.00 C ATOM 853 CH2 TRP B 41 -7.342 -7.455 1.702 1.00 0.00 C ATOM 0 H TRP B 41 -5.853 -6.308 -5.568 1.00 0.00 H new ATOM 0 HA TRP B 41 -5.392 -8.871 -4.442 1.00 0.00 H new ATOM 0 HB2 TRP B 41 -4.234 -6.874 -3.649 1.00 0.00 H new ATOM 0 HB3 TRP B 41 -5.750 -6.104 -3.224 1.00 0.00 H new ATOM 0 HD1 TRP B 41 -3.506 -9.053 -2.188 1.00 0.00 H new ATOM 0 HE1 TRP B 41 -4.062 -9.757 0.235 1.00 0.00 H new ATOM 0 HE3 TRP B 41 -7.472 -5.963 -1.350 1.00 0.00 H new ATOM 0 HZ2 TRP B 41 -5.950 -8.990 2.267 1.00 0.00 H new ATOM 0 HZ3 TRP B 41 -8.597 -5.929 0.857 1.00 0.00 H new ATOM 0 HH2 TRP B 41 -7.836 -7.440 2.662 1.00 0.00 H new ATOM 864 N ILE B 42 -8.336 -7.524 -3.925 1.00 0.00 N ATOM 865 CA ILE B 42 -9.680 -7.813 -3.439 1.00 0.00 C ATOM 866 C ILE B 42 -10.227 -9.066 -4.122 1.00 0.00 C ATOM 867 O ILE B 42 -10.793 -9.942 -3.471 1.00 0.00 O ATOM 868 CB ILE B 42 -10.605 -6.610 -3.718 1.00 0.00 C ATOM 869 CG1 ILE B 42 -10.352 -5.507 -2.679 1.00 0.00 C ATOM 870 CG2 ILE B 42 -12.077 -7.039 -3.649 1.00 0.00 C ATOM 871 CD1 ILE B 42 -10.977 -4.197 -3.161 1.00 0.00 C ATOM 0 H ILE B 42 -8.240 -6.629 -4.405 1.00 0.00 H new ATOM 0 HA ILE B 42 -9.640 -7.990 -2.364 1.00 0.00 H new ATOM 0 HB ILE B 42 -10.389 -6.232 -4.717 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -10.779 -5.794 -1.718 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -9.281 -5.376 -2.526 1.00 0.00 H new ATOM 0 HG21 ILE B 42 -12.716 -6.179 -3.848 1.00 0.00 H new ATOM 0 HG22 ILE B 42 -12.266 -7.812 -4.394 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -12.295 -7.431 -2.656 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -10.797 -3.415 -2.423 1.00 0.00 H new ATOM 0 HD12 ILE B 42 -10.529 -3.909 -4.112 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -12.051 -4.332 -3.292 1.00 0.00 H new ATOM 883 N LEU B 43 -10.056 -9.135 -5.433 1.00 0.00 N ATOM 884 CA LEU B 43 -10.543 -10.277 -6.195 1.00 0.00 C ATOM 885 C LEU B 43 -9.832 -11.550 -5.753 1.00 0.00 C ATOM 886 O LEU B 43 -10.437 -12.616 -5.680 1.00 0.00 O ATOM 887 CB LEU B 43 -10.320 -10.042 -7.689 1.00 0.00 C ATOM 888 CG LEU B 43 -11.228 -8.902 -8.179 1.00 0.00 C ATOM 889 CD1 LEU B 43 -10.770 -8.460 -9.573 1.00 0.00 C ATOM 890 CD2 LEU B 43 -12.700 -9.359 -8.241 1.00 0.00 C ATOM 0 H LEU B 43 -9.587 -8.420 -5.989 1.00 0.00 H new ATOM 0 HA LEU B 43 -11.611 -10.392 -6.010 1.00 0.00 H new ATOM 0 HB2 LEU B 43 -9.275 -9.793 -7.875 1.00 0.00 H new ATOM 0 HB3 LEU B 43 -10.534 -10.954 -8.246 1.00 0.00 H new ATOM 0 HG LEU B 43 -11.156 -8.070 -7.478 1.00 0.00 H new ATOM 0 HD11 LEU B 43 -11.410 -7.652 -9.927 1.00 0.00 H new ATOM 0 HD12 LEU B 43 -9.738 -8.111 -9.524 1.00 0.00 H new ATOM 0 HD13 LEU B 43 -10.836 -9.302 -10.262 1.00 0.00 H new ATOM 0 HD21 LEU B 43 -13.322 -8.535 -8.590 1.00 0.00 H new ATOM 0 HD22 LEU B 43 -12.791 -10.200 -8.929 1.00 0.00 H new ATOM 0 HD23 LEU B 43 -13.028 -9.666 -7.248 1.00 0.00 H new ATOM 902 N ASP B 44 -8.547 -11.429 -5.463 1.00 0.00 N ATOM 903 CA ASP B 44 -7.767 -12.580 -5.036 1.00 0.00 C ATOM 904 C ASP B 44 -8.341 -13.165 -3.748 1.00 0.00 C ATOM 905 O ASP B 44 -8.421 -14.384 -3.595 1.00 0.00 O ATOM 906 CB ASP B 44 -6.315 -12.163 -4.806 1.00 0.00 C ATOM 907 CG ASP B 44 -5.486 -13.374 -4.395 1.00 0.00 C ATOM 908 OD1 ASP B 44 -6.073 -14.420 -4.170 1.00 0.00 O ATOM 909 OD2 ASP B 44 -4.277 -13.238 -4.313 1.00 0.00 O ATOM 0 H ASP B 44 -8.025 -10.554 -5.514 1.00 0.00 H new ATOM 0 HA ASP B 44 -7.809 -13.339 -5.817 1.00 0.00 H new ATOM 0 HB2 ASP B 44 -5.906 -11.723 -5.715 1.00 0.00 H new ATOM 0 HB3 ASP B 44 -6.266 -11.398 -4.031 1.00 0.00 H new ATOM 914 N ARG B 45 -8.739 -12.293 -2.829 1.00 0.00 N ATOM 915 CA ARG B 45 -9.304 -12.743 -1.561 1.00 0.00 C ATOM 916 C ARG B 45 -10.758 -13.161 -1.738 1.00 0.00 C ATOM 917 O ARG B 45 -11.294 -13.932 -0.943 1.00 0.00 O ATOM 918 CB ARG B 45 -9.216 -11.622 -0.523 1.00 0.00 C ATOM 919 CG ARG B 45 -9.716 -12.132 0.831 1.00 0.00 C ATOM 920 CD ARG B 45 -9.546 -11.036 1.884 1.00 0.00 C ATOM 921 NE ARG B 45 -10.007 -11.509 3.183 1.00 0.00 N ATOM 922 CZ ARG B 45 -10.110 -10.684 4.218 1.00 0.00 C ATOM 923 NH1 ARG B 45 -9.787 -9.426 4.086 1.00 0.00 N ATOM 924 NH2 ARG B 45 -10.526 -11.131 5.372 1.00 0.00 N ATOM 0 H ARG B 45 -8.682 -11.280 -2.935 1.00 0.00 H new ATOM 0 HA ARG B 45 -8.731 -13.604 -1.216 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -8.186 -11.276 -0.434 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -9.813 -10.768 -0.844 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -10.764 -12.421 0.758 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -9.159 -13.022 1.124 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -8.498 -10.742 1.947 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -10.109 -10.150 1.591 1.00 0.00 H new ATOM 0 HE ARG B 45 -10.255 -12.492 3.299 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -9.455 -9.076 3.187 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -9.866 -8.793 4.882 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -10.772 -12.115 5.479 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -10.605 -10.496 6.167 1.00 0.00 H new ATOM 938 N LEU B 46 -11.401 -12.642 -2.779 1.00 0.00 N ATOM 939 CA LEU B 46 -12.799 -12.974 -3.025 1.00 0.00 C ATOM 940 C LEU B 46 -12.958 -14.469 -3.278 1.00 0.00 C ATOM 941 O LEU B 46 -13.799 -15.127 -2.666 1.00 0.00 O ATOM 942 CB LEU B 46 -13.313 -12.190 -4.241 1.00 0.00 C ATOM 943 CG LEU B 46 -14.773 -12.565 -4.545 1.00 0.00 C ATOM 944 CD1 LEU B 46 -15.660 -12.281 -3.323 1.00 0.00 C ATOM 945 CD2 LEU B 46 -15.262 -11.747 -5.746 1.00 0.00 C ATOM 0 H LEU B 46 -10.985 -12.001 -3.455 1.00 0.00 H new ATOM 0 HA LEU B 46 -13.380 -12.703 -2.143 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -13.239 -11.120 -4.049 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -12.688 -12.402 -5.109 1.00 0.00 H new ATOM 0 HG LEU B 46 -14.832 -13.628 -4.777 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -16.691 -12.551 -3.551 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -15.310 -12.870 -2.475 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -15.609 -11.221 -3.075 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -16.297 -12.008 -5.967 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -15.198 -10.684 -5.513 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -14.639 -11.966 -6.613 1.00 0.00 H new ATOM 957 N PHE B 47 -12.143 -14.998 -4.183 1.00 0.00 N ATOM 958 CA PHE B 47 -12.199 -16.419 -4.510 1.00 0.00 C ATOM 959 C PHE B 47 -11.596 -17.256 -3.390 1.00 0.00 C ATOM 960 O PHE B 47 -12.088 -18.342 -3.079 1.00 0.00 O ATOM 961 CB PHE B 47 -11.458 -16.682 -5.827 1.00 0.00 C ATOM 962 CG PHE B 47 -12.312 -16.220 -6.989 1.00 0.00 C ATOM 963 CD1 PHE B 47 -12.470 -14.851 -7.239 1.00 0.00 C ATOM 964 CD2 PHE B 47 -12.940 -17.158 -7.815 1.00 0.00 C ATOM 965 CE1 PHE B 47 -13.257 -14.421 -8.313 1.00 0.00 C ATOM 966 CE2 PHE B 47 -13.728 -16.729 -8.890 1.00 0.00 C ATOM 967 CZ PHE B 47 -13.886 -15.360 -9.139 1.00 0.00 C ATOM 0 H PHE B 47 -11.440 -14.470 -4.700 1.00 0.00 H new ATOM 0 HA PHE B 47 -13.244 -16.707 -4.625 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -10.504 -16.155 -5.831 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -11.236 -17.745 -5.925 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -11.984 -14.127 -6.602 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -12.817 -18.214 -7.624 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -13.379 -13.365 -8.505 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -14.214 -17.454 -9.527 1.00 0.00 H new ATOM 0 HZ PHE B 47 -14.493 -15.029 -9.968 1.00 0.00 H new ATOM 977 N PHE B 48 -10.518 -16.749 -2.797 1.00 0.00 N ATOM 978 CA PHE B 48 -9.837 -17.456 -1.715 1.00 0.00 C ATOM 979 C PHE B 48 -10.227 -16.869 -0.365 1.00 0.00 C ATOM 980 O PHE B 48 -9.971 -15.697 -0.087 1.00 0.00 O ATOM 981 CB PHE B 48 -8.322 -17.344 -1.908 1.00 0.00 C ATOM 982 CG PHE B 48 -7.885 -18.258 -3.030 1.00 0.00 C ATOM 983 CD1 PHE B 48 -8.123 -17.892 -4.361 1.00 0.00 C ATOM 984 CD2 PHE B 48 -7.248 -19.471 -2.741 1.00 0.00 C ATOM 985 CE1 PHE B 48 -7.722 -18.740 -5.403 1.00 0.00 C ATOM 986 CE2 PHE B 48 -6.847 -20.318 -3.781 1.00 0.00 C ATOM 987 CZ PHE B 48 -7.081 -19.953 -5.111 1.00 0.00 C ATOM 0 H PHE B 48 -10.098 -15.854 -3.046 1.00 0.00 H new ATOM 0 HA PHE B 48 -10.134 -18.504 -1.737 1.00 0.00 H new ATOM 0 HB2 PHE B 48 -8.050 -16.314 -2.138 1.00 0.00 H new ATOM 0 HB3 PHE B 48 -7.807 -17.612 -0.986 1.00 0.00 H new ATOM 0 HD1 PHE B 48 -8.615 -16.957 -4.584 1.00 0.00 H new ATOM 0 HD2 PHE B 48 -7.066 -19.753 -1.715 1.00 0.00 H new ATOM 0 HE1 PHE B 48 -7.906 -18.460 -6.430 1.00 0.00 H new ATOM 0 HE2 PHE B 48 -6.357 -21.254 -3.556 1.00 0.00 H new ATOM 0 HZ PHE B 48 -6.768 -20.605 -5.913 1.00 0.00 H new ATOM 997 N LYS B 49 -10.843 -17.696 0.471 1.00 0.00 N ATOM 998 CA LYS B 49 -11.266 -17.257 1.796 1.00 0.00 C ATOM 999 C LYS B 49 -11.434 -18.454 2.726 1.00 0.00 C ATOM 1000 O LYS B 49 -11.758 -19.522 2.232 1.00 0.00 O ATOM 1001 CB LYS B 49 -12.588 -16.493 1.695 1.00 0.00 C ATOM 1002 CG LYS B 49 -12.968 -15.946 3.071 1.00 0.00 C ATOM 1003 CD LYS B 49 -14.243 -15.111 2.957 1.00 0.00 C ATOM 1004 CE LYS B 49 -14.614 -14.554 4.332 1.00 0.00 C ATOM 1005 NZ LYS B 49 -15.832 -13.704 4.212 1.00 0.00 N ATOM 1006 OXT LYS B 49 -11.236 -18.286 3.917 1.00 0.00 O ATOM 0 H LYS B 49 -11.060 -18.669 0.257 1.00 0.00 H new ATOM 0 HA LYS B 49 -10.499 -16.599 2.205 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -12.494 -15.675 0.980 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -13.373 -17.152 1.324 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -13.121 -16.768 3.771 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -12.156 -15.336 3.468 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -14.093 -14.294 2.251 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -15.057 -15.723 2.569 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -14.795 -15.371 5.030 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -13.787 -13.969 4.734 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -16.084 -13.325 5.147 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -15.643 -12.917 3.559 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -16.620 -14.276 3.846 1.00 0.00 H new TER 1020 LYS B 49 ATOM 1021 N SER C 19 10.537 25.640 -4.218 1.00 0.00 N ATOM 1022 CA SER C 19 9.059 25.773 -4.343 1.00 0.00 C ATOM 1023 C SER C 19 8.444 24.396 -4.569 1.00 0.00 C ATOM 1024 O SER C 19 7.272 24.174 -4.267 1.00 0.00 O ATOM 1025 CB SER C 19 8.729 26.690 -5.520 1.00 0.00 C ATOM 1026 OG SER C 19 7.346 26.579 -5.829 1.00 0.00 O ATOM 0 HA SER C 19 8.650 26.203 -3.429 1.00 0.00 H new ATOM 0 HB2 SER C 19 8.976 27.722 -5.272 1.00 0.00 H new ATOM 0 HB3 SER C 19 9.330 26.418 -6.388 1.00 0.00 H new ATOM 0 HG SER C 19 7.131 27.167 -6.583 1.00 0.00 H new ATOM 1034 N ASN C 20 9.241 23.475 -5.104 1.00 0.00 N ATOM 1035 CA ASN C 20 8.766 22.120 -5.369 1.00 0.00 C ATOM 1036 C ASN C 20 8.985 21.229 -4.152 1.00 0.00 C ATOM 1037 O ASN C 20 10.105 20.793 -3.883 1.00 0.00 O ATOM 1038 CB ASN C 20 9.509 21.533 -6.569 1.00 0.00 C ATOM 1039 CG ASN C 20 8.905 20.184 -6.947 1.00 0.00 C ATOM 1040 OD1 ASN C 20 7.689 20.007 -6.879 1.00 0.00 O ATOM 1041 ND2 ASN C 20 9.688 19.216 -7.341 1.00 0.00 N ATOM 0 H ASN C 20 10.214 23.641 -5.361 1.00 0.00 H new ATOM 0 HA ASN C 20 7.699 22.165 -5.587 1.00 0.00 H new ATOM 0 HB2 ASN C 20 9.449 22.218 -7.415 1.00 0.00 H new ATOM 0 HB3 ASN C 20 10.566 21.414 -6.330 1.00 0.00 H new ATOM 0 HD21 ASN C 20 9.292 18.310 -7.593 1.00 0.00 H new ATOM 0 HD22 ASN C 20 10.695 19.365 -7.396 1.00 0.00 H new ATOM 1048 N ASP C 21 7.909 20.961 -3.418 1.00 0.00 N ATOM 1049 CA ASP C 21 7.993 20.119 -2.227 1.00 0.00 C ATOM 1050 C ASP C 21 7.977 18.644 -2.614 1.00 0.00 C ATOM 1051 O ASP C 21 8.170 17.769 -1.771 1.00 0.00 O ATOM 1052 CB ASP C 21 6.820 20.418 -1.295 1.00 0.00 C ATOM 1053 CG ASP C 21 7.032 19.727 0.047 1.00 0.00 C ATOM 1054 OD1 ASP C 21 8.154 19.321 0.310 1.00 0.00 O ATOM 1055 OD2 ASP C 21 6.072 19.609 0.790 1.00 0.00 O ATOM 0 H ASP C 21 6.974 21.312 -3.624 1.00 0.00 H new ATOM 0 HA ASP C 21 8.929 20.338 -1.713 1.00 0.00 H new ATOM 0 HB2 ASP C 21 6.726 21.494 -1.149 1.00 0.00 H new ATOM 0 HB3 ASP C 21 5.889 20.075 -1.747 1.00 0.00 H new ATOM 1060 N SER C 22 7.746 18.377 -3.895 1.00 0.00 N ATOM 1061 CA SER C 22 7.704 17.001 -4.387 1.00 0.00 C ATOM 1062 C SER C 22 9.042 16.311 -4.149 1.00 0.00 C ATOM 1063 O SER C 22 9.093 15.107 -3.894 1.00 0.00 O ATOM 1064 CB SER C 22 7.379 16.989 -5.880 1.00 0.00 C ATOM 1065 OG SER C 22 6.012 17.337 -6.064 1.00 0.00 O ATOM 0 H SER C 22 7.586 19.088 -4.608 1.00 0.00 H new ATOM 0 HA SER C 22 6.927 16.463 -3.844 1.00 0.00 H new ATOM 0 HB2 SER C 22 8.020 17.693 -6.410 1.00 0.00 H new ATOM 0 HB3 SER C 22 7.575 16.002 -6.299 1.00 0.00 H new ATOM 0 HG SER C 22 5.499 16.536 -6.299 1.00 0.00 H new ATOM 1071 N SER C 23 10.120 17.080 -4.236 1.00 0.00 N ATOM 1072 CA SER C 23 11.453 16.532 -4.032 1.00 0.00 C ATOM 1073 C SER C 23 11.530 15.831 -2.683 1.00 0.00 C ATOM 1074 O SER C 23 12.446 15.050 -2.437 1.00 0.00 O ATOM 1075 CB SER C 23 12.495 17.649 -4.080 1.00 0.00 C ATOM 1076 OG SER C 23 13.796 17.082 -3.956 1.00 0.00 O ATOM 0 H SER C 23 10.097 18.078 -4.445 1.00 0.00 H new ATOM 0 HA SER C 23 11.657 15.813 -4.826 1.00 0.00 H new ATOM 0 HB2 SER C 23 12.413 18.199 -5.017 1.00 0.00 H new ATOM 0 HB3 SER C 23 12.318 18.362 -3.275 1.00 0.00 H new ATOM 0 HG SER C 23 13.745 16.258 -3.427 1.00 0.00 H new ATOM 1082 N ASP C 24 10.561 16.116 -1.813 1.00 0.00 N ATOM 1083 CA ASP C 24 10.537 15.511 -0.485 1.00 0.00 C ATOM 1084 C ASP C 24 10.899 14.021 -0.568 1.00 0.00 C ATOM 1085 O ASP C 24 10.077 13.207 -0.995 1.00 0.00 O ATOM 1086 CB ASP C 24 9.150 15.658 0.139 1.00 0.00 C ATOM 1087 CG ASP C 24 9.160 15.070 1.549 1.00 0.00 C ATOM 1088 OD1 ASP C 24 10.218 14.647 1.979 1.00 0.00 O ATOM 1089 OD2 ASP C 24 8.113 15.055 2.174 1.00 0.00 O ATOM 0 H ASP C 24 9.790 16.756 -2.003 1.00 0.00 H new ATOM 0 HA ASP C 24 11.270 16.025 0.136 1.00 0.00 H new ATOM 0 HB2 ASP C 24 8.865 16.710 0.174 1.00 0.00 H new ATOM 0 HB3 ASP C 24 8.408 15.147 -0.474 1.00 0.00 H new ATOM 1094 N PRO C 25 12.101 13.642 -0.183 1.00 0.00 N ATOM 1095 CA PRO C 25 12.546 12.217 -0.237 1.00 0.00 C ATOM 1096 C PRO C 25 11.554 11.275 0.438 1.00 0.00 C ATOM 1097 O PRO C 25 11.382 10.132 0.019 1.00 0.00 O ATOM 1098 CB PRO C 25 13.893 12.220 0.509 1.00 0.00 C ATOM 1099 CG PRO C 25 14.403 13.620 0.397 1.00 0.00 C ATOM 1100 CD PRO C 25 13.167 14.519 0.347 1.00 0.00 C ATOM 0 HA PRO C 25 12.624 11.857 -1.263 1.00 0.00 H new ATOM 0 HB2 PRO C 25 13.766 11.930 1.552 1.00 0.00 H new ATOM 0 HB3 PRO C 25 14.591 11.511 0.064 1.00 0.00 H new ATOM 0 HG2 PRO C 25 15.035 13.874 1.248 1.00 0.00 H new ATOM 0 HG3 PRO C 25 15.011 13.743 -0.499 1.00 0.00 H new ATOM 0 HD2 PRO C 25 12.913 14.902 1.335 1.00 0.00 H new ATOM 0 HD3 PRO C 25 13.329 15.383 -0.298 1.00 0.00 H new ATOM 1108 N LEU C 26 10.923 11.755 1.500 1.00 0.00 N ATOM 1109 CA LEU C 26 9.978 10.926 2.233 1.00 0.00 C ATOM 1110 C LEU C 26 8.818 10.513 1.328 1.00 0.00 C ATOM 1111 O LEU C 26 8.453 9.339 1.265 1.00 0.00 O ATOM 1112 CB LEU C 26 9.444 11.710 3.448 1.00 0.00 C ATOM 1113 CG LEU C 26 9.088 10.748 4.598 1.00 0.00 C ATOM 1114 CD1 LEU C 26 8.112 9.679 4.094 1.00 0.00 C ATOM 1115 CD2 LEU C 26 10.375 10.079 5.150 1.00 0.00 C ATOM 0 H LEU C 26 11.045 12.698 1.869 1.00 0.00 H new ATOM 0 HA LEU C 26 10.487 10.025 2.576 1.00 0.00 H new ATOM 0 HB2 LEU C 26 10.194 12.426 3.784 1.00 0.00 H new ATOM 0 HB3 LEU C 26 8.563 12.283 3.160 1.00 0.00 H new ATOM 0 HG LEU C 26 8.615 11.312 5.402 1.00 0.00 H new ATOM 0 HD11 LEU C 26 7.862 9.001 4.910 1.00 0.00 H new ATOM 0 HD12 LEU C 26 7.203 10.159 3.730 1.00 0.00 H new ATOM 0 HD13 LEU C 26 8.575 9.117 3.283 1.00 0.00 H new ATOM 0 HD21 LEU C 26 10.113 9.401 5.962 1.00 0.00 H new ATOM 0 HD22 LEU C 26 10.864 9.519 4.353 1.00 0.00 H new ATOM 0 HD23 LEU C 26 11.053 10.847 5.523 1.00 0.00 H new ATOM 1127 N VAL C 27 8.255 11.481 0.624 1.00 0.00 N ATOM 1128 CA VAL C 27 7.147 11.203 -0.272 1.00 0.00 C ATOM 1129 C VAL C 27 7.600 10.302 -1.415 1.00 0.00 C ATOM 1130 O VAL C 27 6.903 9.359 -1.792 1.00 0.00 O ATOM 1131 CB VAL C 27 6.584 12.510 -0.831 1.00 0.00 C ATOM 1132 CG1 VAL C 27 5.492 12.200 -1.854 1.00 0.00 C ATOM 1133 CG2 VAL C 27 5.989 13.336 0.314 1.00 0.00 C ATOM 0 H VAL C 27 8.545 12.459 0.655 1.00 0.00 H new ATOM 0 HA VAL C 27 6.367 10.690 0.290 1.00 0.00 H new ATOM 0 HB VAL C 27 7.383 13.074 -1.313 1.00 0.00 H new ATOM 0 HG11 VAL C 27 5.091 13.132 -2.252 1.00 0.00 H new ATOM 0 HG12 VAL C 27 5.913 11.609 -2.668 1.00 0.00 H new ATOM 0 HG13 VAL C 27 4.692 11.637 -1.373 1.00 0.00 H new ATOM 0 HG21 VAL C 27 5.587 14.269 -0.081 1.00 0.00 H new ATOM 0 HG22 VAL C 27 5.190 12.771 0.794 1.00 0.00 H new ATOM 0 HG23 VAL C 27 6.766 13.557 1.045 1.00 0.00 H new ATOM 1143 N VAL C 28 8.771 10.602 -1.962 1.00 0.00 N ATOM 1144 CA VAL C 28 9.311 9.820 -3.067 1.00 0.00 C ATOM 1145 C VAL C 28 9.545 8.376 -2.639 1.00 0.00 C ATOM 1146 O VAL C 28 9.210 7.441 -3.367 1.00 0.00 O ATOM 1147 CB VAL C 28 10.628 10.433 -3.546 1.00 0.00 C ATOM 1148 CG1 VAL C 28 11.234 9.552 -4.643 1.00 0.00 C ATOM 1149 CG2 VAL C 28 10.369 11.835 -4.100 1.00 0.00 C ATOM 0 H VAL C 28 9.362 11.377 -1.661 1.00 0.00 H new ATOM 0 HA VAL C 28 8.588 9.831 -3.882 1.00 0.00 H new ATOM 0 HB VAL C 28 11.323 10.498 -2.709 1.00 0.00 H new ATOM 0 HG11 VAL C 28 12.172 9.989 -4.984 1.00 0.00 H new ATOM 0 HG12 VAL C 28 11.422 8.554 -4.246 1.00 0.00 H new ATOM 0 HG13 VAL C 28 10.540 9.485 -5.481 1.00 0.00 H new ATOM 0 HG21 VAL C 28 11.308 12.271 -4.441 1.00 0.00 H new ATOM 0 HG22 VAL C 28 9.673 11.773 -4.937 1.00 0.00 H new ATOM 0 HG23 VAL C 28 9.941 12.462 -3.318 1.00 0.00 H new ATOM 1159 N ALA C 29 10.127 8.198 -1.457 1.00 0.00 N ATOM 1160 CA ALA C 29 10.405 6.861 -0.948 1.00 0.00 C ATOM 1161 C ALA C 29 9.117 6.049 -0.851 1.00 0.00 C ATOM 1162 O ALA C 29 9.092 4.867 -1.183 1.00 0.00 O ATOM 1163 CB ALA C 29 11.054 6.950 0.433 1.00 0.00 C ATOM 0 H ALA C 29 10.413 8.957 -0.838 1.00 0.00 H new ATOM 0 HA ALA C 29 11.087 6.365 -1.639 1.00 0.00 H new ATOM 0 HB1 ALA C 29 11.258 5.946 0.805 1.00 0.00 H new ATOM 0 HB2 ALA C 29 11.988 7.507 0.361 1.00 0.00 H new ATOM 0 HB3 ALA C 29 10.379 7.461 1.120 1.00 0.00 H new ATOM 1169 N ALA C 30 8.049 6.692 -0.399 1.00 0.00 N ATOM 1170 CA ALA C 30 6.767 6.012 -0.265 1.00 0.00 C ATOM 1171 C ALA C 30 6.309 5.454 -1.607 1.00 0.00 C ATOM 1172 O ALA C 30 5.877 4.304 -1.699 1.00 0.00 O ATOM 1173 CB ALA C 30 5.715 6.984 0.269 1.00 0.00 C ATOM 0 H ALA C 30 8.043 7.673 -0.121 1.00 0.00 H new ATOM 0 HA ALA C 30 6.889 5.185 0.435 1.00 0.00 H new ATOM 0 HB1 ALA C 30 4.760 6.469 0.366 1.00 0.00 H new ATOM 0 HB2 ALA C 30 6.027 7.358 1.244 1.00 0.00 H new ATOM 0 HB3 ALA C 30 5.608 7.820 -0.422 1.00 0.00 H new ATOM 1179 N ASN C 31 6.404 6.274 -2.650 1.00 0.00 N ATOM 1180 CA ASN C 31 5.995 5.845 -3.982 1.00 0.00 C ATOM 1181 C ASN C 31 6.877 4.704 -4.480 1.00 0.00 C ATOM 1182 O ASN C 31 6.384 3.733 -5.056 1.00 0.00 O ATOM 1183 CB ASN C 31 6.089 7.021 -4.956 1.00 0.00 C ATOM 1184 CG ASN C 31 5.695 6.569 -6.359 1.00 0.00 C ATOM 1185 OD1 ASN C 31 4.619 6.002 -6.552 1.00 0.00 O ATOM 1186 ND2 ASN C 31 6.509 6.785 -7.356 1.00 0.00 N ATOM 0 H ASN C 31 6.757 7.230 -2.599 1.00 0.00 H new ATOM 0 HA ASN C 31 4.965 5.492 -3.927 1.00 0.00 H new ATOM 0 HB2 ASN C 31 5.435 7.829 -4.628 1.00 0.00 H new ATOM 0 HB3 ASN C 31 7.105 7.417 -4.964 1.00 0.00 H new ATOM 0 HD21 ASN C 31 6.254 6.484 -8.297 1.00 0.00 H new ATOM 0 HD22 ASN C 31 7.400 7.255 -7.194 1.00 0.00 H new ATOM 1193 N ILE C 32 8.181 4.828 -4.256 1.00 0.00 N ATOM 1194 CA ILE C 32 9.121 3.799 -4.691 1.00 0.00 C ATOM 1195 C ILE C 32 8.863 2.490 -3.950 1.00 0.00 C ATOM 1196 O ILE C 32 8.854 1.416 -4.549 1.00 0.00 O ATOM 1197 CB ILE C 32 10.559 4.263 -4.436 1.00 0.00 C ATOM 1198 CG1 ILE C 32 10.880 5.446 -5.357 1.00 0.00 C ATOM 1199 CG2 ILE C 32 11.530 3.115 -4.728 1.00 0.00 C ATOM 1200 CD1 ILE C 32 12.209 6.075 -4.934 1.00 0.00 C ATOM 0 H ILE C 32 8.609 5.622 -3.780 1.00 0.00 H new ATOM 0 HA ILE C 32 8.980 3.631 -5.759 1.00 0.00 H new ATOM 0 HB ILE C 32 10.662 4.568 -3.395 1.00 0.00 H new ATOM 0 HG12 ILE C 32 10.938 5.110 -6.392 1.00 0.00 H new ATOM 0 HG13 ILE C 32 10.082 6.187 -5.307 1.00 0.00 H new ATOM 0 HG21 ILE C 32 12.552 3.448 -4.546 1.00 0.00 H new ATOM 0 HG22 ILE C 32 11.302 2.271 -4.077 1.00 0.00 H new ATOM 0 HG23 ILE C 32 11.428 2.808 -5.769 1.00 0.00 H new ATOM 0 HD11 ILE C 32 12.438 6.916 -5.588 1.00 0.00 H new ATOM 0 HD12 ILE C 32 12.134 6.426 -3.905 1.00 0.00 H new ATOM 0 HD13 ILE C 32 13.003 5.332 -5.007 1.00 0.00 H new ATOM 1212 N ILE C 33 8.657 2.591 -2.641 1.00 0.00 N ATOM 1213 CA ILE C 33 8.404 1.407 -1.827 1.00 0.00 C ATOM 1214 C ILE C 33 7.095 0.743 -2.237 1.00 0.00 C ATOM 1215 O ILE C 33 7.017 -0.480 -2.353 1.00 0.00 O ATOM 1216 CB ILE C 33 8.344 1.803 -0.347 1.00 0.00 C ATOM 1217 CG1 ILE C 33 9.736 2.245 0.121 1.00 0.00 C ATOM 1218 CG2 ILE C 33 7.891 0.601 0.489 1.00 0.00 C ATOM 1219 CD1 ILE C 33 9.612 2.996 1.447 1.00 0.00 C ATOM 0 H ILE C 33 8.660 3.471 -2.125 1.00 0.00 H new ATOM 0 HA ILE C 33 9.216 0.696 -1.982 1.00 0.00 H new ATOM 0 HB ILE C 33 7.636 2.623 -0.222 1.00 0.00 H new ATOM 0 HG12 ILE C 33 10.384 1.377 0.242 1.00 0.00 H new ATOM 0 HG13 ILE C 33 10.198 2.885 -0.630 1.00 0.00 H new ATOM 0 HG21 ILE C 33 7.849 0.884 1.541 1.00 0.00 H new ATOM 0 HG22 ILE C 33 6.903 0.281 0.160 1.00 0.00 H new ATOM 0 HG23 ILE C 33 8.599 -0.218 0.362 1.00 0.00 H new ATOM 0 HD11 ILE C 33 10.601 3.311 1.781 1.00 0.00 H new ATOM 0 HD12 ILE C 33 8.979 3.873 1.311 1.00 0.00 H new ATOM 0 HD13 ILE C 33 9.168 2.341 2.196 1.00 0.00 H new ATOM 1231 N GLY C 34 6.065 1.554 -2.451 1.00 0.00 N ATOM 1232 CA GLY C 34 4.763 1.026 -2.840 1.00 0.00 C ATOM 1233 C GLY C 34 4.851 0.279 -4.166 1.00 0.00 C ATOM 1234 O GLY C 34 4.347 -0.838 -4.297 1.00 0.00 O ATOM 0 H GLY C 34 6.105 2.569 -2.363 1.00 0.00 H new ATOM 0 HA2 GLY C 34 4.392 0.356 -2.065 1.00 0.00 H new ATOM 0 HA3 GLY C 34 4.046 1.843 -2.925 1.00 0.00 H new ATOM 1238 N ILE C 35 5.498 0.900 -5.144 1.00 0.00 N ATOM 1239 CA ILE C 35 5.650 0.286 -6.455 1.00 0.00 C ATOM 1240 C ILE C 35 6.476 -0.989 -6.345 1.00 0.00 C ATOM 1241 O ILE C 35 6.147 -2.006 -6.953 1.00 0.00 O ATOM 1242 CB ILE C 35 6.332 1.262 -7.420 1.00 0.00 C ATOM 1243 CG1 ILE C 35 5.394 2.439 -7.690 1.00 0.00 C ATOM 1244 CG2 ILE C 35 6.638 0.551 -8.741 1.00 0.00 C ATOM 1245 CD1 ILE C 35 6.160 3.554 -8.405 1.00 0.00 C ATOM 0 H ILE C 35 5.923 1.823 -5.055 1.00 0.00 H new ATOM 0 HA ILE C 35 4.661 0.038 -6.840 1.00 0.00 H new ATOM 0 HB ILE C 35 7.261 1.621 -6.977 1.00 0.00 H new ATOM 0 HG12 ILE C 35 4.552 2.113 -8.301 1.00 0.00 H new ATOM 0 HG13 ILE C 35 4.982 2.811 -6.752 1.00 0.00 H new ATOM 0 HG21 ILE C 35 7.123 1.247 -9.425 1.00 0.00 H new ATOM 0 HG22 ILE C 35 7.300 -0.295 -8.554 1.00 0.00 H new ATOM 0 HG23 ILE C 35 5.709 0.193 -9.185 1.00 0.00 H new ATOM 0 HD11 ILE C 35 5.489 4.392 -8.596 1.00 0.00 H new ATOM 0 HD12 ILE C 35 6.987 3.887 -7.778 1.00 0.00 H new ATOM 0 HD13 ILE C 35 6.550 3.179 -9.351 1.00 0.00 H new ATOM 1257 N LEU C 36 7.552 -0.926 -5.568 1.00 0.00 N ATOM 1258 CA LEU C 36 8.419 -2.083 -5.395 1.00 0.00 C ATOM 1259 C LEU C 36 7.638 -3.259 -4.819 1.00 0.00 C ATOM 1260 O LEU C 36 7.810 -4.400 -5.249 1.00 0.00 O ATOM 1261 CB LEU C 36 9.585 -1.731 -4.459 1.00 0.00 C ATOM 1262 CG LEU C 36 10.444 -2.977 -4.182 1.00 0.00 C ATOM 1263 CD1 LEU C 36 10.937 -3.583 -5.504 1.00 0.00 C ATOM 1264 CD2 LEU C 36 11.642 -2.581 -3.311 1.00 0.00 C ATOM 0 H LEU C 36 7.842 -0.094 -5.053 1.00 0.00 H new ATOM 0 HA LEU C 36 8.811 -2.367 -6.372 1.00 0.00 H new ATOM 0 HB2 LEU C 36 10.199 -0.951 -4.909 1.00 0.00 H new ATOM 0 HB3 LEU C 36 9.199 -1.331 -3.521 1.00 0.00 H new ATOM 0 HG LEU C 36 9.843 -3.721 -3.660 1.00 0.00 H new ATOM 0 HD11 LEU C 36 11.544 -4.464 -5.296 1.00 0.00 H new ATOM 0 HD12 LEU C 36 10.081 -3.868 -6.115 1.00 0.00 H new ATOM 0 HD13 LEU C 36 11.537 -2.848 -6.040 1.00 0.00 H new ATOM 0 HD21 LEU C 36 12.254 -3.461 -3.112 1.00 0.00 H new ATOM 0 HD22 LEU C 36 12.240 -1.834 -3.833 1.00 0.00 H new ATOM 0 HD23 LEU C 36 11.285 -2.166 -2.368 1.00 0.00 H new ATOM 1276 N HIS C 37 6.783 -2.975 -3.845 1.00 0.00 N ATOM 1277 CA HIS C 37 5.990 -4.019 -3.217 1.00 0.00 C ATOM 1278 C HIS C 37 5.137 -4.735 -4.257 1.00 0.00 C ATOM 1279 O HIS C 37 4.992 -5.957 -4.218 1.00 0.00 O ATOM 1280 CB HIS C 37 5.091 -3.412 -2.143 1.00 0.00 C ATOM 1281 CG HIS C 37 4.290 -4.507 -1.494 1.00 0.00 C ATOM 1282 ND1 HIS C 37 4.413 -4.819 -0.151 1.00 0.00 N ATOM 1283 CD2 HIS C 37 3.359 -5.379 -1.994 1.00 0.00 C ATOM 1284 CE1 HIS C 37 3.574 -5.838 0.103 1.00 0.00 C ATOM 1285 NE2 HIS C 37 2.905 -6.214 -0.984 1.00 0.00 N ATOM 0 H HIS C 37 6.623 -2.038 -3.476 1.00 0.00 H new ATOM 0 HA HIS C 37 6.665 -4.741 -2.757 1.00 0.00 H new ATOM 0 HB2 HIS C 37 5.694 -2.894 -1.397 1.00 0.00 H new ATOM 0 HB3 HIS C 37 4.425 -2.671 -2.585 1.00 0.00 H new ATOM 0 HD2 HIS C 37 3.028 -5.411 -3.022 1.00 0.00 H new ATOM 0 HE1 HIS C 37 3.457 -6.297 1.074 1.00 0.00 H new ATOM 0 HE2 HIS C 37 2.209 -6.956 -1.058 1.00 0.00 H new ATOM 1293 N LEU C 38 4.580 -3.968 -5.185 1.00 0.00 N ATOM 1294 CA LEU C 38 3.743 -4.545 -6.232 1.00 0.00 C ATOM 1295 C LEU C 38 4.538 -5.525 -7.079 1.00 0.00 C ATOM 1296 O LEU C 38 4.032 -6.573 -7.467 1.00 0.00 O ATOM 1297 CB LEU C 38 3.171 -3.421 -7.123 1.00 0.00 C ATOM 1298 CG LEU C 38 1.816 -2.934 -6.569 1.00 0.00 C ATOM 1299 CD1 LEU C 38 1.517 -1.522 -7.076 1.00 0.00 C ATOM 1300 CD2 LEU C 38 0.693 -3.881 -7.032 1.00 0.00 C ATOM 0 H LEU C 38 4.690 -2.955 -5.236 1.00 0.00 H new ATOM 0 HA LEU C 38 2.922 -5.086 -5.761 1.00 0.00 H new ATOM 0 HB2 LEU C 38 3.874 -2.589 -7.166 1.00 0.00 H new ATOM 0 HB3 LEU C 38 3.045 -3.785 -8.143 1.00 0.00 H new ATOM 0 HG LEU C 38 1.867 -2.926 -5.480 1.00 0.00 H new ATOM 0 HD11 LEU C 38 0.558 -1.188 -6.679 1.00 0.00 H new ATOM 0 HD12 LEU C 38 2.303 -0.843 -6.746 1.00 0.00 H new ATOM 0 HD13 LEU C 38 1.476 -1.528 -8.165 1.00 0.00 H new ATOM 0 HD21 LEU C 38 -0.262 -3.533 -6.638 1.00 0.00 H new ATOM 0 HD22 LEU C 38 0.654 -3.893 -8.121 1.00 0.00 H new ATOM 0 HD23 LEU C 38 0.892 -4.888 -6.665 1.00 0.00 H new ATOM 1312 N ILE C 39 5.777 -5.191 -7.376 1.00 0.00 N ATOM 1313 CA ILE C 39 6.591 -6.070 -8.190 1.00 0.00 C ATOM 1314 C ILE C 39 6.703 -7.444 -7.538 1.00 0.00 C ATOM 1315 O ILE C 39 6.501 -8.470 -8.187 1.00 0.00 O ATOM 1316 CB ILE C 39 7.983 -5.465 -8.362 1.00 0.00 C ATOM 1317 CG1 ILE C 39 7.854 -4.079 -9.006 1.00 0.00 C ATOM 1318 CG2 ILE C 39 8.833 -6.373 -9.249 1.00 0.00 C ATOM 1319 CD1 ILE C 39 9.220 -3.384 -9.040 1.00 0.00 C ATOM 0 H ILE C 39 6.236 -4.333 -7.072 1.00 0.00 H new ATOM 0 HA ILE C 39 6.120 -6.184 -9.167 1.00 0.00 H new ATOM 0 HB ILE C 39 8.464 -5.370 -7.389 1.00 0.00 H new ATOM 0 HG12 ILE C 39 7.461 -4.175 -10.018 1.00 0.00 H new ATOM 0 HG13 ILE C 39 7.143 -3.473 -8.444 1.00 0.00 H new ATOM 0 HG21 ILE C 39 9.825 -5.938 -9.370 1.00 0.00 H new ATOM 0 HG22 ILE C 39 8.921 -7.356 -8.785 1.00 0.00 H new ATOM 0 HG23 ILE C 39 8.360 -6.474 -10.226 1.00 0.00 H new ATOM 0 HD11 ILE C 39 9.117 -2.401 -9.499 1.00 0.00 H new ATOM 0 HD12 ILE C 39 9.597 -3.272 -8.023 1.00 0.00 H new ATOM 0 HD13 ILE C 39 9.919 -3.984 -9.622 1.00 0.00 H new ATOM 1331 N LEU C 40 7.026 -7.460 -6.251 1.00 0.00 N ATOM 1332 CA LEU C 40 7.159 -8.720 -5.529 1.00 0.00 C ATOM 1333 C LEU C 40 5.804 -9.387 -5.316 1.00 0.00 C ATOM 1334 O LEU C 40 5.662 -10.598 -5.473 1.00 0.00 O ATOM 1335 CB LEU C 40 7.838 -8.465 -4.178 1.00 0.00 C ATOM 1336 CG LEU C 40 9.358 -8.327 -4.373 1.00 0.00 C ATOM 1337 CD1 LEU C 40 9.992 -9.683 -4.765 1.00 0.00 C ATOM 1338 CD2 LEU C 40 9.629 -7.287 -5.471 1.00 0.00 C ATOM 0 H LEU C 40 7.199 -6.626 -5.690 1.00 0.00 H new ATOM 0 HA LEU C 40 7.770 -9.395 -6.128 1.00 0.00 H new ATOM 0 HB2 LEU C 40 7.437 -7.558 -3.725 1.00 0.00 H new ATOM 0 HB3 LEU C 40 7.624 -9.285 -3.493 1.00 0.00 H new ATOM 0 HG LEU C 40 9.807 -8.004 -3.434 1.00 0.00 H new ATOM 0 HD11 LEU C 40 11.067 -9.558 -4.897 1.00 0.00 H new ATOM 0 HD12 LEU C 40 9.806 -10.413 -3.977 1.00 0.00 H new ATOM 0 HD13 LEU C 40 9.551 -10.035 -5.697 1.00 0.00 H new ATOM 0 HD21 LEU C 40 10.704 -7.183 -5.616 1.00 0.00 H new ATOM 0 HD22 LEU C 40 9.167 -7.613 -6.403 1.00 0.00 H new ATOM 0 HD23 LEU C 40 9.208 -6.326 -5.174 1.00 0.00 H new ATOM 1350 N TRP C 41 4.813 -8.588 -4.942 1.00 0.00 N ATOM 1351 CA TRP C 41 3.480 -9.119 -4.695 1.00 0.00 C ATOM 1352 C TRP C 41 2.865 -9.661 -5.978 1.00 0.00 C ATOM 1353 O TRP C 41 2.188 -10.687 -5.965 1.00 0.00 O ATOM 1354 CB TRP C 41 2.588 -8.036 -4.083 1.00 0.00 C ATOM 1355 CG TRP C 41 1.196 -8.557 -3.934 1.00 0.00 C ATOM 1356 CD1 TRP C 41 0.753 -9.320 -2.906 1.00 0.00 C ATOM 1357 CD2 TRP C 41 0.044 -8.328 -4.793 1.00 0.00 C ATOM 1358 NE1 TRP C 41 -0.584 -9.606 -3.107 1.00 0.00 N ATOM 1359 CE2 TRP C 41 -1.068 -9.007 -4.250 1.00 0.00 C ATOM 1360 CE3 TRP C 41 -0.139 -7.608 -5.982 1.00 0.00 C ATOM 1361 CZ2 TRP C 41 -2.310 -8.975 -4.867 1.00 0.00 C ATOM 1362 CZ3 TRP C 41 -1.396 -7.567 -6.602 1.00 0.00 C ATOM 1363 CH2 TRP C 41 -2.478 -8.251 -6.041 1.00 0.00 C ATOM 0 H TRP C 41 4.905 -7.582 -4.804 1.00 0.00 H new ATOM 0 HA TRP C 41 3.562 -9.945 -3.989 1.00 0.00 H new ATOM 0 HB2 TRP C 41 2.980 -7.734 -3.112 1.00 0.00 H new ATOM 0 HB3 TRP C 41 2.589 -7.149 -4.717 1.00 0.00 H new ATOM 0 HD1 TRP C 41 1.347 -9.651 -2.067 1.00 0.00 H new ATOM 0 HE1 TRP C 41 -1.144 -10.189 -2.485 1.00 0.00 H new ATOM 0 HE3 TRP C 41 0.694 -7.081 -6.423 1.00 0.00 H new ATOM 0 HZ2 TRP C 41 -3.143 -9.511 -4.437 1.00 0.00 H new ATOM 0 HZ3 TRP C 41 -1.528 -7.006 -7.515 1.00 0.00 H new ATOM 0 HH2 TRP C 41 -3.445 -8.217 -6.520 1.00 0.00 H new ATOM 1374 N ILE C 42 3.104 -8.969 -7.083 1.00 0.00 N ATOM 1375 CA ILE C 42 2.564 -9.394 -8.368 1.00 0.00 C ATOM 1376 C ILE C 42 3.123 -10.765 -8.743 1.00 0.00 C ATOM 1377 O ILE C 42 2.384 -11.649 -9.175 1.00 0.00 O ATOM 1378 CB ILE C 42 2.929 -8.360 -9.455 1.00 0.00 C ATOM 1379 CG1 ILE C 42 1.999 -7.143 -9.348 1.00 0.00 C ATOM 1380 CG2 ILE C 42 2.790 -8.979 -10.851 1.00 0.00 C ATOM 1381 CD1 ILE C 42 2.583 -5.981 -10.152 1.00 0.00 C ATOM 0 H ILE C 42 3.664 -8.117 -7.117 1.00 0.00 H new ATOM 0 HA ILE C 42 1.479 -9.465 -8.292 1.00 0.00 H new ATOM 0 HB ILE C 42 3.963 -8.049 -9.304 1.00 0.00 H new ATOM 0 HG12 ILE C 42 1.007 -7.396 -9.723 1.00 0.00 H new ATOM 0 HG13 ILE C 42 1.881 -6.853 -8.304 1.00 0.00 H new ATOM 0 HG21 ILE C 42 3.051 -8.237 -11.606 1.00 0.00 H new ATOM 0 HG22 ILE C 42 3.459 -9.835 -10.938 1.00 0.00 H new ATOM 0 HG23 ILE C 42 1.761 -9.305 -11.004 1.00 0.00 H new ATOM 0 HD11 ILE C 42 1.922 -5.117 -10.076 1.00 0.00 H new ATOM 0 HD12 ILE C 42 3.565 -5.722 -9.757 1.00 0.00 H new ATOM 0 HD13 ILE C 42 2.678 -6.274 -11.198 1.00 0.00 H new ATOM 1393 N LEU C 43 4.426 -10.929 -8.581 1.00 0.00 N ATOM 1394 CA LEU C 43 5.073 -12.189 -8.915 1.00 0.00 C ATOM 1395 C LEU C 43 4.538 -13.308 -8.031 1.00 0.00 C ATOM 1396 O LEU C 43 4.356 -14.437 -8.484 1.00 0.00 O ATOM 1397 CB LEU C 43 6.587 -12.063 -8.740 1.00 0.00 C ATOM 1398 CG LEU C 43 7.156 -11.103 -9.799 1.00 0.00 C ATOM 1399 CD1 LEU C 43 8.594 -10.733 -9.420 1.00 0.00 C ATOM 1400 CD2 LEU C 43 7.146 -11.758 -11.197 1.00 0.00 C ATOM 0 H LEU C 43 5.054 -10.210 -8.222 1.00 0.00 H new ATOM 0 HA LEU C 43 4.854 -12.429 -9.955 1.00 0.00 H new ATOM 0 HB2 LEU C 43 6.817 -11.694 -7.740 1.00 0.00 H new ATOM 0 HB3 LEU C 43 7.056 -13.042 -8.834 1.00 0.00 H new ATOM 0 HG LEU C 43 6.533 -10.209 -9.832 1.00 0.00 H new ATOM 0 HD11 LEU C 43 9.003 -10.053 -10.167 1.00 0.00 H new ATOM 0 HD12 LEU C 43 8.600 -10.247 -8.444 1.00 0.00 H new ATOM 0 HD13 LEU C 43 9.203 -11.636 -9.379 1.00 0.00 H new ATOM 0 HD21 LEU C 43 7.553 -11.060 -11.929 1.00 0.00 H new ATOM 0 HD22 LEU C 43 7.755 -12.662 -11.180 1.00 0.00 H new ATOM 0 HD23 LEU C 43 6.123 -12.015 -11.471 1.00 0.00 H new ATOM 1412 N ASP C 44 4.288 -12.989 -6.771 1.00 0.00 N ATOM 1413 CA ASP C 44 3.776 -13.980 -5.840 1.00 0.00 C ATOM 1414 C ASP C 44 2.430 -14.519 -6.316 1.00 0.00 C ATOM 1415 O ASP C 44 2.170 -15.719 -6.232 1.00 0.00 O ATOM 1416 CB ASP C 44 3.616 -13.353 -4.456 1.00 0.00 C ATOM 1417 CG ASP C 44 3.120 -14.400 -3.465 1.00 0.00 C ATOM 1418 OD1 ASP C 44 2.794 -15.492 -3.900 1.00 0.00 O ATOM 1419 OD2 ASP C 44 3.071 -14.092 -2.286 1.00 0.00 O ATOM 0 H ASP C 44 4.430 -12.061 -6.373 1.00 0.00 H new ATOM 0 HA ASP C 44 4.485 -14.806 -5.788 1.00 0.00 H new ATOM 0 HB2 ASP C 44 4.569 -12.945 -4.120 1.00 0.00 H new ATOM 0 HB3 ASP C 44 2.912 -12.522 -4.503 1.00 0.00 H new ATOM 1424 N ARG C 45 1.579 -13.628 -6.813 1.00 0.00 N ATOM 1425 CA ARG C 45 0.265 -14.033 -7.296 1.00 0.00 C ATOM 1426 C ARG C 45 0.372 -14.659 -8.681 1.00 0.00 C ATOM 1427 O ARG C 45 -0.499 -15.423 -9.096 1.00 0.00 O ATOM 1428 CB ARG C 45 -0.666 -12.820 -7.357 1.00 0.00 C ATOM 1429 CG ARG C 45 -2.073 -13.267 -7.763 1.00 0.00 C ATOM 1430 CD ARG C 45 -3.015 -12.061 -7.758 1.00 0.00 C ATOM 1431 NE ARG C 45 -4.361 -12.474 -8.136 1.00 0.00 N ATOM 1432 CZ ARG C 45 -5.328 -11.579 -8.310 1.00 0.00 C ATOM 1433 NH1 ARG C 45 -5.080 -10.309 -8.151 1.00 0.00 N ATOM 1434 NH2 ARG C 45 -6.527 -11.974 -8.644 1.00 0.00 N ATOM 0 H ARG C 45 1.773 -12.630 -6.892 1.00 0.00 H new ATOM 0 HA ARG C 45 -0.142 -14.771 -6.605 1.00 0.00 H new ATOM 0 HB2 ARG C 45 -0.698 -12.325 -6.386 1.00 0.00 H new ATOM 0 HB3 ARG C 45 -0.284 -12.093 -8.074 1.00 0.00 H new ATOM 0 HG2 ARG C 45 -2.050 -13.719 -8.754 1.00 0.00 H new ATOM 0 HG3 ARG C 45 -2.437 -14.029 -7.073 1.00 0.00 H new ATOM 0 HD2 ARG C 45 -3.031 -11.606 -6.768 1.00 0.00 H new ATOM 0 HD3 ARG C 45 -2.651 -11.303 -8.451 1.00 0.00 H new ATOM 0 HE ARG C 45 -4.564 -13.465 -8.269 1.00 0.00 H new ATOM 0 HH11 ARG C 45 -4.143 -10.001 -7.893 1.00 0.00 H new ATOM 0 HH12 ARG C 45 -5.823 -9.624 -8.285 1.00 0.00 H new ATOM 0 HH21 ARG C 45 -6.720 -12.968 -8.771 1.00 0.00 H new ATOM 0 HH22 ARG C 45 -7.271 -11.289 -8.778 1.00 0.00 H new ATOM 1448 N LEU C 46 1.440 -14.329 -9.400 1.00 0.00 N ATOM 1449 CA LEU C 46 1.623 -14.869 -10.743 1.00 0.00 C ATOM 1450 C LEU C 46 1.740 -16.389 -10.696 1.00 0.00 C ATOM 1451 O LEU C 46 1.054 -17.095 -11.435 1.00 0.00 O ATOM 1452 CB LEU C 46 2.890 -14.276 -11.374 1.00 0.00 C ATOM 1453 CG LEU C 46 3.124 -14.870 -12.771 1.00 0.00 C ATOM 1454 CD1 LEU C 46 1.914 -14.593 -13.676 1.00 0.00 C ATOM 1455 CD2 LEU C 46 4.385 -14.242 -13.381 1.00 0.00 C ATOM 0 H LEU C 46 2.180 -13.702 -9.083 1.00 0.00 H new ATOM 0 HA LEU C 46 0.756 -14.601 -11.346 1.00 0.00 H new ATOM 0 HB2 LEU C 46 2.795 -13.192 -11.444 1.00 0.00 H new ATOM 0 HB3 LEU C 46 3.750 -14.480 -10.737 1.00 0.00 H new ATOM 0 HG LEU C 46 3.255 -15.949 -12.686 1.00 0.00 H new ATOM 0 HD11 LEU C 46 2.093 -15.019 -14.663 1.00 0.00 H new ATOM 0 HD12 LEU C 46 1.023 -15.046 -13.241 1.00 0.00 H new ATOM 0 HD13 LEU C 46 1.766 -13.517 -13.767 1.00 0.00 H new ATOM 0 HD21 LEU C 46 4.556 -14.660 -14.373 1.00 0.00 H new ATOM 0 HD22 LEU C 46 4.252 -13.163 -13.460 1.00 0.00 H new ATOM 0 HD23 LEU C 46 5.243 -14.457 -12.744 1.00 0.00 H new ATOM 1467 N PHE C 47 2.611 -16.883 -9.825 1.00 0.00 N ATOM 1468 CA PHE C 47 2.811 -18.322 -9.690 1.00 0.00 C ATOM 1469 C PHE C 47 1.636 -18.965 -8.965 1.00 0.00 C ATOM 1470 O PHE C 47 1.222 -20.076 -9.298 1.00 0.00 O ATOM 1471 CB PHE C 47 4.115 -18.599 -8.935 1.00 0.00 C ATOM 1472 CG PHE C 47 5.293 -18.366 -9.858 1.00 0.00 C ATOM 1473 CD1 PHE C 47 5.661 -17.061 -10.205 1.00 0.00 C ATOM 1474 CD2 PHE C 47 6.016 -19.453 -10.364 1.00 0.00 C ATOM 1475 CE1 PHE C 47 6.749 -16.843 -11.059 1.00 0.00 C ATOM 1476 CE2 PHE C 47 7.105 -19.237 -11.215 1.00 0.00 C ATOM 1477 CZ PHE C 47 7.472 -17.931 -11.563 1.00 0.00 C ATOM 0 H PHE C 47 3.187 -16.314 -9.205 1.00 0.00 H new ATOM 0 HA PHE C 47 2.876 -18.758 -10.687 1.00 0.00 H new ATOM 0 HB2 PHE C 47 4.188 -17.948 -8.063 1.00 0.00 H new ATOM 0 HB3 PHE C 47 4.124 -19.625 -8.568 1.00 0.00 H new ATOM 0 HD1 PHE C 47 5.105 -16.222 -9.814 1.00 0.00 H new ATOM 0 HD2 PHE C 47 5.732 -20.460 -10.097 1.00 0.00 H new ATOM 0 HE1 PHE C 47 7.030 -15.836 -11.329 1.00 0.00 H new ATOM 0 HE2 PHE C 47 7.662 -20.077 -11.603 1.00 0.00 H new ATOM 0 HZ PHE C 47 8.313 -17.763 -12.220 1.00 0.00 H new ATOM 1487 N PHE C 48 1.109 -18.263 -7.964 1.00 0.00 N ATOM 1488 CA PHE C 48 -0.014 -18.771 -7.181 1.00 0.00 C ATOM 1489 C PHE C 48 -1.316 -18.122 -7.633 1.00 0.00 C ATOM 1490 O PHE C 48 -1.483 -16.906 -7.543 1.00 0.00 O ATOM 1491 CB PHE C 48 0.222 -18.473 -5.698 1.00 0.00 C ATOM 1492 CG PHE C 48 1.271 -19.417 -5.152 1.00 0.00 C ATOM 1493 CD1 PHE C 48 2.623 -19.208 -5.453 1.00 0.00 C ATOM 1494 CD2 PHE C 48 0.890 -20.500 -4.352 1.00 0.00 C ATOM 1495 CE1 PHE C 48 3.594 -20.083 -4.951 1.00 0.00 C ATOM 1496 CE2 PHE C 48 1.862 -21.374 -3.849 1.00 0.00 C ATOM 1497 CZ PHE C 48 3.214 -21.167 -4.148 1.00 0.00 C ATOM 0 H PHE C 48 1.441 -17.342 -7.677 1.00 0.00 H new ATOM 0 HA PHE C 48 -0.090 -19.848 -7.332 1.00 0.00 H new ATOM 0 HB2 PHE C 48 0.546 -17.440 -5.571 1.00 0.00 H new ATOM 0 HB3 PHE C 48 -0.708 -18.586 -5.141 1.00 0.00 H new ATOM 0 HD1 PHE C 48 2.916 -18.373 -6.072 1.00 0.00 H new ATOM 0 HD2 PHE C 48 -0.153 -20.662 -4.123 1.00 0.00 H new ATOM 0 HE1 PHE C 48 4.637 -19.922 -5.183 1.00 0.00 H new ATOM 0 HE2 PHE C 48 1.568 -22.209 -3.230 1.00 0.00 H new ATOM 0 HZ PHE C 48 3.963 -21.842 -3.760 1.00 0.00 H new ATOM 1507 N LYS C 49 -2.238 -18.948 -8.118 1.00 0.00 N ATOM 1508 CA LYS C 49 -3.527 -18.452 -8.581 1.00 0.00 C ATOM 1509 C LYS C 49 -4.561 -19.574 -8.579 1.00 0.00 C ATOM 1510 O LYS C 49 -4.168 -20.714 -8.755 1.00 0.00 O ATOM 1511 CB LYS C 49 -3.388 -17.879 -9.993 1.00 0.00 C ATOM 1512 CG LYS C 49 -4.720 -17.267 -10.429 1.00 0.00 C ATOM 1513 CD LYS C 49 -4.559 -16.624 -11.807 1.00 0.00 C ATOM 1514 CE LYS C 49 -5.888 -15.997 -12.235 1.00 0.00 C ATOM 1515 NZ LYS C 49 -5.722 -15.335 -13.559 1.00 0.00 N ATOM 1516 OXT LYS C 49 -5.730 -19.274 -8.402 1.00 0.00 O ATOM 0 H LYS C 49 -2.117 -19.957 -8.200 1.00 0.00 H new ATOM 0 HA LYS C 49 -3.861 -17.666 -7.904 1.00 0.00 H new ATOM 0 HB2 LYS C 49 -2.604 -17.122 -10.014 1.00 0.00 H new ATOM 0 HB3 LYS C 49 -3.092 -18.665 -10.688 1.00 0.00 H new ATOM 0 HG2 LYS C 49 -5.492 -18.036 -10.463 1.00 0.00 H new ATOM 0 HG3 LYS C 49 -5.044 -16.521 -9.703 1.00 0.00 H new ATOM 0 HD2 LYS C 49 -3.779 -15.863 -11.776 1.00 0.00 H new ATOM 0 HD3 LYS C 49 -4.246 -17.372 -12.535 1.00 0.00 H new ATOM 0 HE2 LYS C 49 -6.661 -16.763 -12.294 1.00 0.00 H new ATOM 0 HE3 LYS C 49 -6.215 -15.270 -11.492 1.00 0.00 H new ATOM 0 HZ1 LYS C 49 -6.625 -14.909 -13.850 1.00 0.00 H new ATOM 0 HZ2 LYS C 49 -4.996 -14.593 -13.488 1.00 0.00 H new ATOM 0 HZ3 LYS C 49 -5.428 -16.040 -14.265 1.00 0.00 H new TER 1530 LYS C 49 ATOM 1531 N SER D 19 7.417 26.265 6.616 1.00 0.00 N ATOM 1532 CA SER D 19 7.551 26.155 5.137 1.00 0.00 C ATOM 1533 C SER D 19 7.610 24.684 4.740 1.00 0.00 C ATOM 1534 O SER D 19 7.276 24.322 3.613 1.00 0.00 O ATOM 1535 CB SER D 19 8.829 26.865 4.689 1.00 0.00 C ATOM 1536 OG SER D 19 9.120 26.503 3.345 1.00 0.00 O ATOM 0 HA SER D 19 6.692 26.622 4.655 1.00 0.00 H new ATOM 0 HB2 SER D 19 8.706 27.945 4.768 1.00 0.00 H new ATOM 0 HB3 SER D 19 9.659 26.590 5.340 1.00 0.00 H new ATOM 0 HG SER D 19 9.938 26.957 3.054 1.00 0.00 H new ATOM 1544 N ASN D 20 8.041 23.839 5.675 1.00 0.00 N ATOM 1545 CA ASN D 20 8.143 22.406 5.414 1.00 0.00 C ATOM 1546 C ASN D 20 6.828 21.706 5.746 1.00 0.00 C ATOM 1547 O ASN D 20 6.515 21.477 6.916 1.00 0.00 O ATOM 1548 CB ASN D 20 9.267 21.802 6.258 1.00 0.00 C ATOM 1549 CG ASN D 20 9.481 20.343 5.873 1.00 0.00 C ATOM 1550 OD1 ASN D 20 9.390 19.991 4.696 1.00 0.00 O ATOM 1551 ND2 ASN D 20 9.757 19.469 6.801 1.00 0.00 N ATOM 0 H ASN D 20 8.323 24.120 6.614 1.00 0.00 H new ATOM 0 HA ASN D 20 8.363 22.263 4.356 1.00 0.00 H new ATOM 0 HB2 ASN D 20 10.188 22.365 6.108 1.00 0.00 H new ATOM 0 HB3 ASN D 20 9.017 21.875 7.317 1.00 0.00 H new ATOM 0 HD21 ASN D 20 9.898 18.490 6.553 1.00 0.00 H new ATOM 0 HD22 ASN D 20 9.831 19.765 7.774 1.00 0.00 H new ATOM 1558 N ASP D 21 6.066 21.368 4.711 1.00 0.00 N ATOM 1559 CA ASP D 21 4.787 20.693 4.901 1.00 0.00 C ATOM 1560 C ASP D 21 4.999 19.196 5.109 1.00 0.00 C ATOM 1561 O ASP D 21 4.059 18.462 5.417 1.00 0.00 O ATOM 1562 CB ASP D 21 3.891 20.917 3.681 1.00 0.00 C ATOM 1563 CG ASP D 21 2.480 20.425 3.977 1.00 0.00 C ATOM 1564 OD1 ASP D 21 2.175 20.222 5.139 1.00 0.00 O ATOM 1565 OD2 ASP D 21 1.722 20.260 3.033 1.00 0.00 O ATOM 0 H ASP D 21 6.310 21.549 3.737 1.00 0.00 H new ATOM 0 HA ASP D 21 4.306 21.109 5.786 1.00 0.00 H new ATOM 0 HB2 ASP D 21 3.870 21.976 3.424 1.00 0.00 H new ATOM 0 HB3 ASP D 21 4.297 20.388 2.819 1.00 0.00 H new ATOM 1570 N SER D 22 6.238 18.750 4.942 1.00 0.00 N ATOM 1571 CA SER D 22 6.568 17.339 5.114 1.00 0.00 C ATOM 1572 C SER D 22 6.253 16.888 6.534 1.00 0.00 C ATOM 1573 O SER D 22 5.863 15.742 6.762 1.00 0.00 O ATOM 1574 CB SER D 22 8.049 17.104 4.816 1.00 0.00 C ATOM 1575 OG SER D 22 8.269 17.219 3.418 1.00 0.00 O ATOM 0 H SER D 22 7.029 19.342 4.689 1.00 0.00 H new ATOM 0 HA SER D 22 5.965 16.757 4.417 1.00 0.00 H new ATOM 0 HB2 SER D 22 8.660 17.830 5.353 1.00 0.00 H new ATOM 0 HB3 SER D 22 8.350 16.115 5.163 1.00 0.00 H new ATOM 0 HG SER D 22 7.823 16.479 2.955 1.00 0.00 H new ATOM 1581 N SER D 23 6.431 17.794 7.488 1.00 0.00 N ATOM 1582 CA SER D 23 6.165 17.480 8.883 1.00 0.00 C ATOM 1583 C SER D 23 4.746 16.957 9.043 1.00 0.00 C ATOM 1584 O SER D 23 4.411 16.356 10.061 1.00 0.00 O ATOM 1585 CB SER D 23 6.345 18.727 9.749 1.00 0.00 C ATOM 1586 OG SER D 23 6.146 18.384 11.115 1.00 0.00 O ATOM 0 H SER D 23 6.757 18.746 7.321 1.00 0.00 H new ATOM 0 HA SER D 23 6.870 16.713 9.204 1.00 0.00 H new ATOM 0 HB2 SER D 23 7.344 19.141 9.608 1.00 0.00 H new ATOM 0 HB3 SER D 23 5.635 19.498 9.449 1.00 0.00 H new ATOM 0 HG SER D 23 5.489 17.660 11.178 1.00 0.00 H new ATOM 1592 N ASP D 24 3.912 17.195 8.030 1.00 0.00 N ATOM 1593 CA ASP D 24 2.523 16.751 8.075 1.00 0.00 C ATOM 1594 C ASP D 24 2.431 15.330 8.655 1.00 0.00 C ATOM 1595 O ASP D 24 2.758 14.360 7.973 1.00 0.00 O ATOM 1596 CB ASP D 24 1.918 16.757 6.669 1.00 0.00 C ATOM 1597 CG ASP D 24 0.451 16.344 6.744 1.00 0.00 C ATOM 1598 OD1 ASP D 24 -0.026 16.136 7.848 1.00 0.00 O ATOM 1599 OD2 ASP D 24 -0.174 16.249 5.701 1.00 0.00 O ATOM 0 H ASP D 24 4.173 17.689 7.176 1.00 0.00 H new ATOM 0 HA ASP D 24 1.968 17.438 8.714 1.00 0.00 H new ATOM 0 HB2 ASP D 24 2.005 17.750 6.228 1.00 0.00 H new ATOM 0 HB3 ASP D 24 2.467 16.072 6.023 1.00 0.00 H new ATOM 1604 N PRO D 25 2.006 15.187 9.895 1.00 0.00 N ATOM 1605 CA PRO D 25 1.893 13.847 10.550 1.00 0.00 C ATOM 1606 C PRO D 25 1.113 12.851 9.696 1.00 0.00 C ATOM 1607 O PRO D 25 1.399 11.654 9.702 1.00 0.00 O ATOM 1608 CB PRO D 25 1.150 14.138 11.866 1.00 0.00 C ATOM 1609 CG PRO D 25 1.423 15.577 12.163 1.00 0.00 C ATOM 1610 CD PRO D 25 1.584 16.268 10.811 1.00 0.00 C ATOM 0 HA PRO D 25 2.870 13.387 10.701 1.00 0.00 H new ATOM 0 HB2 PRO D 25 0.081 13.954 11.763 1.00 0.00 H new ATOM 0 HB3 PRO D 25 1.508 13.496 12.670 1.00 0.00 H new ATOM 0 HG2 PRO D 25 0.605 16.019 12.731 1.00 0.00 H new ATOM 0 HG3 PRO D 25 2.325 15.686 12.766 1.00 0.00 H new ATOM 0 HD2 PRO D 25 0.650 16.724 10.484 1.00 0.00 H new ATOM 0 HD3 PRO D 25 2.328 17.063 10.857 1.00 0.00 H new ATOM 1618 N LEU D 26 0.110 13.346 8.986 1.00 0.00 N ATOM 1619 CA LEU D 26 -0.715 12.475 8.165 1.00 0.00 C ATOM 1620 C LEU D 26 0.136 11.792 7.094 1.00 0.00 C ATOM 1621 O LEU D 26 0.060 10.578 6.907 1.00 0.00 O ATOM 1622 CB LEU D 26 -1.833 13.304 7.499 1.00 0.00 C ATOM 1623 CG LEU D 26 -3.085 12.437 7.272 1.00 0.00 C ATOM 1624 CD1 LEU D 26 -2.709 11.180 6.472 1.00 0.00 C ATOM 1625 CD2 LEU D 26 -3.708 12.036 8.634 1.00 0.00 C ATOM 0 H LEU D 26 -0.149 14.332 8.962 1.00 0.00 H new ATOM 0 HA LEU D 26 -1.160 11.707 8.797 1.00 0.00 H new ATOM 0 HB2 LEU D 26 -2.084 14.158 8.128 1.00 0.00 H new ATOM 0 HB3 LEU D 26 -1.481 13.701 6.547 1.00 0.00 H new ATOM 0 HG LEU D 26 -3.819 13.011 6.707 1.00 0.00 H new ATOM 0 HD11 LEU D 26 -3.598 10.570 6.314 1.00 0.00 H new ATOM 0 HD12 LEU D 26 -2.294 11.473 5.508 1.00 0.00 H new ATOM 0 HD13 LEU D 26 -1.968 10.604 7.026 1.00 0.00 H new ATOM 0 HD21 LEU D 26 -4.593 11.423 8.463 1.00 0.00 H new ATOM 0 HD22 LEU D 26 -2.980 11.469 9.214 1.00 0.00 H new ATOM 0 HD23 LEU D 26 -3.990 12.934 9.184 1.00 0.00 H new ATOM 1637 N VAL D 27 0.946 12.578 6.404 1.00 0.00 N ATOM 1638 CA VAL D 27 1.802 12.036 5.364 1.00 0.00 C ATOM 1639 C VAL D 27 2.832 11.085 5.966 1.00 0.00 C ATOM 1640 O VAL D 27 3.096 10.013 5.422 1.00 0.00 O ATOM 1641 CB VAL D 27 2.506 13.170 4.622 1.00 0.00 C ATOM 1642 CG1 VAL D 27 3.489 12.586 3.605 1.00 0.00 C ATOM 1643 CG2 VAL D 27 1.463 14.019 3.890 1.00 0.00 C ATOM 0 H VAL D 27 1.028 13.585 6.544 1.00 0.00 H new ATOM 0 HA VAL D 27 1.185 11.480 4.658 1.00 0.00 H new ATOM 0 HB VAL D 27 3.049 13.789 5.336 1.00 0.00 H new ATOM 0 HG11 VAL D 27 3.990 13.397 3.077 1.00 0.00 H new ATOM 0 HG12 VAL D 27 4.230 11.978 4.123 1.00 0.00 H new ATOM 0 HG13 VAL D 27 2.948 11.967 2.890 1.00 0.00 H new ATOM 0 HG21 VAL D 27 1.962 14.830 3.359 1.00 0.00 H new ATOM 0 HG22 VAL D 27 0.923 13.396 3.177 1.00 0.00 H new ATOM 0 HG23 VAL D 27 0.761 14.436 4.612 1.00 0.00 H new ATOM 1653 N VAL D 28 3.413 11.495 7.087 1.00 0.00 N ATOM 1654 CA VAL D 28 4.420 10.682 7.756 1.00 0.00 C ATOM 1655 C VAL D 28 3.826 9.348 8.200 1.00 0.00 C ATOM 1656 O VAL D 28 4.442 8.296 8.023 1.00 0.00 O ATOM 1657 CB VAL D 28 4.969 11.428 8.974 1.00 0.00 C ATOM 1658 CG1 VAL D 28 5.956 10.528 9.721 1.00 0.00 C ATOM 1659 CG2 VAL D 28 5.682 12.701 8.514 1.00 0.00 C ATOM 0 H VAL D 28 3.206 12.380 7.549 1.00 0.00 H new ATOM 0 HA VAL D 28 5.229 10.490 7.052 1.00 0.00 H new ATOM 0 HB VAL D 28 4.147 11.694 9.639 1.00 0.00 H new ATOM 0 HG11 VAL D 28 6.347 11.059 10.589 1.00 0.00 H new ATOM 0 HG12 VAL D 28 5.446 9.622 10.049 1.00 0.00 H new ATOM 0 HG13 VAL D 28 6.779 10.261 9.058 1.00 0.00 H new ATOM 0 HG21 VAL D 28 6.073 13.233 9.381 1.00 0.00 H new ATOM 0 HG22 VAL D 28 6.504 12.437 7.849 1.00 0.00 H new ATOM 0 HG23 VAL D 28 4.977 13.341 7.984 1.00 0.00 H new ATOM 1669 N ALA D 29 2.631 9.398 8.778 1.00 0.00 N ATOM 1670 CA ALA D 29 1.972 8.186 9.245 1.00 0.00 C ATOM 1671 C ALA D 29 1.771 7.209 8.091 1.00 0.00 C ATOM 1672 O ALA D 29 1.945 6.002 8.252 1.00 0.00 O ATOM 1673 CB ALA D 29 0.613 8.533 9.858 1.00 0.00 C ATOM 0 H ALA D 29 2.103 10.257 8.933 1.00 0.00 H new ATOM 0 HA ALA D 29 2.605 7.719 10.000 1.00 0.00 H new ATOM 0 HB1 ALA D 29 0.127 7.621 10.205 1.00 0.00 H new ATOM 0 HB2 ALA D 29 0.756 9.211 10.700 1.00 0.00 H new ATOM 0 HB3 ALA D 29 -0.013 9.015 9.107 1.00 0.00 H new ATOM 1679 N ALA D 30 1.412 7.736 6.927 1.00 0.00 N ATOM 1680 CA ALA D 30 1.194 6.890 5.761 1.00 0.00 C ATOM 1681 C ALA D 30 2.461 6.114 5.414 1.00 0.00 C ATOM 1682 O ALA D 30 2.411 4.912 5.152 1.00 0.00 O ATOM 1683 CB ALA D 30 0.776 7.748 4.567 1.00 0.00 C ATOM 0 H ALA D 30 1.267 8.733 6.766 1.00 0.00 H new ATOM 0 HA ALA D 30 0.401 6.179 5.995 1.00 0.00 H new ATOM 0 HB1 ALA D 30 0.615 7.109 3.699 1.00 0.00 H new ATOM 0 HB2 ALA D 30 -0.147 8.277 4.805 1.00 0.00 H new ATOM 0 HB3 ALA D 30 1.562 8.470 4.345 1.00 0.00 H new ATOM 1689 N ASN D 31 3.595 6.807 5.409 1.00 0.00 N ATOM 1690 CA ASN D 31 4.864 6.168 5.089 1.00 0.00 C ATOM 1691 C ASN D 31 5.225 5.122 6.140 1.00 0.00 C ATOM 1692 O ASN D 31 5.681 4.026 5.809 1.00 0.00 O ATOM 1693 CB ASN D 31 5.971 7.219 5.022 1.00 0.00 C ATOM 1694 CG ASN D 31 7.309 6.551 4.721 1.00 0.00 C ATOM 1695 OD1 ASN D 31 7.431 5.817 3.742 1.00 0.00 O ATOM 1696 ND2 ASN D 31 8.326 6.767 5.511 1.00 0.00 N ATOM 0 H ASN D 31 3.661 7.803 5.621 1.00 0.00 H new ATOM 0 HA ASN D 31 4.764 5.675 4.122 1.00 0.00 H new ATOM 0 HB2 ASN D 31 5.740 7.953 4.250 1.00 0.00 H new ATOM 0 HB3 ASN D 31 6.029 7.758 5.967 1.00 0.00 H new ATOM 0 HD21 ASN D 31 9.225 6.326 5.317 1.00 0.00 H new ATOM 0 HD22 ASN D 31 8.221 7.376 6.322 1.00 0.00 H new ATOM 1703 N ILE D 32 5.024 5.468 7.408 1.00 0.00 N ATOM 1704 CA ILE D 32 5.337 4.551 8.498 1.00 0.00 C ATOM 1705 C ILE D 32 4.448 3.313 8.428 1.00 0.00 C ATOM 1706 O ILE D 32 4.918 2.186 8.590 1.00 0.00 O ATOM 1707 CB ILE D 32 5.142 5.254 9.845 1.00 0.00 C ATOM 1708 CG1 ILE D 32 6.194 6.356 10.001 1.00 0.00 C ATOM 1709 CG2 ILE D 32 5.299 4.240 10.984 1.00 0.00 C ATOM 1710 CD1 ILE D 32 5.847 7.227 11.209 1.00 0.00 C ATOM 0 H ILE D 32 4.649 6.369 7.704 1.00 0.00 H new ATOM 0 HA ILE D 32 6.377 4.240 8.401 1.00 0.00 H new ATOM 0 HB ILE D 32 4.144 5.690 9.883 1.00 0.00 H new ATOM 0 HG12 ILE D 32 7.182 5.914 10.130 1.00 0.00 H new ATOM 0 HG13 ILE D 32 6.233 6.966 9.099 1.00 0.00 H new ATOM 0 HG21 ILE D 32 5.160 4.743 11.941 1.00 0.00 H new ATOM 0 HG22 ILE D 32 4.553 3.453 10.876 1.00 0.00 H new ATOM 0 HG23 ILE D 32 6.296 3.802 10.946 1.00 0.00 H new ATOM 0 HD11 ILE D 32 6.596 8.011 11.319 1.00 0.00 H new ATOM 0 HD12 ILE D 32 4.867 7.680 11.061 1.00 0.00 H new ATOM 0 HD13 ILE D 32 5.831 6.612 12.109 1.00 0.00 H new ATOM 1722 N ILE D 33 3.159 3.530 8.188 1.00 0.00 N ATOM 1723 CA ILE D 33 2.211 2.426 8.104 1.00 0.00 C ATOM 1724 C ILE D 33 2.540 1.528 6.914 1.00 0.00 C ATOM 1725 O ILE D 33 2.514 0.302 7.024 1.00 0.00 O ATOM 1726 CB ILE D 33 0.787 2.975 7.963 1.00 0.00 C ATOM 1727 CG1 ILE D 33 0.376 3.669 9.266 1.00 0.00 C ATOM 1728 CG2 ILE D 33 -0.182 1.826 7.679 1.00 0.00 C ATOM 1729 CD1 ILE D 33 -0.857 4.539 9.013 1.00 0.00 C ATOM 0 H ILE D 33 2.749 4.454 8.049 1.00 0.00 H new ATOM 0 HA ILE D 33 2.282 1.834 9.017 1.00 0.00 H new ATOM 0 HB ILE D 33 0.757 3.689 7.140 1.00 0.00 H new ATOM 0 HG12 ILE D 33 0.159 2.926 10.034 1.00 0.00 H new ATOM 0 HG13 ILE D 33 1.197 4.282 9.639 1.00 0.00 H new ATOM 0 HG21 ILE D 33 -1.194 2.219 7.579 1.00 0.00 H new ATOM 0 HG22 ILE D 33 0.106 1.327 6.754 1.00 0.00 H new ATOM 0 HG23 ILE D 33 -0.150 1.111 8.501 1.00 0.00 H new ATOM 0 HD11 ILE D 33 -1.150 5.033 9.939 1.00 0.00 H new ATOM 0 HD12 ILE D 33 -0.623 5.291 8.259 1.00 0.00 H new ATOM 0 HD13 ILE D 33 -1.677 3.914 8.660 1.00 0.00 H new ATOM 1741 N GLY D 34 2.847 2.143 5.778 1.00 0.00 N ATOM 1742 CA GLY D 34 3.169 1.384 4.576 1.00 0.00 C ATOM 1743 C GLY D 34 4.399 0.511 4.797 1.00 0.00 C ATOM 1744 O GLY D 34 4.401 -0.676 4.470 1.00 0.00 O ATOM 0 H GLY D 34 2.880 3.156 5.664 1.00 0.00 H new ATOM 0 HA2 GLY D 34 2.320 0.760 4.297 1.00 0.00 H new ATOM 0 HA3 GLY D 34 3.348 2.068 3.746 1.00 0.00 H new ATOM 1748 N ILE D 35 5.443 1.109 5.360 1.00 0.00 N ATOM 1749 CA ILE D 35 6.677 0.378 5.626 1.00 0.00 C ATOM 1750 C ILE D 35 6.419 -0.735 6.632 1.00 0.00 C ATOM 1751 O ILE D 35 6.908 -1.853 6.472 1.00 0.00 O ATOM 1752 CB ILE D 35 7.745 1.330 6.168 1.00 0.00 C ATOM 1753 CG1 ILE D 35 8.152 2.311 5.068 1.00 0.00 C ATOM 1754 CG2 ILE D 35 8.977 0.527 6.602 1.00 0.00 C ATOM 1755 CD1 ILE D 35 8.993 3.438 5.666 1.00 0.00 C ATOM 0 H ILE D 35 5.461 2.090 5.639 1.00 0.00 H new ATOM 0 HA ILE D 35 7.032 -0.061 4.694 1.00 0.00 H new ATOM 0 HB ILE D 35 7.343 1.875 7.022 1.00 0.00 H new ATOM 0 HG12 ILE D 35 8.720 1.791 4.296 1.00 0.00 H new ATOM 0 HG13 ILE D 35 7.264 2.723 4.588 1.00 0.00 H new ATOM 0 HG21 ILE D 35 9.737 1.207 6.988 1.00 0.00 H new ATOM 0 HG22 ILE D 35 8.694 -0.181 7.381 1.00 0.00 H new ATOM 0 HG23 ILE D 35 9.377 -0.016 5.746 1.00 0.00 H new ATOM 0 HD11 ILE D 35 9.281 4.135 4.878 1.00 0.00 H new ATOM 0 HD12 ILE D 35 8.410 3.965 6.422 1.00 0.00 H new ATOM 0 HD13 ILE D 35 9.889 3.019 6.125 1.00 0.00 H new ATOM 1767 N LEU D 36 5.652 -0.422 7.670 1.00 0.00 N ATOM 1768 CA LEU D 36 5.347 -1.406 8.700 1.00 0.00 C ATOM 1769 C LEU D 36 4.640 -2.613 8.094 1.00 0.00 C ATOM 1770 O LEU D 36 4.935 -3.757 8.442 1.00 0.00 O ATOM 1771 CB LEU D 36 4.459 -0.778 9.783 1.00 0.00 C ATOM 1772 CG LEU D 36 4.042 -1.840 10.814 1.00 0.00 C ATOM 1773 CD1 LEU D 36 5.287 -2.511 11.415 1.00 0.00 C ATOM 1774 CD2 LEU D 36 3.228 -1.170 11.927 1.00 0.00 C ATOM 0 H LEU D 36 5.234 0.496 7.820 1.00 0.00 H new ATOM 0 HA LEU D 36 6.284 -1.735 9.149 1.00 0.00 H new ATOM 0 HB2 LEU D 36 4.996 0.030 10.280 1.00 0.00 H new ATOM 0 HB3 LEU D 36 3.573 -0.338 9.326 1.00 0.00 H new ATOM 0 HG LEU D 36 3.436 -2.601 10.322 1.00 0.00 H new ATOM 0 HD11 LEU D 36 4.980 -3.261 12.144 1.00 0.00 H new ATOM 0 HD12 LEU D 36 5.861 -2.989 10.622 1.00 0.00 H new ATOM 0 HD13 LEU D 36 5.904 -1.759 11.907 1.00 0.00 H new ATOM 0 HD21 LEU D 36 2.930 -1.919 12.661 1.00 0.00 H new ATOM 0 HD22 LEU D 36 3.836 -0.407 12.413 1.00 0.00 H new ATOM 0 HD23 LEU D 36 2.339 -0.707 11.499 1.00 0.00 H new ATOM 1786 N HIS D 37 3.706 -2.352 7.190 1.00 0.00 N ATOM 1787 CA HIS D 37 2.959 -3.423 6.549 1.00 0.00 C ATOM 1788 C HIS D 37 3.907 -4.375 5.831 1.00 0.00 C ATOM 1789 O HIS D 37 3.725 -5.592 5.867 1.00 0.00 O ATOM 1790 CB HIS D 37 1.968 -2.840 5.547 1.00 0.00 C ATOM 1791 CG HIS D 37 1.192 -3.959 4.913 1.00 0.00 C ATOM 1792 ND1 HIS D 37 -0.177 -4.093 5.062 1.00 0.00 N ATOM 1793 CD2 HIS D 37 1.584 -5.014 4.128 1.00 0.00 C ATOM 1794 CE1 HIS D 37 -0.553 -5.190 4.384 1.00 0.00 C ATOM 1795 NE2 HIS D 37 0.481 -5.787 3.794 1.00 0.00 N ATOM 0 H HIS D 37 3.449 -1.413 6.886 1.00 0.00 H new ATOM 0 HA HIS D 37 2.416 -3.974 7.317 1.00 0.00 H new ATOM 0 HB2 HIS D 37 1.290 -2.149 6.048 1.00 0.00 H new ATOM 0 HB3 HIS D 37 2.497 -2.270 4.783 1.00 0.00 H new ATOM 0 HD2 HIS D 37 2.599 -5.213 3.817 1.00 0.00 H new ATOM 0 HE1 HIS D 37 -1.571 -5.545 4.325 1.00 0.00 H new ATOM 0 HE2 HIS D 37 0.466 -6.630 3.220 1.00 0.00 H new ATOM 1803 N LEU D 38 4.919 -3.815 5.185 1.00 0.00 N ATOM 1804 CA LEU D 38 5.892 -4.625 4.459 1.00 0.00 C ATOM 1805 C LEU D 38 6.621 -5.567 5.406 1.00 0.00 C ATOM 1806 O LEU D 38 6.881 -6.717 5.068 1.00 0.00 O ATOM 1807 CB LEU D 38 6.907 -3.711 3.740 1.00 0.00 C ATOM 1808 CG LEU D 38 6.408 -3.364 2.321 1.00 0.00 C ATOM 1809 CD1 LEU D 38 7.079 -2.080 1.828 1.00 0.00 C ATOM 1810 CD2 LEU D 38 6.745 -4.510 1.351 1.00 0.00 C ATOM 0 H LEU D 38 5.089 -2.810 5.147 1.00 0.00 H new ATOM 0 HA LEU D 38 5.360 -5.223 3.719 1.00 0.00 H new ATOM 0 HB2 LEU D 38 7.053 -2.796 4.315 1.00 0.00 H new ATOM 0 HB3 LEU D 38 7.875 -4.208 3.680 1.00 0.00 H new ATOM 0 HG LEU D 38 5.328 -3.220 2.358 1.00 0.00 H new ATOM 0 HD11 LEU D 38 6.720 -1.844 0.826 1.00 0.00 H new ATOM 0 HD12 LEU D 38 6.836 -1.260 2.503 1.00 0.00 H new ATOM 0 HD13 LEU D 38 8.160 -2.221 1.803 1.00 0.00 H new ATOM 0 HD21 LEU D 38 6.390 -4.257 0.352 1.00 0.00 H new ATOM 0 HD22 LEU D 38 7.824 -4.659 1.325 1.00 0.00 H new ATOM 0 HD23 LEU D 38 6.260 -5.426 1.688 1.00 0.00 H new ATOM 1822 N ILE D 39 6.958 -5.087 6.585 1.00 0.00 N ATOM 1823 CA ILE D 39 7.667 -5.923 7.534 1.00 0.00 C ATOM 1824 C ILE D 39 6.858 -7.177 7.844 1.00 0.00 C ATOM 1825 O ILE D 39 7.385 -8.292 7.812 1.00 0.00 O ATOM 1826 CB ILE D 39 7.914 -5.137 8.822 1.00 0.00 C ATOM 1827 CG1 ILE D 39 8.717 -3.873 8.495 1.00 0.00 C ATOM 1828 CG2 ILE D 39 8.690 -6.004 9.813 1.00 0.00 C ATOM 1829 CD1 ILE D 39 8.828 -2.982 9.739 1.00 0.00 C ATOM 0 H ILE D 39 6.758 -4.140 6.906 1.00 0.00 H new ATOM 0 HA ILE D 39 8.621 -6.221 7.099 1.00 0.00 H new ATOM 0 HB ILE D 39 6.960 -4.856 9.268 1.00 0.00 H new ATOM 0 HG12 ILE D 39 9.712 -4.146 8.144 1.00 0.00 H new ATOM 0 HG13 ILE D 39 8.233 -3.324 7.687 1.00 0.00 H new ATOM 0 HG21 ILE D 39 8.865 -5.441 10.730 1.00 0.00 H new ATOM 0 HG22 ILE D 39 8.113 -6.900 10.042 1.00 0.00 H new ATOM 0 HG23 ILE D 39 9.646 -6.290 9.375 1.00 0.00 H new ATOM 0 HD11 ILE D 39 9.400 -2.087 9.496 1.00 0.00 H new ATOM 0 HD12 ILE D 39 7.830 -2.695 10.072 1.00 0.00 H new ATOM 0 HD13 ILE D 39 9.332 -3.530 10.535 1.00 0.00 H new ATOM 1841 N LEU D 40 5.579 -6.995 8.141 1.00 0.00 N ATOM 1842 CA LEU D 40 4.716 -8.129 8.453 1.00 0.00 C ATOM 1843 C LEU D 40 4.422 -8.963 7.209 1.00 0.00 C ATOM 1844 O LEU D 40 4.431 -10.193 7.255 1.00 0.00 O ATOM 1845 CB LEU D 40 3.405 -7.619 9.066 1.00 0.00 C ATOM 1846 CG LEU D 40 3.619 -7.277 10.550 1.00 0.00 C ATOM 1847 CD1 LEU D 40 3.852 -8.559 11.383 1.00 0.00 C ATOM 1848 CD2 LEU D 40 4.833 -6.342 10.678 1.00 0.00 C ATOM 0 H LEU D 40 5.119 -6.085 8.173 1.00 0.00 H new ATOM 0 HA LEU D 40 5.233 -8.769 9.168 1.00 0.00 H new ATOM 0 HB2 LEU D 40 3.060 -6.737 8.527 1.00 0.00 H new ATOM 0 HB3 LEU D 40 2.628 -8.377 8.967 1.00 0.00 H new ATOM 0 HG LEU D 40 2.726 -6.783 10.933 1.00 0.00 H new ATOM 0 HD11 LEU D 40 4.001 -8.291 12.429 1.00 0.00 H new ATOM 0 HD12 LEU D 40 2.984 -9.212 11.296 1.00 0.00 H new ATOM 0 HD13 LEU D 40 4.736 -9.078 11.012 1.00 0.00 H new ATOM 0 HD21 LEU D 40 4.992 -6.094 11.727 1.00 0.00 H new ATOM 0 HD22 LEU D 40 5.719 -6.840 10.284 1.00 0.00 H new ATOM 0 HD23 LEU D 40 4.649 -5.428 10.113 1.00 0.00 H new ATOM 1860 N TRP D 41 4.144 -8.287 6.102 1.00 0.00 N ATOM 1861 CA TRP D 41 3.830 -8.979 4.861 1.00 0.00 C ATOM 1862 C TRP D 41 5.043 -9.751 4.352 1.00 0.00 C ATOM 1863 O TRP D 41 4.910 -10.860 3.835 1.00 0.00 O ATOM 1864 CB TRP D 41 3.345 -7.982 3.808 1.00 0.00 C ATOM 1865 CG TRP D 41 3.135 -8.688 2.506 1.00 0.00 C ATOM 1866 CD1 TRP D 41 2.025 -9.386 2.165 1.00 0.00 C ATOM 1867 CD2 TRP D 41 4.011 -8.732 1.345 1.00 0.00 C ATOM 1868 NE1 TRP D 41 2.192 -9.893 0.889 1.00 0.00 N ATOM 1869 CE2 TRP D 41 3.394 -9.507 0.342 1.00 0.00 C ATOM 1870 CE3 TRP D 41 5.273 -8.184 1.074 1.00 0.00 C ATOM 1871 CZ2 TRP D 41 4.009 -9.732 -0.886 1.00 0.00 C ATOM 1872 CZ3 TRP D 41 5.891 -8.402 -0.166 1.00 0.00 C ATOM 1873 CH2 TRP D 41 5.257 -9.174 -1.141 1.00 0.00 C ATOM 0 H TRP D 41 4.130 -7.269 6.038 1.00 0.00 H new ATOM 0 HA TRP D 41 3.031 -9.694 5.056 1.00 0.00 H new ATOM 0 HB2 TRP D 41 2.415 -7.516 4.135 1.00 0.00 H new ATOM 0 HB3 TRP D 41 4.076 -7.183 3.686 1.00 0.00 H new ATOM 0 HD1 TRP D 41 1.153 -9.524 2.787 1.00 0.00 H new ATOM 0 HE1 TRP D 41 1.508 -10.481 0.412 1.00 0.00 H new ATOM 0 HE3 TRP D 41 5.772 -7.590 1.825 1.00 0.00 H new ATOM 0 HZ2 TRP D 41 3.520 -10.336 -1.636 1.00 0.00 H new ATOM 0 HZ3 TRP D 41 6.861 -7.971 -0.367 1.00 0.00 H new ATOM 0 HH2 TRP D 41 5.736 -9.338 -2.095 1.00 0.00 H new ATOM 1884 N ILE D 42 6.220 -9.163 4.504 1.00 0.00 N ATOM 1885 CA ILE D 42 7.447 -9.810 4.053 1.00 0.00 C ATOM 1886 C ILE D 42 7.662 -11.115 4.816 1.00 0.00 C ATOM 1887 O ILE D 42 7.989 -12.145 4.224 1.00 0.00 O ATOM 1888 CB ILE D 42 8.647 -8.863 4.273 1.00 0.00 C ATOM 1889 CG1 ILE D 42 8.678 -7.798 3.169 1.00 0.00 C ATOM 1890 CG2 ILE D 42 9.963 -9.651 4.250 1.00 0.00 C ATOM 1891 CD1 ILE D 42 9.615 -6.661 3.582 1.00 0.00 C ATOM 0 H ILE D 42 6.353 -8.247 4.932 1.00 0.00 H new ATOM 0 HA ILE D 42 7.361 -10.036 2.990 1.00 0.00 H new ATOM 0 HB ILE D 42 8.535 -8.383 5.245 1.00 0.00 H new ATOM 0 HG12 ILE D 42 9.017 -8.240 2.232 1.00 0.00 H new ATOM 0 HG13 ILE D 42 7.674 -7.411 2.994 1.00 0.00 H new ATOM 0 HG21 ILE D 42 10.798 -8.969 4.406 1.00 0.00 H new ATOM 0 HG22 ILE D 42 9.953 -10.400 5.042 1.00 0.00 H new ATOM 0 HG23 ILE D 42 10.074 -10.145 3.285 1.00 0.00 H new ATOM 0 HD11 ILE D 42 9.637 -5.904 2.798 1.00 0.00 H new ATOM 0 HD12 ILE D 42 9.257 -6.213 4.509 1.00 0.00 H new ATOM 0 HD13 ILE D 42 10.620 -7.055 3.734 1.00 0.00 H new ATOM 1903 N LEU D 43 7.485 -11.062 6.126 1.00 0.00 N ATOM 1904 CA LEU D 43 7.673 -12.242 6.958 1.00 0.00 C ATOM 1905 C LEU D 43 6.665 -13.320 6.582 1.00 0.00 C ATOM 1906 O LEU D 43 6.982 -14.506 6.578 1.00 0.00 O ATOM 1907 CB LEU D 43 7.516 -11.871 8.434 1.00 0.00 C ATOM 1908 CG LEU D 43 8.680 -10.964 8.870 1.00 0.00 C ATOM 1909 CD1 LEU D 43 8.349 -10.338 10.227 1.00 0.00 C ATOM 1910 CD2 LEU D 43 9.992 -11.770 8.983 1.00 0.00 C ATOM 0 H LEU D 43 7.213 -10.221 6.635 1.00 0.00 H new ATOM 0 HA LEU D 43 8.678 -12.630 6.793 1.00 0.00 H new ATOM 0 HB2 LEU D 43 6.566 -11.360 8.591 1.00 0.00 H new ATOM 0 HB3 LEU D 43 7.497 -12.773 9.045 1.00 0.00 H new ATOM 0 HG LEU D 43 8.816 -10.185 8.120 1.00 0.00 H new ATOM 0 HD11 LEU D 43 9.171 -9.694 10.541 1.00 0.00 H new ATOM 0 HD12 LEU D 43 7.437 -9.747 10.142 1.00 0.00 H new ATOM 0 HD13 LEU D 43 8.203 -11.126 10.966 1.00 0.00 H new ATOM 0 HD21 LEU D 43 10.800 -11.108 9.293 1.00 0.00 H new ATOM 0 HD22 LEU D 43 9.870 -12.563 9.721 1.00 0.00 H new ATOM 0 HD23 LEU D 43 10.233 -12.210 8.015 1.00 0.00 H new ATOM 1922 N ASP D 44 5.449 -12.899 6.270 1.00 0.00 N ATOM 1923 CA ASP D 44 4.407 -13.840 5.899 1.00 0.00 C ATOM 1924 C ASP D 44 4.813 -14.628 4.658 1.00 0.00 C ATOM 1925 O ASP D 44 4.586 -15.836 4.579 1.00 0.00 O ATOM 1926 CB ASP D 44 3.106 -13.090 5.621 1.00 0.00 C ATOM 1927 CG ASP D 44 1.995 -14.077 5.285 1.00 0.00 C ATOM 1928 OD1 ASP D 44 2.296 -15.251 5.144 1.00 0.00 O ATOM 1929 OD2 ASP D 44 0.860 -13.646 5.172 1.00 0.00 O ATOM 0 H ASP D 44 5.162 -11.920 6.266 1.00 0.00 H new ATOM 0 HA ASP D 44 4.260 -14.535 6.726 1.00 0.00 H new ATOM 0 HB2 ASP D 44 2.826 -12.497 6.492 1.00 0.00 H new ATOM 0 HB3 ASP D 44 3.248 -12.394 4.794 1.00 0.00 H new ATOM 1934 N ARG D 45 5.413 -13.942 3.693 1.00 0.00 N ATOM 1935 CA ARG D 45 5.842 -14.594 2.461 1.00 0.00 C ATOM 1936 C ARG D 45 7.146 -15.350 2.684 1.00 0.00 C ATOM 1937 O ARG D 45 7.469 -16.279 1.942 1.00 0.00 O ATOM 1938 CB ARG D 45 6.038 -13.550 1.359 1.00 0.00 C ATOM 1939 CG ARG D 45 6.384 -14.248 0.041 1.00 0.00 C ATOM 1940 CD ARG D 45 6.513 -13.207 -1.071 1.00 0.00 C ATOM 1941 NE ARG D 45 6.842 -13.859 -2.334 1.00 0.00 N ATOM 1942 CZ ARG D 45 7.120 -13.148 -3.421 1.00 0.00 C ATOM 1943 NH1 ARG D 45 7.107 -11.844 -3.369 1.00 0.00 N ATOM 1944 NH2 ARG D 45 7.406 -13.753 -4.540 1.00 0.00 N ATOM 0 H ARG D 45 5.613 -12.943 3.738 1.00 0.00 H new ATOM 0 HA ARG D 45 5.071 -15.302 2.158 1.00 0.00 H new ATOM 0 HB2 ARG D 45 5.131 -12.958 1.241 1.00 0.00 H new ATOM 0 HB3 ARG D 45 6.835 -12.860 1.636 1.00 0.00 H new ATOM 0 HG2 ARG D 45 7.317 -14.802 0.145 1.00 0.00 H new ATOM 0 HG3 ARG D 45 5.610 -14.972 -0.213 1.00 0.00 H new ATOM 0 HD2 ARG D 45 5.579 -12.653 -1.171 1.00 0.00 H new ATOM 0 HD3 ARG D 45 7.287 -12.483 -0.814 1.00 0.00 H new ATOM 0 HE ARG D 45 6.859 -14.878 -2.383 1.00 0.00 H new ATOM 0 HH11 ARG D 45 6.883 -11.371 -2.494 1.00 0.00 H new ATOM 0 HH12 ARG D 45 7.321 -11.298 -4.204 1.00 0.00 H new ATOM 0 HH21 ARG D 45 7.416 -14.772 -4.581 1.00 0.00 H new ATOM 0 HH22 ARG D 45 7.619 -13.207 -5.375 1.00 0.00 H new ATOM 1958 N LEU D 46 7.899 -14.947 3.701 1.00 0.00 N ATOM 1959 CA LEU D 46 9.171 -15.604 3.985 1.00 0.00 C ATOM 1960 C LEU D 46 8.951 -17.072 4.330 1.00 0.00 C ATOM 1961 O LEU D 46 9.605 -17.955 3.774 1.00 0.00 O ATOM 1962 CB LEU D 46 9.871 -14.900 5.158 1.00 0.00 C ATOM 1963 CG LEU D 46 11.192 -15.608 5.500 1.00 0.00 C ATOM 1964 CD1 LEU D 46 12.120 -15.624 4.275 1.00 0.00 C ATOM 1965 CD2 LEU D 46 11.871 -14.867 6.659 1.00 0.00 C ATOM 0 H LEU D 46 7.658 -14.183 4.333 1.00 0.00 H new ATOM 0 HA LEU D 46 9.798 -15.542 3.095 1.00 0.00 H new ATOM 0 HB2 LEU D 46 10.066 -13.859 4.901 1.00 0.00 H new ATOM 0 HB3 LEU D 46 9.217 -14.896 6.030 1.00 0.00 H new ATOM 0 HG LEU D 46 10.985 -16.638 5.791 1.00 0.00 H new ATOM 0 HD11 LEU D 46 13.052 -16.128 4.531 1.00 0.00 H new ATOM 0 HD12 LEU D 46 11.633 -16.155 3.457 1.00 0.00 H new ATOM 0 HD13 LEU D 46 12.334 -14.600 3.967 1.00 0.00 H new ATOM 0 HD21 LEU D 46 12.809 -15.363 6.908 1.00 0.00 H new ATOM 0 HD22 LEU D 46 12.072 -13.837 6.364 1.00 0.00 H new ATOM 0 HD23 LEU D 46 11.215 -14.874 7.529 1.00 0.00 H new ATOM 1977 N PHE D 47 8.027 -17.325 5.249 1.00 0.00 N ATOM 1978 CA PHE D 47 7.726 -18.691 5.664 1.00 0.00 C ATOM 1979 C PHE D 47 6.928 -19.418 4.589 1.00 0.00 C ATOM 1980 O PHE D 47 7.127 -20.609 4.353 1.00 0.00 O ATOM 1981 CB PHE D 47 6.948 -18.680 6.984 1.00 0.00 C ATOM 1982 CG PHE D 47 7.893 -18.375 8.126 1.00 0.00 C ATOM 1983 CD1 PHE D 47 8.391 -17.079 8.296 1.00 0.00 C ATOM 1984 CD2 PHE D 47 8.273 -19.392 9.012 1.00 0.00 C ATOM 1985 CE1 PHE D 47 9.265 -16.797 9.352 1.00 0.00 C ATOM 1986 CE2 PHE D 47 9.148 -19.110 10.069 1.00 0.00 C ATOM 1987 CZ PHE D 47 9.644 -17.811 10.239 1.00 0.00 C ATOM 0 H PHE D 47 7.476 -16.607 5.719 1.00 0.00 H new ATOM 0 HA PHE D 47 8.666 -19.222 5.811 1.00 0.00 H new ATOM 0 HB2 PHE D 47 6.155 -17.933 6.945 1.00 0.00 H new ATOM 0 HB3 PHE D 47 6.468 -19.646 7.143 1.00 0.00 H new ATOM 0 HD1 PHE D 47 8.101 -16.295 7.612 1.00 0.00 H new ATOM 0 HD2 PHE D 47 7.891 -20.394 8.880 1.00 0.00 H new ATOM 0 HE1 PHE D 47 9.648 -15.795 9.483 1.00 0.00 H new ATOM 0 HE2 PHE D 47 9.440 -19.894 10.752 1.00 0.00 H new ATOM 0 HZ PHE D 47 10.318 -17.592 11.054 1.00 0.00 H new ATOM 1997 N PHE D 48 6.017 -18.693 3.945 1.00 0.00 N ATOM 1998 CA PHE D 48 5.177 -19.270 2.899 1.00 0.00 C ATOM 1999 C PHE D 48 5.698 -18.881 1.521 1.00 0.00 C ATOM 2000 O PHE D 48 5.747 -17.702 1.172 1.00 0.00 O ATOM 2001 CB PHE D 48 3.740 -18.770 3.065 1.00 0.00 C ATOM 2002 CG PHE D 48 3.090 -19.476 4.234 1.00 0.00 C ATOM 2003 CD1 PHE D 48 3.417 -19.104 5.545 1.00 0.00 C ATOM 2004 CD2 PHE D 48 2.167 -20.506 4.010 1.00 0.00 C ATOM 2005 CE1 PHE D 48 2.817 -19.759 6.628 1.00 0.00 C ATOM 2006 CE2 PHE D 48 1.568 -21.160 5.092 1.00 0.00 C ATOM 2007 CZ PHE D 48 1.894 -20.786 6.401 1.00 0.00 C ATOM 0 H PHE D 48 5.842 -17.705 4.129 1.00 0.00 H new ATOM 0 HA PHE D 48 5.201 -20.356 2.988 1.00 0.00 H new ATOM 0 HB2 PHE D 48 3.736 -17.693 3.230 1.00 0.00 H new ATOM 0 HB3 PHE D 48 3.172 -18.955 2.153 1.00 0.00 H new ATOM 0 HD1 PHE D 48 4.131 -18.313 5.720 1.00 0.00 H new ATOM 0 HD2 PHE D 48 1.917 -20.796 3.000 1.00 0.00 H new ATOM 0 HE1 PHE D 48 3.067 -19.471 7.639 1.00 0.00 H new ATOM 0 HE2 PHE D 48 0.855 -21.952 4.918 1.00 0.00 H new ATOM 0 HZ PHE D 48 1.433 -21.291 7.237 1.00 0.00 H new ATOM 2017 N LYS D 49 6.085 -19.886 0.743 1.00 0.00 N ATOM 2018 CA LYS D 49 6.603 -19.649 -0.599 1.00 0.00 C ATOM 2019 C LYS D 49 6.463 -20.902 -1.454 1.00 0.00 C ATOM 2020 O LYS D 49 6.491 -21.985 -0.892 1.00 0.00 O ATOM 2021 CB LYS D 49 8.073 -19.233 -0.525 1.00 0.00 C ATOM 2022 CG LYS D 49 8.576 -18.885 -1.928 1.00 0.00 C ATOM 2023 CD LYS D 49 10.020 -18.389 -1.845 1.00 0.00 C ATOM 2024 CE LYS D 49 10.514 -18.026 -3.245 1.00 0.00 C ATOM 2025 NZ LYS D 49 11.906 -17.500 -3.159 1.00 0.00 N ATOM 2026 OXT LYS D 49 6.328 -20.763 -2.659 1.00 0.00 O ATOM 0 H LYS D 49 6.050 -20.868 1.017 1.00 0.00 H new ATOM 0 HA LYS D 49 6.025 -18.847 -1.058 1.00 0.00 H new ATOM 0 HB2 LYS D 49 8.186 -18.374 0.137 1.00 0.00 H new ATOM 0 HB3 LYS D 49 8.670 -20.042 -0.103 1.00 0.00 H new ATOM 0 HG2 LYS D 49 8.518 -19.761 -2.574 1.00 0.00 H new ATOM 0 HG3 LYS D 49 7.942 -18.118 -2.373 1.00 0.00 H new ATOM 0 HD2 LYS D 49 10.080 -17.520 -1.190 1.00 0.00 H new ATOM 0 HD3 LYS D 49 10.657 -19.160 -1.411 1.00 0.00 H new ATOM 0 HE2 LYS D 49 10.484 -18.903 -3.892 1.00 0.00 H new ATOM 0 HE3 LYS D 49 9.858 -17.279 -3.691 1.00 0.00 H new ATOM 0 HZ1 LYS D 49 12.243 -17.253 -4.111 1.00 0.00 H new ATOM 0 HZ2 LYS D 49 11.920 -16.653 -2.556 1.00 0.00 H new ATOM 0 HZ3 LYS D 49 12.527 -18.227 -2.750 1.00 0.00 H new TER 2040 LYS D 49 HETATM 2041 S 3LW C 100 2.791 8.170 0.376 1.00 0.00 S HETATM 2042 BR 3LW C 100 4.687 10.324 1.105 1.00 0.00 BR HETATM 2043 C1 3LW C 100 3.041 9.607 0.480 1.00 0.00 C HETATM 2044 C2 3LW C 100 1.994 10.341 0.089 1.00 0.00 C HETATM 2045 N2 3LW C 100 0.908 5.988 0.487 1.00 0.00 N HETATM 2046 C3 3LW C 100 1.017 9.511 -0.284 1.00 0.00 C HETATM 2047 C5 3LW C 100 0.587 7.054 -0.466 1.00 0.00 C HETATM 2048 C10 3LW C 100 0.652 4.582 0.088 1.00 0.00 C HETATM 2049 C12 3LW C 100 1.414 8.242 -0.143 1.00 0.00 C HETATM 2050 C61 3LW C 100 1.453 4.173 -1.193 1.00 0.00 C HETATM 2051 C62 3LW C 100 -0.862 4.323 -0.199 1.00 0.00 C HETATM 2052 C63 3LW C 100 1.075 3.598 1.217 1.00 0.00 C HETATM 2053 C71 3LW C 100 1.177 2.710 -1.584 1.00 0.00 C HETATM 2054 C72 3LW C 100 -1.117 2.857 -0.597 1.00 0.00 C HETATM 2055 C73 3LW C 100 0.809 2.130 0.815 1.00 0.00 C HETATM 2056 C81 3LW C 100 -0.321 2.518 -1.864 1.00 0.00 C HETATM 2057 C82 3LW C 100 -0.688 1.927 0.544 1.00 0.00 C HETATM 2058 C83 3LW C 100 1.608 1.778 -0.445 1.00 0.00 C